NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
5989 |
1iba   |
cing | 1-original | 1 | DYANA/DIANA | distance | NOE | simple |
# DIANA distance restraints, upper limits (.upl)
15 MET
H 15 MET HA 2.80 1.00E+01
H 15 MET QB 3.50
H 15 MET QG 3.70
H 16 ALA H 2.80 1.00E+01
HA 16 ALA H 3.50
HA 18 ALA H 3.50
HA 18 ALA QB 3.50
QB 16 ALA H 4.50
16 ALA
H 16 ALA HA 2.80 1.00E+01
H 16 ALA QB 3.50
H 17 PRO QD 4.50
QB 17 PRO QB 5.50
QB 57 LEU QQD 6.70
QB 87 TYR H 6.00
QB 87 TYR HA 6.00
QB 87 TYR QB 6.70
17 PRO
QD 18 ALA H 4.50
QD 19 LEU H 4.50
QD 19 LEU QB 6.00
QD 20 VAL QQG 7.50
18 ALA
H 18 ALA HA 2.80 1.00E+01
H 18 ALA QB 3.70
H 19 LEU H 2.80 1.00E+01
H 20 VAL H 4.50 1.00E+01
H 20 VAL QQG 6.70
H 21 ALA QB 6.00
H 87 TYR HA 6.00
H 87 TYR QB 6.70
HA 19 LEU H 3.50 1.00E+01
HA 21 ALA H 3.50 1.00E+01
HA 21 ALA QB 4.50 1.00E+01
HA 22 ALA H 4.50 1.00E+01
QB 19 LEU H 3.50
QB 21 ALA H 4.50
O 22 ALA N 3.30 1.00E+01
O 22 ALA H 2.30 1.00E+01
19 LEU
H 19 LEU QB 3.70
H 19 LEU QQD 6.70
H 20 VAL H 2.80 1.00E+01
HA 20 VAL H 3.50 1.00E+01
HA 22 ALA H 3.50 1.00E+01
HA 22 ALA QB 4.50 1.00E+01
QB 20 VAL H 4.50
HG 20 VAL H 5.00
HG 54 LEU QQD 6.70
QQD 20 VAL H 6.70
QQD 22 ALA H 6.70
QQD 22 ALA QB 6.70
QQD 23 PHE H 6.70
QQD 51 GLN QG 6.70
QQD 54 LEU QQD 6.70
O 23 PHE N 3.30 1.00E+01
O 23 PHE H 2.30 1.00E+01
20 VAL
H 20 VAL HA 2.80 1.00E+01
H 20 VAL HB 2.80
H 21 ALA H 2.80 1.00E+01
HA 21 ALA H 3.50 1.00E+01
HA 23 PHE H 3.50 1.00E+01
HA 24 GLY H 5.50
HB 21 ALA H 4.50
QQG 21 ALA H 5.50
QQG 21 ALA HA 4.50
QQG 23 PHE QB 6.70
QQG 25 GLY H 7.70
QQG 84 MET HA 6.70
QQG 84 MET QB 6.70
QQG 87 TYR QB 6.70
O 24 GLY N 3.30 1.00E+01
O 24 GLY H 2.30 1.00E+01
21 ALA
H 21 ALA HA 2.80 1.00E+01
HA 22 ALA H 3.50 1.00E+01
HA 24 GLY H 3.50 1.00E+01
HA 25 GLY H 4.50
HA 25 GLY QA 6.50
QB 22 ALA H 5.50
QB 22 ALA HA 5.50
O 25 GLY N 3.30 1.00E+01
O 25 GLY H 2.30 1.00E+01
22 ALA
H 22 ALA HA 2.80 1.00E+01
H 22 ALA QB 3.50
H 23 PHE H 2.80 1.00E+01
