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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650176 |
6sx6   |
34436 | cing | 1-original | 3 | AMBER | dihedral angle |
## Restraints file 3: Torsion_angle_restraint.txt #Torsion restraints # 1 GUA CHI: (1 DG5 O4')-(1 DG5 C1')-(1 DG5 N9)-(1 DG5 C4) 30.0 90.0 &rst iat = 8, 9, 11, 25, r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0, rk2 = 200.0, rk3 = 200.0, &end # 2 CYT CHI: (2 DC O4')-(2 DC C1')-(2 DC N1)-(2 DC C2) 200.0 280.0 &rst iat = 41, 42, 44, 54, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 3 GUA CHI: (3 DG O4')-(3 DG C1')-(3 DG N9)-(3 DG C4) 200.0 280.0 &rst iat = 71, 72, 74, 88, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 4 GUA CHI: (4 DG O4')-(4 DG C1')-(4 DG N9)-(4 DG C4) 200.0 280.0 &rst iat = 104, 105, 107, 121, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 5 ADE CHI: (5 DA O4')-(5 DA C1')-(5 DA N9)-(5 DA C4) 200.0 280.0 &rst iat = 137, 138, 140, 153, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 6 GUA CHI: (6 DG O4')-(6 DG C1')-(6 DG N9)-(6 DG C4) 200.0 280.0 &rst iat = 169, 170, 172, 186, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 7 GUA CHI: (7 DG O4')-(7 DG C1')-(7 DG N9)-(7 DG C4) 200.0 280.0 &rst iat = 202, 203, 205, 219, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 8 GUA CHI: (8 DG O4')-(8 DG C1')-(8 DG N9)-(8 DG C4) 200.0 280.0 &rst iat = 235, 236, 238, 252, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 9 GUA CHI: (9 DG O4')-(9 DG C1')-(9 DG N9)-(9 DG C4) 200.0 280.0 &rst iat = 268, 269, 271, 285, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 10 ADE CHI: (10 DA O4')-(10 DA C1')-(10 DA N9)-(10 DA C4) 200.0 280.0 &rst iat = 301, 302, 304, 317, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 11 GUA CHI: (11 DG O4')-(11 DG C1')-(11 DG N9)-(11 DG C4) 200.0 280.0 &rst iat = 333, 334, 336, 350, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 12 GUA CHI: (12 DG3 O4')-(12 DG3 C1')-(12 DG3 N9)-(12 DG3 C4) 200.0 280.0 &rst iat = 366, 367, 369, 383, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 13 GUA CHI: (13 DG5 O4')-(13 DG5 C1')-(13 DG5 N9)-(13 DG5 C4) 30.0 90.0 &rst iat = 398, 399, 401, 415, r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0, &end # 14 CYT CHI: (14 DC O4')-(14 DC C1')-(14 DC N1)-(14 DC C2) 200.0 280.0 &rst iat = 431, 432, 434, 444, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 15 GUA CHI: (15 DG O4')-(15 DG C1')-(15 DG N9)-(15 DG C4) 200.0 280.0 &rst iat = 461, 462, 464, 478, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 16 GUA CHI: (16 DG O4')-(16 DG C1')-(16 DG N9)-(16 DG C4) 200.0 280.0 &rst iat = 494, 495, 497, 511, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 17 ADE CHI: (17 DA O4')-(17 DA C1')-(17 DA N9)-(17 DA C4) 200.0 280.0 &rst iat = 527, 528, 530, 543, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 18 GUA CHI: (18 DG O4')-(18 DG C1')-(18 DG N9)-(18 DG C4) 200.0 280.0 &rst iat = 559, 560, 562, 576, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 19 GUA CHI: (19 DG O4')-(19 DG C1')-(19 DG N9)-(19 DG C4) 200.0 280.0 &rst iat = 592, 593, 595, 609, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 20 GUA CHI: (20 DG O4')-(20 DG C1')-(20 DG N9)-(20 DG C4) 200.0 280.0 &rst iat = 625, 626, 