BMRBj - BMREntryMaster

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BMRB: 30904

7MP7

Rules for designing protein fold switches and their implications for the folding code

Authors

He, Y., Chen, Y., Ruan, B., Choi, J., Chen, Y., Motabar, D., Solomon, T., Simmerman, R., Kauffman, T., Gallagher, T., Bryan, P., Orban, J.

Assembly

Sb3

Entity

1. Sb3 (polymer, Thiol state: not present), 87 monomers, 10056.92 Da Detail

TTYKYILNLK FAFGDTNSEA VDAAEAEKKF KQYANDHGVD GEWTYDDATK TFTVTAKDSH ADRVRELAQR LRQRPRVERV EITEVTE

Formula weight

10056.92 Da

Source organism

Thermus thermophilus

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 333, ¹³C: 287, ¹⁵N: 76 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	4	LYS	C	C	173.651	0	1
2	1	4	LYS	CA	C	54.932	0	1
3	1	4	LYS	CB	C	35.153	0	1
4	1	4	LYS	CG	C	25.099	0	1
5	1	4	LYS	CD	C	29.646	0	1
6	1	5	TYR	H	H	8.591	0.008	1
7	1	5	TYR	HA	H	5.192	0.02	1
8	1	5	TYR	HB2	H	2.643	0	1
9	1	5	TYR	HB3	H	2.643	0	1
10	1	5	TYR	C	C	174.192	0.007	1
11	1	5	TYR	CA	C	57.096	0.09	1
12	1	5	TYR	CB	C	42.23	0.091	1
13	1	5	TYR	N	N	119.607	0	1
14	1	6	ILE	H	H	8.979	0.011	1
15	1	6	ILE	HA	H	4.71	0.013	1
16	1	6	ILE	HB	H	1.643	0	1
17	1	6	ILE	HD11	H	0.684	0	1
18	1	6	ILE	HD12	H	0.684	0	1
19	1	6	ILE	HD13	H	0.684	0	1
20	1	6	ILE	C	C	175.459	0	1
21	1	6	ILE	CA	C	60.018	0.05	1
22	1	6	ILE	CB	C	40.001	0.039	1
23	1	6	ILE	CG2	C	18.469	0	1
24	1	6	ILE	N	N	122.568	0	1
25	1	7	LEU	H	H	9.064	0.002	1
26	1	7	LEU	HA	H	5.244	0.013	1
27	1	7	LEU	HB2	H	1.341	0	1
28	1	7	LEU	HB3	H	1.341	0	1
29	1	7	LEU	HD11	H	0.629	0	1
30	1	7	LEU	HD12	H	0.629	0	1
31	1	7	LEU	HD13	H	0.629	0	1
32	1	7	LEU	C	C	174.562	0.02	1
33	1	7	LEU	CA	C	53.79	0.228	1
34	1	7	LEU	CB	C	43.563	0.116	1
35	1	7	LEU	CG	C	25.921	0	1
36	1	7	LEU	CD1	C	28.331	0	1
37	1	7	LEU	N	N	129.404	0	1
38	1	8	ASN	H	H	8.865	0.004	1
39	1	8	ASN	HA	H	5.641	0	1
40	1	8	ASN	HB2	H	2.519	0	1
41	1	8	ASN	HB3	H	2.519	0	1
42	1	8	ASN	C	C	173.713	0.034	1
43	1	8	ASN	CA	C	51.982	0.19	1
44	1	8	ASN	CB	C	42.723	0.168	1
45	1	8	ASN	N	N	121.846	0	1
46	1	9	LEU	H	H	9.752	0.001	1
47	1	9	LEU	HA	H	5.223	0.012	1
48	1	9	LEU	HB2	H	1.698	0	1
49	1	9	LEU	HB3	H	1.698	0	1
50	1	9	LEU	HG	H	1.122	0	1
51	1	9	LEU	HD11	H	0.492	0	2
52	1	9	LEU	HD12	H	0.492	0	2
53	1	9	LEU	HD13	H	0.492	0	2
54	1	9	LEU	C	C	173.871	0	1
55	1	9	LEU	CA	C	54.247	0.082	1
56	1	9	LEU	CB	C	45.773	0.013	1
57	1	9	LEU	CG	C	21.592	0	1
58	1	9	LEU	CD1	C	27.838	0	1
59	1	9	LEU	N	N	127.29	0	1
60	1	10	LYS	H	H	8.784	0.002	1
61	1	10	LYS	HA	H	5.115	0.027	1
62	1	10	LYS	HB2	H	1.862	0	1
63	1	10	LYS	HB3	H	1.862	0	1
64	1	10	LYS	HG2	H	1.52	0	1
65	1	10	LYS	HG3	H	1.52	0	1
66	1	10	LYS	C	C	174.474	0.027	1
67	1	10	LYS	CA	C	55.306	0.009	1
68	1	10	LYS	CB	C	35.107	0.091	1
69	1	10	LYS	CG	C	24.989	0	1
70	1	10	LYS	N	N	127.451	0.014	1
71	1	11	PHE	H	H	9.176	0.002	1