HA 23 PHE H 3.50 1.00E+01
HA 24 GLY H 4.50
HA 50 ASP H 5.50
HA 50 ASP QB 5.50
QB 23 PHE H 3.50
QB 23 PHE QB 5.50
QB 50 ASP QB 5.50
QB 54 LEU H 5.50
QB 54 LEU HA 5.50
QB 54 LEU QB 6.70
QB 54 LEU HG 5.50
QB 54 LEU QQD 6.70
23 PHE
H 23 PHE HA 2.80 1.00E+01
H 23 PHE QB 3.50
H 24 GLY H 2.80 1.00E+01
H 49 VAL QQG 6.70
H 51 GLN HA 5.50
HA 23 PHE QR 4.50
HA 24 GLY H 3.50
HA 26 LYS H 3.50
HA 43 VAL QQG 6.70
HA 49 VAL HA 5.50
HA 49 VAL QQG 6.70
QR 45 ASP H 6.70
QR 49 VAL QQG 6.70
QR 51 GLN QG 6.70
QR 54 LEU QQD 6.70
24 GLY
H 25 GLY H 2.80
QA 26 LYS QB 6.50
QA 39 LEU QB 6.50
25 GLY
H 26 LYS QG 4.50
QA 26 LYS H 3.50
QA 26 LYS QG 5.50
26 LYS
H 26 LYS HA 2.80
H 26 LYS QB 3.50
H 26 LYS HG2 3.50
H 26 LYS HG1 2.80
H 26 LYS HD1 2.80
H 27 GLU H 3.50 1.00E+01
HA 26 LYS HG2 3.50
HA 26 LYS HG1 3.50
HA 26 LYS HD1 4.50
HA 27 GLU H 3.50
HA 28 ASN H 4.50
QB 27 GLU H 5.50
QG 27 GLU H 5.50
QD 27 GLU H 5.50
QE 45 ASP QB 5.50
27 GLU
H 27 GLU HA 2.80
H 27 GLU QB 3.70
H 27 GLU QG 5.50
H 28 ASN H 2.80 1.00E+01
HA 27 GLU QG 3.50
HA 28 ASN H 3.50
QB 28 ASN H 4.00
QG 28 ASN QB 4.50
28 ASN
H 28 ASN HA 2.80
H 28 ASN QB 2.80
H 29 ILE H 2.80 1.00E+01
HA 29 ILE H 3.50
QB 29 ILE H 4.50
29 ILE
H 29 ILE HB 2.80
H 29 ILE HG12 4.50
H 29 ILE QD1 3.50
H 43 VAL HB 5.50
H 43 VAL QQG 6.70
HA 29 ILE HB 2.80
HA 29 ILE QG2 3.50
HA 29 ILE QD1 3.50
HA 30 THR H 2.50
HA 31 ASN H 4.50
HA 41 VAL QQG 6.70
HA 43 VAL HA 5.50
HA 43 VAL QQG 6.70
HB 29 ILE QD1 3.50
QG2 30 THR H 4.50
QG2 31 ASN H 4.50
QG2 41 VAL QQG 6.70
QG1 31 ASN H 5.50
QD1 41 VAL QQG 6.70
30 THR
H 30 THR HB 3.50
H 30 THR QG2 3.50
H 31 ASN H 2.80
H 43 VAL H 5.50
H 43 VAL HA 3.50 1.00E+01
HA 30 THR HB 2.50
HA 30 THR QG2 3.50
HA 43 VAL QQG 6.70
HB 43 VAL HB 5.50
HB 43 VAL QQG 6.70
31 ASN
N 42 SER O 3.30 1.00E+01
H 31 ASN HA 2.80
H 32 LEU QQD 6.70
H 41 VAL QQG 6.70
H 42 SER H 3.50 1.00E+01
H 42 SER QB 5.50
H 42 SER O 2.30 1.00E+01
H 43 VAL QQG 6.70
HA 32 LEU H 2.50 1.00E+01
HA 32 LEU QB 4.50
QB 42 SER H 5.50
