Comparison of PREDITOR
predictions with PDB-derived angles for T Cell Signal Trans. Molecule .
Chemical shifts were obtained from 5211,
Reference structure is 1D4TA.
PDB Homologue: 1I3Z; BLAST E value= 1e-18; %Seq Identity= 32.28
Res# AA φpred Error φexp ψpred Error ψexp χ1pred Conf χ1exp ωpred ωexp
1 M NONE 50.00 NONE NONE 52.00 100.23 NONE 0.00 -53.95 180.00 -168.58
2 D -95.66 50.00 -72.98 -3.52 52.00 -15.04 -60.00 0.51 -60.55 180.00 -174.20
3 A -62.84 40.00 -106.37 142.87 42.00 12.35 NONE 0.00 NONE 180.00 -171.86
4 V -85.97 30.00 -116.19 110.38 32.00 99.98 180.00 0.99 175.87 180.00 -171.95
5 A -61.75 10.00 -64.72 -32.70 11.00 -24.69 NONE 0.00 NONE 180.00 178.18
6 V -110.32 10.00 -83.99 11.51 11.00 9.19 -60.00 1.00 -63.11 180.00 179.86
7 Y -93.00 20.00 -90.95 126.35 22.00 120.92 -60.00 0.59 175.47 180.00 -176.24
8 H 59.05 20.00 -102.64 24.00 22.00 3.27 -60.00 0.94 -66.32 180.00 178.14
9 G -103.67* 37.00 78.01 -40.38* 44.00 -144.67 NONE 0.00 NONE 180.00 -167.83
10 K -80.68 30.00 -91.22 131.13 32.00 43.45 180.00 0.57 -159.92 180.00 173.25
11 I -112.37 30.00 -73.37 156.15 32.00 150.81 60.00 0.90 60.37 180.00 179.15
12 S -85.67 20.00 -70.73 162.43 22.00 157.56 60.00 0.64 -60.94 180.00 174.48
13 R -58.15 10.00 -48.12 -38.26 11.00 -48.73 -60.00 0.50 179.56 180.00 -175.06
14 E -65.09 10.00 -68.85 -44.11 11.00 -32.89 -60.00 0.59 -54.21 180.00 174.24
15 T -64.82 10.00 -61.33 -44.20 11.00 -46.17 -60.00 0.88 -56.96 180.00 175.43
16 G -70.21* 13.50 -59.98 -32.87* 17.00 -41.90 NONE 0.00 NONE 180.00 175.37
17 E -61.23 10.00 -56.26 -43.55 11.00 -47.36 -60.00 0.54 -66.08 180.00 -176.25
18 K -63.30 10.00 -67.54 -42.02 11.00 -37.53 180.00 0.50 -69.02 180.00 175.42
19 L -61.62 10.00 -62.13 -45.90 11.00 -41.45 180.00 0.52 -68.98 180.00 178.84
20 L -60.81 10.00 -70.84 -41.25 11.00 -44.75 -60.00 0.60 -70.07 180.00 179.58
21 L -65.68 10.00 -60.01 -37.48 11.00 -31.91 -60.00 0.63 -68.48 180.00 -179.51
22 A -60.02 10.00 -62.42 -42.27 11.00 -30.10 NONE 0.00 NONE 180.00 175.85
23 T -63.73 20.00 -71.35 -40.96 21.00 -31.27 -60.00 0.88 61.92 180.00 -179.92
24 G 137.14* 37.00 66.42 -76.12* 44.00 13.75 NONE 0.00 NONE 180.00 -170.20
25 L -112.53 20.00 -116.36 138.11 22.00 119.35 -60.00 0.83 -72.87 180.00 174.10
26 D -66.31 20.00 -60.09 146.34 22.00 138.19 -60.00 0.76 -69.53 180.00 -175.04
27 G 97.47* 27.00 90.39 -1.46* 34.00 1.20 NONE 0.00 NONE 180.00 166.85
28 S -76.58 20.00 -68.57 135.55 22.00 147.29 180.00 0.43 -57.28 180.00 -176.77
29 Y -138.61 20.00 -155.23 157.59 22.00 157.61 60.00 0.54 67.54 180.00 172.39
