Comparison of CABS Dynamics with Molecular Dynamics

Using data deposited in the MoDEL database, we selected proteins satisfying the following conditions:

• sequence identity: < 30%,
• chain length: < 400 aa,
• single chain in the trajectory,
• simulation length: 10ns,

to get total of 393 Cα trajectories. Force-field for all MD trajectories: parm99, simulated using AMBER 8.0 (except of few trajectories simulated with NAMD 2.5/2.6).

#	PDB ID	rs	RMS	Chain length	CATH Class Architecture	CABS trajectory
1.	1A6F	0.61	2.40	113	Alpha Beta, 2-Layer Sandwich
2.	1AD6	0.77	4.11	185	Mainly Alpha, Orthogonal Bundle
3.	1AEP	0.72	1.29	153	Mainly Alpha, Up-down Bundle
4.	1AGI	0.78	3.87	125	Alpha Beta, Roll
5.	1AH7	0.67	2.79	245	Mainly Alpha, Orthogonal Bundle
6.	1AIR	0.81	3.23	352	Mainly Beta, 3 Solenoid
7.	1AJ2	0.71	2.73	282	Alpha Beta, Alpha-Beta Barrel
8.	1AK2	0.71	4.07	220	Alpha Beta, 3-Layer(aba) Sandwich
9.	1AKO	0.71	3.15	268	Alpha Beta, 4-Layer Sandwich
10.	1AKZ	0.52	2.66	223	Alpha Beta, 3-Layer(aba) Sandwich
11.	1AL3	0.69	2.40	237	Alpha Beta, 3-Layer(aba) Sandwich
12.	1AMX	0.52	3.73	150	Mainly Beta, Sandwich
13.	1AN8	0.76	2.56	206	Alpha Beta, Roll
14.	1ANU	0.82	2.97	138	Mainly Beta, Sandwich
15.	1AQB	0.74	4.06	175	Mainly Beta, Beta Barrel
16.	1AQT	0.72	2.27	135	Mainly Beta, Sandwich
17.	1AS0	0.55	3.54	313	Alpha Beta, 3-Layer(aba) Sandwich
18.	1ASH	0.70	2.63	147	Mainly Alpha, Orthogonal Bundle
19.	1ASS	0.72	2.15	152	Alpha Beta, 3-Layer(bba) Sandwich
20.	1ATR	0.67	3.27	383	Alpha Beta, 2-Layer Sandwich
21.	1ATU	0.72	3.35	374	Alpha Beta, 2-Layer Sandwich
22.	1AUA	0.76	3.04	296	Mainly Alpha, Orthogonal Bundle
23.	1AW9	0.77	5.92	216	Alpha Beta, 3-Layer(aba) Sandwich
24.	1B11	0.82	7.60	113	Mainly Beta, Beta Barrel
25.	1B1B	0.47	2.43	140	Mainly Alpha, Orthogonal Bundle
26.	1B4L	0.74	3.19	153	Mainly Beta, Sandwich
27.	1B56	0.76	2.68	133	Mainly Beta, Beta Barrel
28.	1B63	0.69	11.59	333	Alpha Beta, 2-Layer Sandwich
29.	1B71	0.68	5.05	191	Mainly Alpha, Up-down Bundle
30.	1BD8	0.59	3.40	156	Mainly Alpha, Alpha Horseshoe
31.	1BEA	0.81	2.77	116	Mainly Alpha, Orthogonal Bundle
32.	1BED	0.62	3.54	181	Alpha Beta, 3-Layer(aba) Sandwich
33.	1BET	0.88	4.80	107	Mainly Beta, Ribbon
34.	1BFG	0.68	2.65	126	Mainly Beta, Sandwich
35.	1BFS	0.53	1.99	106	Mainly Beta, Sandwich
36.	1BG2	0.77	8.81	323	Alpha Beta, 3-Layer(aba) Sandwich
37.	1BG5	0.87	19.97	254	Alpha Beta, 3-Layer(aba) Sandwich
38.	1BGF	0.88	4.03	124	Mainly Alpha, Orthogonal Bundle
39.	1BHE	0.71	2.76	376	Mainly Beta, 3 Solenoid
40.	1BHP	0.72	6.97	45	Alpha Beta, 2-Layer Sandwich
41.	1BJ7	0.68	3.05	150	Mainly Beta, Beta Barrel
