X5D304_HUMAN Loading...

T-box transcription factor TBX6

AlphaFold DB , UniProt , Accession X5D304, Species HUMAN (Homo sapiens, Human), Gene TBX6, Length 227 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	38.2	Very low	233 Å²	233	180.1 Å²	180.1	100%	1.148	87%	0.874	S	S	*	*				0	107	0	-77.4	-151.2	-92.2	0	0	108.3
2	Y	30.5	Very low	37.6	Very low	240 Å²	240	171.3 Å²	171.3	94%	0.941	86%	0.864	S	S	*	*			trans	-139.6	130.1	168.3	-89.7	-83.6	0	0	0	108.2
3	H	32.2	Very low	37.4	Very low	173 Å²	173	166.5 Å²	166.5	80%	0.801	87%	0.868	S	S	*	*			trans	-96.9	131.7	-166.4	-147.7	-68.9	0	0	0	109.3	R5	H3-R5 PolarHBondContact O-N 3.4Å
4	P	38.4	Very low	37.2	Very low	118 Å²	118	159.5 Å²	159.5	77%	0.766	86%	0.856	S	S	*	*			trans	-92.1	97.3	-176.2	31	-27.2	0	0	0	110.8
5	R	42.5	Very low	36.9	Very low	232 Å²	232	164.9 Å²	164.9	88%	0.875	86%	0.862	S	S	*	*			trans	-143.3	27.4	171.5	-94.9	-143.2	165.9	172.6	-1.6	116.1	H3	H3-R5 PolarHBondContact O-N 3.4Å
6	E	47.6	Very low	36.6	Very low	185 Å²	185	169.9 Å²	169.9	86%	0.864	87%	0.866	S	S	*	*			trans	-127.1	90.6	171.3	-68.7	-177.7	-171	0	0	109.5
7	L	37.3	Very low	36.5	Very low	160 Å²	160	170.5 Å²	170.5	84%	0.838	87%	0.87	S	S	*	*	S	Bend	trans	-163.4	29.5	155.9	-99	-163.8	0	0	0	114.8
8	Y	35.4	Very low	36.3	Very low	233 Å²	233	164.6 Å²	164.6	91%	0.914	86%	0.858	S	S	*	*			trans	-152.3	104.2	161	-84.2	-75.9	0	0	0	112
9	P	38.6	Very low	36.4	Very low	112 Å²	112	162.9 Å²	162.9	73%	0.727	86%	0.859	S	S	*	*			trans	-98.3	139.1	158.3	29.8	-17.5	0	0	0	111.5
10	S	39	Very low	36.2	Very low	109 Å²	109	159.6 Å²	159.6	76%	0.762	86%	0.856	S	S	*	*			trans	66	105.5	147.6	61.7	0	0	0	0	120.1
11	L	36.6	Very low	36.3	Very low	186 Å²	186	160.7 Å²	160.7	97%	0.974	86%	0.856	S	S	*	*				169.4	116.8	126.9	-88.5	163.4	0	0	0	105.1
12	G	30.8	Very low	36	Very low	74 Å²	74	155.1 Å²	155.1	76%	0.763	84%	0.837	S	S	*	*			cis	-174.4	153.8	3.9	0	0	0	0	0	106.2
13	A	35.1	Very low	36.3	Very low	110 Å²	110	147.5 Å²	147.5	91%	0.909	83%	0.831	S	S	*	*			trans	-68.7	144.3	-176.1	0	0	0	0	0	113.5
14	G	35.3	Very low	36.3	Very low	68 Å²	68	144 Å²	144	70%	0.701	83%	0.833	S	S	*	*				97.7	105.1	129.3	0	0	0	0	0	118
15	Y	31.6	Very low	36	Very low	240 Å²	240	146.3 Å²	146.3	94%	0.941	84%	0.838	S	S	*	*			trans	-143.3	142.6	130.2	26.6	-90.2	0	0	0	110.4
16	R	32	Very low	35.5	Very low	246 Å²	246	141 Å²	141	93%	0.928	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73	148.9	-159.1	-74.1	174.5	164.1	175.3	-5.2	114.1
17	L	34.8	Very low	34.7	Very low	179 Å²	179	137.5 Å²	137.5	94%	0.937	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-59.7	126.9	156.5	-68.4	162.3	0	0	0	110
18	G	33.8	Very low	34.4	Very low	64 Å²	64	138.8 Å²	138.8	66%	0.66	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-84.3	157.3	164	0	0	0	0	0	111.2
19	P	38.6	Very low	34.4	Very low	133 Å²	133	133.5 Å²	133.5	86%	0.864	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.1	158.7	-174.5	33	-33.1	0	0	0	112.9
20	A	32.4	Very low	34.7	Very low	97 Å²	97	133.1 Å²	133.1	80%	0.802	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-66.3	142.8	-179.2	0	0	0	0	0	113.5
