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 |
|
|
644850 |
6tr2   |
34467 | cing | 1-original | 3 | AMBER | dihedral angle |
#Torsion angle restraints # # 1 THY EPSILON: (1 DT5 C4')-(1 DT5 C3')-(1 DT5 O3')-(2 DAP P) 170.0 290.0 &rst iat = 6, 25, 30, 31, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, rk2 = 200.0, rk3 = 200.0, &end # 2 DAP EPSILON: (2 DAP C4')-(2 DAP C3')-(2 DAP O3')-(3 DG P) 170.0 290.0 &rst iat = 38, 57, 62, 64, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 3 GUA EPSILON: (3 DG C4')-(3 DG C3')-(3 DG O3')-(4 DG P) 170.0 290.0 &rst iat = 71, 91, 96, 97, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 4 GUA EPSILON: (4 DG C4')-(4 DG C3')-(4 DG O3')-(5 DG P) 170.0 290.0 &rst iat = 104, 124, 129, 130, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 5 GUA EPSILON: (5 DG C4')-(5 DG C3')-(5 DG O3')-(6 DT P) 170.0 290.0 &rst iat = 137, 157, 162, 163, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 6 THY EPSILON: (6 DT C4')-(6 DT C3')-(6 DT O3')-(7 DT P) 170.0 290.0 &rst iat = 170, 189, 194, 195, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 7 THY EPSILON: (7 DT C4')-(7 DT C3')-(7 DT O3')-(8 DA P) 170.0 290.0 &rst iat = 202, 221, 226, 227, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 8 ADE EPSILON: (8 DA C4')-(8 DA C3')-(8 DA O3')-(9 DG P) 170.0 290.0 &rst iat = 234, 253, 258, 259, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 9 GUA EPSILON: (9 DG C4')-(9 DG C3')-(9 DG O3')-(10 DG P) 170.0 290.0 &rst iat = 266, 286, 291, 292, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 10 GUA EPSILON: (10 DG C4')-(10 DG C3')-(10 DG O3')-(11 DG P) 170.0 290.0 &rst iat = 299, 319, 324, 325, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 11 GUA EPSILON: (11 DG C4')-(11 DG C3')-(11 DG O3')-(12 DT P) 170.0 290.0 &rst iat = 332, 352, 357, 358, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 12 THY EPSILON: (12 DT C4')-(12 DT C3')-(12 DT O3')-(13 DT P) 170.0 290.0 &rst iat = 365, 384, 389, 390, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 13 THY EPSILON: (13 DT C4')-(13 DT C3')-(13 DT O3')-(14 DA P) 170.0 290.0 &rst iat = 397, 416, 421, 422, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 14 ADE EPSILON: (14 DA C4')-(14 DA C3')-(14 DA O3')-(15 DG P) 170.0 290.0 &rst iat = 429, 448, 453, 454, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 15 GUA EPSILON: (15 DG C4')-(15 DG C3')-(15 DG O3')-(16 DG P) 170.0 290.0 &rst iat = 461, 481, 486, 487, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 16 GUA EPSILON: (16 DG C4')-(16 DG C3')-(16 DG O3')-(17 DG P) 170.0 290.0 &rst iat = 494, 514, 519, 520, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 17 GUA EPSILON: (17 DG C4')-(17 DG C3')-(17 DG O3')-(18 DT P) 170.0 290.0 &rst iat = 527, 547, 552, 553, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 18 THY EPSILON: (18 DT C4')-(18 DT C3')-(18 DT O3')-(19 DT P) 170.0 290.0 &rst iat = 560, 579, 584, 585, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 19 THY EPSILON: (19 DT C4')-(19 DT C3')-(19 DT O3')-(20 DAP P) 170.0 290.0 &rst iat = 592, 611, 616, 617, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 20 DAP EPSILON: (20 DAP C4')-(20 DAP C3')-(20 DAP O3')-(21 DG P) 170.0 290.0 &rst iat = 624, 643, 648, 650, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 21 GUA EPSILON: (21 DG C4')-(21 DG C3')-(21 DG O3')-(22 DG P) 170.0 290.0 &rst iat = 657, 677, 682, 683, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 22 GUA EPSILON: (22 DG C4')-(22 DG C3')-(22 DG O3')-(23 DG3 P) 170.0 290.0 &rst iat = 690, 710, 715, 716, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 22 GUA EPSILON: (22 DG C4')-(22 DG C3')-(22 DG O3')-(23 DG3 P) 170.0 290.0 &rst iat = 690, 710, 715, 716, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 1 THY NU0: (1 DT5 C4')-(1 DT5 O4')-(1 DT5 C1')-(1 DT5 C2') -35.7 -5.7 &rst iat = 6, 8, 9, 27, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 1 THY NU1: (1 DT5 O4')-(1 DT5 C1')-(1 DT5 C2')-(1 DT5 C3') 18.8 48.8 &rst iat = 8, 9, 27, 25, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 1 THY NU2: (1 DT5 C1')-(1 DT5 C2')-(1 DT5 C3')-(1 DT5 C4') -49.0 -19.0 &rst iat = 9, 27, 25, 6, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 1 THY NU3: (1 DT5 C2')-(1 DT5 C3')-(1 DT5 C4')-(1 DT5 O4') 6.2 36.2 &rst iat = 27, 25, 6, 8, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 1 THY NU4: (1 DT5 C3')-(1 DT5 C4')-(1 DT5 O4')-(1 DT5 C1') -15.3 14.7 &rst iat = 25, 6, 8, 9, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 2 DAP NU0: (2 DAP C4')-(2 DAP O4')-(2 DAP C1')-(2 DAP C2') -35.7 -5.7 &rst iat = 38, 40, 41, 59, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 2 DAP NU1: (2 DAP O4')-(2 DAP C1')-(2 DAP C2')-(2 DAP C3') 18.8 48.8 &rst iat = 40, 41, 59, 57, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 2 DAP NU2: (2 DAP C1')-(2 DAP C2')-(2 DAP C3')-(2 DAP C4') -49.0 -19.0 &rst iat = 41, 59, 57, 38, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 2 DAP NU3: (2 DAP C2')-(2 DAP C3')-(2 DAP C4')-(2 DAP O4') 6.2 36.2 &rst iat = 59, 57, 38, 40, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 2 DAP NU4: (2 DAP C3')-(2 DAP C4')-(2 DAP O4')-(2 DAP C1') -15.3 14.7 &rst iat = 57, 38, 40, 41, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 3 GUA NU0: (3 DG C4')-(3 DG O4')-(3 DG C1')-(3 DG C2') -35.7 -5.7 &rst iat = 71, 73, 74, 93, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 3 GUA NU1: (3 DG O4')-(3 DG C1')-(3 DG C2')-(3 DG C3') 18.8 48.8 &rst iat = 73, 74, 93, 91, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 3 GUA NU2: (3 DG C1')-(3 DG C2')-(3 DG C3')-(3 DG C4') -49.0 -19.0 &rst iat = 74, 93, 91, 71, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 3 GUA NU3: (3 DG C2')-(3 DG C3')-(3 DG C4')-(3 DG O4') 6.2 36.2 &rst iat = 93, 91, 71, 73, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 3 GUA NU4: (3 DG C3')-(3 DG C4')-(3 DG O4')-(3 DG C1') -15.3 14.7 &rst iat = 91, 71, 73, 74, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 4 GUA NU0: (4 DG C4')-(4 DG O4')-(4 DG C1')-(4 DG C2') -35.7 -5.7 &rst iat = 104, 106, 107, 126, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 4 GUA NU1: (4 DG O4')-(4 DG C1')-(4 DG C2')-(4 DG C3') 18.8 48.8 &rst iat = 106, 107, 126, 124, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 4 GUA NU2: (4 DG C1')-(4 DG C2')-(4 DG C3')-(4 DG C4') -49.0 -19.0 &rst iat = 107, 126, 124, 104, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 4 GUA NU3: (4 DG C2')-(4 DG C3')-(4 DG C4')-(4 DG O4') 6.2 36.2 &rst iat = 126, 124, 104, 106, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 4 GUA NU4: (4 DG C3')-(4 DG C4')-(4 DG O4')-(4 DG C1') -15.3 14.7 &rst iat = 124, 104, 106, 107, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 5 GUA NU0: (5 DG C4')-(5 DG O4')-(5 DG C1')-(5 DG C2') -35.7 -5.7 &rst iat = 137, 139, 140, 159, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 5 GUA NU1: (5 DG O4')-(5 DG C1')-(5 DG C2')-(5 DG C3') 18.8 48.8 &rst iat = 139, 140, 159, 157, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 5 GUA NU2: (5 DG C1')-(5 DG C2')-(5 DG C3')-(5 DG C4') -49.0 -19.0 &rst iat = 140, 159, 157, 137, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 5 GUA NU3: (5 DG C2')-(5 DG C3')-(5 DG C4')-(5 DG O4') 6.2 36.2 &rst iat = 159, 157, 137, 139, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 5 GUA NU4: (5 DG C3')-(5 DG C4')-(5 DG O4')-(5 DG C1') -15.3 14.7 &rst iat = 157, 137, 139, 140, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 6 THY NU0: (6 DT C4')-(6 DT O4')-(6 DT C1')-(6 DT C2') -35.7 -5.7 &rst iat = 170, 172, 173, 191, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 6 THY NU1: (6 DT O4')-(6 DT C1')-(6 DT C2')-(6 DT C3') 18.8 48.8 &rst iat = 172, 173, 191, 189, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 6 THY NU2: (6 DT C1')-(6 DT C2')-(6 DT C3')-(6 DT C4') -49.0 -19.0 &rst iat = 173, 191, 189, 170, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 6 THY NU3: (6 DT C2')-(6 DT C3')-(6 DT C4')-(6 DT O4') 6.2 36.2 &rst iat = 191, 189, 170, 172, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 6 THY NU4: (6 DT C3')-(6 DT C4')-(6 DT O4')-(6 DT C1') -15.3 14.7 &rst iat = 189, 170, 172, 173, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 7 THY NU0: (7 DT C4')-(7 DT O4')-(7 DT C1')-(7 DT C2') -35.7 -5.7 &rst iat = 202, 204, 205, 223, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 7 THY NU1: (7 DT O4')-(7 DT C1')-(7 DT C2')-(7 DT C3') 18.8 48.8 &rst iat = 204, 205, 223, 221, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 7 THY NU2: (7 DT C1')-(7 DT C2')-(7 DT C3')-(7 DT C4') -49.0 -19.0 &rst iat = 205, 223, 221, 202, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 7 THY NU3: (7 DT C2')-(7 DT C3')-(7 DT C4')-(7 DT O4') 6.2 36.2 &rst iat = 223, 221, 202, 204, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 7 THY NU4: (7 DT C3')-(7 DT C4')-(7 DT O4')-(7 DT C1') -15.3 14.7 &rst iat = 221, 202, 204, 205, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 8 ADE NU0: (8 DA C4')-(8 DA O4')-(8 DA C1')-(8 DA C2') -35.7 -5.7 &rst iat = 234, 236, 237, 255, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 8 ADE NU1: (8 DA O4')-(8 DA C1')-(8 DA C2')-(8 DA C3') 18.8 48.8 &rst iat = 236, 237, 255, 253, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 8 ADE NU2: (8 DA C1')-(8 DA C2')-(8 DA C3')-(8 DA C4') -49.0 -19.0 &rst iat = 237, 255, 253, 234, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 8 ADE NU3: (8 DA C2')-(8 DA C3')-(8 DA C4')-(8 DA O4') 6.2 36.2 &rst iat = 255, 253, 234, 236, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 8 ADE NU4: (8 DA C3')-(8 DA C4')-(8 DA O4')-(8 DA C1') -15.3 14.7 &rst iat = 253, 234, 236, 237, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 9 GUA NU0: (9 DG C4')-(9 DG O4')-(9 DG C1')-(9 DG C2') -35.7 -5.7 &rst iat = 266, 268, 269, 288, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 9 GUA NU1: (9 DG O4')-(9 DG C1')-(9 DG C2')-(9 DG C3') 18.8 48.8 &rst iat = 268, 269, 288, 286, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 9 GUA NU2: (9 DG C1')-(9 DG C2')-(9 DG C3')-(9 DG C4') -49.0 -19.0 &rst iat = 269, 288, 286, 266, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 9 GUA NU3: (9 DG C2')-(9 DG C3')-(9 DG C4')-(9 DG O4') 6.2 36.2 &rst iat = 288, 286, 266, 268, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 9 GUA NU4: (9 DG C3')-(9 DG C4')-(9 DG O4')-(9 DG C1') -15.3 14.7 &rst iat = 286, 266, 268, 269, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 10 GUA NU0: (10 DG C4')-(10 DG O4')-(10 DG C1')-(10 DG C2') -35.7 -5.7 &rst iat = 299, 301, 302, 321, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 10 GUA NU1: (10 DG O4')-(10 DG C1')-(10 DG C2')-(10 DG C3') 18.8 48.8 &rst