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Comparison of PREDITOR predictions with PDB-derived angles for Glur2 ligand binding core (Rat).
Chemical shifts were obtained from 5182,
Reference structure is 1M5EA.


PDB Homologue: 1XHY;    BLAST E value= 0;    %Seq Identity= 99.62


Res#AAφpredErrorφexpψpredErrorψexpχ1predConfχ1expωpredωexp
1GNONE60.00NONENONE62.00NONENONE0.00NONE180.00NONE
2A-69.2660.00NONE146.8262.00NONENONE0.00NONE180.00NONE
3N-71.7450.00NONE134.4552.00NONE180.000.56NONE180.00NONE
4KNONE41.00NONE179.40*41.00-57.47-60.00*0.85-157.27180.00179.40
5T-70.70*21.00-71.12135.76*21.00122.90-60.00*0.85-58.62180.00-179.33
6V-81.65*11.00-73.80129.11*11.00125.45180.00*0.85174.55180.00179.12
7V-91.10*11.00-87.33116.68*11.00116.48180.00*0.85177.34180.00-179.31
8V-95.94*11.00-101.90125.20*11.00125.51180.00*0.85179.70180.00176.06
9T-98.85*11.00-99.73137.98*11.00138.37180.00*0.85-176.64180.00178.95
10T-148.00*11.00-149.90-172.69*11.00-177.57180.00*0.85-169.18180.00-175.75
11I-149.66*11.00-134.19147.59*11.00146.75180.00*0.85-172.75180.00179.05
12L-78.16*21.00-79.66118.57*21.0091.96-60.00*0.85-72.46180.00-179.07
13E-159.86*21.00-137.87126.54*21.00110.60180.00*0.85-172.33180.00179.81
14S-80.36*21.00-70.04141.73*21.00142.12-60.00*0.85-55.320.000.09
15P-99.83*11.00-96.8927.22*11.0017.2935.56*0.8542.93180.00-178.68
16Y-77.30*5.50-69.40-49.69*5.50-50.46-60.00*0.85-66.30180.00177.66
17V-146.81*11.00-144.29124.66*11.00125.84180.00*0.85-178.72180.00-178.74
18M-142.07*11.00-140.84147.69*11.00153.69-60.00*0.85-50.82180.00178.31
19M-77.88*21.00-78.69134.29*21.00132.76-60.00*0.85-55.87180.00177.75
20K-64.72*21.00-67.67152.17*21.00151.33-60.00*0.85-74.17180.00-179.53
21K-51.22*15.50-52.46-37.60*15.50-38.72180.00*0.85-178.19180.00-179.05
22N-105.77*11.00-109.0931.16*11.0036.0760.00*0.8563.16180.00-178.80
23H-60.11*5.50-58.89-28.35*5.50-31.1160.00*0.8570.30180.00-178.92
24E-61.73*5.50-60.64-22.51*5.50-26.71-60.00*0.85-166.09180.00-179.57
25M-92.09*5.50-98.65-6.37*5.506.70-60.00*0.85-63.66180.00-179.74
26L-108.79*11.00-112.78179.14*11.00164.49-60.00*0.85-58.33180.00-178.81
27E-142.86*11.00-118.95152.01*11.00150.57-60.00*0.85-62.69180.00178.36
28G64.12*11.0047.34-143.17*11.00-132.47NONE0.00NONE180.00-178.62
29N-63.78*5.50-61.07-23.47*5.50-21.62-60.00*0.85-57.58180.00-179.88
30E-70.46*5.50-68.34-8.91*5.50-13.33-60.00*0.85-73.05180.00-179.96
31R-67.60*5.50-72.79-25.40*5.50-18.18-60.00*0.85-65.99180.00-176.29
32Y-107.35*11.00-114.03153.71*11.00160.63-60.00*0.85-46.60180.00177.74
33E-144.04*11.00-150.17158.69*11.00158.9260.00*0.8570.33180.00179.42