21	Q	36.8	Very low	34.2	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-98.7	132.4	165	-83.3	-77.4	-69.5	0	0	109.6
22	P	35.9	Very low	34	Very low	116 Å²	116	130.7 Å²	130.7	75%	0.753	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95	143.2	178.2	35.1	-29.3	0	0	0	112.1
23	G	36.7	Very low	33.9	Very low	80 Å²	80	131.7 Å²	131.7	83%	0.825	82%	0.816	S	S	*	*			trans	110.9	90.3	157.5	0	0	0	0	0	116.2
24	A	34	Very low	33.6	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	81%	0.813	S	S	*	*			trans	-161	115.8	140.2	0	0	0	0	0	108.8
25	D	31.4	Very low	33.5	Very low	165 Å²	165	134.6 Å²	134.6	88%	0.882	81%	0.808	S	S	*	*			trans	-67.1	138.2	-179.7	-59.8	-53.9	0	0	0	112.2
26	S	32.1	Very low	33.2	Very low	121 Å²	121	134.1 Å²	134.1	85%	0.846	81%	0.806	S	S	*	*			trans	-159.3	114.9	140.6	45.6	0	0	0	0	110.3
27	S	30.7	Very low	33	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	81%	0.805	S	S	*	*			trans	-80.8	119.8	177.7	46.8	0	0	0	0	112.1
28	F	30.2	Very low	32.7	Very low	186 Å²	186	135.7 Å²	135.7	82%	0.816	80%	0.801	S	S	*	*			trans	41.1	146.3	135.9	-79.9	-71.6	0	0	0	121.9
29	P	36.6	Very low	32.7	Very low	122 Å²	122	137.5 Å²	137.5	79%	0.792	80%	0.801	S	S	*	*				-140	166.8	60	37.9	-19.3	0	0	0	117.6
30	P	44	Very low	32.4	Very low	104 Å²	104	138.6 Å²	138.6	68%	0.675	80%	0.795	S	S	*	*			trans	-90.3	157.6	169.8	36	-27.2	0	0	0	111.8
31	A	29.7	Very low	32.9	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	80%	0.802	S	S	*	*			trans	115.4	137.1	155.3	0	0	0	0	0	118.4
32	L	31.3	Very low	32.6	Very low	154 Å²	154	139.1 Å²	139.1	81%	0.806	79%	0.789	S	S	*	*			trans	84.8	94.1	155	-76.6	145.8	0	0	0	120.2
33	A	28.5	Very low	32.9	Very low	94 Å²	94	138.4 Å²	138.4	78%	0.777	78%	0.783	S	S	*	*				-172.5	91	124.7	0	0	0	0	0	106.7
34	E	29.3	Very low	33	Very low	182 Å²	182	139 Å²	139	85%	0.85	77%	0.772	S	S	*	*				32.7	112.5	95.8	-99.7	179	147.6	0	0	114.2
35	G	32.3	Very low	33.3	Very low	58 Å²	58	141.9 Å²	141.9	60%	0.598	77%	0.766	S	S	*	*			trans	93.3	78.8	147	0	0	0	0	0	117.3
36	Y	26.7	Very low	33.9	Very low	230 Å²	230	138.3 Å²	138.3	90%	0.902	75%	0.746	S	S	*	*			trans	-150.7	67.1	133.4	-75.2	-64.6	0	0	0	109.7	Y38	Y36-Y38 PolarHBondContact O-N 3.17Å
37	R	27	Very low	34.4	Very low	239 Å²	239	137.6 Å²	137.6	90%	0.902	73%	0.733	S	S	*	*			trans	-76.2	106	156.7	-166.5	179.6	-172.6	150.7	1.1	105.2	P39	R37-P39 WeakPolarHBondContact O-CD 3.19Å
38	Y	28.6	Very low	35	Very low	218 Å²	218	137 Å²	137	86%	0.855	73%	0.728	S	S	*	*			trans	-63.4	117.7	168.8	-107.6	-91.1	0	0	0	107.6	Y36	Y36-Y38 PolarHBondContact O-N 3.17Å
39	P	34.7	Very low	35.7	Very low	103 Å²	103	133.7 Å²	133.7	67%	0.669	71%	0.713	S	S	*	*			trans	-74.5	137.9	166.7	-4	23.4	0	0	0	108.5	R37	R37-P39 WeakPolarHBondContact O-CD 3.19Å
40	E	31.9	Very low	36	Very low	156 Å²	156	134 Å²	134	73%	0.729	71%	0.707	S	S	*	*			trans	55.1	116.5	155.7	-83.9	179.2	120.1	0	0	120.3	D42	E40-D42 PolarHBondContact O-N 3.27Å