QB 42 SER QB 5.50
O 42 SER N 3.30 1.00E+01
O 42 SER H 2.30 1.00E+01
32 LEU
H 32 LEU QB 3.50
H 32 LEU QQD 6.70
HA 33 ASP H 2.50 1.00E+01
HA 41 VAL HA 2.50 1.00E+01
HA 41 VAL QQG 6.70
HA 42 SER H 3.50 1.00E+01
QB 33 ASP H 5.00
QB 33 ASP HA 5.00
QB 40 ARG H 5.50
HG 41 VAL QQG 6.70
QQD 33 ASP H 6.70
QQD 40 ARG QB 6.70
QQD 41 VAL HA 6.70
QQD 41 VAL HB 6.70
QQD 41 VAL QQG 6.70
33 ASP
N 40 ARG O 3.30 1.00E+01
H 33 ASP HA 2.80
H 33 ASP QB 3.50
H 40 ARG H 3.50 1.00E+01
H 40 ARG O 2.30 1.00E+01
H 41 VAL HA 3.50 1.00E+01
H 41 VAL QQG 6.70
HA 34 ALA H 2.50 1.00E+01
QB 34 ALA H 4.50
O 40 ARG N 3.30 1.00E+01
O 40 ARG H 2.30 1.00E+01
34 ALA
H 34 ALA HA 2.80
H 34 ALA QB 3.50
HA 35 CYS H 2.50 1.00E+01
HA 39 LEU HA 2.50 1.00E+01
HA 40 ARG H 3.50 1.00E+01
QB 35 CYS H 3.50
QB 39 LEU HA 4.50
QB 39 LEU QB 5.50
QB 40 ARG H 5.50
35 CYS
N 38 ARG O 3.30 1.00E+01
H 38 ARG H 3.50 1.00E+01
H 38 ARG O 2.30 1.00E+01
H 39 LEU HA 3.50 1.00E+01
HA 36 ILE H 3.60
QB 36 ILE H 2.80
QB 39 LEU HA 4.50
O 38 ARG N 3.30 1.00E+01
O 38 ARG H 2.30 1.00E+01
36 ILE
HA 36 ILE QG2 3.50
HA 36 ILE QD1 4.00
HB 38 ARG H 5.00
QG2 37 THR H 4.50
QG1 37 THR H 5.50
QG1 38 ARG H 4.50
QD1 38 ARG QB 5.50
37 THR
HA 39 LEU HG 5.50
O 73 PHE N 3.30 1.00E+01
O 73 PHE H 2.30 1.00E+01
38 ARG
H 39 LEU H 4.50
HA 39 LEU H 2.50 1.00E+01
HA 71 ALA QB 5.50
HA 72 ILE HA 2.50 1.00E+01
HA 72 ILE QG1 5.50
HA 73 PHE H 3.50 1.00E+01
39 LEU
N 71 ALA O 3.30 1.00E+01
H 39 LEU QB 3.50
H 39 LEU HG 3.50
H 39 LEU QQD 6.70
H 71 ALA H 3.50 1.00E+01
H 71 ALA QB 5.50
H 71 ALA O 2.30 1.00E+01
HA 39 LEU HG 3.50
HA 40 ARG H 2.50 1.00E+01
QB 41 VAL QQG 6.70
QB 71 ALA H 5.50
QB 71 ALA QB 5.50
HG 41 VAL QQG 6.70
QQD 40 ARG H 6.70
QQD 41 VAL QQG 6.70
QQD 71 ALA QB 6.70
QQD 72 ILE HA 6.70
O 71 ALA N 3.30 1.00E+01
O 71 ALA H 2.30 1.00E+01
40 ARG
H 40 ARG QG 3.70
HA 41 VAL H 2.50 1.00E+01
HA 70 GLN HA 2.50 1.00E+01
HA 71 ALA H 3.50 1.00E+01
HA 71 ALA HA 2.50 1.00E+01
HA 71 ALA QB 5.50
41 VAL
N 69 VAL O 3.30 1.00E+01