30 L -118.90 20.00 -149.88 131.42 22.00 171.28 -60.00 0.53 60.31 180.00 170.64
31 L -144.27 20.00 -119.12 148.01 22.00 141.22 -60.00 0.72 -81.95 180.00 174.86
32 R -126.95 20.00 -143.70 144.67 22.00 166.77 -60.00 0.66 60.86 180.00 174.10
33 D -70.97 20.00 -67.59 121.61 22.00 149.91 180.00 0.82 -64.20 180.00 163.69
34 S -93.65 20.00 -61.93 -7.41 21.00 143.36 60.00 0.77 170.19 180.00 172.76
35 E -91.04 20.00 -86.64 -30.64 21.00 -7.47 -60.00 0.81 -61.53 180.00 -165.41
36 S -95.88 30.00 -114.45 133.46 32.00 -32.68 180.00 0.50 34.97 180.00 -171.14
37 V -140.69 30.00 -138.88 134.26 32.00 120.78 180.00 0.80 177.27 180.00 -179.18
38 P -61.09 40.00 -54.91 138.99 42.00 137.95 -24.90 0.69 -27.62 180.00 176.52
39 G 101.97* 47.00 70.24 -16.11* 54.00 9.64 NONE 0.00 NONE 180.00 171.43
40 V -92.81 40.00 -100.44 134.02 42.00 153.97 180.00 0.97 170.84 180.00 -178.69
41 Y -112.70 30.00 -124.53 138.01 32.00 163.40 -60.00 0.81 -61.92 180.00 177.99
42 C -113.50 30.00 -123.51 129.62 32.00 119.92 -60.00 0.58 -66.92 180.00 171.22
43 L -102.92 30.00 -88.83 123.62 32.00 112.93 180.00 0.58 171.96 180.00 -169.25
44 C -114.58 20.00 -110.30 138.09 22.00 120.47 -60.00 0.73 -57.65 180.00 -170.89
45 V -122.89 20.00 -125.49 143.31 22.00 124.83 180.00 0.76 -171.22 180.00 179.45
46 L -113.51 30.00 -81.84 125.20 32.00 131.85 -60.00 0.58 -177.43 180.00 172.62
47 Y -118.74 40.00 -153.06 126.48 42.00 118.19 -60.00 0.70 -177.85 180.00 175.09
48 H 49.41 40.00 53.03 43.55 42.00 46.93 -60.00 0.92 -74.06 180.00 172.54
49 G 60.18* 47.00 78.46 34.41* 54.00 1.08 NONE 0.00 NONE 180.00 177.72
50 Y -148.87 30.00 -117.80 156.29 32.00 154.61 60.00 0.83 -75.61 180.00 -175.08
51 I -86.23 30.00 -109.22 106.29 32.00 99.48 -60.00 1.00 -62.21 180.00 178.77
52 Y -70.42 30.00 -77.52 122.14 32.00 120.25 180.00 0.72 -68.03 180.00 -164.34
53 T -116.73 30.00 -121.82 130.88 32.00 120.38 -60.00 0.88 -57.14 180.00 -174.36
54 Y -111.24 20.00 -112.00 132.46 22.00 119.22 -60.00 0.68 -59.10 180.00 -179.59
55 R -71.65 20.00 -76.81 129.26 22.00 132.37 180.00 0.53 -64.11 180.00 -173.40
56 V -111.98 20.00 -124.13 141.21 22.00 127.96 180.00 0.82 170.81 180.00 -173.89
57 S -115.50 20.00 -131.24 135.97 22.00 152.82 -60.00 0.44 -51.72 180.00 175.19
58 Q -97.99 20.00 -103.00 127.95 22.00 142.54 -60.00 0.55 -172.43 180.00 177.95
59 T -86.44 30.00 -93.02 164.51 32.00 170.58 60.00 0.97 73.34 180.00 178.67
60 E -61.89 30.00 -70.68 -19.83 32.00 -9.73 -60.00 0.60 66.67 180.00 174.73
61 T -91.44 40.00 -90.22 5.06 42.00 -5.41 60.00 1.00 68.58 180.00 -177.22