41	L	43.5	Very low	35.9	Very low	179 Å²	179	134 Å²	134	94%	0.937	71%	0.711	S	S	*	*			trans	-56	82.1	141.7	-81.1	149	0	0	0	109.2	T43	L41-T43 PolarHBondContact O-N 3.18Å
42	D	29.8	Very low	36.3	Very low	111 Å²	111	132.8 Å²	132.8	59%	0.594	71%	0.707	S	S	*	*			trans	-76.7	104.1	161.9	-97.4	-36.8	0	0	0	108	E40	E40-D42 PolarHBondContact O-N 3.27Å
43	T	41.6	Very low	36.9	Very low	101 Å²	101	133.6 Å²	133.6	62%	0.62	71%	0.708	S	S	*	*			trans	-39	139.5	150.3	22.6	0	0	0	0	110	L41 K45	L41-T43 PolarHBondContact O-N 3.18Å; T43-K45 PolarHBondContact O-N 3.01Å
44	P	39.6	Very low	37.3	Very low	92 Å²	92	137.7 Å²	137.7	60%	0.597	71%	0.711	S	S	*	*			trans	-57.3	130.8	-179.1	24	-32.4	0	0	0	109.7	L46	P44-L46 PolarHBondContact O-N 3.33Å
45	K	39.2	Very low	37.7	Very low	161 Å²	161	133.6 Å²	133.6	70%	0.7	71%	0.708	S	S	*	*	S	Bend	trans	-55.3	67.8	176.9	-73	177.4	174.8	170.6	0	113	T43	T43-K45 PolarHBondContact O-N 3.01Å
46	L	43.6	Very low	37.7	Very low	90 Å²	90	134.8 Å²	134.8	47%	0.471	71%	0.712	S	S	.	*			trans	-86.3	-23.9	164	-63.9	173.9	0	0	0	109.9	P44 C48 F49 L50	P44-L46 PolarHBondContact O-N 3.33Å; L46-C48 PolarHBondContact O-N 3.2Å; L46-F49 PolarHBondContact O-N 3.44Å; L46-F49 VanDerWaalsContact O-N 3.12Å; L46-L50 PolarHBondContact O-N 2.67Å
47	D	42.8	Very low	38.1	Very low	106 Å²	106	129.6 Å²	129.6	57%	0.567	71%	0.707	S	S	*	*	H	α-helix	trans	-66.3	-35.6	-178.7	-59.2	-49.3	0	0	0	113.3	F49 S51	D47-F49 PolarHBondContact O-N 3.19Å; D47-S51 PolarHBondContact O-N 3.22Å; D47-S51 PolarHBondContact O-OG 3.23Å
48	C	44.3	Very low	38.7	Very low	100 Å²	100	130.1 Å²	130.1	68%	0.676	71%	0.709	S	S	*	*	H	α-helix	trans	-66.6	-21.1	175.5	-69.2	0	0	0	0	113	L46	L46-C48 PolarHBondContact O-N 3.2Å
49	F	45.4	Very low	39.1	Very low	117 Å²	117	125.8 Å²	125.8	51%	0.513	71%	0.705	S	S	.	*	H	α-helix	trans	-92.8	-33.3	-179.2	-138.1	-88.9	0	0	0	112.2	L46 D47	L46-F49 PolarHBondContact O-N 3.44Å; L46-F49 VanDerWaalsContact O-N 3.12Å; D47-F49 PolarHBondContact O-N 3.19Å
50	L	42.3	Very low	39.4	Very low	127 Å²	127	128.7 Å²	128.7	67%	0.665	71%	0.714	S	S	*	*	H	α-helix	trans	-77	-20.2	178.1	-67.1	175.9	0	0	0	113.7	L46 G52	L46-L50 PolarHBondContact O-N 2.67Å; L50-G52 PolarHBondContact O-N 3.22Å
51	S	41.8	Very low	39.4	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-5.6	179.6	-65.6	0	0	0	0	114.6	D47	D47-S51 PolarHBondContact O-N 3.22Å; D47-S51 PolarHBondContact O-OG 3.23Å
52	G	39	Very low	39.2	Very low	65 Å²	65	121.9 Å²	121.9	67%	0.67	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-1.4	-174.3	0	0	0	0	0	116.4	L50 E54	L50-G52 PolarHBondContact O-N 3.22Å; G52-E54 PolarHBondContact O-N 3.12Å
53	M	42.8	Very low	39.8	Very low	171 Å²	171	125.5 Å²	125.5	84%	0.842	72%	0.724	S	S	*	*			trans	-87.5	78.5	174.2	-67.1	-179.5	69.7	0	0	109.5	A55	M53-A55 PolarHBondContact O-N 3.28Å
54	E	36.8	Very low	40.1	Very low	180 Å²	180	126 Å²	126	84%	0.841	73%	0.729	S	S	*	*			trans	-68	108.3	178	-170.3	159.7	120.3	0	0	110.8	G52	G52-E54 PolarHBondContact O-N 3.12Å
55	A	37.8	Very low	40.4	Very low	95 Å²	95	127.7 Å²	127.7	79%	0.785	74%	0.74	S	S	*	*			trans	-80.8	110.6	160.7	0	0	0	0	0	108.1	M53	M53-A55 PolarHBondContact O-N 3.28Å