H 41 VAL HB 2.80
H 43 VAL QQG 6.70
H 69 VAL H 3.50 1.00E+01
H 69 VAL QQG 6.70
H 69 VAL O 2.30 1.00E+01
H 70 GLN HA 3.50 1.00E+01
HA 42 SER H 2.50 1.00E+01
HB 69 VAL H 4.50
HB 69 VAL HB 4.50
QQG 42 SER H 6.70
QQG 43 VAL H 6.70
QQG 43 VAL HB 6.70
O 69 VAL N 3.30 1.00E+01
O 69 VAL H 2.30 1.00E+01
42 SER
H 42 SER QB 3.50
H 43 VAL QQG 5.50
HA 43 VAL H 2.50 1.00E+01
HA 43 VAL QQG 6.70
HA 68 GLY QA 4.00
HA 69 VAL H 3.50 1.00E+01
QB 43 VAL H 4.50
43 VAL
H 43 VAL QQG 3.80
H 68 GLY QA 4.50
HA 43 VAL HB 2.80
HA 44 ALA H 3.50
HA 44 ALA QB 5.50
HB 44 ALA H 2.80
HB 45 ASP H 5.50
QQG 44 ALA H 6.70
QQG 45 ASP H 6.70
QQG 46 VAL H 6.70
QQG 46 VAL HA 6.70
QQG 46 VAL HB 6.70
QQG 68 GLY QA 6.70
QQG 69 VAL H 6.70
44 ALA
H 44 ALA HA 2.80
H 44 ALA QB 3.50
H 45 ASP H 3.50
H 45 ASP QB 5.50
HA 46 VAL QQG 6.70
QB 45 ASP HA 4.50
QB 45 ASP QB 6.50
QB 46 VAL QQG 6.70
45 ASP
H 45 ASP HA 2.80
H 45 ASP QB 3.50
HA 46 VAL H 2.80
HA 46 VAL QQG 6.00
HA 47 SER H 4.50
QB 46 VAL HB 5.50
QB 49 VAL QQG 6.70
46 VAL
H 46 VAL HA 3.50
H 46 VAL HB 3.50
H 47 SER H 3.50
HA 46 VAL HB 2.80
HA 47 SER QB 5.50
HA 49 VAL H 5.00
HA 49 VAL HB 4.50
HA 49 VAL QQG 6.70
QQG 47 SER H 6.70
QQG 47 SER HA 6.70
QQG 47 SER QB 6.70
47 SER
H 47 SER HA 2.80
H 47 SER QB 3.70
H 48 LYS H 3.50
48 LYS
H 48 LYS HA 2.80
H 48 LYS QG 4.50
H 48 LYS QD 3.50
H 49 VAL H 2.80
H 49 VAL QQG 6.70
HA 48 LYS QD 3.50
QB 49 VAL H 5.50
QB 49 VAL HA 5.50
QG 50 ASP H 6.00
QD 49 VAL H 6.00
QD 49 VAL HA 5.50
49 VAL
H 49 VAL HA 2.80
H 49 VAL HB 2.80
HA 49 VAL HB 2.80
HA 50 ASP H 2.80
QQG 48 LYS H 6.70
QQG 50 ASP H 6.70
QQG 50 ASP HA 6.70
QQG 51 GLN H 6.70
QQG 51 GLN HA 6.70
QQG 51 GLN QG 6.70
QQG 53 GLY H 6.70
QQG 54 LEU QQD 6.70
QQG 64 VAL QQG 6.70
50 ASP
H 50 ASP QB 2.80
HA 51 GLN H 2.80
HA 51 GLN HG1 4.50
HA 52 ALA QB 5.50
51 GLN
H 51 GLN HA 2.80
H 51 GLN QB 2.80
H 51 GLN QG 3.50
HA 51 GLN QG 3.50
HA 52 ALA H 3.50
HA 52 ALA QB 5.50
HA 54 LEU HG 5.00
QB 52 ALA H 3.50
QB 55 LYS QD 6.00