42.	1BLE	0.75	2.28	161	Alpha Beta, 3-Layer(aba) Sandwich
43.	1BM8	0.74	2.36	99	Alpha Beta, Roll
44.	1BOL	0.68	4.35	222	Alpha Beta, Alpha-Beta Complex
45.	1BOY	0.75	3.77	211	Mainly Beta, Sandwich
46.	1BQC	0.63	3.45	302	Alpha Beta, Alpha-Beta Barrel
47.	1BRT	0.54	3.20	277	Alpha Beta, 3-Layer(aba) Sandwich
48.	1BSN	0.80	2.41	138	Mainly Beta, Sandwich
49.	1BSQ	0.73	2.70	162	Mainly Beta, Beta Barrel
50.	1BUD	0.74	2.89	197	Alpha Beta, 3-Layer(aba) Sandwich
51.	1BWP	0.71	3.31	212	Alpha Beta, 3-Layer(aba) Sandwich
52.	1BWZ	0.80	2.82	274	Alpha Beta, Roll
53.	1BZ4	0.68	1.79	144	Mainly Alpha, Up-down Bundle
54.	1C25	0.76	11.64	161	Alpha Beta, 3-Layer(aba) Sandwich
55.	1C3D	0.51	2.56	294	Mainly Alpha, Alpha/alpha barrel
56.	1C3G	0.51	10.36	170	Mainly Beta, Sandwich
57.	1C44	0.73	4.22	123	Alpha Beta, 2-Layer Sandwich
58.	1C52	0.68	2.07	131	Mainly Alpha, Orthogonal Bundle
59.	1C75	0.47	4.48	71	Mainly Alpha, Orthogonal Bundle
60.	1C7K	0.62	2.30	132	Alpha Beta, 3-Layer(aba) Sandwich
61.	1C8Z	0.86	6.00	265	Alpha Beta, Alpha-Beta Barrel
62.	1CBY	0.82	21.53	227	Alpha Beta, 3-Layer(aba) Sandwich
63.	1CD5	0.74	3.10	266	Alpha Beta, 3-Layer(aba) Sandwich
64.	1CDY	0.73	2.49	178	Mainly Beta, Sandwich
65.	1CFR	0.71	4.26	283	Alpha Beta, 3-Layer(aba) Sandwich
66.	1CHN	0.69	3.36	126	Alpha Beta, 3-Layer(aba) Sandwich
67.	1CID	0.81	2.18	177	Mainly Beta, Sandwich
68.	1CO6	0.40	2.50	107	Mainly Alpha, Orthogonal Bundle
69.	1COF	0.58	2.56	135	Alpha Beta, 3-Layer(aba) Sandwich
70.	1CPQ	0.39	4.71	129	Mainly Alpha, Up-down Bundle
71.	1CQY	0.71	2.34	99	Mainly Beta, Sandwich
72.	1CS3	0.51	10.11	116	Alpha Beta, 2-Layer Sandwich
73.	1CS6	0.70	3.42	382	Mainly Beta, Sandwich
74.	1CSP	0.86	2.75	67	Mainly Beta, Beta Barrel
75.	1CTF	0.52	2.03	68	Alpha Beta, 2-Layer Sandwich
76.	1CUO	0.79	3.93	129	Mainly Beta, Sandwich
77.	1CYO	0.79	3.02	88	Alpha Beta, Roll
78.	1CZT	0.85	2.89	160	Mainly Beta, Sandwich
79.	1D1L	0.80	8.95	61	Alpha Beta, 2-Layer Sandwich
80.	1D2P	0.29	28.14	373	Mainly Beta, Sandwich
81.	1D9V	0.58	2.39	309	Alpha Beta, 3-Layer(aba) Sandwich
82.	1DFF	0.62	3.18	164	Alpha Beta, Alpha-Beta Complex
83.	1DFX	0.75	5.44	125	Mainly Beta, Sandwich
84.	1DG9	0.79	5.69	157	Alpha Beta, 3-Layer(aba) Sandwich
85.	1DHN	0.89	4.46	121	Alpha Beta, 2-Layer Sandwich
86.	1DLW	0.69	1.57	116	Mainly Alpha, Orthogonal Bundle
87.	1DOL	0.73	22.92	71	Mainly Beta, Beta Barrel
88.	1DOV	0.83	11.26	181	Mainly Alpha, Up-down Bundle
89.	1DPO	0.74	3.01	223	Mainly Beta, Beta Barrel
90.	1DT4	0.52	2.31	73	Alpha Beta, 2-Layer Sandwich
91.	1DUA	0.71	4.83	242	Mainly Beta, Beta Barrel
92.	1DVO	0.44	42.79	152	Mainly Alpha, Orthogonal Bundle