72	1	11	PHE	HA	H	5.212	0.019	1
73	1	11	PHE	HB2	H	2.999	0	1
74	1	11	PHE	HB3	H	2.999	0	1
75	1	11	PHE	C	C	173.987	0.007	1
76	1	11	PHE	CA	C	56.694	0.11	1
77	1	11	PHE	CB	C	43.398	0.116	1
78	1	11	PHE	N	N	130.281	0	1
79	1	12	ALA	H	H	8.633	0.001	1
80	1	12	ALA	HA	H	4.491	0	1
81	1	12	ALA	HB1	H	1.246	0	1
82	1	12	ALA	HB2	H	1.246	0	1
83	1	12	ALA	HB3	H	1.246	0	1
84	1	12	ALA	C	C	176.165	0.048	1
85	1	12	ALA	CA	C	51.179	0.09	1
86	1	12	ALA	CB	C	18.579	0.039	1
87	1	12	ALA	N	N	128.178	0	1
88	1	13	PHE	H	H	8.349	0.002	1
89	1	13	PHE	HA	H	4.268	0	1
90	1	13	PHE	HB2	H	3.259	0	2
91	1	13	PHE	HB3	H	2.971	0	2
92	1	13	PHE	C	C	176.411	0.035	1
93	1	13	PHE	CA	C	59.415	0.11	1
94	1	13	PHE	CB	C	40.075	0.091	1
95	1	13	PHE	N	N	122.127	0	1
96	1	14	GLY	H	H	8.547	0.002	1
97	1	14	GLY	HA2	H	3.94	0	1
98	1	14	GLY	HA3	H	3.94	0	1
99	1	14	GLY	C	C	173.74	0.007	1
100	1	14	GLY	CA	C	44.987	0.15	1
101	1	14	GLY	N	N	109.089	0	1
102	1	15	ASP	H	H	8.35	0.002	1
103	1	15	ASP	HA	H	4.339	0	1
104	1	15	ASP	C	C	176.651	0.069	1
105	1	15	ASP	CA	C	54.046	0.17	1
106	1	15	ASP	CB	C	41.024	0.013	1
107	1	15	ASP	N	N	121.083	0	1
108	1	16	THR	H	H	8.17	0.001	1
109	1	16	THR	HA	H	4.304	0	1
110	1	16	THR	HG21	H	1.191	0	1
111	1	16	THR	HG22	H	1.191	0	1
112	1	16	THR	HG23	H	1.191	0	1
113	1	16	THR	C	C	174.603	0.034	1
114	1	16	THR	CA	C	62.1	0.05	1
115	1	16	THR	CB	C	69.405	0.142	1
116	1	16	THR	CG2	C	21.674	0	1
117	1	16	THR	N	N	114.699	0	1
118	1	17	ASN	H	H	8.514	0.002	1
119	1	17	ASN	HA	H	4.726	0	1
120	1	17	ASN	C	C	173.61	0	1
121	1	17	ASN	CA	C	54.466	0	1
122	1	17	ASN	CB	C	35.345	0	1
123	1	17	ASN	N	N	121.006	0	1
124	1	18	SER	C	C	174.61	0	1
125	1	18	SER	CA	C	57.89	0	1
126	1	18	SER	CB	C	63.369	0	1
127	1	19	GLU	H	H	8.295	0.001	1
128	1	19	GLU	HA	H	4.081	0	1
129	1	19	GLU	HB2	H	2.054	0	1
130	1	19	GLU	HB3	H	2.054	0	1
131	1	19	GLU	C	C	176.206	0.021	1
132	1	19	GLU	CA	C	57.735	0.31	1
133	1	19	GLU	CB	C	29.756	0.194	1
134	1	19	GLU	CG	C	36.331	0	1
135	1	19	GLU	N	N	123.533	0	1
136	1	20	ALA	H	H	8.134	0.002	1
137	1	20	ALA	HA	H	4.081	0	1
138	1	20	ALA	HB1	H	1.437	0	1
139	1	20	ALA	HB2	H	1.437	0	1
140	1	20	ALA	HB3	H	1.437	0	1
141	1	20	ALA	C	C	179.062	0	1
142	1	20	ALA	CA	C	53.967	0.243	1
143	1	20	ALA	CB	C	18.622	0.124	1
144	1	20	ALA	N	N	123.05	0	1
145	1	21	VAL	H	H	8.212	0.006	1
146	1	21	VAL	HA	H	4.092	0	1
147	1	21	VAL	CA	C	61.863	0	1
148	1	21	VAL	CB	C	32.824	0	1
149	1	21	VAL	N	N	121.694	0.033	1
150	1	22	ASP	CA	C	55.315	0	1
151	1	22	ASP	CB	C	40.686	0	1
152	1	23	ALA	H	H	8.827	0.001	1
153	1	23	ALA	HA	H	4.351	0	1
154	1	23	ALA	C	C	177.541	0	1
155	1	23	ALA	CA	C	55.379	0.07	1
156	1	23	ALA	CB	C	17.593	0.194	1
157	1	23	ALA	N	N	124.879	0	1
158	1	24	ALA	H	H	7.822	0.002	1
159	1	24	ALA	HA	H	4.034	0	1
160	1	24	ALA	C	C	180.966	0	1
161	1	24	ALA	CA	C	54.759	0.05	1
162	1	24	ALA	CB	C	17.94	0.091	1
163	1	24	ALA	N	N	120.433	0	1