HG1 54 LEU H 5.50
QG 54 LEU H 5.50
52 ALA
H 52 ALA HA 2.80
H 52 ALA QB 3.50
H 53 GLY H 2.80
HA 54 LEU H 4.50
HA 55 LYS H 4.50
HA 55 LYS QB 4.50
HA 55 LYS QD 4.50
HA 56 LYS H 4.50
HA 56 LYS QD 5.50
HA 64 VAL QQG 6.70
QB 53 GLY QA 5.50
53 GLY
H 54 LEU H 2.80
QA 54 LEU HA 4.50
QA 54 LEU QB 5.50
QA 56 LYS H 4.50
QA 56 LYS QB 6.00
O 57 LEU N 3.30
O 57 LEU H 2.30
54 LEU
H 54 LEU HA 2.80
H 54 LEU QB 2.80
H 54 LEU HG 4.00
H 54 LEU QQD 6.70
H 55 LYS H 2.80
HA 54 LEU HG 2.80
HA 55 LYS H 3.50
HA 57 LEU H 3.50
HA 57 LEU QB 4.50
HA 57 LEU QQD 6.70
QB 55 LYS H 4.50
QB 58 GLY QA 4.50
HG 57 LEU QB 5.50
HG 57 LEU QQD 6.70
HG 58 GLY QA 3.50
QQD 55 LYS H 6.70
QQD 57 LEU QQD 7.20
QQD 58 GLY QA 7.20
QQD 62 VAL QQG 7.20
QQD 71 ALA QB 7.20
O 58 GLY N 3.30
O 58 GLY H 2.30
55 LYS
H 55 LYS HA 2.80
H 55 LYS QB 3.50
H 55 LYS QG 4.50
H 56 LYS H 2.80
HA 55 LYS QG 3.50
HA 56 LYS H 3.50
HA 58 GLY H 3.50
HA 59 ALA QB 6.00
QB 56 LYS H 5.50
QB 59 ALA QB 6.50
HG1 56 LYS H 4.50
QD 56 LYS QG 5.50
O 59 ALA N 3.30
O 59 ALA H 2.30
56 LYS
H 56 LYS HA 2.80
H 56 LYS QB 3.50
H 56 LYS HG2 3.50
H 56 LYS QD 5.50
H 57 LEU H 2.80
HA 56 LYS QG 3.80
HA 57 LEU H 3.50
HA 58 GLY H 4.50
HA 59 ALA H 4.50
QB 56 LYS QE 3.50
QB 57 LEU H 4.50
HG2 57 LEU QB 4.00
57 LEU
H 57 LEU HA 2.80
H 57 LEU QB 2.80
H 57 LEU QQD 6.70
H 58 GLY H 2.80
HA 57 LEU HG 3.50
HA 58 GLY H 3.50
HA 59 ALA H 5.50
QQD 80 LEU HA 6.70
QQD 84 MET QG 7.20
58 GLY
H 59 ALA H 2.80
QA 62 VAL QQG 6.70
QA 84 MET QG 5.50
59 ALA
H 59 ALA HA 2.80
H 59 ALA QB 3.50
H 61 GLY H 4.50
HA 60 ALA H 3.50
HA 60 ALA QB 4.50
HA 61 GLY H 4.50
HA 73 PHE HA 4.50
QB 60 ALA H 3.50
QB 60 ALA HA 4.50
QB 61 GLY H 3.50
QB 62 VAL HB 4.50
QB 62 VAL QQG 5.06
QB 72 ILE H 5.50
QB 73 PHE H 6.40
QB 73 PHE HA 5.40
60 ALA
H 60 ALA HA 2.80
H 60 ALA QB 3.50
H 61 GLY H 3.50
H 61 GLY QA 5.50
H 72 ILE HB 5.50
H 72 ILE QG2 5.50
H 73 PHE HA 5.50
H 73 PHE QB 5.50
H 80 LEU QQD 6.70
HA 61 GLY H 2.50 1.00E+01
HA 73 PHE HA 2.50 1.00E+01