93.	1DXH	0.80	3.75	335	Alpha Beta, 3-Layer(aba) Sandwich
94.	1E5W	0.63	4.70	346	Alpha Beta, Roll
95.	1E9M	0.64	1.82	106	Alpha Beta, Roll
96.	1EB6	0.77	3.30	177	Alpha Beta, 3-Layer(aba) Sandwich
97.	1ECA	0.64	2.01	136	Mainly Alpha, Orthogonal Bundle
98.	1EE6	0.62	1.81	197	Mainly Beta, 3 Solenoid
99.	1EJ8	0.82	3.32	140	Mainly Beta, Sandwich
100.	1EJE	0.91	13.70	192	Mainly Beta, Roll
101.	1ENF	0.62	3.20	212	Alpha Beta, Roll
102.	1ENH	0.56	8.27	54	Mainly Alpha, Orthogonal Bundle
103.	1EUR	0.75	4.74	361	Mainly Beta, 6 Propellor
104.	1EW0	0.38	33.84	130	Alpha Beta, 2-Layer Sandwich
105.	1EW4	0.83	3.80	106	Alpha Beta, 2-Layer Sandwich
106.	1EYH	0.76	2.83	144	Mainly Alpha, Alpha Horseshoe
107.	1EZM	0.56	3.62	298	Alpha Beta, Roll
108.	1F2F	0.70	4.18	104	Alpha Beta, 2-Layer Sandwich
109.	1F3G	0.78	2.59	150	Mainly Beta, Distorted Sandwich
110.	1F94	0.71	2.51	63	Mainly Beta, Ribbon
111.	1FAS	0.87	1.69	61	Mainly Beta, Ribbon
112.	1FF4	0.83	3.26	65	Mainly Beta, Ribbon
113.	1FI2	0.74	6.87	201	Mainly Beta, Sandwich
114.	1FOB	0.70	2.95	334	Alpha Beta, Alpha-Beta Barrel
115.	1FPS	0.71	2.99	348	Mainly Alpha, Orthogonal Bundle
116.	1FRD	0.74	3.15	98	Alpha Beta, Roll
117.	1FSZ	0.73	8.12	334	Alpha Beta, 3-Layer(aba) Sandwich
118.	1FTS	0.63	2.74	295	Mainly Alpha, Up-down Bundle
119.	1FVQ	0.68	1.04	72	Alpha Beta, 2-Layer Sandwich
120.	1FX4	0.83	4.33	231	Alpha Beta, 2-Layer Sandwich
121.	1G2B	0.66	2.64	62	Mainly Beta, Roll
122.	1G2U	0.82	7.17	345	Alpha Beta, 3-Layer(aba) Sandwich
123.	1G3Q	0.71	1.93	237	Alpha Beta, 3-Layer(aba) Sandwich
124.	1G43	0.53	2.65	160	Mainly Beta, Sandwich
125.	1G5Z	0.65	2.11	164	Mainly Alpha, Up-down Bundle
126.	1G62	0.65	2.34	224	Alpha Beta, 5-stranded Propeller
127.	1G66	0.63	2.85	207	Alpha Beta, 3-Layer(aba) Sandwich
128.	1G8A	0.74	2.89	227	Alpha Beta, 2-Layer Sandwich
129.	1G9O	0.64	8.05	91	Mainly Beta, Roll
130.	1GEN	0.81	5.03	200	Mainly Beta, 4 Propellor
131.	1GHR	0.71	3.40	306	Alpha Beta, Alpha-Beta Barrel
132.	1GNR	0.56	3.75	166	Alpha Beta, 3-Layer(aba) Sandwich
133.	1GNU	0.79	2.88	117	Alpha Beta, Roll
134.	1GPC	0.76	3.42	218	Alpha Beta, Alpha-Beta Complex
135.	1GQN	0.68	2.65	252	Alpha Beta, Alpha-Beta Barrel
136.	1GQV	0.60	5.06	135	Alpha Beta, Roll
137.	1GS6	0.72	8.14	336	Mainly Beta, Sandwich
138.	1GTG	0.71	2.79	357	Alpha Beta, 3-Layer(aba) Sandwich
139.	1GUI	0.74	3.19	155	Mainly Beta, Sandwich
140.	1GYV	0.78	2.23	120	Mainly Beta, Sandwich
141.	1H2E	0.79	3.22	207	Alpha Beta, 3-Layer(aba) Sandwich
142.	1H3Q	0.82	3.16	140	Alpha Beta, 2-Layer Sandwich
143.	1H6L	0.77	4.28	353	Mainly Beta, 6 Propellor
144.	1HCV	0.80	2.70	116	Mainly Beta, Sandwich
145.	1HCZ	0.63	4.13	250	Mainly Beta, Sandwich