164	1	25	GLU	H	H	7.938	0	1
165	1	25	GLU	HA	H	3.975	0	1
166	1	25	GLU	HB2	H	2.026	0	1
167	1	25	GLU	HB3	H	2.026	0	1
168	1	25	GLU	C	C	178.74	0.007	1
169	1	25	GLU	CA	C	58.63	0.03	1
170	1	25	GLU	CB	C	29.373	0.116	1
171	1	25	GLU	CG	C	36.276	0	1
172	1	25	GLU	N	N	119.13	0	1
173	1	26	ALA	H	H	7.997	0.003	1
174	1	26	ALA	HA	H	3.963	0	1
175	1	26	ALA	HB1	H	1.314	0	1
176	1	26	ALA	HB2	H	1.314	0	1
177	1	26	ALA	HB3	H	1.314	0	1
178	1	26	ALA	C	C	178.172	0	1
179	1	26	ALA	CA	C	54.667	0.07	1
180	1	26	ALA	CB	C	18.031	0.194	1
181	1	26	ALA	N	N	122.298	0	1
182	1	27	GLU	H	H	7.935	0.003	1
183	1	27	GLU	HA	H	3.905	0	1
184	1	27	GLU	C	C	178.706	0	1
185	1	27	GLU	CA	C	58.356	0	1
186	1	27	GLU	CB	C	29.427	0	1
187	1	27	GLU	N	N	119.746	0.002	1
188	1	28	LYS	H	H	7.936	0	1
189	1	28	LYS	N	N	119.746	0	1
190	1	29	LYS	H	H	7.936	0	1
191	1	29	LYS	C	C	179.048	0	1
192	1	29	LYS	N	N	119.746	0	1
193	1	30	PHE	H	H	8.254	0.001	1
194	1	30	PHE	HA	H	4.081	0	1
195	1	30	PHE	C	C	177.562	0.021	1
196	1	30	PHE	CA	C	59.014	0.15	1
197	1	30	PHE	CB	C	36.294	0.013	1
198	1	30	PHE	N	N	119.803	0.042	1
199	1	31	LYS	H	H	7.877	0.003	1
200	1	31	LYS	HA	H	3.74	0	1
201	1	31	LYS	HB2	H	1.643	0	1
202	1	31	LYS	HB3	H	1.643	0	1
203	1	31	LYS	HG2	H	1.04	0	1
204	1	31	LYS	HG3	H	1.04	0	1
205	1	31	LYS	C	C	178.884	0	1
206	1	31	LYS	CA	C	59.598	0.07	1
207	1	31	LYS	CB	C	32.076	0.065	1
208	1	31	LYS	CG	C	25.318	0	1
209	1	31	LYS	CD	C	29.372	0	1
210	1	31	LYS	CE	C	42.412	0	1
211	1	31	LYS	N	N	119.615	0	1
212	1	32	GLN	H	H	7.483	0.001	1
213	1	32	GLN	HA	H	3.975	0	1
214	1	32	GLN	HB2	H	2.108	0	1
215	1	32	GLN	HB3	H	2.108	0	1
216	1	32	GLN	HG2	H	2.424	0	1
217	1	32	GLN	HG3	H	2.424	0	1
218	1	32	GLN	C	C	179.706	0	1
219	1	32	GLN	CA	C	58.758	0.07	1
220	1	32	GLN	CB	C	27.93	0.013	1
221	1	32	GLN	CG	C	33.81	0	1
222	1	32	GLN	N	N	119.376	0	1
223	1	33	TYR	H	H	8.102	0.001	1
224	1	33	TYR	HA	H	4.057	0	1
225	1	33	TYR	C	C	178.939	0.027	1
226	1	33	TYR	CA	C	60.438	0.21	1
227	1	33	TYR	CB	C	38.084	0.039	1
228	1	33	TYR	N	N	119.341	0	1
229	1	34	ALA	H	H	8.879	0.002	1
230	1	34	ALA	HA	H	4.151	0	1
231	1	34	ALA	HB1	H	1.903	0	1
232	1	34	ALA	HB2	H	1.903	0	1
233	1	34	ALA	HB3	H	1.903	0	1
234	1	34	ALA	C	C	179.733	0.055	1
235	1	34	ALA	CA	C	55.854	0.11	1
236	1	34	ALA	CB	C	18.177	0.065	1
237	1	34	ALA	N	N	121.814	0	1
238	1	35	ASN	H	H	8.526	0.001	1
239	1	35	ASN	HA	H	4.397	0	1
240	1	35	ASN	HB2	H	2.944	0	2
241	1	35	ASN	HB3	H	2.944	0	2
242	1	35	ASN	C	C	178.966	0.027	1
243	1	35	ASN	CA	C	56.639	0.01	1
244	1	35	ASN	CB	C	38.796	0.039	1
245	1	35	ASN	N	N	118.963	0	1
246	1	36	ASP	H	H	8.54	0.001	1
247	1	36	ASP	HA	H	4.327	0	1
248	1	36	ASP	HB2	H	2.848	0	1
249	1	36	ASP	HB3	H	2.424	0	1
250	1	36	ASP	C	C	177.226	0.014	1
251	1	36	ASP	CA	C	56.713	0.03	1
252	1	36	ASP	CB	C	40.02	0.091	1
253	1	36	ASP	N	N	121.342	0	1
254	1	37	HIS	H	H	7.665	0.001	1