34G135.15*11.00137.64175.68*11.00175.20NONE0.00NONE180.00-179.93
35Y-54.27*5.50-52.98-48.70*5.50-49.24180.00*0.85178.01180.00-179.23
36C-71.62*5.50-74.31-30.13*5.50-22.58-60.00*0.85-76.69180.00177.75
37V-61.81*5.50-71.70-50.77*5.50-43.52180.00*0.85175.97180.00178.07
38D-59.39*5.50-64.17-42.94*5.50-43.58-60.00*0.85-71.72180.00-179.54
39L-63.65*5.50-64.38-44.22*5.50-41.66180.00*0.85-179.95180.00179.69
40A-59.81*5.50-59.88-41.14*5.50-42.95NONE0.00NONE180.00179.87
41A-63.94*5.50-60.65-41.23*5.50-41.31NONE0.00NONE180.00179.72
42E-67.72*5.50-69.24-39.69*5.50-45.86-60.00*0.85-78.78180.00179.48
43I-65.32*5.50-59.28-46.48*5.50-44.98-60.00*0.85-69.59180.00179.82
44A-59.73*5.50-62.85-41.90*5.50-42.32NONE0.00NONE180.00-179.63
45K-63.41*5.50-64.70-45.11*5.50-42.72180.00*0.85-168.80180.00-179.45
46H-71.38*5.50-73.57-31.41*5.50-26.97-60.00*0.85-75.16180.00179.84
47C-92.42*5.50-94.82-3.24*5.50-10.13-60.00*0.85-67.07180.00178.53
48G69.11*11.0072.6234.29*11.0044.00NONE0.00NONE180.00178.38
49F-121.82*11.00-135.99154.30*11.00154.7060.00*0.8564.26180.00177.67
50K-84.49*11.00-93.55151.40*11.00151.45-60.00*0.85-68.25180.00-177.40
51Y-148.79*11.00-147.09159.73*11.00165.2260.00*0.8563.92180.00178.43
52K-130.41*11.00-132.38118.80*11.00119.43180.00*0.85-179.91180.00178.87
53L-74.69*11.00-77.15125.97*11.00132.92-60.00*0.85-62.83180.00178.50
54T-128.39*11.00-136.09152.90*11.00141.3360.00*0.8567.16180.00-179.78
55I-108.27*11.00-89.47125.47*11.00127.88-60.00*0.85-55.38180.00-179.72
56V-54.25*11.00-49.30133.06*11.00127.1860.00*0.8558.08180.00-177.66
57G-62.42*5.50-51.38-40.09*5.50-46.91NONE0.00NONE180.00-178.66
58D-93.68*15.50-90.41-0.21*15.504.1660.00*0.8562.92180.00178.74
59G67.59*21.0061.8628.33*21.0023.21NONE0.00NONE180.00-178.69
60K-119.56*11.00-114.07161.20*11.00160.88-60.00*0.85-60.08180.00178.93
61Y-91.80*5.50-79.15-57.53*5.50-58.78-60.00*0.85-76.84180.00177.79
62G164.68*11.00149.53115.40*11.00119.02NONE0.00NONE180.00178.25
63A-149.27*11.00-147.67155.31*11.00156.33NONE0.00NONE180.00179.77
64R-106.54*11.00-97.77126.13*11.00123.05180.00*0.85-172.68180.00179.92
65D-60.29*11.00-60.47125.02*11.00131.07180.00*0.85-171.67180.00-178.79
66A-61.98*5.50-60.50-34.77*5.50-35.67NONE0.00NONE180.00-178.85
67D-82.95*5.50-90.23-52.96*5.50-47.16-60.00*0.85-56.33180.00-178.93
68T-85.07*5.50-85.90-17.40*5.50-17.9260.00*0.8567.03180.00-179.56
69K58.81*21.0066.6322.90*21.0014.83-60.00*0.85-70.98180.00179.96
70I-89.43*21.00-91.48133.74*21.00133.31-60.00*0.85-64.06180.00179.28
71W-83.64*21.00-82.80132.95*21.00135.26-60.00*0.85-76.07180.00177.99
72N-102.19*11.00-109.12-178.89*11.00-171.9860.00*0.8562.80180.00178.79