62 G 75.43* 47.00 94.77 17.14* 54.00 -6.83 NONE 0.00 NONE 180.00 -176.23
63 S -81.02 40.00 -82.79 151.76 42.00 162.64 60.00 0.46 65.25 180.00 -175.86
64 W -111.07 40.00 -119.48 144.96 42.00 144.23 -60.00 0.86 -65.87 180.00 175.64
65 S -82.00 30.00 -150.84 161.26 32.00 157.02 60.00 0.74 67.09 180.00 174.58
66 A -120.09 20.00 -100.03 141.11 22.00 150.64 NONE 0.00 NONE 180.00 176.39
67 E -61.11 20.00 -55.58 132.44 22.00 128.36 180.00 0.63 -169.84 180.00 -171.29
68 T -123.35 30.00 -124.81 134.39 32.00 144.80 -60.00 0.88 -58.41 180.00 -177.79
69 A -79.64 40.00 -61.97 122.13 42.00 149.86 NONE 0.00 NONE 180.00 176.18
70 P -74.83 40.00 -56.70 138.01 42.00 136.05 25.30 0.57 -19.90 180.00 175.30
71 G -116.71* 47.00 84.06 26.03* 54.00 -9.75 NONE 0.00 NONE 180.00 178.89
72 V -74.87 40.00 -86.70 121.60 42.00 140.02 180.00 0.98 172.23 180.00 178.43
73 H -71.85 40.00 -60.75 138.21 42.00 112.78 180.00 0.55 -179.63 180.00 -177.11
74 K -86.75 40.00 -82.36 -15.98 42.00 133.88 -60.00 0.89 -177.22 180.00 -175.01
75 R -95.46 30.00 -103.83 136.74 32.00 136.64 -60.00 0.65 -77.45 180.00 176.80
76 Y -126.64 30.00 -117.69 129.55 32.00 140.06 -60.00 0.63 -64.96 180.00 -173.37
77 F -120.04 20.00 -124.88 134.40 22.00 142.58 -60.00 0.70 -62.27 180.00 -177.56
78 R -77.05 10.00 -67.08 -21.28 11.00 -35.36 -60.00 0.80 -85.18 180.00 -170.63
79 K -116.60 20.00 -141.33 157.20 22.00 151.09 -60.00 0.89 -55.93 180.00 175.42
80 I -62.80 10.00 -55.09 -37.14 11.00 -40.21 -60.00 0.93 -74.53 180.00 -178.17
81 K -63.38 10.00 -62.24 -45.81 11.00 -30.84 180.00 0.61 65.65 180.00 177.96
82 N -68.02 10.00 -72.17 -42.20 11.00 -33.81 -60.00 0.76 -60.10 180.00 172.14
83 L -58.15 10.00 -62.45 -44.71 11.00 -46.74 -60.00 0.60 -178.52 180.00 179.12
84 I -61.01 10.00 -60.58 -49.02 11.00 -48.15 -60.00 0.99 -65.60 180.00 179.57
85 S -62.81 10.00 -56.66 -40.02 11.00 -41.49 -60.00 0.43 -71.79 180.00 -178.63
86 A -64.24 20.00 -63.93 -38.88 21.00 -41.38 NONE 0.00 NONE 180.00 -176.50
87 F -70.61 30.00 -85.64 9.72 32.00 2.86 -60.00 0.78 -70.20 180.00 163.51
88 Q -70.93 30.00 -74.59 150.18 32.00 -19.16 -60.00 0.70 -70.75 180.00 -169.44
89 K -92.84 30.00 -82.11 154.06 32.00 153.40 -60.00 0.87 -68.30 180.00 175.64
90 P -61.55 30.00 -63.22 140.67 32.00 146.07 -24.90 0.69 -25.32 180.00 164.05
91 D 55.09 30.00 58.97 8.80 32.00 57.41 -60.00 0.81 -160.70 180.00 -176.04
92 Q -99.13 10.00 -111.64 10.20 11.00 5.24 -60.00 0.95 -63.30 180.00 176.78
93 G 113.46* 27.00 97.15 -2.73* 34.00 10.70 NONE 0.00 NONE 180.00 169.70
94 I -90.20 20.00 -110.18 165.81 22.00 171.03 60.00 0.95 63.44 180.00 -167.67