146.	1HLB	0.59	3.94	157	Mainly Alpha, Orthogonal Bundle
147.	1HQ0	0.78	4.13	295	Alpha Beta, 4-Layer Sandwich
148.	1HQ8	0.90	3.45	123	Alpha Beta, Roll
149.	1HQD	0.58	3.14	320	Alpha Beta, 3-Layer(aba) Sandwich
150.	1HUP	0.59	22.48	141	Alpha Beta, Roll
151.	1HYP	0.79	4.14	75	Mainly Alpha, Orthogonal Bundle
152.	1HZI	0.59	1.72	129	Mainly Alpha, Up-down Bundle
153.	1I27	0.64	4.30	73	Mainly Alpha, Orthogonal Bundle
154.	1I2T	0.50	1.27	61	Mainly Alpha, Orthogonal Bundle
155.	1I5G	0.67	2.77	144	Alpha Beta, 3-Layer(aba) Sandwich
156.	1I6F	0.87	4.21	60	Alpha Beta, 2-Layer Sandwich
157.	1I71	0.79	6.28	83	Mainly Beta, Beta Barrel
158.	1I82	0.76	2.62	189	Mainly Beta, Sandwich
159.	1IAE	0.50	3.90	200	Alpha Beta, 3-Layer(aba) Sandwich
160.	1IC6	0.73	2.25	279	Alpha Beta, 3-Layer(aba) Sandwich
161.	1ICX	0.70	4.01	155	Alpha Beta, 2-Layer Sandwich
162.	1IFG	0.83	4.72	140	Mainly Beta, Sandwich
163.	1IL6	0.78	5.16	166	Mainly Alpha, Up-down Bundle
164.	1ILK	0.48	33.84	151	Mainly Alpha, Up-down Bundle
165.	1IO2	0.82	3.26	213	Alpha Beta, 2-Layer Sandwich
166.	1IS1	0.66	4.39	185	Mainly Alpha, Orthogonal Bundle
167.	1IU9	0.58	2.36	111	Alpha Beta, 3-Layer(aba) Sandwich
168.	1IXH	0.30	2.26	321	Alpha Beta, 3-Layer(aba) Sandwich
169.	1J0P	0.69	13.14	108	Alpha Beta, Alpha-Beta Complex
170.	1J2A	0.76	4.86	166	Mainly Beta, Beta Barrel
171.	1J7G	0.84	7.75	144	Alpha Beta, 3-Layer(bba) Sandwich
172.	1JDR	0.70	3.45	294	Mainly Alpha, Orthogonal Bundle
173.	1JDW	0.62	2.28	360	Alpha Beta, 5-stranded Propeller
174.	1JE6	0.70	2.69	275	Alpha Beta, 2-Layer Sandwich
175.	1JER	0.75	3.53	110	Mainly Beta, Sandwich
176.	1JFX	0.67	2.69	217	Alpha Beta, Alpha-Beta Barrel
177.	1JHS	0.89	6.94	188	Alpha Beta, 3-Layer(aba) Sandwich
178.	1JKW	0.59	3.94	277	Mainly Alpha, Orthogonal Bundle
179.	1JML	0.47	22.32	72	Alpha Beta, Roll
180.	1JMW	0.76	6.86	146	Mainly Alpha, Up-down Bundle
181.	1JO8	0.74	2.71	58	Mainly Beta, Roll
182.	1JOB	0.70	6.92	162	Mainly Beta, Sandwich
183.	1JPC	0.68	22.25	108	Mainly Beta, Orthogonal Prism
184.	1JUD	0.35	2.53	220	Alpha Beta, 3-Layer(aba) Sandwich
185.	1JWQ	0.68	2.48	179	Alpha Beta, 3-Layer(aba) Sandwich
186.	1K0F	0.72	3.27	277	Alpha Beta, 3-Layer(aba) Sandwich
187.	1K40	0.68	0.78	126	Mainly Alpha, Up-down Bundle
188.	1K5P	0.52	2.79	295	Alpha Beta, 3-Layer(aba) Sandwich
189.	1KFR	0.83	1.05	147	Mainly Alpha, Orthogonal Bundle
190.	1KGE	0.73	2.64	257	Alpha Beta, 3-Layer(aba) Sandwich
191.	1KKH	0.83	2.68	317	Alpha Beta, 2-Layer Sandwich
192.	1KLO	0.54	3.98	162	Mainly Beta, Ribbon
193.	1KNT	0.52	1.92	55	Few Secondary Structures, Irregular
194.	1KOE	0.65	2.10	172	Alpha Beta, Roll
