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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619521 |
5u9b   |
30210 | cing | 1-original | 2 | DYANA/DIANA | dihedral angle |
# Restraints file 2: tnt6d.aco
#Num Res Ang Low High
#A
95 RGU GAMMA 20.0 100.0
95 RGU DELTA 55.0 190.0
95 RGU EPSI 170.0 300.0
# 95 RGU ZETA -120.0 120.0
# 95 RGU CHI -170.0 -70.0
96 URA ALPHA -120.0 120.0
96 URA BETA 140.0 220.0
96 URA GAMMA 20.0 100.0
96 URA DELTA 55.0 190.0
96 URA EPSLN 170.0 300.0
96 URA ZETA -120.0 120.0
# 96 URA CHI -170.0 -70.0
97 RCY ALPHA -120.0 120.0
97 RCY BETA 140.0 220.0
97 RCY GAMMA 20.0 100.0
97 RCY DELTA 55.0 190.0
97 RCY EPSI 170.0 300.0
97 RCY ZETA -120.0 120.0
# 97 RCY CHI -170.0 -70.0
98 URA ALPHA -120.0 120.0
98 URA BETA 140.0 220.0
98 URA GAMMA 20.0 100.0
98 URA DELTA 55.0 190.0
98 URA EPSLN 170.0 300.0
98 URA ZETA -120.0 120.0
# 98 URA CHI -170.0 -70.0
99 RCY ALPHA -120.0 120.0
99 RCY BETA 140.0 220.0
99 RCY GAMMA 20.0 100.0
99 RCY DELTA 55.0 190.0
99 RCY EPSI 170.0 300.0
99 RCY ZETA -120.0 120.0
# 99 RCY CHI -170.0 -70.0
#1202 100 RGU ALPHA -120.0 120.0
#1202 100 RGU BETA 140.0 220.0
#1202 100 RGU GAMMA 20.0 100.0
#1202 100 RGU DELTA 55.0 190.0
#1202 100 RGU EPSLN 170.0 300.0
#1202 100 RGU ZETA -120.0 120.0
#100 RGU CHI -170.0 -70.0
101 RCY ALPHA -120.0 120.0
101 RCY BETA 140.0 220.0
101 RCY GAMMA 20.0 100.0
101 RCY DELTA 55.0 190.0
101 RCY EPSI 170.0 300.0
101 RCY ZETA -120.0 120.0
#101 RCY CHI -170.0 -70.0
102 URA ALPHA -120.0 120.0
102 URA BETA 140.0 220.0
102 URA GAMMA 20.0 100.0
102 URA DELTA 55.0 190.0
102 URA EPSLN 170.0 300.0
102 URA ZETA -120.0 120.0
#102 URA CHI -170.0 -70.0
103 URA ALPHA -120.0 120.0
103 URA BETA 140.0 220.0
103 URA GAMMA 20.0 100.0
103 URA DELTA 55.0 190.0
103 URA EPSLN 170.0 300.0
103 URA ZETA -120.0 120.0
#103 URA CHI -170.0 -70.0
104 URA ALPHA -120.0 120.0
104 URA BETA 140.0 220.0
104 URA GAMMA 20.0 100.0
104 URA DELTA 55.0 190.0
104 URA EPSLN 170.0 300.0
104 URA ZETA -120.0 120.0
#104 URA CHI -170.0 -70.0
105 URA ALPHA -120.0 120.0
105 URA BETA 140.0 220.0
105 URA GAMMA 20.0 100.0
105 URA DELTA 55.0 190.0
105 URA EPSLN 170.0 300.0
105 URA ZETA -120.0 120.0
#105 URA CHI -170.0 -70.0
106 RCY ALPHA -120.0 120.0
106 RCY BETA 140.0 220.0