QB 61 GLY H 4.50
QB 72 ILE H 5.50
QB 72 ILE QG2 5.50
61 GLY
N 72 ILE O 3.30 1.00E+01
H 62 VAL QQG 6.70
H 71 ALA QB 6.70
H 72 ILE H 3.50 1.00E+01
H 72 ILE HB 4.50
H 72 ILE O 2.30 1.00E+01
H 73 PHE HA 3.50 1.00E+01
QA 62 VAL H 3.50
QA 62 VAL QQG 5.50
QA 72 ILE QG2 5.50
QA 72 ILE QD1 6.70
O 72 ILE N 3.30 1.00E+01
O 72 ILE H 2.30 1.00E+01
62 VAL
HA 62 VAL HB 2.80
HA 63 VAL H 2.50 1.00E+01
HA 63 VAL QQG 6.70
HA 71 ALA HA 2.50
HA 72 ILE H 3.50 1.00E+01
HB 64 VAL QQG 6.70
HB 70 GLN QG 5.50
HB 72 ILE QD1 6.70
QG1 71 ALA QB 5.50
QQG 63 VAL H 6.70
QQG 63 VAL QQG 6.70
QQG 69 VAL QQG 6.70
QQG 70 GLN QG 7.20
QQG 71 ALA HA 6.70
QQG 71 ALA QB 6.70
QQG 72 ILE HB 6.70
63 VAL
N 70 GLN O 3.30 1.00E+01
H 63 VAL HB 3.50
H 63 VAL QQG 4.00
H 70 GLN H 3.50 1.00E+01
H 70 GLN QB 5.50
H 70 GLN O 2.30 1.00E+01
H 71 ALA HA 3.50 1.00E+01
HA 63 VAL HB 2.50
HA 64 VAL H 2.50
HA 64 VAL HB 4.50
HB 70 GLN QB 5.50
QQG 64 VAL H 6.70
QQG 64 VAL HA 6.70
QQG 65 ALA HA 6.70
QQG 65 ALA QB 6.70
O 70 GLN N 3.30 1.00E+01
O 70 GLN H 2.30 1.00E+01
64 VAL
H 64 VAL HB 3.50
HA 65 ALA H 2.50 1.00E+01
HA 69 VAL HA 2.50 1.00E+01
HA 70 GLN H 3.50 1.00E+01
QQG 65 ALA H 6.70
QQG 65 ALA HA 6.70
QQG 66 GLY QA 6.70
QQG 69 VAL HA 6.70
QQG 69 VAL QQG 6.70
65 ALA
N 68 GLY O 3.30 1.00E+01
H 65 ALA HA 2.80
H 65 ALA QB 3.50
H 68 GLY H 3.50
H 68 GLY O 2.30 1.00E+01
H 69 VAL HA 3.50 1.00E+01
O 68 GLY N 3.30 1.00E+01
O 68 GLY H 2.30 1.00E+01
66 GLY
QA 67 SER HA 4.50
67 SER
H 68 GLY H 4.50
H 69 VAL HA 5.50
HA 68 GLY H 3.50
HA 68 GLY QA 4.50
68 GLY
QA 69 VAL H 3.00
69 VAL
H 69 VAL HA 2.80
H 69 VAL HB 2.80
HA 69 VAL HB 2.80
HA 70 GLN H 2.50 1.00E+01
HB 71 ALA QB 5.50
QQG 70 GLN H 6.70
70 GLN
H 70 GLN QG 4.40
HA 71 ALA H 2.50 1.00E+01
HA 71 ALA QB 4.50
71 ALA
H 71 ALA QB 3.50
H 72 ILE HB 5.50
HA 72 ILE H 2.50 1.00E+01
QB 72 ILE HA 4.50
72 ILE
H 72 ILE HB 3.50
H 72 ILE QD1 4.50
HA 72 ILE QD1 4.50
HA 73 PHE H 2.50 1.00E+01
HB 72 ILE QD1 3.50
QG2 72 ILE QD1 4.50
QG2 73 PHE H 4.50