195.	1KP6	0.76	1.77	79	Alpha Beta, 2-Layer Sandwich
196.	1KPF	0.82	10.85	111	Alpha Beta, 2-Layer Sandwich
197.	1KQW	0.73	2.34	134	Mainly Beta, Beta Barrel
198.	1KR7	0.56	2.52	110	Mainly Alpha, Orthogonal Bundle
199.	1KS9	0.62	2.16	291	Alpha Beta, 3-Layer(aba) Sandwich
200.	1KTE	0.74	2.05	105	Alpha Beta, 3-Layer(aba) Sandwich
201.	1KUU	0.84	3.61	202	Alpha Beta, 4-Layer Sandwich
202.	1KXA	0.83	10.22	158	Mainly Beta, Beta Barrel
203.	1L3P	0.74	2.51	102	Mainly Alpha, Up-down Bundle
204.	1L7L	0.47	3.38	121	Mainly Beta, Sandwich
205.	1L8F	0.69	2.48	207	Mainly Beta, Beta Barrel
206.	1LBU	0.67	4.29	213	Mainly Alpha, Orthogonal Bundle
207.	1LCL	0.81	3.32	141	Mainly Beta, Sandwich
208.	1LEO	0.72	7.63	150	Alpha Beta, 2-Layer Sandwich
209.	1LIS	0.73	2.69	131	Mainly Alpha, Up-down Bundle
210.	1LMI	0.87	2.23	131	Mainly Beta, Sandwich
211.	1LP8	0.74	2.61	254	Alpha Beta, 3-Layer(aba) Sandwich
212.	1LPL	0.78	10.87	95	Mainly Beta, Roll
213.	1LRV	0.60	3.40	233	Mainly Alpha, Alpha Horseshoe
214.	1LWB	0.56	3.33	122	Mainly Alpha, Up-down Bundle
215.	1LXA	0.60	3.85	262	Mainly Beta, 3 Solenoid
216.	1M4L	0.61	3.45	307	Alpha Beta, 3-Layer(aba) Sandwich
217.	1MAT	0.63	2.51	263	Alpha Beta, Alpha-Beta Complex
218.	1MD6	0.76	4.28	154	Mainly Beta, Trefoil
219.	1MHN	0.89	3.02	59	Mainly Beta, Roll
220.	1MIX	0.77	5.80	206	Mainly Alpha, Up-down Bundle
221.	1MJC	0.90	3.03	69	Mainly Beta, Beta Barrel
222.	1MJN	0.69	2.16	179	Alpha Beta, 3-Layer(aba) Sandwich
223.	1MKP	0.82	2.79	144	Alpha Beta, Alpha-Beta Complex
224.	1MML	0.55	2.82	251	Alpha Beta, 2-Layer Sandwich
225.	1MOF	0.52	22.72	53	Mainly Alpha, Orthogonal Bundle
226.	1MRJ	0.71	2.99	247	Alpha Beta, 3-Layer(aba) Sandwich
227.	1MSC	0.86	16.99	129	Alpha Beta, 2-Layer Sandwich
228.	1MWP	0.65	3.12	96	Alpha Beta, Alpha-Beta Complex
229.	1N81	0.71	21.43	186	Mainly Alpha, Orthogonal Bundle
230.	1NAR	0.74	4.26	289	Alpha Beta, Alpha-Beta Barrel
231.	1NB0	0.85	3.84	147	Mainly Beta, Beta Barrel
232.	1NE9	0.66	3.42	335	Alpha Beta, 3-Layer(aba) Sandwich
233.	1NG6	0.42	2.81	148	Mainly Alpha, Orthogonal Bundle
234.	1NOF	0.71	3.22	383	Mainly Beta, Sandwich
235.	1NPI	0.56	6.67	61	Alpha Beta, 2-Layer Sandwich
236.	1NQ6	0.54	3.00	302	Alpha Beta, Alpha-Beta Barrel
237.	1NSO	0.54	5.25	107	Mainly Beta, Beta Barrel
238.	1NXQ	0.73	4.01	251	Alpha Beta, 3-Layer(aba) Sandwich
239.	1O08	0.67	2.05	221	Alpha Beta, 3-Layer(aba) Sandwich
240.	1O5T	0.64	2.74	378	Alpha Beta, 3-Layer(aba) Sandwich
241.	1OA4	0.78	2.33	222	Mainly Beta, Sandwich
242.	1OAL	0.63	4.41	151	Mainly Beta, Sandwich
243.	1OFV	0.60	2.38	169	Alpha Beta, 3-Layer(aba) Sandwich
244.	1OK0	0.66	2.60	74	Mainly Beta, Sandwich