628, 642, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 21 GUA CHI: (21 DG O4')-(21 DG C1')-(21 DG N9)-(21 DG C4) 200.0 280.0 &rst iat = 658, 659, 661, 675, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 22 ADE CHI: (22 DA O4')-(22 DA C1')-(22 DA N9)-(22 DA C4) 200.0 280.0 &rst iat = 691, 692, 694, 707, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 23 GUA CHI: (23 DG O4')-(23 DG C1')-(23 DG N9)-(23 DG C4) 200.0 280.0 &rst iat = 723, 724, 726, 740, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 24 GUA CHI: (24 DG3 O4')-(24 DG3 C1')-(24 DG3 N9)-(24 DG3 C4) 200.0 280.0 &rst iat = 756, 757, 759, 773, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 24 GUA CHI: (24 DG3 O4')-(24 DG3 C1')-(24 DG3 N9)-(24 DG3 C4) 200.0 280.0 &rst iat = 756, 757, 759, 773, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 1 GUA EPSILON: (1 DG5 C4')-(1 DG5 C3')-(1 DG5 O3')-(2 DC P) 170.0 290.0 &rst iat = 6, 26, 31, 32, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 2 CYT EPSILON: (2 DC C4')-(2 DC C3')-(2 DC O3')-(3 DG P) 170.0 290.0 &rst iat = 39, 56, 61, 62, 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 = 69, 89, 94, 95, 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 DA P) 170.0 290.0 &rst iat = 102, 122, 127, 128, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 5 ADE EPSILON: (5 DA C4')-(5 DA C3')-(5 DA O3')-(6 DG P) 170.0 290.0 &rst iat = 135, 154, 159, 160, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 6 GUA EPSILON: (6 DG C4')-(6 DG C3')-(6 DG O3')-(7 DG P) 170.0 290.0 &rst iat = 167, 187, 192, 193, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 7 GUA EPSILON: (7 DG C4')-(7 DG C3')-(7 DG O3')-(8 DG P) 170.0 290.0 &rst iat = 200, 220, 225, 226, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 8 GUA EPSILON: (8 DG C4')-(8 DG C3')-(8 DG O3')-(9 DG P) 170.0 290.0 &rst iat = 233, 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 DA 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 ADE EPSILON: (10 DA C4')-(10 DA C3')-(10 DA O3')-(11 DG P) 170.0 290.0 &rst iat = 299, 318, 323, 324, 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 DG3 P) 170.0 290.0 &rst iat = 331, 351, 356, 357, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 13 GUA EPSILON: (13 DG5 C4')-(13 DG5 C3')-(13 DG5 O3')-(14 DC P) 170.0 290.0 &rst iat = 396, 416, 421, 422, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 14 CYT EPSILON: (14 DC C4')-(14 DC C3')-(14 DC O3')-(15 DG P) 170.0 290.0 &rst iat = 429, 446, 451, 452, 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 = 459, 479, 484, 485, 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 DA P) 170.0 290.0 &rst iat = 492, 512, 517, 518, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 17 ADE EPSILON: (17 DA C4')-(17 DA C3')-(17 DA O3')-(18 DG P) 170.0 290.0 &rst iat = 525, 544, 549, 550, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 18 GUA EPSILON: (18 DG C4')-(18 DG C3')-(18 DG O3')-(19 DG P) 170.0 290.0 &rst iat = 557, 577, 582, 583, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 19 GUA EPSILON: (19 DG C4')-(19 DG C3')-(19 DG O3')-(20 DG P) 170.0 290.0 &rst iat = 590, 610, 615, 616, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 20 GUA EPSILON: (20 DG C4')-(20 DG C3')-(20 DG O3')-(21 DG P) 170.0 