255	1	37	HIS	HA	H	4.176	0.246	1
256	1	37	HIS	HB2	H	3.492	0	2
257	1	37	HIS	HB3	H	2.711	0	2
258	1	37	HIS	C	C	174.637	0.028	1
259	1	37	HIS	CA	C	57.077	0.05	1
260	1	37	HIS	CB	C	29.774	0.142	1
261	1	37	HIS	N	N	116.237	0	1
262	1	38	GLY	H	H	7.839	0.001	1
263	1	38	GLY	HA2	H	3.952	0	1
264	1	38	GLY	HA3	H	3.952	0	1
265	1	38	GLY	C	C	174.487	0.069	1
266	1	38	GLY	CA	C	46.503	0.07	1
267	1	38	GLY	N	N	107.634	0	1
268	1	39	VAL	H	H	8.238	0	1
269	1	39	VAL	HA	H	4.104	0	1
270	1	39	VAL	HB	H	1.903	0	1
271	1	39	VAL	HG11	H	0.752	0	2
272	1	39	VAL	HG12	H	0.752	0	2
273	1	39	VAL	HG13	H	0.752	0	2
274	1	39	VAL	C	C	174.048	0.014	1
275	1	39	VAL	CA	C	61.79	0.13	1
276	1	39	VAL	CB	C	32.66	0.039	1
277	1	39	VAL	CG1	C	21.264	0	1
278	1	39	VAL	N	N	121.728	0	1
279	1	40	ASP	H	H	8.372	0.001	1
280	1	40	ASP	HA	H	4.82	0	1
281	1	40	ASP	HB2	H	2.697	0	1
282	1	40	ASP	HB3	H	2.697	0	1
283	1	40	ASP	C	C	175.418	0.014	1
284	1	40	ASP	CA	C	53.133	0.07	1
285	1	40	ASP	CB	C	41.901	0.168	1
286	1	40	ASP	N	N	127.548	0	1
287	1	41	GLY	H	H	8.073	0.001	1
288	1	41	GLY	HA2	H	3.86	0.015	1
289	1	41	GLY	HA3	H	3.86	0.015	1
290	1	41	GLY	C	C	172.008	0	1
291	1	41	GLY	CA	C	44.604	0.137	1
292	1	41	GLY	N	N	108.196	0	1
293	1	42	GLU	H	H	8.213	0.003	1
294	1	42	GLU	HA	H	4.653	0.018	1
295	1	42	GLU	HB2	H	1.972	0	1
296	1	42	GLU	HB3	H	1.972	0	1
297	1	42	GLU	HG2	H	2.287	0	1
298	1	42	GLU	HG3	H	2.287	0	1
299	1	42	GLU	C	C	176.233	0.021	1
300	1	42	GLU	CA	C	55.398	0.09	1
301	1	42	GLU	CB	C	31.181	0.116	1
302	1	42	GLU	CG	C	36.44	0	1
303	1	42	GLU	N	N	119.926	0.001	1
304	1	43	TRP	H	H	9.196	0.002	1
305	1	43	TRP	HA	H	5.271	0.007	1
306	1	43	TRP	HB2	H	3.218	0	1
307	1	43	TRP	HB3	H	3.218	0	1
308	1	43	TRP	C	C	176.87	0.041	1
309	1	43	TRP	CA	C	57.224	0.23	1
310	1	43	TRP	CB	C	30.341	0.168	1
311	1	43	TRP	N	N	127.023	0	1
312	1	44	THR	H	H	9.385	0.001	1
313	1	44	THR	HA	H	4.867	0	1
314	1	44	THR	HB	H	4.177	0	1
315	1	44	THR	HG21	H	1.218	0	1
316	1	44	THR	HG22	H	1.218	0	1
317	1	44	THR	HG23	H	1.218	0	1
318	1	44	THR	C	C	172.837	0.021	1
319	1	44	THR	CA	C	60.894	0.11	1
320	1	44	THR	CB	C	71.853	0.013	1
321	1	44	THR	CG2	C	21.921	0	1
322	1	44	THR	N	N	115.17	0	1
323	1	45	TYR	H	H	8.86	0.002	1
324	1	45	TYR	HA	H	4.891	0.002	1
325	1	45	TYR	HB2	H	2.766	0	1
326	1	45	TYR	HB3	H	2.766	0	1
327	1	45	TYR	C	C	173.7	0.02	1
328	1	45	TYR	CA	C	56.603	0.028	1
329	1	45	TYR	CB	C	41.134	0.065	1
330	1	45	TYR	N	N	123.778	0	1
331	1	46	ASP	H	H	7.718	0.003	1
332	1	46	ASP	HA	H	4.609	0	1
333	1	46	ASP	HB2	H	2.643	0	1
334	1	46	ASP	HB3	H	2.643	0	1
335	1	46	ASP	C	C	174.651	0.014	1
336	1	46	ASP	CA	C	51.726	0.09	1
337	1	46	ASP	CB	C	42.832	0.091	1
338	1	46	ASP	N	N	128.202	0	1
339	1	47	ASP	H	H	8.498	0.001	1
340	1	47	ASP	HA	H	4.104	0	1
341	1	47	ASP	HB2	H	2.766	0	2
342	1	47	ASP	HB3	H	2.506	0	2
343	1	47	ASP	C	C	177.233	0.007	1
344	1	47	ASP	CA	C	55.891	0.21	1