106 RCY GAMMA 20.0 100.0
106 RCY DELTA 55.0 190.0
106 RCY EPSI 170.0 300.0
106 RCY ZETA -120.0 120.0
#106 RCY CHI -170.0 -70.0
107 RCY ALPHA -120.0 120.0
107 RCY BETA 140.0 220.0
107 RCY GAMMA 20.0 100.0
107 RCY DELTA 55.0 190.0
107 RCY EPSI 170.0 300.0
107 RCY ZETA -120.0 120.0
#107 RCY CHI -170.0 -70.0
108 RCY ALPHA -120.0 120.0
108 RCY BETA 140.0 220.0
108 RCY GAMMA 20.0 100.0
108 RCY DELTA 55.0 190.0
108 RCY EPSI 170.0 300.0
108 RCY ZETA -120.0 120.0
#108 RCY CHI -170.0 -70.0
109 RCY ALPHA -120.0 120.0
109 RCY BETA 140.0 220.0
109 RCY GAMMA 20.0 100.0
109 RCY DELTA 55.0 190.0
#109 RCY EPSI 170.0 300.0
#109 RCY ZETA -120.0 120.0
#109 RCY CHI -170.0 -70.0
# Restraints file 3: talos.aco
2 ALA PHI -180.0 0.0 # from 2-7 deleted 1/15/2015 re-intro1/19/2015
3 VAL PHI -180.0 0.0
4 SER PHI -180.0 0.0
5 VAL PHI -180.0 0.0
#1/17/2015
# 6 THR PHI -180.0 0.0
6 THR PHI -104.3 -62.5
6 THR PSI 106.5 150.2
7 PRO PHI -180.0 0.0
8 ILE PHI -120 -80
8 ILE PSI 100 160
9 ARG+ PHI -180 0.0 #rein 1/28/2015
9 ARG+ PSI 90 180
10 ASP- PHI -180 0.0 #rein 1/28/2015
10 ASP- PSI 100 170
11 THR PHI -120 -38 #1/27/2015 -107.6 -38.2
# 11 THR PSI 100 180 #1/28/2015#1/27/2015 significant -79.2 19.1
12 LYS+ PHI -100 -20
12 LYS+ PSI -60 20
13 TRP PHI -120 -20 #aug 13 TRP PHI -90 -50
13 TRP PSI -30 0
14 LEU PHI -120 -60
14 LEU PSI -60 0
15 THR PHI -150 -80
15 THR PSI 120 170
16 LEU PHI -150 -100.0
16 LEU PSI 135 180 #1/27/2015 #aug 16 LEU PSI 135 170
17 GLU- PHI -125 -60 #1/27/2015 -115 -60
17 GLU- PSI 115 160 #1/27/2015 115 155
18 VAL PHI -125 -70 #1/27/2015 -110 -70
18 VAL PSI 105 140
19 CYSZ PHI -160.1 -20.1 #re-into 0908
19 CYSZ PSI 100 180 #re-intro 0908
20 ARG+ PHI -110 -50 #1/27/2015 -85 -50
# 20 ARG+ PSI 100 180 #1/28/2015 #1/27/2015 significant -45 -10
21 GLU- PHI -80 -50
21 GLU- PSI -50 -15
22 PHE PHI -90 -50
22 PHE PSI -55 -10
23 GLN PHI -91.0 -48.9
23 GLN PSI -56.3 -16.3
#1/27/2015
24 ARG+ PHI -120 -40
24 ARG+ PSI -60 0
# 25 GLY PHI -83.4 -43.4
# 25 GLY PSI -54.9 -14.2
#1/27/2015
25 GLY PHI 40 80
25 GLY PSI 0 60
27 CYS- PHI -130 -10
27 CYS- PSI 100.0 180.0 #2/2/2015 20/0
28 SER PHI -140 -55 #3/10/2015 20/0 #2/2/2015 10/0 #1/27/2015 0/5 7/18+5/0
28 SER PSI 60 150 #2/2/2015 20/0 #7/18+20/0
