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 |
|
|
497585 |
2l56   |
cing | 1-original | 1 | unknown | distance | NOE | simple |
#AUTHOR USED MR FILE FROM PDB ENTRY 2OVN.
!set message=off echo=off end
!
! Weak NOE = 5.0, Medium NOE = 3.5, Strong NOE = 2.7
!
! W 1.8 0.0 5.0
! M 1.8 0.0 3.5
! S 1.8 0.0 2.7
!
! CSPKRYH # +1.0
! Tyr, Phe # +2.0
! Leu, Ile # +2.5
! Ala, Thr # +1.5
!
! H-BONDS
NOE Hydrogen-atom pair NOE upper
bound [nm]
seq. nr.
1 HN(31) - HA(30) 0.350
2 HN(31) - HN(30) 0.500
3 HN(30) - HA(29) 0.350
4 HN(30) - HN(29) 0.500
5 HN(30) - HN(28) 0.350
6 HN(29) - HA(28) 0.350
7 HN(29) - HA(26) 0.500
8 HN(29) - HA(25) 0.500
9 HN(29) - HN(28) 0.270
10 HN(28) - HA(27) 0.350
11 HN(28) - HA(25) 0.500
12 HN(28) - HN(27) 0.270
13 HN(28) - HN(26) 0.500
14 HN(27) - HN(26) 0.270
15 HN(27) - HN(25) 0.500
16 HN(26) - HA(25) 0.350
17 HN(26) - HA(23) 0.350
18 HN(26) - HA(22) 0.500
19 HN(26) - HN(25) 0.350
20 HN(26) - HN(24) 0.500
21 HN(25) - HA(24) 0.350
22 HN(25) - HA(22) 0.350
23 HN(25) - HA(21) 0.500
24 HN(25) - HN(24) 0.270
25 HN(24) - HA(23) 0.350
26 HN(24) - HA(22) 0.500
27 HN(24) - HA(21) 0.350
28 HN(24) - HN(23) 0.350
29 HN(24) - HN(22) 0.500
30 HN(23) - HA(22) 0.350
31 HN(23) - HA(21) 0.500
32 HN(23) - HA(20) 0.350
33 HN(23) - HA(19) 0.500
34 HN(23) - HN(22) 0.270
35 HN(23) - HN(21) 0.500
36 HN(22) - HA(21) 0.350
37 HN(22) - HA(19) 0.500
38 HN(22) - HA(20) 0.500
39 HN(22) - HN(21) 0.350
40 HN(22) - HN(20) 0.500
41 HN(21) - HA(20) 0.350
42 HN(21) - HA(18) 0.500
43 HN(21) - HA(17) 0.500
44 HN(21) - HN(20) 0.270
45 HN(21) - HN(19) 0.500
46 HN(20) - HA(19) 0.350
47 HN(20) - HA(18) 0.500
48 HN(20) - HA(17) 0.500
49 HN(20) - HN(18) 0.500
50 HN(20) - HN(19) 0.270
51 HN(19) - HA(18) 0.350
52 HN(19) - HN(18) 0.500
53 HN(18) - HN(17) 0.500
54 HN(18) - HN(16) 0.500
55 HN(17) - HA(16) 0.500
56 HN(17) - HN(16) 0.500
57 HA(16) - HB1(19) 0.500
58 HA(16) - HB2(19) 0.500
59 HA(17) - HB@(20) 0.590
60 HA(18) - HB@(21) 0.440
61 HA(19) - HB@(22) 0.440
62 HA(19) - HG@(22) 0.590
63 HA(20) - HB(23) 0.350
64 HA(21) - HB@(24) 0.450
65 HA(22) - HB1(25) 0.350
66 HA(22) - HB2(25) 0.350
67 HA(23) - HB@(26) 0.440
68 HA(24) - HB1(27) 0.500
69 HA(24) - HB2(27) 0.500
70 HA(26) - HB@(29) 0.440
71 HA(27) - HB(30) 0.500
72 HN(20) - HB@(20) 0.360
73 HN(20) - HG@(20) 0.360
74 HN(20) - HB1(19) 0.350
75 HN(20) - HB2(19) 0.350
76 HN(20) - HD@(19) 0.720
77 HN(21) - HB@(21) 0.360
78 HN(21) - HB@(20) 0.590
79 HN(21) - HG@(20) 0.590
80 HN(21) - HG@(25) 0.590
81 HN(22) - HB@(22) 0.360
82 HN(22) - HG@(22) 0.440
83 HN(22) - HB@(21) 0.440
84 HN(22) - HG@(23) 0.570
85 HN(17) - HD@(17) 0.710
86 HN(21) - HD@(21) 0.600