345	1	47	ASP	CB	C	41.737	0.168	1
346	1	47	ASP	N	N	124.941	0	1
347	1	48	ALA	H	H	8.222	0.001	1
348	1	48	ALA	HA	H	4.151	0	1
349	1	48	ALA	HB1	H	1.506	0	1
350	1	48	ALA	HB2	H	1.506	0	1
351	1	48	ALA	HB3	H	1.506	0	1
352	1	48	ALA	C	C	179.911	0.068	1
353	1	48	ALA	CA	C	55.068	0.09	1
354	1	48	ALA	CB	C	18.451	0.142	1
355	1	48	ALA	N	N	119.925	0	1
356	1	49	THR	H	H	7.092	0.001	1
357	1	49	THR	HA	H	4.304	0	1
358	1	49	THR	HB	H	4.067	0	1
359	1	49	THR	C	C	175.507	0.007	1
360	1	49	THR	CA	C	60.931	0.03	1
361	1	49	THR	CB	C	70.191	0.193	1
362	1	49	THR	CG2	C	21.538	0	1
363	1	49	THR	N	N	103.937	0	1
364	1	50	LYS	H	H	7.968	0.002	1
365	1	50	LYS	HA	H	4.233	0	1
366	1	50	LYS	HB2	H	1.643	0	1
367	1	50	LYS	HB3	H	1.643	0	1
368	1	50	LYS	HG2	H	1.273	0	1
369	1	50	LYS	HG3	H	1.273	0	1
370	1	50	LYS	HE2	H	2.396	0	1
371	1	50	LYS	HE3	H	2.396	0	1
372	1	50	LYS	C	C	174.946	0.048	1
373	1	50	LYS	CA	C	56.091	0.01	1
374	1	50	LYS	CB	C	28.902	0.016	1
375	1	50	LYS	CG	C	25.154	0	1
376	1	50	LYS	N	N	121.552	0	1
377	1	51	THR	H	H	7.143	0.002	1
378	1	51	THR	HA	H	5.473	0.008	1
379	1	51	THR	HB	H	3.862	0	1
380	1	51	THR	HG21	H	1.095	0	1
381	1	51	THR	HG22	H	1.095	0	1
382	1	51	THR	HG23	H	1.095	0	1
383	1	51	THR	C	C	174.357	0.007	1
384	1	51	THR	CA	C	61.095	0.082	1
385	1	51	THR	CB	C	72.218	0.116	1
386	1	51	THR	CG2	C	20.99	0	1
387	1	51	THR	N	N	109.432	0.002	1
388	1	52	PHE	H	H	9.764	0.003	1
389	1	52	PHE	HA	H	5.714	0.016	1
390	1	52	PHE	HB2	H	3.314	0	1
391	1	52	PHE	HB3	H	3.314	0	1
392	1	52	PHE	C	C	175.425	0.075	1
393	1	52	PHE	CA	C	57.424	0.082	1
394	1	52	PHE	CB	C	42.686	0.039	1
395	1	52	PHE	N	N	125.799	0	1
396	1	53	THR	H	H	9.283	0.015	1
397	1	53	THR	HA	H	5.578	0.035	1
398	1	53	THR	C	C	172.556	0	1
399	1	53	THR	CA	C	61.369	0	1
400	1	53	THR	CB	C	71.944	0	1
401	1	53	THR	N	N	118.397	0	1
402	1	54	VAL	HA	H	4.259	0	1
403	1	54	VAL	HB	H	1.903	0	1
404	1	54	VAL	HG11	H	0.903	0	2
405	1	54	VAL	HG12	H	0.903	0	2
406	1	54	VAL	HG13	H	0.903	0	2
407	1	54	VAL	C	C	176.226	0	1
408	1	54	VAL	CA	C	60.794	0	1
409	1	54	VAL	CB	C	38.44	0	1
410	1	54	VAL	CG1	C	17.702	0	1
411	1	55	THR	H	H	8.221	0.002	1
412	1	55	THR	HA	H	4.33	0.009	1
413	1	55	THR	HB	H	3.944	0	1
414	1	55	THR	HG21	H	0.999	0	1
415	1	55	THR	HG22	H	0.999	0	1
416	1	55	THR	HG23	H	0.999	0	1
417	1	55	THR	C	C	174.186	0	1
418	1	55	THR	CA	C	61.114	0.21	1
419	1	55	THR	CB	C	69.405	0.245	1
420	1	55	THR	CG2	C	21.209	0	1
421	1	55	THR	N	N	118.722	0	1
422	1	56	ALA	H	H	9.207	0.023	1
423	1	56	ALA	HA	H	4.815	0.035	1
424	1	56	ALA	HB1	H	1.341	0	1
425	1	56	ALA	HB2	H	1.341	0	1
426	1	56	ALA	HB3	H	1.341	0	1
427	1	56	ALA	C	C	176.13	0.014	1
428	1	56	ALA	CA	C	50.777	0.01	1
429	1	56	ALA	CB	C	21.063	0.013	1
430	1	56	ALA	N	N	130.309	0	1
431	1	57	LYS	H	H	8.843	0.011	1
432	1	57	LYS	HA	H	4.813	0.007	1
433	1	57	LYS	HB2	H	1.78	0	1
434	1	57	LYS	HB3	H	1.78	0	1