73G72.55*11.0061.56-161.28*11.00-160.05NONE0.00NONE180.00179.98
74M-66.83*5.50-63.09-37.30*5.50-33.37-60.00*0.85-67.94180.00178.36
75V-58.11*5.50-61.33-45.23*5.50-45.21180.00*0.85175.35180.00178.76
76G-57.87*5.50-61.15-39.43*5.50-41.13NONE0.00NONE180.00179.93
77E-63.10*5.50-57.31-36.37*5.50-37.30-60.00*0.85-53.24180.00179.25
78L-71.38*5.50-76.44-50.39*5.50-47.47-60.00*0.85-66.65180.00-179.11
79V-57.45*5.50-56.73-39.93*5.50-41.90180.00*0.85169.30180.00-177.89
80Y-94.84*5.50-93.863.87*5.509.74-60.00*0.85-57.57180.00177.22
81G88.56*11.0079.0514.84*11.0019.30NONE0.00NONE180.00-179.81
82K-85.76*5.50-85.01-21.41*5.50-20.56-60.00*0.85-51.06180.00179.85
83A-144.10*11.00-139.29157.68*11.00154.06NONE0.00NONE180.00-179.11
84D-96.78*5.50-94.02-27.02*5.50-21.69-60.00*0.85-60.27180.00-177.86
85I-153.14*11.00-162.12145.36*11.00152.00180.00*0.85-172.06180.00177.90
86A-118.72*11.00-119.92125.24*11.00123.26NONE0.00NONE180.00178.52
87I-129.36*11.00-122.28102.84*11.0097.46-60.00*0.85-61.11180.00-176.00
88A-168.59*11.00-164.09167.60*11.00175.20NONE0.00NONE180.00179.20
89P-72.62*11.00-78.2766.37*11.0067.3126.55*0.8530.35180.00-177.95
90L-93.90*11.00-101.00109.83*11.00118.22180.00*0.85-173.45180.00-177.47
91T-69.33*11.00-74.96132.14*11.00133.05-60.00*0.85-54.20180.00177.71
92I-78.57*11.00-74.31112.08*11.00117.36-60.00*0.85-63.72180.00179.03
93T-128.44*11.00-136.50155.85*11.00158.5460.00*0.8571.72180.00-179.69
94L-55.10*5.50-57.48-47.15*5.50-52.22180.00*0.85171.98180.00-179.07
95V-64.73*5.50-59.52-35.36*5.50-32.7160.00*0.85-70.98180.00179.02
96R-75.14*5.50-78.18-38.40*5.50-40.44-60.00*0.85-70.92180.00-179.85
97E-63.47*5.50-62.16-25.29*5.50-19.87180.00*0.85-176.76180.00179.08
98E-69.28*5.50-75.02-23.72*5.50-20.43-60.00*0.85-63.45180.00-179.33
99V-117.15*5.50-118.08-20.85*5.50-18.00-60.00*0.85-61.65180.00177.79
100I-126.58*11.00-138.61168.14*11.00165.4660.00*0.8558.66180.00178.60
101D-95.42*21.00-100.30132.29*21.00151.98-60.00*0.85-71.73180.00179.12
102F-112.09*21.00-131.42138.28*21.00143.79-60.00*0.85-78.89180.00175.62
103S-59.91*21.00-78.16161.54*21.00171.8260.00*0.8567.88180.00175.30
104K-51.11*21.00-63.93149.42*21.00158.02-60.00*0.85-69.89180.00-179.00
105P-63.37*11.00-55.27141.57*11.00139.857.83*0.85-25.34180.00175.37
106F-95.23*5.50-106.81-12.23*5.50-8.5760.00*0.8564.22180.00177.13
107M-159.16*21.00-149.83141.41*21.00140.60180.00*0.85-80.00180.00179.03
108S-93.23*21.00-111.46152.02*21.00136.7760.00*0.85-64.34180.00-178.20
109L-164.70*31.00-161.96174.41*31.00-173.0960.00*0.8552.51180.00179.12
110G-156.69*21.00-160.50162.73*21.00161.80NONE0.00NONE180.00178.31
111I-67.59*11.00-64.47137.87*11.00139.96-60.00*0.85-65.88180.00-179.04