290.0 &rst iat = 623, 643, 648, 649, 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 DA P) 170.0 290.0 &rst iat = 656, 676, 681, 682, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 22 ADE EPSILON: (22 DA C4')-(22 DA C3')-(22 DA O3')-(23 DG P) 170.0 290.0 &rst iat = 689, 708, 713, 714, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 23 GUA EPSILON: (23 DG C4')-(23 DG C3')-(23 DG O3')-(24 DG3 P) 170.0 290.0 &rst iat = 721, 741, 746, 747, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 23 GUA EPSILON: (23 DG C4')-(23 DG C3')-(23 DG O3')-(24 DG3 P) 170.0 290.0 &rst iat = 721, 741, 746, 747, r1 = 169.0, r2 = 170.0, r3 = 290.0, r4 = 291.0, &end # 1 GUA NU0: (1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2') -35.7 -5.7 &rst iat = 6, 8, 9, 28, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 1 GUA NU1: (1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3') 18.8 48.8 &rst iat = 8, 9, 28, 26, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 1 GUA NU2: (1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4') -49.0 -19.0 &rst iat = 9, 28, 26, 6, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 1 GUA NU3: (1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4') 6.2 36.2 &rst iat = 28, 26, 6, 8, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 1 GUA NU4: (1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1') -15.3 14.7 &rst iat = 26, 6, 8, 9, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 2 CYT NU0: (2 DC C4')-(2 DC O4')-(2 DC C1')-(2 DC C2') -35.7 -5.7 &rst iat = 39, 41, 42, 58, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 2 CYT NU1: (2 DC O4')-(2 DC C1')-(2 DC C2')-(2 DC C3') 18.8 48.8 &rst iat = 41, 42, 58, 56, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 2 CYT NU2: (2 DC C1')-(2 DC C2')-(2 DC C3')-(2 DC C4') -49.0 -19.0 &rst iat = 42, 58, 56, 39, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 2 CYT NU3: (2 DC C2')-(2 DC C3')-(2 DC C4')-(2 DC O4') 6.2 36.2 &rst iat = 58, 56, 39, 41, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 2 CYT NU4: (2 DC C3')-(2 DC C4')-(2 DC O4')-(2 DC C1') -15.3 14.7 &rst iat = 56, 39, 41, 42, 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 = 69, 71, 72, 91, 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 = 71, 72, 91, 89, 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 = 72, 91, 89, 69, 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 = 91, 89, 69, 71, 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 = 89, 69, 71, 72, 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 = 102, 104, 105, 124, 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 = 104, 105, 124, 122, 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 = 105, 124, 122, 102, 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 = 124, 122, 102, 104, 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 = 122, 102, 104, 105, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 7 GUA NU0: (7 DG C4')-(7 DG O4')-(7 DG C1')-(7 DG C2') -35.7 -5.7 &rst iat = 200, 202, 203, 222, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 7 GUA NU1: (7 DG O4')-(7 DG C1')-(7 DG C2')-(7 DG C3') 18.8 48.8 &rst iat = 202, 203, 222, 220, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 7 GUA NU2: (7 DG C1')-(7 DG C2')-(7 