29 ARG+ PHI -180 -65 #2/2/2015 30/0 #1/27/2015 0/5 #re-intro 0908 #7/18+5/0
29 ARG+ PSI 90 170 #1/27/2015 0/5 #re-into 0908
30 PRO PHI -180 -0 #reintro Jan2012
30 PRO PSI 120 160 #reintro Jan 2012
32 THR PHI -130 -41.1
32 THR PSI -69.9 30
#1/27/2015
33 GLU- PHI -120 -80
33 GLU- PSI -40 0
34 CYS- PHI -120 -50
34 CYS- PSI 100 170 #3/10/2015 0/10
# 34 CYS- PHI -120 -50 #1/25/2015
# 34 CYS- PSI 110 160
# 35 LYS+ PHI -120 -50 #1/25/2015
# 35 LYS+ PSI 110 160
36 PHE PHI -155 -100 #1/27/2015 0/10
36 PHE PSI 140 180
37 ALA PHI -140 -90
37 ALA PSI 120 150
#1/27/2015
38 HIS PHI -120 -60
38 HIS PSI 40 160
# 38 HIS PHI -180 -31.1
# 38 HIS PSI -58.0 -18.0
# 39 PRO PHI -90 -55 #1/27/2015
39 PRO PSI 135 165
#7/17/2012 #Inserted by sangho
40 SER PHI -105.44 -76.96
40 SER PSI 134.72 182.29
41 LYS+ PHI -85.13 -55.66 #20/0
41 LYS+ PSI -38.10 -17.85
42 SER PHI -91.64 -60.27
42 SER PSI -40.13 -3.51
#aug 40 SER PHI -120 -80
#aug 40 SER PSI 100 180
#aug 41 LYS+ PHI -95 -55
#aug 41 LYS+ PSI -30 10
# 42 SER PHI -110.3 -70.3
# 42 SER PSI -31.3 13.7
# 43 CYS PHI -180 -103.2
# 43 CYS PSI 99.4 180
44 GLN PHI -120 -60 #2/26/2015 0/20
44 GLN PSI 40 150 #3/10/2015 20/0 #2/2/2015 30/0
45 VAL PHI -115 -55 #2/26/2015 0/30
45 VAL PSI 110 145 #1/27/2015 0/10
46 GLU- PHI -155 -90 #1/27/2015 15/0
46 GLU- PSI 115 160
47 ASN PHI 40 60
47 ASN PSI 32 52
#1/27/2015
48 GLY PHI 75 100
48 GLY PSI 0 40
# 48 GLY PHI -114.2 -43.5
# 48 GLY PSI -56.4 14.0
49 ARG+ PHI -155 -90 #1/27/2015 0/35
49 ARG+ PSI 135 170 #1/27/2015 0/10
50 VAL PHI -150 -120
50 VAL PSI 120 160
51 ILE PHI -120 -40 #1/27/2015 0/-40
51 ILE PSI 110 135
52 ALA PHI -131 -75
52 ALA PSI 120 152
54 PHE PHI -75 -48
54 PHE PSI -60 -20 #3/10/2015 15/0
55 ASP- PHI -75 -55
55 ASP- PSI -50 -30
56 SER PHI -76 -56
56 SER PSI -50 -30
57 LEU PHI -75 -50
57 LEU PSI -33 -13
#1/27/2015
58 LYS+ PHI -105 -70
58 LYS+ PSI -10 20
# 58 LYS+ PHI -82.2 -42.2
# 58 LYS+ PSI -61.1 -21.1
59 GLY PHI 50 90
59 GLY PSI 0 45
# 60 ARG+ PHI -109.7 -38.8
# 60 ARG+ PSI -64.2 -4.9
61 CYS- PHI -130 -45 #1/28/2015 0/-5 #1/25/2105 0/40 #SP 11/5/2012 #re-in 11/9/2012
61 CYS- PSI 110 160 #1/25/2015 0/25
#1/27/2015
62 SER PHI -160 -70 #1/28/2015 -140 -70
62 SER PSI 20 150 #2/2/2015 40/0 #1/28/2015 80 150