95 V -70.79 10.00 -63.93 -18.79 11.00 -35.99 -60.00 0.52 64.75 180.00 -179.23
96 I -136.28 20.00 -155.63 125.05 22.00 148.08 -60.00 0.74 -169.49 180.00 178.43
97 P -58.99 20.00 -66.05 136.80 22.00 151.56 -24.90 0.69 -27.63 180.00 177.21
98 L 51.21 20.00 -68.75 31.90 22.00 111.86 -60.00 0.96 -55.61 180.00 -173.45
99 Q -131.69 20.00 -124.74 133.20 22.00 -37.28 180.00 0.49 -70.66 180.00 -167.91
100 Y -87.13 20.00 -125.16 128.88 22.00 88.59 -60.00 0.59 -53.72 180.00 -176.22
101 P -66.67 30.00 -64.70 143.63 32.00 135.65 25.30 0.57 8.17 180.00 172.93
102 V -76.77 40.00 -99.26 101.61 42.00 101.59 180.00 0.97 176.51 180.00 -172.55
103 E -72.22 50.00 -82.51 152.58 52.00 138.19 -60.00 0.69 -56.39 180.00 171.18
104 K -69.41 50.00 -58.19 130.44 52.00 NONE 180.00 0.62 71.17 180.00 NONE
105 K -96.52 50.00 NONE 128.32 52.00 NONE -60.00 0.50 NONE 180.00 NONE
106 S -81.45 40.00 NONE 120.71 42.00 NONE 180.00 0.59 NONE 180.00 NONE
107 S -82.06 50.00 NONE 0.34 52.00 NONE 60.00 0.80 NONE 180.00 NONE
108 A -74.75 50.00 NONE 156.52 52.00 NONE NONE 0.00 NONE 180.00 NONE
109 R -79.98 50.00 NONE 157.93 52.00 NONE -60.00 0.85 NONE 180.00 NONE
110 S -74.29 50.00 NONE 154.23 52.00 NONE 60.00 0.42 NONE 180.00 NONE
111 T -74.71 50.00 NONE 118.18 52.00 NONE -60.00 0.94 NONE 180.00 NONE
112 Q -99.63 50.00 NONE 139.32 52.00 NONE -60.00 0.67 NONE 180.00 NONE
113 G 80.65 40.00 NONE 18.57 42.00 NONE NONE 0.00 NONE 180.00 NONE
114 T -78.98 50.00 NONE -11.98 52.00 NONE 60.00 0.96 NONE 180.00 NONE
115 T -83.44 50.00 NONE 150.57 52.00 NONE 60.00 0.76 NONE 180.00 NONE
116 G 89.74 50.00 NONE 12.43 52.00 NONE NONE 0.00 NONE 180.00 NONE
117 I -72.02 50.00 NONE 120.28 52.00 NONE -60.00 0.97 NONE 180.00 NONE
118 R -76.75 50.00 NONE 141.15 52.00 NONE -60.00 0.64 NONE 180.00 NONE
119 E -75.84 50.00 NONE 139.57 52.00 NONE -60.00 0.63 NONE 180.00 NONE
120 D -93.23 50.00 NONE 151.33 52.00 NONE -60.00 0.72 NONE 180.00 NONE
121 P -65.38 50.00 NONE 144.45 52.00 NONE 25.30 0.57 NONE 180.00 NONE
122 D -81.37 40.00 NONE 1.11 42.00 NONE 60.00 0.50 NONE 180.00 NONE
123 V -86.15 50.00 NONE 133.77 52.00 NONE 180.00 0.97 NONE 180.00 NONE
124 C -72.41 50.00 NONE 137.79 52.00 NONE -60.00 0.59 NONE 180.00 NONE
125 L -81.78 60.00 NONE 131.71 62.00 NONE -60.00 0.52 NONE 180.00 NONE
126 K -76.22 60.00 NONE 138.29 62.00 NONE -60.00 0.61 NONE 180.00 NONE
127 A NONE 60.00 NONE NONE 62.00 NONE NONE 0.00 NONE 180.00 NONE
Have a problem with PREDITOR or a suggestion? Contact
Mark Berjanskii , Steve Neal ,
or David Wishart .