245.	1OMR	0.57	5.75	201	Mainly Alpha, Orthogonal Bundle
246.	1OOI	0.40	1.54	124	Mainly Alpha, Orthogonal Bundle
247.	1OPC	0.57	2.15	99	Mainly Alpha, Orthogonal Bundle
248.	1OPD	0.61	1.53	85	Alpha Beta, 2-Layer Sandwich
249.	1ORB	0.76	5.65	293	Alpha Beta, 3-Layer(aba) Sandwich
250.	1OUR	0.74	3.16	114	Mainly Beta, Sandwich
251.	1P1L	0.67	2.93	102	Alpha Beta, 2-Layer Sandwich
252.	1P36	0.59	3.03	164	Mainly Alpha, Orthogonal Bundle
253.	1P3C	0.63	2.44	215	Mainly Beta, Beta Barrel
254.	1P4X	0.77	3.73	250	Mainly Alpha, Orthogonal Bundle
255.	1P6P	0.71	3.15	125	Mainly Beta, Beta Barrel
256.	1P7N	0.85	8.48	176	Mainly Alpha, Orthogonal Bundle
257.	1PA2	0.67	3.72	306	Mainly Alpha, Orthogonal Bundle
258.	1PA7	0.86	2.59	130	Mainly Alpha, Orthogonal Bundle
259.	1PBV	0.79	2.24	195	Mainly Alpha, Orthogonal Bundle
260.	1PDO	0.64	3.30	129	Alpha Beta, 3-Layer(aba) Sandwich
261.	1PHK	0.71	4.69	277	Alpha Beta, 2-Layer Sandwich
262.	1PHT	0.71	4.41	83	Mainly Beta, Roll
263.	1PI1	0.79	4.55	185	Mainly Alpha, Up-down Bundle
264.	1PIL	0.67	11.25	112	Alpha Beta, 2-Layer Sandwich
265.	1PJB	0.72	3.55	361	Alpha Beta, 3-Layer(aba) Sandwich
266.	1PKP	0.72	2.28	145	Alpha Beta, 2-Layer Sandwich
267.	1PLC	0.64	2.95	99	Mainly Beta, Sandwich
268.	1PLR	0.69	3.21	258	Alpha Beta, Box
269.	1PM1	0.83	3.83	180	Mainly Beta, Beta Barrel
270.	1PMJ	0.61	5.05	185	Mainly Beta, Sandwich
271.	1PNE	0.67	2.36	139	Alpha Beta, 2-Layer Sandwich
272.	1PPO	0.85	2.37	216	Alpha Beta, Alpha-Beta Complex
273.	1PTQ	0.76	2.40	50	Alpha Beta, 2-Layer Sandwich
274.	1PUD	0.69	2.03	372	Alpha Beta, Alpha-Beta Barrel
275.	1PXU	0.85	3.56	131	Mainly Beta, Beta Barrel
276.	1PY9	0.83	2.78	116	Mainly Beta, Sandwich
277.	1Q2Y	0.81	1.79	140	Alpha Beta, 3-Layer(aba) Sandwich
278.	1Q9B	0.83	3.16	43	Alpha Beta, 2-Layer Sandwich
279.	1QAU	0.83	6.15	112	Mainly Beta, Roll
280.	1QAZ	0.72	5.31	351	Mainly Alpha, Alpha/alpha barrel
281.	1QCX	0.72	3.94	359	Mainly Beta, 3 Solenoid
282.	1QCY	0.59	2.67	193	Alpha Beta, 3-Layer(aba) Sandwich
283.	1QHD	0.70	3.14	397	Mainly Alpha, Orthogonal Bundle
284.	1QHV	0.85	15.31	195	Mainly Beta, Sandwich
285.	1QIB	0.82	4.88	161	Alpha Beta, 3-Layer(aba) Sandwich
286.	1QLJ	0.59	3.52	374	Alpha Beta, Alpha-Beta Complex
287.	1QLM	0.74	2.21	316	Alpha Beta, Roll
288.	1QQH	0.77	4.99	144	Mainly Beta, Beta Complex
289.	1QST	0.66	3.65	160	Alpha Beta, 3-Layer(aba) Sandwich
290.	1QTO	0.54	10.35	122	Alpha Beta, Roll
291.	1QTS	0.71	9.02	247	Mainly Beta, Sandwich
292.	1QTW	0.65	3.13	285	Alpha Beta, Alpha-Beta Barrel
293.	1QWG	0.72	2.62	251	Alpha Beta, Alpha-Beta Barrel
294.	1QZM	0.53	2.27	94	Mainly Alpha, Orthogonal Bundle
295.	1R69	0.68	1.40	63	Mainly Alpha, Orthogonal Bundle