435	1	57	LYS	HG2	H	1.341	0	1
436	1	57	LYS	HG3	H	1.341	0	1
437	1	57	LYS	C	C	176.076	0.014	1
438	1	57	LYS	CA	C	55.836	0.27	1
439	1	57	LYS	CB	C	34.157	0.22	1
440	1	57	LYS	CG	C	25.044	0	1
441	1	57	LYS	CD	C	29.537	0	1
442	1	57	LYS	N	N	121.858	0.02	1
443	1	58	ASP	H	H	8.934	0.001	1
444	1	58	ASP	HA	H	4.75	0	1
445	1	58	ASP	HB2	H	2.971	0	2
446	1	58	ASP	HB3	H	2.656	0	2
447	1	58	ASP	C	C	175.925	0.027	1
448	1	58	ASP	CA	C	54.375	0.01	1
449	1	58	ASP	CB	C	41.755	0.039	1
450	1	58	ASP	N	N	121.282	0	1
451	1	59	SER	H	H	8.62	0.021	1
452	1	59	SER	C	C	173.843	0	1
453	1	59	SER	CA	C	58.027	0.348	1
454	1	59	SER	CB	C	64.767	0.039	1
455	1	59	SER	N	N	114.93	0	1
456	1	60	HIS	H	H	8.42	0.002	1
457	1	60	HIS	HA	H	4.714	0	1
458	1	60	HIS	HB2	H	3.163	0	1
459	1	60	HIS	HB3	H	3.163	0	1
460	1	60	HIS	C	C	175.672	0.007	1
461	1	60	HIS	CA	C	55.598	0.01	1
462	1	60	HIS	CB	C	32.076	0.065	1
463	1	60	HIS	N	N	120.829	0.002	1
464	1	61	ALA	H	H	8.391	0.002	1
465	1	61	ALA	HA	H	3.3	0	1
466	1	61	ALA	HB1	H	1.177	0	1
467	1	61	ALA	HB2	H	1.177	0	1
468	1	61	ALA	HB3	H	1.177	0	1
469	1	61	ALA	C	C	179.076	0.027	1
470	1	61	ALA	CA	C	55.379	0.013	1
471	1	61	ALA	CB	C	18.853	0.039	1
472	1	61	ALA	N	N	126.551	0	1
473	1	62	ASP	H	H	9.383	0.002	1
474	1	62	ASP	HA	H	4.259	0	1
475	1	62	ASP	HB2	H	2.684	0	1
476	1	62	ASP	HB3	H	2.684	0	1
477	1	62	ASP	C	C	178.993	0.028	1
478	1	62	ASP	CA	C	57.443	0.065	1
479	1	62	ASP	CB	C	39.801	0.065	1
480	1	62	ASP	N	N	116.73	0	1
481	1	63	ARG	H	H	7.648	0.002	1
482	1	63	ARG	HA	H	4.21	0	1
483	1	63	ARG	HB2	H	1.944	0	1
484	1	63	ARG	HB3	H	1.944	0	1
485	1	63	ARG	C	C	178.939	0	1
486	1	63	ARG	CA	C	58.484	0.07	1
487	1	63	ARG	CB	C	30.15	0.131	1
488	1	63	ARG	CG	C	27.126	0	1
489	1	63	ARG	CD	C	43.453	0	1
490	1	63	ARG	N	N	119.245	0.009	1
491	1	64	VAL	H	H	7.724	0.001	1
492	1	64	VAL	HA	H	3.459	0	1
493	1	64	VAL	C	C	180.569	0	1
494	1	64	VAL	CA	C	66.41	0	1
495	1	64	VAL	CB	C	30.797	0	1
496	1	64	VAL	N	N	119.176	0	1
497	1	65	ARG	C	C	179.24	0	1
498	1	65	ARG	CA	C	60.137	0	1
499	1	65	ARG	CB	C	29.619	0	1
500	1	65	ARG	CG	C	28.77	0	1
501	1	65	ARG	CD	C	43.399	0	1
502	1	66	GLU	H	H	7.821	0.001	1
503	1	66	GLU	HA	H	4.045	0	1
504	1	66	GLU	HB2	H	2.287	0	1
505	1	66	GLU	HB3	H	2.287	0	1
506	1	66	GLU	HG2	H	2.629	0	1
507	1	66	GLU	HG3	H	2.629	0	1
508	1	66	GLU	C	C	178.815	0.014	1
509	1	66	GLU	CA	C	59.397	0.09	1
510	1	66	GLU	CB	C	29.354	0.091	1
511	1	66	GLU	CG	C	36.221	0	1
512	1	66	GLU	N	N	120.772	0	1
513	1	67	LEU	H	H	7.982	0.001	1
514	1	67	LEU	HA	H	4.163	0	1
515	1	67	LEU	C	C	178.021	0.014	1
516	1	67	LEU	CA	C	57.589	0.03	1
517	1	67	LEU	CB	C	41.006	0.22	1
518	1	67	LEU	CG	C	26.633	0	1
519	1	67	LEU	N	N	120.758	0	1
520	1	68	ALA	H	H	8.394	0.001	1
521	1	68	ALA	HA	H	3.776	0	1
522	1	68	ALA	C	C	178.418	0	1
523	1	68	ALA	CA	C	55.763	0.01	1
524	1	68	ALA	CB	C	18.341	0.013	1
525	1	68	ALA	N	N	119.976	0	1