iat = 301, 302, 321, 319, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 10 GUA NU2: (10 DG C1')-(10 DG C2')-(10 DG C3')-(10 DG C4') -49.0 -19.0 &rst iat = 302, 321, 319, 299, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 10 GUA NU3: (10 DG C2')-(10 DG C3')-(10 DG C4')-(10 DG O4') 6.2 36.2 &rst iat = 321, 319, 299, 301, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 10 GUA NU4: (10 DG C3')-(10 DG C4')-(10 DG O4')-(10 DG C1') -15.3 14.7 &rst iat = 319, 299, 301, 302, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 11 GUA NU0: (11 DG C4')-(11 DG O4')-(11 DG C1')-(11 DG C2') -35.7 -5.7 &rst iat = 332, 334, 335, 354, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 11 GUA NU1: (11 DG O4')-(11 DG C1')-(11 DG C2')-(11 DG C3') 18.8 48.8 &rst iat = 334, 335, 354, 352, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 11 GUA NU2: (11 DG C1')-(11 DG C2')-(11 DG C3')-(11 DG C4') -49.0 -19.0 &rst iat = 335, 354, 352, 332, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 11 GUA NU3: (11 DG C2')-(11 DG C3')-(11 DG C4')-(11 DG O4') 6.2 36.2 &rst iat = 354, 352, 332, 334, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 11 GUA NU4: (11 DG C3')-(11 DG C4')-(11 DG O4')-(11 DG C1') -15.3 14.7 &rst iat = 352, 332, 334, 335, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 12 THY NU0: (12 DT C4')-(12 DT O4')-(12 DT C1')-(12 DT C2') -35.7 -5.7 &rst iat = 365, 367, 368, 386, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 12 THY NU1: (12 DT O4')-(12 DT C1')-(12 DT C2')-(12 DT C3') 18.8 48.8 &rst iat = 367, 368, 386, 384, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 12 THY NU2: (12 DT C1')-(12 DT C2')-(12 DT C3')-(12 DT C4') -49.0 -19.0 &rst iat = 368, 386, 384, 365, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 12 THY NU3: (12 DT C2')-(12 DT C3')-(12 DT C4')-(12 DT O4') 6.2 36.2 &rst iat = 386, 384, 365, 367, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 12 THY NU4: (12 DT C3')-(12 DT C4')-(12 DT O4')-(12 DT C1') -15.3 14.7 &rst iat = 384, 365, 367, 368, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 13 THY NU0: (13 DT C4')-(13 DT O4')-(13 DT C1')-(13 DT C2') -35.7 -5.7 &rst iat = 397, 399, 400, 418, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 13 THY NU1: (13 DT O4')-(13 DT C1')-(13 DT C2')-(13 DT C3') 18.8 48.8 &rst iat = 399, 400, 418, 416, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 13 THY NU2: (13 DT C1')-(13 DT C2')-(13 DT C3')-(13 DT C4') -49.0 -19.0 &rst iat = 400, 418, 416, 397, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 13 THY NU3: (13 DT C2')-(13 DT C3')-(13 DT C4')-(13 DT O4') 6.2 36.2 &rst iat = 418, 416, 397, 399, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 13 THY NU4: (13 DT C3')-(13 DT C4')-(13 DT O4')-(13 DT C1') -15.3 14.7 &rst iat = 416, 397, 399, 400, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 14 ADE NU0: (14 DA C4')-(14 DA O4')-(14 DA C1')-(14 DA C2') -35.7 -5.7 &rst iat = 429, 431, 432, 450, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 14 ADE NU1: (14 DA O4')-(14 DA C1')-(14 DA C2')-(14 DA C3') 18.8 48.8 &rst iat = 431, 432, 450, 448, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 14 ADE NU2: (14 DA C1')-(14 DA C2')-(14 DA C3')-(14 DA C4') -49.0 -19.0 &rst iat = 432, 450, 448, 429, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 14 ADE NU3: (14 DA C2')-(14 DA C3')-(14 DA C4')-(14 DA O4') 6.2 36.2 &rst iat = 450, 448, 429, 431, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 14 ADE NU4: (14 DA C3')-(14 DA C4')-(14 DA O4')-(14 DA C1') -15.3 14.7 &rst iat = 448, 429, 