112S-142.34*11.00-141.64166.81*11.00171.9660.00*0.8562.82180.00-179.46
113I-109.70*11.00-109.84126.78*11.00126.39-60.00*0.85-57.94180.00177.25
114M-105.43*11.00-106.81126.07*11.00129.12180.00*0.85170.12180.00178.34
115I-122.39*11.00-129.98156.50*11.00159.9760.00*0.8557.27180.00175.45
116K-70.60*11.00-79.65137.24*11.00138.14180.00*0.85-174.38180.00-179.05
117K-49.07*11.00-51.89134.85*11.00131.92-60.00*0.85-73.11180.00179.81
118G98.42*21.00104.99-11.76*21.00-16.79NONE0.00NONE180.00179.83
119T-69.32*31.00-63.73129.15*31.00128.82-60.00*0.85-58.86180.00-179.89
120P-84.59*31.00-75.5767.00*31.0066.1533.00*0.8534.42180.00179.62
121I-137.93*11.00-141.28131.37*11.00130.25-60.00*0.85-67.86180.00-179.74
122E-125.14*5.50-122.03-3.15*5.50-9.13-60.00*0.85-61.09180.00-178.95
123S-165.54*11.00-160.84165.87*11.00173.0160.00*0.8558.55180.00178.98
124A-59.74*5.50-66.79-43.89*5.50-37.56NONE0.00NONE180.00179.11
125E-58.89*5.50-57.27-39.80*5.50-40.68180.00*0.85172.80180.00179.46
126D-53.23*5.50-60.69-48.96*5.50-48.33-60.00*0.85-71.44180.00179.63
127L-62.48*5.50-59.77-41.12*5.50-43.70-60.00*0.85-72.14180.00-177.83
128S-66.10*5.50-65.06-27.79*5.50-26.7260.00*0.8573.73180.00-178.50
129K-85.36*5.50-93.751.97*5.50-7.20-60.00*0.85-64.30180.00179.69
130Q-143.68*11.00-118.08172.01*11.00171.3460.00*0.8561.66180.00-178.99
131T-135.76*5.50-133.14-8.79*5.50-17.4760.00*0.8557.11180.00-179.66
132E-59.99*5.50-55.50-42.63*5.50-42.88180.00*0.85-173.85180.00-179.64
133I-96.02*11.00-97.79105.98*11.00116.60-60.00*0.85-57.29180.00179.58
134A-66.98*11.00-78.23152.68*11.00158.97NONE0.00NONE180.00178.69
135Y-154.50*11.00-154.90141.98*11.00145.1660.00*0.8553.25180.00-179.60
136G-161.51*11.00-149.95-172.24*11.00-163.37NONE0.00NONE180.00-178.57
137T-128.12*11.00-155.01177.06*11.00-178.1760.00*0.85-167.46180.00-178.34
138L-55.87*11.00-78.30146.22*11.00132.75-60.00*0.85-179.25180.00178.35
139D-84.15*5.50-71.440.18*5.50142.3660.00*0.85-107.55180.00179.81
140S-143.67*11.0062.46152.65*11.0023.69180.00*0.85-65.12180.00178.72
141G117.57*11.00-110.17175.67*11.00165.99NONE0.00NONE180.00-178.85
142S-66.99*5.50-69.54-27.41*5.50-25.10-60.00*0.8555.44180.00179.80
143T-67.57*5.50-68.97-50.33*5.50-42.62-60.00*0.85-66.77180.00179.14
144K-56.21*5.50-62.07-48.47*5.50-42.55180.00*0.85-175.21180.00-179.79
145E-57.84*5.50-64.17-37.12*5.50-38.43-60.00*0.85-55.54180.00179.09
146F-55.35*5.50-58.56-51.83*5.50-51.96180.00*0.85170.96180.00-179.27
147F-67.09*5.50-62.15-44.57*5.50-39.57-60.00*0.85-83.04180.00-179.65
148R-59.94*5.50-65.48-36.88*5.50-30.41180.00*0.85173.11180.00-178.54
