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Comparison of PREDITOR predictions with PDB-derived angles for Profilin I (A.castellani).
Chemical shifts were obtained from Cornilescu G, Delaglio F, Bax A. J. Biomol. NMR. 1999; 13: 289-302.,
Reference structure is 1ACF.


PDB Homologue: 2ACG;    BLAST E value= 2e-31;    %Seq Identity= 72.00


Res#AAφpredErrorφexpψpredErrorψexpχ1predConfχ1expωpredωexp
3Q-71.47*9.00-56.84-27.39*10.00-49.68180.00*0.75-156.83180.00173.63
4T-81.26*9.00-54.90-29.89*10.00-44.7760.00*0.75-48.32180.00-177.39
5Y-64.55*9.00-50.85-28.81*10.00-53.12-60.00*0.75-69.83180.00177.43
6V-81.44*9.00-61.45-54.01*10.00-58.42180.00*0.75149.73180.00-175.15
7D-67.02*9.00-67.56-43.80*10.00-57.12-60.00*0.75-64.74180.00179.82
8T-99.93*9.00-82.85-53.32*10.00-46.32-60.00*0.75-47.03180.00-173.20
9N-71.85*9.00-85.33-22.55*10.00-18.49-60.00*0.75-64.36180.00178.39
10L-111.10*9.00-110.22-78.25*10.00-71.18-60.00*0.75-83.63180.00-177.65
11V-61.64*9.00-63.39-32.11*10.00-51.08180.00*0.75164.63180.00178.45
12G-62.71*28.00-49.39-31.35*30.00-20.23NONE0.00NONE180.00-176.47
13T-64.98*38.00-87.02-36.79*40.00-20.4960.00*0.7579.85180.00-178.21
14G102.89*48.0076.24-16.15*50.0012.71NONE0.00NONE180.00-178.97
15A-71.22*38.00-96.25-6.85*40.00-9.48NONE0.00NONE180.00-178.63
16V-149.25*28.00-140.39138.85*30.00141.38-60.00*0.75141.64180.00-178.82
17T-81.74*28.00-89.31-47.13*30.00-46.6260.00*0.75-74.68180.00-178.98
18Q-128.45*18.00-135.05153.36*20.00137.93-60.00*0.75-57.32180.00-179.90
19A-160.61*28.00-142.65166.63*30.00148.21NONE0.00NONE180.00176.85
20A-164.71*18.00-138.91166.48*20.00159.89NONE0.00NONE180.00176.51
21I-134.31*18.00-127.38109.39*20.00116.86-60.00*0.75-76.43180.00178.88
22L-98.53*18.00-108.90160.36*20.00166.73-60.00*0.75-72.16180.00174.10
23G-92.54*28.00-93.67164.58*30.00157.18NONE0.00NONE180.00179.69
24L-62.28*38.00-68.70-13.74*40.00-9.86-60.00*0.75-68.98180.00174.16
25D-86.24*38.00-88.35-25.90*40.00-1.6060.00*0.7553.72180.00-178.07
26G118.65*38.0085.76-19.11*40.003.33NONE0.00NONE180.00178.12
27N-73.64*38.00-84.75124.67*40.00140.73-60.00*0.75-69.16180.00-177.42
28T-63.12*28.00-75.30129.86*30.00141.87-60.00*0.75-62.23180.00179.24
29W-91.29*9.00-100.15-46.61*10.00-38.90-60.00*0.75-74.89180.00179.22
30A-147.89*18.00-161.59161.30*20.00147.50NONE0.00NONE180.00-179.51
31T-160.20*28.00-140.91165.59*30.00152.81180.00*0.75-157.20180.00176.40
32S-96.47*28.00-73.24157.74*30.00139.0260.00*0.7552.05180.00-176.51
33A-31.93*38.00-42.43-64.80*40.00126.90NONE0.00NONE180.00-177.68
34G-98.08*28.0079.8537.49*30.00-10.55NONE0.00NONE180.00176.15