DG C3')-(7 DG C4') -49.0 -19.0 &rst iat = 203, 222, 220, 200, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 7 GUA NU3: (7 DG C2')-(7 DG C3')-(7 DG C4')-(7 DG O4') 6.2 36.2 &rst iat = 222, 220, 200, 202, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 7 GUA NU4: (7 DG C3')-(7 DG C4')-(7 DG O4')-(7 DG C1') -15.3 14.7 &rst iat = 220, 200, 202, 203, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 8 GUA NU0: (8 DG C4')-(8 DG O4')-(8 DG C1')-(8 DG C2') -35.7 -5.7 &rst iat = 233, 235, 236, 255, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 8 GUA NU1: (8 DG O4')-(8 DG C1')-(8 DG C2')-(8 DG C3') 18.8 48.8 &rst iat = 235, 236, 255, 253, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 8 GUA NU2: (8 DG C1')-(8 DG C2')-(8 DG C3')-(8 DG C4') -49.0 -19.0 &rst iat = 236, 255, 253, 233, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 8 GUA NU3: (8 DG C2')-(8 DG C3')-(8 DG C4')-(8 DG O4') 6.2 36.2 &rst iat = 255, 253, 233, 235, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 8 GUA NU4: (8 DG C3')-(8 DG C4')-(8 DG O4')-(8 DG C1') -15.3 14.7 &rst iat = 253, 233, 235, 236, 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 ADE NU0: (10 DA C4')-(10 DA O4')-(10 DA C1')-(10 DA C2') -14.4 18.1 &rst iat = 299, 301, 302, 320, r1 = -15.4, r2 = -14.4, r3 = 18.1, r4 = 19.1, &end # 10 ADE NU1: (10 DA O4')-(10 DA C1')-(10 DA C2')-(10 DA C3') -37.0 -7.0 &rst iat = 301, 302, 320, 318, r1 = -38.0, r2 = -37.0, r3 = -7.0, r4 = -6.0, &end # 10 ADE NU2: (10 DA C1')-(10 DA C2')-(10 DA C3')-(10 DA C4') 19.0 49.0 &rst iat = 302, 320, 318, 299, r1 = 18.0, r2 = 19.0, r3 = 49.0, r4 = 50.0, &end # 10 ADE NU3: (10 DA C2')-(10 DA C3')-(10 DA C4')-(10 DA O4') -47.6 -17.6 &rst iat = 320, 318, 299, 301, r1 = -48.6, r2 = -47.6, r3 = -17.6, r4 = -16.6, &end # 10 ADE NU4: (10 DA C3')-(10 DA C4')-(10 DA O4')-(10 DA C1') 4.0 34.0 &rst iat = 318, 299, 301, 302, r1 = 3.0, r2 = 4.0, r3 = 34.0, r4 = 35.0, &end # 11 GUA NU0: (11 DG C4')-(11 DG O4')-(11 DG C1')-(11 DG C2') -35.7 -5.7 &rst iat = 331, 333, 334, 353, 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 = 333, 334, 353, 351, 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 = 334, 353, 351, 331, 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 = 353, 351, 331, 333, 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 = 351, 331, 333, 334, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 12 GUA NU0: (12 DG3 C4')-(12 DG3 O4')-(12 DG3 C1')-(12 DG3 C2') -35.7 -5.7 &rst iat = 364, 366, 367, 386, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 12 GUA NU1: (12 DG3 O4')-(12 DG3 C1')-(12 DG3 C2')-(12 DG3 C3') 18.8 48.8 &rst iat = 366, 367, 386, 384, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 12 GUA NU2: (12 DG3 C1')-(12 DG3 C2')-(12 DG3 C3')-(12 DG3 C4') -49.0 -19.0 &rst iat = 367, 386, 384, 364, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 12 GUA NU3: (12 DG3 C2')-(12 DG3 C3')-(12 DG3 C4')-(12 DG3 O4') 6.2 36.2 &rst iat = 386, 384, 364, 366, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 12 GUA NU4: (12 DG3 C3')-(12 DG3 C4')-(12 DG3 O4')-(12 DG3 C1') -15.3 14.7 &rst iat = 384, 364, 366, 367, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 13 GUA NU0: (13 DG5 C4')-(13 DG5 O4')-(13 DG5 C1')-(13 DG5 C2') -35.7 -5.7 &rst iat = 396, 