526	1	69	GLN	H	H	7.656	0	1
527	1	69	GLN	HA	H	3.987	0	1
528	1	69	GLN	HB2	H	2.136	0	1
529	1	69	GLN	HB3	H	2.136	0	1
530	1	69	GLN	HG2	H	2.465	0	1
531	1	69	GLN	HG3	H	2.465	0	1
532	1	69	GLN	C	C	178.466	0.007	1
533	1	69	GLN	CA	C	58.666	0.05	1
534	1	69	GLN	CB	C	28.185	0.142	1
535	1	69	GLN	CG	C	33.701	0	1
536	1	70	ARG	H	H	7.786	0.001	1
537	1	70	ARG	HA	H	4.034	0	1
538	1	70	ARG	HB2	H	1.917	0	1
539	1	70	ARG	HB3	H	1.917	0	1
540	1	70	ARG	HG2	H	1.602	0	1
541	1	70	ARG	HG3	H	1.602	0	1
542	1	70	ARG	C	C	180.617	0.035	1
543	1	70	ARG	CA	C	58.74	0.03	1
544	1	70	ARG	CB	C	29.884	0.013	1
545	1	70	ARG	CG	C	27.29	0	1
546	1	70	ARG	CD	C	43.015	0	1
547	1	70	ARG	N	N	118.616	0	1
548	1	71	LEU	H	H	8.645	0.001	1
549	1	71	LEU	HA	H	3.858	0	1
550	1	71	LEU	HB2	H	1.944	0	1
551	1	71	LEU	HB3	H	1.944	0	1
552	1	71	LEU	HG	H	1.191	0	1
553	1	71	LEU	HD11	H	0.78	0	2
554	1	71	LEU	HD12	H	0.78	0	2
555	1	71	LEU	HD13	H	0.78	0	2
556	1	71	LEU	C	C	178.226	0	1
557	1	71	LEU	CA	C	57.79	0.13	1
558	1	71	LEU	CB	C	42.12	0.091	1
559	1	71	LEU	CG	C	26.304	0	1
560	1	71	LEU	N	N	119.642	0	1
561	1	72	ARG	H	H	7.811	0.002	1
562	1	72	ARG	HA	H	3.822	0	1
563	1	72	ARG	HB2	H	1.889	0	1
564	1	72	ARG	HB3	H	1.889	0	1
565	1	72	ARG	HG2	H	1.588	0	1
566	1	72	ARG	HG3	H	1.588	0	1
567	1	72	ARG	HD2	H	3.149	0	1
568	1	72	ARG	HD3	H	3.149	0	1
569	1	72	ARG	C	C	176.925	0.041	1
570	1	72	ARG	CA	C	58.521	0.09	1
571	1	72	ARG	CB	C	30.377	0.142	1
572	1	72	ARG	CD	C	44.111	0	1
573	1	72	ARG	N	N	114.775	0	1
574	1	73	GLN	H	H	7.077	0.001	1
575	1	73	GLN	HA	H	4.351	0	1
576	1	73	GLN	HB2	H	2.026	0	1
577	1	73	GLN	HB3	H	2.026	0	1
578	1	73	GLN	HG2	H	2.437	0	1
579	1	73	GLN	HG3	H	2.437	0	1
580	1	73	GLN	C	C	176.281	0.028	1
581	1	73	GLN	CA	C	55.269	0.05	1
582	1	73	GLN	CB	C	29.299	0.013	1
583	1	73	GLN	CG	C	34.084	0	1
584	1	73	GLN	N	N	113.33	0	1
585	1	74	ARG	H	H	7.583	0.001	1
586	1	74	ARG	HA	H	4.538	0	1
587	1	74	ARG	C	C	174.323	0	1
588	1	74	ARG	N	N	120.785	0	1
589	1	75	PRO	HB2	H	2.341	0	1
590	1	75	PRO	HB3	H	2.341	0	1
591	1	75	PRO	HG2	H	1.862	0	1
592	1	75	PRO	HG3	H	1.862	0	1
593	1	75	PRO	C	C	176.61	0	1
594	1	75	PRO	CA	C	64.082	0	1
595	1	75	PRO	CB	C	31.756	0	1
596	1	75	PRO	CG	C	27.893	0	1
597	1	75	PRO	CD	C	50.959	0	1
598	1	76	ARG	H	H	8.48	0.001	1
599	1	76	ARG	HA	H	3.611	0	1
600	1	76	ARG	HB2	H	1.862	0	1
601	1	76	ARG	HB3	H	1.862	0	1
602	1	76	ARG	HG2	H	1.465	0	1
603	1	76	ARG	HG3	H	1.465	0	1
604	1	76	ARG	C	C	174.029	0.021	1
605	1	76	ARG	CA	C	57.936	0.05	1
606	1	76	ARG	CB	C	27.51	0.116	1
607	1	76	ARG	CD	C	43.289	0	1
608	1	76	ARG	N	N	112.726	0	1
609	1	77	VAL	H	H	7.342	0.001	1
610	1	77	VAL	HA	H	4.022	0	1
611	1	77	VAL	HB	H	2.218	0	1
612	1	77	VAL	HG11	H	1.013	0	2
613	1	77	VAL	HG12	H	1.013	0	2
614	1	77	VAL	HG13	H	1.013	0	2
615	1	77	VAL	HG21	H	0.643	0	2
616	1	77	VAL	HG22	H	0.643	0	2
617	1	77	VAL	HG23	H	0.643	0	2
