Solution NMR structure of designed peptide BH26 (RGVTVPHNGESKDYSV)
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 1 | ARG | H | H | 8.482 | ||
2 | 1 | 1 | ARG | HA | H | 4.236 | ||
3 | 1 | 1 | ARG | HB2 | H | 1.819 | ||
4 | 1 | 1 | ARG | HB3 | H | 1.819 | ||
5 | 1 | 1 | ARG | CA | C | 56.559 | ||
6 | 1 | 1 | ARG | CB | C | 30.622 | ||
7 | 1 | 1 | ARG | N | N | 126.820 | ||
8 | 1 | 2 | GLY | H | H | 8.643 | ||
9 | 1 | 2 | GLY | HA2 | H | 3.928 | ||
10 | 1 | 2 | GLY | HA3 | H | 3.928 | ||
11 | 1 | 2 | GLY | CA | C | 45.347 | ||
12 | 1 | 2 | GLY | N | N | 110.716 | ||
13 | 1 | 3 | VAL | H | H | 8.072 | ||
14 | 1 | 3 | VAL | HA | H | 4.147 | ||
15 | 1 | 3 | VAL | HB | H | 2.035 | ||
16 | 1 | 3 | VAL | CA | C | 62.217 | ||
17 | 1 | 3 | VAL | CB | C | 32.648 | ||
18 | 1 | 3 | VAL | N | N | 119.733 | ||
19 | 1 | 4 | THR | H | H | 8.466 | ||
20 | 1 | 4 | THR | HA | H | 4.327 | ||
21 | 1 | 4 | THR | HB | H | 4.069 | ||
22 | 1 | 4 | THR | CA | C | 63.021 | ||
23 | 1 | 4 | THR | CB | C | 69.833 | ||
24 | 1 | 4 | THR | N | N | 117.479 | ||
25 | 1 | 5 | VAL | H | H | 8.418 | ||
26 | 1 | 5 | VAL | HA | H | 4.371 | ||
27 | 1 | 5 | VAL | HB | H | 2.025 | ||
28 | 1 | 5 | VAL | CA | C | 59.802 | ||
29 | 1 | 5 | VAL | CB | C | 32.407 | ||
30 | 1 | 5 | VAL | N | N | 125.726 | ||
31 | 1 | 6 | PRO | HA | H | 4.318 | ||
32 | 1 | 6 | PRO | HB2 | H | 2.214 | ||
33 | 1 | 6 | PRO | HB3 | H | 2.214 | ||
34 | 1 | 6 | PRO | CA | C | 61.905 | ||
35 | 1 | 6 | PRO | CB | C | 32.225 | ||
36 | 1 | 7 | HIS | H | H | 8.746 | ||
37 | 1 | 7 | HIS | HA | H | 4.638 | ||
38 | 1 | 7 | HIS | HB2 | H | 3.185 | ||
39 | 1 | 7 | HIS | HB3 | H | 3.185 | ||
40 | 1 | 7 | HIS | CA | C | 55.235 | ||
41 | 1 | 7 | HIS | CB | C | 28.910 | ||
42 | 1 | 7 | HIS | N | N | 119.353 | ||
43 | 1 | 8 | ASN | H | H | 8.357 | ||
44 | 1 | 8 | ASN | HA | H | 4.584 | ||
45 | 1 | 8 | ASN | HB2 | H | 2.744 | ||
46 | 1 | 8 | ASN | HB3 | H | 2.744 | ||
47 | 1 | 8 | ASN | CA | C | 53.295 | ||
48 | 1 | 8 | ASN | CB | C | 39.287 | ||
49 | 1 | 8 | ASN | N | N | 120.282 | ||
50 | 1 | 9 | GLY | H | H | 8.590 | ||
51 | 1 | 9 | GLY | HA2 | H | 3.909 | ||
52 | 1 | 9 | GLY | HA3 | H | 3.909 | ||
53 | 1 | 9 | GLY | CA | C | 45.284 | ||
54 | 1 | 9 | GLY | N | N | 109.944 | ||
55 | 1 | 10 | GLU | H | H | 8.275 | ||
56 | 1 | 10 | GLU | HA | H | 4.354 | ||
57 | 1 | 10 | GLU | HB2 | H | 2.080 | ||
58 | 1 | 10 | GLU | HB3 | H | 2.080 | ||
59 | 1 | 10 | GLU | CA | C | 55.806 | ||
60 | 1 | 10 | GLU | CB | C | 29.183 | ||
61 | 1 | 10 | GLU | N | N | 119.864 | ||
62 | 1 | 11 | SER | H | H | 8.465 | ||
63 | 1 | 11 | SER | HA | H | 4.352 | ||
64 | 1 | 11 | SER | HB2 | H | 3.835 | ||
65 | 1 | 11 | SER | HB3 | H | 3.835 | ||
66 | 1 | 11 | SER | CA | C | 58.554 | ||
67 | 1 | 11 | SER | CB | C | 63.687 | ||
68 | 1 | 11 | SER | N | N | 120.135 | ||
69 | 1 | 12 | LYS | H | H | 8.485 | ||
70 | 1 | 12 | LYS | HA | H | 4.215 | ||
71 | 1 | 12 | LYS | HB2 | H | 1.667 | ||
72 | 1 | 12 | LYS | HB3 | H | 1.667 | ||
73 | 1 | 12 | LYS | CA | C | 56.418 | ||
74 | 1 | 12 | LYS | CB | C | 32.745 | ||
75 | 1 | 12 | LYS | N | N | 123.375 | ||
76 | 1 | 13 | ASP | H | H | 8.643 | ||
77 | 1 | 13 | ASP | HA | H | 4.652 | ||
78 | 1 | 13 | ASP | HB2 | H | 2.754 | ||
79 | 1 | 13 | ASP | HB3 | H | 2.754 | ||
80 | 1 | 13 | ASP | CA | C | 53.299 | ||
81 | 1 | 13 | ASP | CB | C | 38.825 | ||
82 | 1 | 13 | ASP | N | N | 120.641 | ||
83 | 1 | 14 | TYR | H | H | 8.202 | ||
84 | 1 | 14 | TYR | HA | H | 4.494 | ||
85 | 1 | 14 | TYR | HB2 | H | 3.036 | ||
86 | 1 | 14 | TYR | HB3 | H | 3.036 | ||
87 | 1 | 14 | TYR | CA | C | 58.161 | ||
88 | 1 | 14 | TYR | CB | C | 38.611 | ||
89 | 1 | 14 | TYR | N | N | 121.687 | ||
90 | 1 | 15 | SER | H | H | 8.245 | ||
91 | 1 | 15 | SER | HA | H | 4.373 | ||
92 | 1 | 15 | SER | HB2 | H | 3.775 | ||
93 | 1 | 15 | SER | HB3 | H | 3.775 | ||
94 | 1 | 15 | SER | CA | C | 58.241 | ||
95 | 1 | 15 | SER | CB | C | 63.797 | ||
96 | 1 | 15 | SER | N | N | 118.097 | ||
97 | 1 | 16 | VAL | H | H | 8.115 | ||
98 | 1 | 16 | VAL | HA | H | 4.040 | ||
99 | 1 | 16 | VAL | HB | H | 2.047 | ||
100 | 1 | 16 | VAL | CA | C | 62.142 | ||
101 | 1 | 16 | VAL | CB | C | 32.392 | ||
102 | 1 | 16 | VAL | N | N | 122.209 |