35F-142.23*28.00-91.08138.79*30.00125.10180.00*0.75178.21180.00-179.84
36A-155.30*28.00-130.18140.86*30.00107.91NONE0.00NONE180.00176.23
37V-123.72*18.00-93.96133.29*20.00117.0360.00*0.75168.63180.00-177.77
39P-51.50*9.00-52.58-46.55*10.00-57.39-37.52*0.75-30.00180.00177.83
40A-57.33*9.00-48.52-46.69*10.00-50.43NONE0.00NONE180.00179.63
41Q-64.05*9.00-64.30-35.08*10.00-40.67-60.00*0.75-81.67180.00179.30
42G-79.47*9.00-62.66-38.11*10.00-48.06NONE0.00NONE180.00179.77
43Q-72.95*9.00-66.19-20.30*10.00-32.26180.00*0.7584.13180.00176.85
44T-78.34*9.00-66.02-28.54*10.00-42.62180.00*0.75-65.27180.00-177.36
45L-80.38*9.00-59.50-46.56*10.00-58.13180.00*0.75-167.83180.00-178.63
46A-55.89*9.00-47.82-18.33*10.00-55.60NONE0.00NONE180.00-179.71
47S-101.55*9.00-48.00-33.78*10.00-44.35180.00*0.75NONE180.00-178.52
48A-56.45*9.00-67.54-12.14*10.00-25.02NONE0.00NONE180.00179.19
49F-80.07*9.00-63.91-23.06*10.00-33.65-60.00*0.75-82.87180.00176.02
50N-87.24*38.00-76.59-25.52*40.00-62.20-60.00*0.75-59.74180.00179.14
51N178.01*38.00-127.90114.31*40.00112.4260.00*0.75177.33180.00179.91
55I-73.50*9.00-48.53-31.54*10.00-40.5160.00*0.75-91.19180.00-178.87
56R-57.54*9.00-61.53-34.45*10.00-40.62180.00*0.75-158.93180.00-179.08
57A-98.12*19.00-90.00-41.57*20.00-34.38NONE0.00NONE180.00-176.57
58S-93.33*28.00-101.34-36.41*30.00-8.39-60.00*0.75NONE180.00-176.39
59G106.90*38.0076.58-164.77*40.00-173.70NONE0.00NONE180.00179.74
60F-148.50*28.00-145.72154.58*30.00162.5360.00*0.7549.48180.00178.60
61D-111.91*28.00-107.48147.93*30.00126.74-60.00*0.75-69.66180.00172.99
62L-148.77*38.00-132.47120.99*40.00118.04-60.00*0.75-86.74180.00177.68
65V47.43*38.00-106.4844.40*40.00130.28180.00*0.75-173.42180.00175.71
66H-93.84*38.00-97.40115.80*40.00117.21180.00*0.75-175.35180.00177.82
67Y-102.99*38.00-103.00159.25*40.00154.78-60.00*0.75-62.79180.00176.20
68V-109.20*28.00-103.36130.65*30.00143.42180.00*0.75-55.57180.00-179.30
69T-65.23*28.00-74.57117.95*30.00116.80-60.00*0.75-46.09180.00178.17
70L-99.88*38.00-86.56-61.78*40.00-45.88-60.00*0.75-96.24180.00-178.75
71R-118.43*38.00-142.55152.93*40.00133.49180.00*0.75150.72180.00178.76
72A-175.68*38.00-147.6688.36*40.00117.96NONE0.00NONE180.00179.64
73D-108.04*38.00-141.47-151.41*40.00-164.2760.00*0.7560.63180.00-177.32
74D-104.31*38.00-80.7216.01*40.00-18.6560.00*0.75-53.96180.00178.79
75R-145.49*38.00-114.65-28.06*40.00-35.46180.00*0.75178.81180.00-174.35
76S-136.50*28.00-132.35126.65*30.00127.77-60.00*0.75-71.94180.00173.01
77I-124.61*28.00-120.17120.34*30.00118.95180.00*0.75-71.37180.00179.06
78Y-116.94*18.00-110.23146.76*20.00135.07-60.00*0.75-68.07180.00179.21