# 62 SER PHI -135 -70 #1/25/2015
# 62 SER PSI 85 145 #PD 08/15/2011
63 ARG+ PHI -130 -30 #1/25/2015 0/40
63 ARG+ PSI 100 180
# 1/25/2015 suggested by Peter
# 2/13/2015 removed
# 64 GLU- PHI -180 0
# 64 GLU- PSI 80 180
# 65 ASN PHI -180 0
# 65 ASN PSI 80 180
# 64 GLU- PHI -153.2 -40.0
# 64 GLU- PSI 134.0 180
#aug 65 ASN PHI -130 -70
#aug 65 ASN PSI 90 140
66 CYS- PHI -135 -80 #1/27/2015 0/10
66 CYS- PSI 112 152
67 LYS+ PHI -134 -54 #1/25/2015 20/20
# 67 LYS+ PSI 90 167 #1/28/2015 #1/25/2015 rm #aug 110 147
68 TYR PHI -150 -90
68 TYR PSI 130 170
69 LEU PHI -145 -85 #1/27/2015 25/0
69 LEU PSI 100 135
70 HIS PHI -120 -70
70 HIS PSI 105 156
71 PRO PHI -103 -43
71 PRO PSI 135 165
73 PRO PHI -63 -43
73 PRO PSI -46 -26
74 HIS PHI -98.0 -42.0
74 HIS PSI -66.0 6.0
75 LEU PHI -86.0 -46.0
75 LEU PSI -60.0 -20.0
76 LYS+ PHI -83.0 -43.0
76 LYS+ PSI -61.0 -21.0
77 THR PHI -80.0 -40.0
77 THR PSI -63.0 -19.0
78 GLN PHI -81.0 -41.0
78 GLN PSI -63.0 -23.0
79 LEU PHI -81.0 -41.0
79 LEU PSI -63.0 -17.0
80 GLU- PHI -85.0 -45.0
80 GLU- PSI -62.0 -22.0
81 ILE PHI -82.0 -42.0
81 ILE PSI -61.0 -21.0
82 ASN PHI -84.0 -44.0
82 ASN PSI -59.0 -19.0
83 GLY PHI -84.0 -44.0
83 GLY PSI -60.0 -20.0
84 ARG+ PHI -84.0 -44.0
84 ARG+ PSI -64.0 -24.0
85 ASN PHI -82.0 -42.0
85 ASN PSI -56.0 -8.0
86 ASN PHI -104.0 -60.0
86 ASN PSI -60.0 8.0
#1/27/2015
87 LEU PHI -100 -55.1 #3/10/2015 18/0
87 LEU PSI -51.2 0 #2/2/2015 0/25
88 ILE PHI -101.2 -64.2
88 ILE PSI -39.3 2.2
90 GLN PHI -70.0 -50.0
90 GLN PSI -48.3 -21.8
91 LYS+ PHI -88.6 -45.0 #3/10/2015 0/20
91 LYS+ PSI -46.6 0 #3/10/2015 0/14
# 87 LEU PHI -180 -87.0 #1/27/2015
# 87 LEU PSI 134.0 174.0
# 88 ILE PHI -175.0 -99.0 #1/27/2015
# 88 ILE PSI 133.0 173.0
# 89 GLN PHI -172.0 -124.0 #3/10/2015 rm #rein 1/28/2015 #1/27/2015
# 89 GLN PSI 104.0 180.0 #1/27/2015
# 90 GLN PHI -153.0 -69.0 #1/27/2015
# 90 GLN PSI 110.0 166.0
# 91 LYS+ PHI -158.0 -78.0 #1/27/2015
# 91 LYS+ PSI 116.0 156.0 #1/27/2015
# CHI angeles ditermined by SIDER run
16 LEU CHI1 -80 -40
16 LEU CHI2 160 200
18 VAL CHI1 160 200
50 VAL CHI1 160 200
# 57 LEU CHI2 160 180
# 57 LEU CHI1 -80 -40
# 69 LEU CHI2 160 180
# 69 LEU CHI1 -80 -40
# 75 LEU CHI2 160 180
# 75 LEU CHI1 -80 -40
# 79 LEU CHI2 160 180
# 79 LEU CHI1 -80 -40
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