QG2 74 GLY H 5.50
QG1 73 PHE H 4.50
QG1 74 GLY H 4.50
73 PHE
H 73 PHE QB 3.50
H 74 GLY H 2.80
QB 80 LEU H 6.50
QB 81 LYS QB 6.70
74 GLY
QA 76 LYS H 5.50
76 LYS
H 76 LYS HA 2.80 1.00E+01
H 76 LYS QD 4.50
H 77 SER H 3.50 1.00E+01
HA 79 ASN H 3.50 1.00E+01
HA 79 ASN QB 3.50 1.00E+01
QB 79 ASN QB 6.70
QG 77 SER H 5.50
QG 78 ASP H 6.50
O 80 LEU N 3.30 1.00E+01
O 80 LEU H 2.30 1.00E+01
77 SER
H 77 SER HA 2.80 1.00E+01
H 77 SER QB 3.70
H 78 ASP H 4.50 1.00E+01
HA 78 ASP H 3.50 1.00E+01
HA 80 LEU H 3.50 1.00E+01
HA 80 LEU QB 3.50 1.00E+01
O 81 LYS N 3.30 1.00E+01
O 81 LYS H 2.30 1.00E+01
78 ASP
H 78 ASP HA 2.80 1.00E+01
H 78 ASP QB 3.50
H 79 ASN H 2.80 1.00E+01
HA 79 ASN H 3.50 1.00E+01
HA 81 LYS H 3.50 1.00E+01
HA 81 LYS QB 3.50 1.00E+01
QB 79 ASN H 3.50
O 82 THR N 3.30 1.00E+01
O 82 THR H 2.30 1.00E+01
79 ASN
H 79 ASN HA 2.80 1.00E+01
H 79 ASN QB 3.70
H 80 LEU H 3.50 1.00E+01
HA 80 LEU H 3.50 1.00E+01
HA 82 THR H 4.50 1.00E+01
HA 82 THR HB 4.50 1.00E+01
QB 80 LEU H 4.50
O 83 GLU N 3.30 1.00E+01
O 83 GLU H 2.30 1.00E+01
80 LEU
H 80 LEU HA 2.80 1.00E+01
H 80 LEU HG 3.50
H 80 LEU QQD 6.70
H 81 LYS H 2.80 1.00E+01
HA 81 LYS H 3.50 1.00E+01
HA 83 GLU H 4.50 1.00E+01
HA 83 GLU QB 5.50 1.00E+01
QB 81 LYS H 4.00
QQD 84 MET QG 6.70
O 84 MET N 3.30 1.00E+01
O 84 MET H 2.30 1.00E+01
81 LYS
H 81 LYS HA 2.80 1.00E+01
H 81 LYS QB 3.50
H 82 THR H 2.80 1.00E+01
HA 81 LYS QG 3.50
HA 82 THR H 3.50 1.00E+01
HA 84 MET H 3.50 1.00E+01
HA 84 MET QB 4.50 1.00E+01
QB 82 THR H 4.50
QB 85 ASP QB 6.00
QE 82 THR H 5.50
O 85 ASP N 3.30 1.00E+01
O 85 ASP H 2.30 1.00E+01
82 THR
H 82 THR HA 2.80 1.00E+01
H 82 THR HB 3.50
H 82 THR QG2 4.50
H 83 GLU H 2.80 1.00E+01
HA 82 THR QG2 3.50
HA 83 GLU H 3.50 1.00E+01
HA 85 ASP H 3.50 1.00E+01
HA 85 ASP QB 4.50 1.00E+01
HB 83 GLU H 3.50
QG2 83 GLU H 4.50
QG2 83 GLU QB 6.70
QG2 84 MET H 6.00
QG2 85 ASP QB 6.70
O 86 GLU N 3.30 1.00E+01
O 86 GLU H 2.30 1.00E+01
83 GLU
H 83 GLU HA 2.80 1.00E+01