618	1	77	VAL	C	C	176.055	0.048	1
619	1	77	VAL	CA	C	63.525	0.05	1
620	1	77	VAL	CB	C	31.235	0.039	1
621	1	77	VAL	CG1	C	22.633	0	1
622	1	77	VAL	N	N	119.288	0	1
623	1	78	GLU	H	H	8.974	0.001	1
624	1	78	GLU	HA	H	4.233	0	1
625	1	78	GLU	C	C	176.062	0	1
626	1	78	GLU	CA	C	58.393	0.11	1
627	1	78	GLU	CB	C	31.582	0.091	1
628	1	78	GLU	N	N	129.898	0	1
629	1	79	ARG	H	H	8.251	0.006	1
630	1	79	ARG	HA	H	4.128	0	1
631	1	79	ARG	C	C	175.268	0	1
632	1	79	ARG	CA	C	55.361	0.01	1
633	1	79	ARG	CB	C	31.674	0.116	1
634	1	79	ARG	N	N	119.782	0.035	1
635	1	80	VAL	H	H	8.759	0.002	1
636	1	80	VAL	HA	H	4.365	0.015	1
637	1	80	VAL	C	C	175.185	0	1
638	1	80	VAL	CA	C	61.169	0.05	1
639	1	80	VAL	CB	C	34.03	0	1
640	1	80	VAL	CG1	C	21.866	0	1
641	1	80	VAL	N	N	126.372	0.063	1
642	1	81	GLU	H	H	8.979	0.002	1
643	1	81	GLU	HA	H	4.82	0	1
644	1	81	GLU	HB2	H	1.93	0	1
645	1	81	GLU	HB3	H	1.93	0	1
646	1	81	GLU	HG2	H	2.245	0	1
647	1	81	GLU	HG3	H	2.245	0	1
648	1	81	GLU	C	C	174.863	0.035	1
649	1	81	GLU	CA	C	54.356	0.03	1
650	1	81	GLU	CB	C	33.719	0.065	1
651	1	81	GLU	CG	C	36.44	0	1
652	1	81	GLU	N	N	127.204	0	1
653	1	82	ILE	H	H	8.806	0.002	1
654	1	82	ILE	HA	H	5.006	0.004	1
655	1	82	ILE	HB	H	1.656	0	1
656	1	82	ILE	HG12	H	1.341	0	1
657	1	82	ILE	HG13	H	1.341	0	1
658	1	82	ILE	HD11	H	0.835	0	1
659	1	82	ILE	HD12	H	0.835	0	1
660	1	82	ILE	HD13	H	0.835	0	1
661	1	82	ILE	C	C	175.726	0.048	1
662	1	82	ILE	CA	C	59.89	0.027	1
663	1	82	ILE	CB	C	40.805	0.168	1
664	1	82	ILE	CG1	C	27.729	0	1
665	1	82	ILE	CD1	C	17.812	0	1
666	1	82	ILE	N	N	123.21	0	1
667	1	83	THR	H	H	9.298	0.004	1
668	1	83	THR	HA	H	4.55	0	1
669	1	83	THR	HB	H	3.958	0	1
670	1	83	THR	C	C	172.412	0.007	1
671	1	83	THR	CA	C	61.698	0.03	1
672	1	83	THR	CB	C	71.012	0.116	1
673	1	83	THR	CG2	C	21.65	0	1
674	1	83	THR	N	N	124.579	0	1
675	1	84	GLU	H	H	8.796	0.002	1
676	1	84	GLU	HA	H	4.543	0.004	1
677	1	84	GLU	C	C	172.583	0	1
678	1	84	GLU	CA	C	55.233	0	1
679	1	84	GLU	CB	C	31.783	0	1
680	1	84	GLU	N	N	127.447	0.006	1
681	1	85	VAL	C	C	176.226	0	1
682	1	85	VAL	CA	C	62.328	0	1
683	1	85	VAL	CB	C	32.797	0	1
684	1	85	VAL	CG1	C	21.099	0	1
685	1	86	THR	H	H	8.334	0.002	1
686	1	86	THR	HA	H	4.386	0	1
687	1	86	THR	C	C	173.659	0.02	1
688	1	86	THR	CA	C	61.205	0.33	1
689	1	86	THR	CB	C	70.008	0.013	1
690	1	86	THR	CG2	C	21.921	0	1
691	1	86	THR	N	N	118.871	0.04	1
692	1	87	GLU	H	H	8.082	0.002	1
693	1	87	GLU	HA	H	4.151	0	1
694	1	87	GLU	CA	C	57.753	0	1
695	1	87	GLU	CB	C	31.728	0	1
696	1	87	GLU	N	N	128.438	0.012	1

Release date

2021-05-05

Citation

Design and characterization of a protein fold switching network
Chen, Y., Ruan, B., He, Y., Chen, Y., Choi, E., Motabar, D., Solomon, T., Simmerman, R., Kauffman, T., Gallagher, D., Orban, J., Bryan, P.
Nat. Commun. (2023), 14, 431-431, PubMed 36702827 , DOI 10.1038/s41467-023-36065-3 , Abstract