296.	1R6J	0.77	2.70	82	Mainly Beta, Roll
297.	1R8N	0.84	6.70	185	Mainly Beta, Trefoil
298.	1RC9	0.78	8.62	221	Alpha Beta, 3-Layer(aba) Sandwich
299.	1RIE	0.62	3.54	127	Mainly Beta, 3-layer Sandwich
300.	1RIS	0.72	2.35	97	Alpha Beta, 2-Layer Sandwich
301.	1RMD	0.66	4.13	116	Alpha Beta, 2-Layer Sandwich
302.	1RMR	0.59	14.53	64	Few Secondary Structures, Irregular
303.	1S2O	0.65	2.85	244	Alpha Beta, 3-Layer(aba) Sandwich
304.	1S3D	0.69	4.49	138	Alpha Beta, 3-Layer(aba) Sandwich
305.	1S7I	0.68	7.27	124	Alpha Beta, 2-Layer Sandwich
306.	1S8I	0.80	2.81	121	Mainly Alpha, Up-down Bundle
307.	1SBP	0.59	2.34	309	Alpha Beta, 3-Layer(aba) Sandwich
308.	1SDF	0.87	4.63	67	Mainly Beta, Beta Barrel
309.	1SFP	0.81	3.40	111	Mainly Beta, Sandwich
310.	1SK3	0.72	2.14	165	Alpha Beta, 3-Layer(aba) Sandwich
311.	1SKF	0.75	2.71	262	Alpha Beta, 3-Layer(aba) Sandwich
312.	1SKZ	0.74	5.59	104	Mainly Beta, Ribbon
313.	1SRA	0.82	3.08	151	Mainly Alpha, Orthogonal Bundle
314.	1SRV	0.61	3.78	145	Alpha Beta, 3-Layer(bba) Sandwich
315.	1SUR	0.80	3.85	215	Alpha Beta, 3-Layer(aba) Sandwich
316.	1T00	0.49	2.98	112	Alpha Beta, 3-Layer(aba) Sandwich
317.	1T2I	0.64	4.53	96	Alpha Beta, Roll
318.	1T4W	0.85	4.33	196	Mainly Beta, Sandwich
319.	1T6K	0.81	2.78	278	Alpha Beta, Roll
320.	1T8K	0.72	1.78	77	Mainly Alpha, Orthogonal Bundle
321.	1TFE	0.68	2.36	142	Alpha Beta, 2-Layer Sandwich
322.	1TFG	0.74	3.66	112	Mainly Beta, Ribbon
323.	1TFU	0.66	3.39	157	Alpha Beta, 3-Layer(aba) Sandwich
324.	1THF	0.71	2.47	253	Alpha Beta, Alpha-Beta Barrel
325.	1TIB	0.67	2.39	269	Alpha Beta, 3-Layer(aba) Sandwich
326.	1TIF	0.64	3.52	76	Alpha Beta, Roll
327.	1TIG	0.69	2.99	88	Alpha Beta, 2-Layer Sandwich
328.	1TIS	0.81	5.30	286	Alpha Beta, 2-Layer Sandwich
329.	1TJD	0.83	2.90	216	Alpha Beta, Roll
330.	1TJE	0.71	2.87	224	Alpha Beta, Roll
331.	1TLK	0.89	13.18	103	Mainly Beta, Sandwich
332.	1TMY	0.60	1.80	118	Alpha Beta, 3-Layer(aba) Sandwich
333.	1TQG	0.56	2.86	105	Mainly Alpha, Up-down Bundle
334.	1TUL	0.67	3.04	102	Mainly Beta, Distorted Sandwich
335.	1TZQ	0.79	2.34	175	Mainly Beta, Sandwich
336.	1TZW	0.71	3.21	142	Mainly Alpha, Orthogonal Bundle
337.	1UB9	0.60	12.92	100	Mainly Alpha, Orthogonal Bundle
338.	1UBI	0.81	1.91	76	Alpha Beta, Roll
339.	1UCS	0.44	3.20	64	Alpha Beta, Alpha-Beta Complex
340.	1UE8	0.44	3.78	367	Mainly Alpha, Orthogonal Bundle
341.	1UHN	0.55	3.28	189	Mainly Alpha, Orthogonal Bundle
342.	1UMH	0.78	3.14	184	Mainly Beta, Sandwich
343.	1UTG	0.71	3.13	70	Mainly Alpha, Orthogonal Bundle
344.	1V7R	0.63	2.18	186	Alpha Beta, Alpha-Beta Complex
345.	1VBW	0.83	4.11	68	Alpha Beta, 2-Layer Sandwich