87 HN(29) - HB@(29) 0.440
88 HN(29) - HG(29) 0.350
89 HN(24) - HB(23) 0.350
90 HN(24) - HB@(24) 0.520
91 HN(24) - HG1@(23) 0.700
92 HN(24) - HG2@(23) 0.700
93 HN(24) - HB@(25) 0.690
94 HN(19) - HB1(18) 0.500
95 HN(19) - HB2(18) 0.500
96 HN(30) - HB(30) 0.350
97 HN(30) - HB@(29) 0.590
98 HN(30) - HG(29) 0.270
99 HN(30) - HG@(30) 0.570
100 HN(19) - HB@(19) 0.590
101 HN(23) - HB(23) 0.600
102 HN(23) - HG@(22) 0.440
103 HN(23) - HB@(22) 0.440
104 HN(23) - HG@(23) 0.680
105 HN(25) - HB@(22) 0.590
106 HN(25) - HB2(25) 0.350
107 HN(25) - HB1(25) 0.350
108 HN(25) - HG2(25) 0.500
109 HN(25) - HG1(25) 0.500
110 HN(25) - HB@(24) 0.400
111 HN(26) - HB1(25) 0.350
112 HN(26) - HB2(25) 0.350
113 HN(26) - HG2(25) 0.500
114 HN(26) - HG1(25) 0.500
115 HN(26) - HB1(26) 0.350
116 HN(26) - HB2(26) 0.350
117 HN(26) - HD1@(26) 0.600
118 HN(26) - HD2@(26) 0.600
119 HE1(18) - HB@(18) 0.590
120 HE1(18) - HD1@(19) 0.600
121 HE1(18) - HD2@(19) 0.600
122 HE1(18) - HE@(17) 0.710
123 HE1(18) - HD@(17) 0.710
124 HD@(17) - HB1(17) 0.560
125 HD@(17) - HB2(17) 0.560
126 HD@(17) - HD1@(19) 0.810
127 HD@(17) - HD2@(19) 0.810
128 HD@(17) - HA(17) 0.560
129 HE@(17) - HA(17) 0.810
130 HE@(17) - HB1(17) 0.810
131 HE@(17) - HB2(17) 0.810
132 HE@(17) - HD1@(19) 0.760
133 HE@(17) - HD2@(19) 0.760
134 HD2(18) - HB@(18) 0.360
135 HD2(18) - HD1@(19) 0.600
136 HD2(18) - HD2@(19) 0.600
137 HD2(18) - HA(18) 0.350
138 HE1(18) - HG@(22) 0.590
139 HD2(18) - HB@(20) 0.590
140 HD2(18) - HG@(20) 0.590
141 HD2(18) - HG@(22) 0.590
142 HD@(17) - HB@(20) 0.850
143 HE@(17) - HB@(22) 0.850
144 HD@(17) - HG@(20) 0.800
145 HD@(17) - HG@(22) 0.800
146 HE@(17) - HG@(20) 0.800
147 HE@(17) - HG@(22) 0.800
148 HG@(22) - HD1(25) 0.440
149 HG@(22) - HD2(25) 0.440
150 HD1(25) - HB@(21) 0.590
151 HD1(25) - HA(25) 0.500
152 HD1(25) - HA(22) 0.500
153 HD2(25) - HB@(21) 0.590
154 HD2(25) - HA(25) 0.500
155 HD2(25) - HA(22) 0.350
156 HD1@(26) - HB@(25) 0.540
157 HD2@(26) - HB@(25) 0.540
158 HA(22) - HG@(25) 0.440
159 HG@(22) - HB@(19) 0.680
160 HG@(22) - HG@(23) 0.810
161 HG@(22) - HD@(19) 0.660
162 HB@(22) - HB@(19) 0.680
163 HB@(22) - HB@(26) 0.680
164 HB@(22) - HD@(25) 0.680
165 HB@(22) - HA(19) 0.440
166 HB@(24) - HB@(21) 0.640
167 HA(21) - HB@(20) 0.590
168 HA(21) - HG@(20) 0.590
169 HA(18) - HB1(19) 0.550
170 HA(18) - HB2(19) 0.550
171 HA(17) - HG@(20) 0.590
172 HB@(17) - HD@(19) 0.660
173 HB@(17) - HB@(19) 0.530
174 HA(16) - HD@@(19) 0.720
175 HA(23) - HB@(26) 0.590
176 HA(23) - HG(26) 0.500
177 HA(23) - HG@(22) 0.590
178 HG@(23) - HG@(22) 0.810
179 HG@(23) - HA(20) 0.720
!
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