398, 399, 418, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 13 GUA NU1: (13 DG5 O4')-(13 DG5 C1')-(13 DG5 C2')-(13 DG5 C3') 18.8 48.8 &rst iat = 398, 399, 418, 416, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 13 GUA NU2: (13 DG5 C1')-(13 DG5 C2')-(13 DG5 C3')-(13 DG5 C4') -49.0 -19.0 &rst iat = 399, 418, 416, 396, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 13 GUA NU3: (13 DG5 C2')-(13 DG5 C3')-(13 DG5 C4')-(13 DG5 O4') 6.2 36.2 &rst iat = 418, 416, 396, 398, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 13 GUA NU4: (13 DG5 C3')-(13 DG5 C4')-(13 DG5 O4')-(13 DG5 C1') -15.3 14.7 &rst iat = 416, 396, 398, 399, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 14 CYT NU0: (14 DC C4')-(14 DC O4')-(14 DC C1')-(14 DC C2') -35.7 -5.7 &rst iat = 429, 431, 432, 448, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 14 CYT NU1: (14 DC O4')-(14 DC C1')-(14 DC C2')-(14 DC C3') 18.8 48.8 &rst iat = 431, 432, 448, 446, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 14 CYT NU2: (14 DC C1')-(14 DC C2')-(14 DC C3')-(14 DC C4') -49.0 -19.0 &rst iat = 432, 448, 446, 429, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 14 CYT NU3: (14 DC C2')-(14 DC C3')-(14 DC C4')-(14 DC O4') 6.2 36.2 &rst iat = 448, 446, 429, 431, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 14 CYT NU4: (14 DC C3')-(14 DC C4')-(14 DC O4')-(14 DC C1') -15.3 14.7 &rst iat = 446, 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 = 459, 461, 462, 481, 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 = 461, 462, 481, 479, 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 = 462, 481, 479, 459, 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 = 481, 479, 459, 461, 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 = 479, 459, 461, 462, 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 = 492, 494, 495, 514, 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 = 494, 495, 514, 512, 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 = 495, 514, 512, 492, 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 = 514, 512, 492, 494, 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 = 512, 492, 494, 495, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 19 GUA NU0: (19 DG C4')-(19 DG O4')-(19 DG C1')-(19 DG C2') -35.7 -5.7 &rst iat = 590, 592, 593, 612, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 19 GUA NU1: (19 DG O4')-(19 DG C1')-(19 DG C2')-(19 DG C3') 18.8 48.8 &rst iat = 592, 593, 612, 610, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 19 GUA NU2: (19 DG C1')-(19 DG C2')-(19 DG C3')-(19 DG C4') -49.0 -19.0 &rst iat = 593, 612, 610, 590, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 19 GUA NU3: (19 DG C2')-(19 DG C3')-(19 DG C4')-(19 DG O4') 6.2 36.2 &rst iat = 612, 610, 590, 592, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 19 GUA NU4: (19 DG C3')-(19 DG C4')-(19 DG O4')-(19 DG C1') -15.3 14.7 &rst iat = 610, 590, 592, 593, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 20 GUA NU0: (20 DG C4')-(20 DG O4')-(20 DG C1')-(20 DG C2') -35.7 -5.7 &rst iat = 623, 625, 626, 645, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 20 GUA NU1: (20 DG O4')-(20 DG C1')-(20 DG C2')-(20 DG C3') 18.8 48.8 &rst iat = 625, 626, 645, 643, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 20 GUA NU2: (20 DG C1')-(20 DG C2')-(20 DG C3')-(20 DG C4') -49.0 -19.0 &rst iat = 626, 645, 643, 623, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 20 GUA NU3: (20 DG C2')-(20 DG C3')-(20 DG C4')-(20 DG O4') 6.2 36.2 &rst iat = 645, 643, 623, 625, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 20 GUA NU4: (20 DG C3')-(20 DG C4')-(20 DG O4')-(20 DG C1') -15.3 14.7 &rst iat = 643, 623, 625, 626, 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 = 656, 658, 659, 678, 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 = 658, 659, 678, 676, 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 = 659, 678, 676, 656, 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 = 678, 676, 656, 658, 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 = 676, 656, 658, 659, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 22 ADE NU0: (22 DA C4')-(22 DA O4')-(22 DA C1')-(22 DA C2') -14.4 18.1 &rst iat = 689, 691, 692, 710, r1 = -15.4, r2 = -14.4, r3 = 18.1, r4 = 19.1, &end # 22 ADE NU1: (22 DA O4')-(22 DA C1')-(22 DA C2')-(22 DA C3') -37.0 -7.0 &rst iat = 691, 692, 710, 708, r1 = -38.0, r2 = -37.0, r3 = -7.0, r4 = -6.0, &end # 22 ADE NU2: (22 DA C1')-(22 DA C2')-(22 DA C3')-(22 DA C4') 19.0 49.0 &rst iat = 692, 710, 708, 689, r1 = 18.0, r2 = 19.0, r3 = 49.0, r4 = 50.0, &end # 22 ADE NU3: (22 DA C2')-(22 DA C3')-(22 DA C4')-(22 DA O4') -47.6 -17.6 &rst iat = 710, 708, 689, 691, r1 = -48.6, r2 = -47.6, r3 = -17.6, r4 = -16.6, &end # 22 ADE NU4: (22 DA C3')-(22 DA C4')-(22 DA O4')-(22 DA C1') 4.0 34.0 &rst iat = 708, 689, 691, 692, r1 = 3.0, r2 = 4.0, r3 = 34.0, r4 = 35.0, &end # 23 GUA NU0: (23 DG C4')-(23 DG O4')-(23 DG C1')-(23 DG C2') -35.7 -5.7 &rst iat = 721, 723, 724, 743, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 23 GUA NU1: (23 DG O4')-(23 DG C1')-(23 DG C2')-(23 DG C3') 18.8 48.8 &rst iat = 723, 724, 743, 741, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 23 GUA NU2: (23 DG C1')-(23 DG C2')-(23 DG C3')-(23 DG C4') -49.0 -19.0 &rst iat = 724, 743, 741, 721, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 23 GUA NU3: (23 DG C2')-(23 DG C3')-(23 DG C4')-(23 DG O4') 6.2 36.2 &rst iat = 743, 741, 721, 723, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 23 GUA NU4: (23 DG C3')-(23 DG C4')-(23 DG O4')-(23 DG C1') -15.3 14.7 &rst iat = 741, 721, 723, 724, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end # 24 GUA NU0: (24 DG3 C4')-(24 DG3 O4')-(24 DG3 C1')-(24 DG3 C2') -35.7 -5.7 &rst iat = 754, 756, 757, 776, r1 = -36.7, r2 = -35.7, r3 = -5.7, r4 = -4.7, &end # 24 GUA NU1: (24 DG3 O4')-(24 DG3 C1')-(24 DG3 C2')-(24 DG3 C3') 18.8 48.8 &rst iat = 756, 757, 776, 774, r1 = 17.8, r2 = 18.8, r3 = 48.8, r4 = 49.8, &end # 24 GUA NU2: (24 DG3 C1')-(24 DG3 C2')-(24 DG3 C3')-(24 DG3 C4') -49.0 -19.0 &rst iat = 757, 776, 774, 754, r1 = -50.0, r2 = -49.0, r3 = -19.0, r4 = -18.0, &end # 24 GUA NU3: (24 DG3 C2')-(24 DG3 C3')-(24 DG3 C4')-(24 DG3 O4') 6.2 36.2 &rst iat = 776, 774, 754, 756, r1 = 5.2, r2 = 6.2, r3 = 36.2, r4 = 37.2, &end # 24 GUA NU4: (24 DG3 C3')-(24 DG3 C4')-(24 DG3 O4')-(24 DG3 C1') -15.3 14.7 &rst iat = 774, 754, 756, 757, r1 = -16.3, r2 = -15.3, r3 = 14.7, r4 = 15.7, &end
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