H 83 GLU QB 3.50
H 83 GLU HG2 3.50
H 84 MET H 2.80 1.00E+01
HA 83 GLU QG 4.00
HA 84 MET H 3.50 1.00E+01
HA 84 MET QG 5.50
HA 86 GLU H 4.50 1.00E+01
HA 86 GLU QB 4.50 1.00E+01
QB 87 TYR H 5.50
O 87 TYR N 3.30 1.00E+01
O 87 TYR H 2.30 1.00E+01
84 MET
H 84 MET HA 2.80 1.00E+01
H 84 MET QB 3.70
H 85 ASP H 2.80 1.00E+01
H 85 ASP QB 5.00
HA 85 ASP H 3.50 1.00E+01
HA 85 ASP QB 6.00
HA 87 TYR H 3.50 1.00E+01
HA 87 TYR QB 4.50 1.00E+01
HA 88 ILE QD1 4.50
QB 85 ASP H 4.50
O 88 ILE N 3.30 1.00E+01
O 88 ILE H 2.30 1.00E+01
85 ASP
H 85 ASP HA 2.80 1.00E+01
H 85 ASP QB 3.70
H 86 GLU H 2.80 1.00E+01
H 88 ILE QD1 6.70
HA 86 GLU H 3.50 1.00E+01
HA 86 GLU QB 6.50
HA 88 ILE H 3.50 1.00E+01
HA 88 ILE HB 3.50 1.00E+01
HA 88 ILE QD1 6.70
QB 86 GLU H 4.50
QB 88 ILE QD1 6.70
O 89 ARG N 3.30 1.00E+01
O 89 ARG H 2.30 1.00E+01
86 GLU
H 86 GLU HA 2.80 1.00E+01
H 86 GLU QG 3.50
H 87 TYR H 2.80 1.00E+01
H 88 ILE QD1 4.50
HA 87 TYR H 3.50
HA 89 ARG H 3.50 1.00E+01
HA 89 ARG QB 3.50 1.00E+01
QB 89 ARG QB 6.00
O 90 ASN N 3.30 1.00E+01
O 90 ASN H 2.30 1.00E+01
87 TYR
H 87 TYR HA 2.80 1.00E+01
H 87 TYR QB 3.50
H 88 ILE H 2.80 1.00E+01
H 89 ARG H 4.50 1.00E+01
HA 88 ILE QD1 6.50
HA 90 ASN H 3.50 1.00E+01
HA 90 ASN QB 4.50 1.00E+01
HA 91 PHE H 4.50 1.00E+01
QB 88 ILE H 3.50
QB 91 PHE QB 6.70
O 91 PHE N 3.30 1.00E+01
O 91 PHE H 2.30 1.00E+01
88 ILE
H 88 ILE HA 2.80 1.00E+01
H 88 ILE HB 3.50
H 88 ILE QD1 5.50
H 89 ARG H 3.50 1.00E+01
HA 88 ILE QD1 4.50
HA 91 PHE H 3.50 1.00E+01
HA 91 PHE QB 3.50 1.00E+01
HB 88 ILE QD1 3.50
HB 89 ARG H 3.50
HB 89 ARG QD 5.50
QG2 89 ARG QG 5.50
QD1 89 ARG H 5.50
QD1 89 ARG HA 6.00
QD1 89 ARG QB 6.50
O 92 GLY N 3.30 1.00E+01
O 92 GLY H 2.30 1.00E+01
89 ARG
H 89 ARG HA 2.80
H 89 ARG QB 3.50
H 90 ASN H 3.50 1.00E+01
HA 89 ARG QG 3.50
HA 89 ARG QD 4.50
HA 90 ASN H 3.50
QB 90 ASN H 4.50
90 ASN
H 90 ASN HA 2.80
H 90 ASN QB 2.80
91 PHE
H 91 PHE HA 2.80
HA 92 GLY H 2.80
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