149R-92.09*5.50-98.34-11.71*5.50-8.61-60.00*0.85-58.78180.00-178.05
150S-68.11*11.00-69.59140.88*11.00137.76180.00*0.85-173.87180.00179.11
151K-105.85*5.50-107.77-0.15*5.504.70-60.00*0.85-58.50180.00178.96
152I-74.52*11.00-73.91129.37*11.00125.93-60.00*0.85-59.27180.00-178.70
153A-53.77*5.50-38.36-49.49*5.50-61.43NONE0.00NONE180.00-178.88
154V-63.10*5.50-58.27-41.08*5.50-46.50180.00*0.85177.22180.00-179.42
155F-75.08*5.50-70.15-36.77*5.50-29.86-60.00*0.85-53.25180.00178.76
156D-58.02*5.50-64.62-44.44*5.50-46.88180.00*0.85171.97180.00179.89
157K-64.96*5.50-63.32-39.32*5.50-38.97180.00*0.85-175.70180.00179.77
158M-61.15*5.50-66.23-40.49*5.50-40.11-60.00*0.85-68.71180.00179.20
159W-67.10*5.50-66.41-44.34*5.50-42.18180.00*0.85174.49180.00179.93
160T-58.89*5.50-57.54-36.96*5.50-36.00-60.00*0.85-60.22180.00179.08
161Y-66.36*5.50-74.61-48.35*5.50-53.99180.00*0.85155.33180.00-178.36
162M-66.02*5.50-58.43-40.22*5.50-42.54-60.00*0.85-65.48180.00-179.37
163R-63.99*5.50-60.09-32.60*5.50-32.10-60.00*0.85162.02180.00-178.44
164S-97.86*5.50-105.41-8.37*5.50-5.5660.00*0.85-60.13180.00-179.27
165A-79.01*11.00-60.71144.00*11.00138.11NONE0.00NONE180.00179.09
166E-131.53*11.00-135.78140.57*11.00127.17-60.00*0.85-64.010.000.09
167P-70.27*11.00-64.34-178.85*11.00165.4633.84*0.85-28.81180.00-179.75
168S-58.72*21.00-53.20136.13*21.00138.87180.00*0.85176.63180.00178.82
169V-93.38*21.00-98.41-1.73*21.000.78-60.00*0.85-65.72180.00179.52
170F-87.07*21.00-89.46152.35*21.00150.87-60.00*0.85-57.74180.00179.92
171V-126.76*11.00-125.48160.34*11.00161.29-60.00*0.85-63.94180.00-178.56
172R-91.74*5.50-82.90-25.26*5.50-30.29-60.00*0.85-173.06180.00-179.84
173T-140.57*11.00-140.90161.45*11.00159.7260.00*0.8561.76180.00179.05
174T-58.72*5.50-59.15-45.21*5.50-41.93-60.00*0.85-60.51180.00-179.90
175A-56.34*5.50-57.87-44.36*5.50-37.16NONE0.00NONE180.00179.62
176E-61.21*5.50-66.82-41.62*5.50-39.59180.00*0.85-171.38180.00179.41
177G-64.68*5.50-65.16-44.75*5.50-44.27NONE0.00NONE180.00179.81
178V-63.47*5.50-63.75-41.11*5.50-44.51180.00*0.85174.46180.00179.44
179A-65.95*5.50-61.02-36.20*5.50-37.53NONE0.00NONE180.00179.96
180R-67.03*5.50-66.43-45.39*5.50-38.80180.00*0.85-172.45180.00178.25
181V-54.08*5.50-64.54-51.30*5.50-46.63180.00*0.85168.70180.00-178.36
182R-66.28*5.50-64.16-25.92*5.50-30.66-60.00*0.85-73.64180.00-179.17
183K-99.38*5.50-97.58-5.30*5.50-1.30-60.00*0.8567.50180.00-178.01
184S-101.47*5.50-83.5210.07*5.50-4.65-60.00*0.8571.41180.00-179.30
185K60.98*21.0057.6036.65*21.0027.52-60.00*0.85-60.61180.00179.23
186G82.84*31.0092.148.57*31.004.64NONE0.00NONE180.00-179.29
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