346.	1VC2	0.83	4.72	331	Alpha Beta, 3-Layer(aba) Sandwich
347.	1VCC	0.76	5.51	77	Alpha Beta, 2-Layer Sandwich
348.	1VHH	0.81	6.47	157	Alpha Beta, 2-Layer Sandwich
349.	1VIE	0.91	5.87	60	Mainly Beta, Roll
350.	1VIN	0.71	2.11	252	Mainly Alpha, Orthogonal Bundle
351.	1WBC	0.85	4.04	183	Mainly Beta, Trefoil
352.	1WHI	0.78	3.74	122	Mainly Beta, Beta Barrel
353.	1WHP	0.68	2.16	94	Mainly Beta, Sandwich
354.	1WWB	0.87	20.37	103	Mainly Beta, Sandwich
355.	1XBN	0.77	3.61	195	Alpha Beta, Alpha-Beta Complex
356.	1XDW	0.78	5.89	331	Alpha Beta, 3-Layer(aba) Sandwich
357.	1XSM	0.68	5.20	288	Mainly Alpha, Orthogonal Bundle
358.	1YER	0.72	2.30	207	Alpha Beta, 2-Layer Sandwich
359.	1YFQ	0.88	7.14	342	Mainly Beta, 7 Propellor
360.	1YTN	0.65	3.95	283	Alpha Beta, Alpha-Beta Complex
361.	1YW5	0.76	5.01	177	Alpha Beta, Roll
362.	1YZF	0.66	2.56	195	Alpha Beta, 3-Layer(aba) Sandwich
363.	1Z33	0.76	3.64	235	Alpha Beta, 3-Layer(aba) Sandwich
364.	2ACY	0.56	4.04	98	Alpha Beta, 2-Layer Sandwich
365.	2ARA	0.64	3.43	149	Mainly Beta, Sandwich
366.	2BAA	0.75	4.58	243	Mainly Alpha, Orthogonal Bundle
367.	2CHR	0.57	2.21	370	Alpha Beta, 2-Layer Sandwich
368.	2DRI	0.59	2.08	271	Alpha Beta, 3-Layer(aba) Sandwich
369.	2E2C	0.66	8.80	156	Alpha Beta, Roll
370.	2EBN	0.67	3.28	285	Alpha Beta, Alpha-Beta Barrel
371.	2ERL	0.61	4.91	40	Mainly Alpha, Up-down Bundle
372.	2FCB	0.66	2.53	173	Mainly Beta, Sandwich
373.	2GDM	0.79	2.65	153	Mainly Alpha, Orthogonal Bundle
374.	2HBG	0.60	1.53	147	Mainly Alpha, Orthogonal Bundle
375.	2IGD	0.87	4.25	61	Alpha Beta, Roll
376.	2LHB	0.63	2.68	149	Mainly Alpha, Orthogonal Bundle
377.	2LIV	0.60	2.61	344	Alpha Beta, 3-Layer(aba) Sandwich
378.	2MCM	0.56	2.22	112	Mainly Beta, Sandwich
379.	2OVO	0.67	7.02	56	Alpha Beta, 2-Layer Sandwich
380.	2PIA	0.66	2.77	321	Mainly Beta, Beta Barrel
381.	2PLC	0.45	2.58	274	Alpha Beta, Alpha-Beta Barrel
382.	2PRD	0.68	4.61	174	Alpha Beta, Alpha-Beta Complex
383.	2RHE	0.82	2.84	114	Mainly Beta, Sandwich
384.	2SAS	0.79	3.09	185	Mainly Alpha, Orthogonal Bundle
385.	2YGS	0.50	1.00	92	Mainly Alpha, Orthogonal Bundle
386.	3EBX	0.81	2.12	62	Mainly Beta, Ribbon
387.	3EZM	0.31	15.63	101	Mainly Beta, Roll
388.	3MBP	0.55	2.47	370	Alpha Beta, 3-Layer(aba) Sandwich
389.	3SSI	0.86	5.53	108	Alpha Beta, 2-Layer Sandwich
390.	3TSS	0.69	2.96	190	Alpha Beta, Roll
391.	3VUB	0.79	3.87	101	Mainly Beta, Roll
392.	4THI	0.69	2.75	362	Alpha Beta, 3-Layer(aba) Sandwich
393.	5NUL	0.75	1.86	138	Alpha Beta, 3-Layer(aba) Sandwich
avg.		0.70	4.66

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© Laboratory of Theory of Biopolymers, Faculty of Chemistry, University of Warsaw 2013