79G-142.90*18.00-118.66165.29*20.00147.21NONE0.00NONE180.00-179.41
80K-149.16*18.00-139.75155.99*20.00135.1660.00*0.75-170.16180.00177.21
84A-132.94*18.00-108.78167.93*20.00168.48NONE0.00-74.48180.00179.30
85G176.94*18.00-178.39-168.59*20.00-176.54NONE0.00NONE180.00-179.17
86V-136.62*18.00-147.97144.41*20.00141.5860.00*0.7562.03180.00179.97
87I-109.08*18.00-117.66123.87*20.00116.88-60.00*0.75-61.75180.00177.33
88T-125.12*18.00-116.02128.58*20.00132.7060.00*0.7562.07180.00179.63
89V-130.12*18.00-130.39123.23*20.00117.56180.00*0.75-177.95180.00178.39
90K-81.08*18.00-85.14132.28*20.00129.60180.00*0.75166.64180.00176.70
91T-111.79*18.00-97.96-171.77*20.00-162.2460.00*0.7563.99180.00177.36
92S-73.25*9.00-67.97-30.46*10.00-44.2160.00*0.7592.16180.00-178.33
93K-121.80*9.00-122.04-13.67*10.00-0.98-60.00*0.75-67.59180.00-173.08
94S-128.26*28.00-147.28-165.28*30.00170.57180.00*0.75NONE180.00177.13
95I-154.27*28.00-128.40112.76*30.00128.14-60.00*0.75-50.58180.00177.97
96L-85.08*38.00-94.64147.53*40.00132.51-60.00*0.75-53.22180.00176.04
97V-148.39*38.00-124.65123.95*40.00118.69-60.00*0.75-172.14180.00178.80
98G-139.63*38.00-123.19130.70*40.00100.30NONE0.00NONE180.00179.15
99V-103.77*28.00-83.91154.22*30.00137.30-60.00*0.75169.07180.00177.59
100Y-137.60*18.00-127.43156.15*20.00159.2860.00*0.7560.08180.00178.37
108T-67.69*9.00-71.08-47.77*10.00-41.56-60.00*0.75-54.40180.00178.10
109A-58.76*9.00-59.95-61.10*10.00-43.47NONE0.00NONE180.00-178.26
110A-47.97*9.00-64.13-36.15*10.00-49.94NONE0.00NONE180.00-179.97
111N-69.99*9.00-61.55-45.15*10.00-40.03180.00*0.75-163.25180.00178.53
112V-63.39*9.00-68.72-49.84*10.00-45.29180.00*0.75165.14180.00-178.39
113V-59.93*9.00-66.47-57.65*10.00-47.31180.00*0.75-171.61180.00176.36
114E-42.99*9.00-56.49-51.71*10.00-42.55-60.00*0.75-70.68180.00176.39
115K-63.77*9.00-72.05-45.63*10.00-35.91-60.00*0.75-93.81180.00179.38
116L-60.47*9.00-70.03-34.84*10.00-30.87180.00*0.75-138.46180.00179.21
117A-61.02*9.00-65.42-44.48*10.00-51.70NONE0.00NONE180.00176.96
118D-54.60*9.00-52.01-53.53*10.00-47.06-60.00*0.75-77.58180.00179.74
119Y-50.01*9.00-66.59-55.03*10.00-37.21180.00*0.75166.28180.00-178.06
120L-62.25*9.00-71.97-39.49*10.00-37.81-60.00*0.75-68.85180.00175.54
121I-61.27*9.00-58.07-39.29*10.00-56.21-60.00*0.75-84.02180.00174.34
122G-61.21*28.00-47.96-25.55*30.00-21.10NONE0.00NONE180.00179.57
123Q-92.30*38.00-94.09-16.71*40.00-11.83-60.00*0.75-53.23180.00-176.52
124G104.42*48.00105.6721.76*50.0011.13NONE0.00NONE180.00-177.87
125F-126.06*48.00-106.76NONE50.00NONE-60.00*0.75-58.31180.00NONE

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