431, 432, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 15 GUA NU0: (15 DG C4')-(15 DG O4')-(15 DG C1')-(15 DG C2') -35.7 -5.7 &rst iat = 461, 463, 464, 483, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 15 GUA NU1: (15 DG O4')-(15 DG C1')-(15 DG C2')-(15 DG C3') 18.8 48.8 &rst iat = 463, 464, 483, 481, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 15 GUA NU2: (15 DG C1')-(15 DG C2')-(15 DG C3')-(15 DG C4') -49.0 -19.0 &rst iat = 464, 483, 481, 461, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 15 GUA NU3: (15 DG C2')-(15 DG C3')-(15 DG C4')-(15 DG O4') 6.2 36.2 &rst iat = 483, 481, 461, 463, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 15 GUA NU4: (15 DG C3')-(15 DG C4')-(15 DG O4')-(15 DG C1') -15.3 14.7 &rst iat = 481, 461, 463, 464, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 16 GUA NU0: (16 DG C4')-(16 DG O4')-(16 DG C1')-(16 DG C2') -35.7 -5.7 &rst iat = 494, 496, 497, 516, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 16 GUA NU1: (16 DG O4')-(16 DG C1')-(16 DG C2')-(16 DG C3') 18.8 48.8 &rst iat = 496, 497, 516, 514, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 16 GUA NU2: (16 DG C1')-(16 DG C2')-(16 DG C3')-(16 DG C4') -49.0 -19.0 &rst iat = 497, 516, 514, 494, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 16 GUA NU3: (16 DG C2')-(16 DG C3')-(16 DG C4')-(16 DG O4') 6.2 36.2 &rst iat = 516, 514, 494, 496, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 16 GUA NU4: (16 DG C3')-(16 DG C4')-(16 DG O4')-(16 DG C1') -15.3 14.7 &rst iat = 514, 494, 496, 497, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 17 GUA NU0: (17 DG C4')-(17 DG O4')-(17 DG C1')-(17 DG C2') -35.7 -5.7 &rst iat = 527, 529, 530, 549, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 17 GUA NU1: (17 DG O4')-(17 DG C1')-(17 DG C2')-(17 DG C3') 18.8 48.8 &rst iat = 529, 530, 549, 547, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 17 GUA NU2: (17 DG C1')-(17 DG C2')-(17 DG C3')-(17 DG C4') -49.0 -19.0 &rst iat = 530, 549, 547, 527, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 17 GUA NU3: (17 DG C2')-(17 DG C3')-(17 DG C4')-(17 DG O4') 6.2 36.2 &rst iat = 549, 547, 527, 529, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 17 GUA NU4: (17 DG C3')-(17 DG C4')-(17 DG O4')-(17 DG C1') -15.3 14.7 &rst iat = 547, 527, 529, 530, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 18 THY NU0: (18 DT C4')-(18 DT O4')-(18 DT C1')-(18 DT C2') -35.7 -5.7 &rst iat = 560, 562, 563, 581, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 18 THY NU1: (18 DT O4')-(18 DT C1')-(18 DT C2')-(18 DT C3') 18.8 48.8 &rst iat = 562, 563, 581, 579, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 18 THY NU2: (18 DT C1')-(18 DT C2')-(18 DT C3')-(18 DT C4') -49.0 -19.0 &rst iat = 563, 581, 579, 560, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 18 THY NU3: (18 DT C2')-(18 DT C3')-(18 DT C4')-(18 DT O4') 6.2 36.2 &rst iat = 581, 579, 560, 562, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 18 THY NU4: (18 DT C3')-(18 DT C4')-(18 DT O4')-(18 DT C1') -15.3 14.7 &rst iat = 579, 560, 562, 563, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 19 THY NU0: (19 DT C4')-(19 DT O4')-(19 DT C1')-(19 DT C2') -35.7 -5.7 &rst iat = 592, 594, 595, 613, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 19 THY NU1: (19 DT O4')-(19 DT C1')-(19 DT C2')-(19 DT C3') 18.8 48.8 &rst iat = 594, 595, 613, 611, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 19 THY NU2: (19 DT C1')-(19 DT C2')-(19 DT C3')-(19 DT C4') -49.0 -19.0 &rst iat = 595, 613, 611, 592, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 19 THY NU3: (19 DT C2')-(19 DT C3')-(19 DT C4')-(19 DT O4') 6.2 36.2 &rst iat = 613, 611, 592, 594, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 19 THY NU4: (19 DT C3')-(19 DT C4')-(19 DT O4')-(19 DT C1') -15.3 14.7 &rst iat = 611, 592, 594, 595, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 20 DAP NU0: (20 DAP C4')-(20 DAP O4')-(20 DAP C1')-(20 DAP C2') -35.7 -5.7 &rst iat = 624, 626, 627, 645, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 20 DAP NU1: (20 DAP O4')-(20 DAP C1')-(20 DAP C2')-(20 DAP C3') 18.8 48.8 &rst iat = 626, 627, 645, 643, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 20 DAP NU2: (20 DAP C1')-(20 DAP C2')-(20 DAP C3')-(20 DAP C4') -49.0 -19.0 &rst iat = 627, 645, 643, 624, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 20 DAP NU3: (20 DAP C2')-(20 DAP C3')-(20 DAP C4')-(20 DAP O4') 6.2 36.2 &rst iat = 645, 643, 624, 626, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 20 DAP NU4: (20 DAP C3')-(20 DAP C4')-(20 DAP O4')-(20 DAP C1') -15.3 14.7 &rst iat = 643, 624, 626, 627, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 21 GUA NU0: (21 DG C4')-(21 DG O4')-(21 DG C1')-(21 DG C2') -35.7 -5.7 &rst iat = 657, 659, 660, 679, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 21 GUA NU1: (21 DG O4')-(21 DG C1')-(21 DG C2')-(21 DG C3') 18.8 48.8 &rst iat = 659, 660, 679, 677, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 21 GUA NU2: (21 DG C1')-(21 DG C2')-(21 DG C3')-(21 DG C4') -49.0 -19.0 &rst iat = 660, 679, 677, 657, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 21 GUA NU3: (21 DG C2')-(21 DG C3')-(21 DG C4')-(21 DG O4') 6.2 36.2 &rst iat = 679, 677, 657, 659, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 21 GUA NU4: (21 DG C3')-(21 DG C4')-(21 DG O4')-(21 DG C1') -15.3 14.7 &rst iat = 677, 657, 659, 660, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 22 GUA NU0: (22 DG C4')-(22 DG O4')-(22 DG C1')-(22 DG C2') -35.7 -5.7 &rst iat = 690, 692, 693, 712, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 22 GUA NU1: (22 DG O4')-(22 DG C1')-(22 DG C2')-(22 DG C3') 18.8 48.8 &rst iat = 692, 693, 712, 710, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 22 GUA NU2: (22 DG C1')-(22 DG C2')-(22 DG C3')-(22 DG C4') -49.0 -19.0 &rst iat = 693, 712, 710, 690, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 22 GUA NU3: (22 DG C2')-(22 DG C3')-(22 DG C4')-(22 DG O4') 6.2 36.2 &rst iat = 712, 710, 690, 692, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 22 GUA NU4: (22 DG C3')-(22 DG C4')-(22 DG O4')-(22 DG C1') -15.3 14.7 &rst iat = 710, 690, 692, 693, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 23 GUA NU0: (23 DG3 C4')-(23 DG3 O4')-(23 DG3 C1')-(23 DG3 C2') -35.7 -5.7 &rst iat = 723, 725, 726, 745, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 23 GUA NU1: (23 DG3 O4')-(23 DG3 C1')-(23 DG3 C2')-(23 DG3 C3') 18.8 48.8 &rst iat = 725, 726, 745, 743, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 23 GUA NU2: (23 DG3 C1')-(23 DG3 C2')-(23 DG3 C3')-(23 DG3 C4') -49.0 -19.0 &rst iat = 726, 745, 743, 723, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 23 GUA NU3: (23 DG3 C2')-(23 DG3 C3')-(23 DG3 C4')-(23 DG3 O4') 6.2 36.2 &rst iat = 745, 743, 723, 725, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 23 GUA NU4: (23 DG3 C3')-(23 DG3 C4')-(23 DG3 O4')-(23 DG3 C1') -15.3 14.7 &rst iat = 743, 723, 725, 726, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # Restraints file 4: amber.crd
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