56	A	33	Very low	40.9	Very low	83 Å²	83	128.1 Å²	128.1	69%	0.686	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-52.6	138.1	177	0	0	0	0	0	112.1	R58	A56-R58 PolarHBondContact O-N 3.41Å
57	P	35	Very low	40.8	Very low	121 Å²	121	129.7 Å²	129.7	79%	0.786	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-80.1	119.2	179.7	31.8	-30.4	0	0	0	109.4
58	R	38.9	Very low	40.7	Very low	250 Å²	250	133 Å²	133	94%	0.943	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-98	117.6	160.6	-76	-170.2	133.2	105.7	0.6	108.9	A56	A56-R58 PolarHBondContact O-N 3.41Å
59	T	36.3	Very low	40.8	Very low	127 Å²	127	136.3 Å²	136.3	78%	0.779	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.7	136.1	177.8	-10.9	0	0	0	0	112.1
60	L	41.3	Very low	40.9	Very low	164 Å²	164	136.2 Å²	136.2	86%	0.859	80%	0.802	S	S	*	*			trans	53.9	110.7	146.7	-88.4	151.8	0	0	0	120.7
61	A	32.7	Very low	41.2	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	81%	0.811	S	S	*	*			trans	-156.2	138.9	131	0	0	0	0	0	110.6
62	A	38.5	Very low	41.4	Very low	95 Å²	95	136 Å²	136	79%	0.785	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.4	151	-174.6	0	0	0	0	0	114.1
63	H	43.4	Very low	41.7	Very low	186 Å²	186	142.2 Å²	142.2	86%	0.861	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.8	132.5	176.2	-64.4	-84.7	0	0	0	112.2
64	P	48.3	Very low	41.5	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.6	158.9	162.8	32.2	-30.1	0	0	0	111.6
65	P	45.5	Very low	41.8	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.3	149.8	-168	31.8	-33.9	0	0	0	113.1
66	L	50.3	Low	41.7	Very low	170 Å²	170	139.2 Å²	139.2	89%	0.89	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-62.1	139.4	-179.9	-65.2	167.4	0	0	0	113
67	P	39.5	Very low	42.2	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-93	150.1	155.5	19.5	-3.1	0	0	0	112.2
68	L	42.1	Very low	42.6	Very low	175 Å²	175	138.3 Å²	138.3	92%	0.916	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-66.1	147.2	-174.7	-68.8	153.7	0	0	0	114
69	L	45.7	Very low	43	Very low	171 Å²	171	132.4 Å²	132.4	90%	0.895	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.3	147.7	174.2	-72.9	157.5	0	0	0	113.7
70	P	48.2	Very low	43.2	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	81%	0.813	S	S	*	*			trans	-123.3	171.5	145.2	34.6	-18.9	0	0	0	112.3
71	P	47.3	Very low	43.6	Very low	130 Å²	130	127.5 Å²	127.5	84%	0.844	80%	0.803	S	S	*	*			trans	-90.9	170.3	-138.3	36	-37	0	0	0	116.3
72	A	47.7	Very low	44.2	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	80%	0.804	S	S	*	*			trans	-50.9	129.2	-178.7	0	0	0	0	0	115.3
73	M	45.6	Very low	44.3	Very low	197 Å²	197	132.4 Å²	132.4	97%	0.97	80%	0.804	S	S	*	*			trans	-172.2	118.1	134.6	-106.8	-176.1	75.4	0	0	107.9
74	G	37.2	Very low	44.3	Very low	75 Å²	75	128 Å²	128	77%	0.773	80%	0.8	S	S	*	*			trans	163.5	101.8	175.4	0	0	0	0	0	111	E76	G74-E76 PolarHBondContact O-N 3.37Å
75	T	42.7	Very low	44.3	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	81%	0.805	S	S	*	*			trans	-17.5	109.5	161.8	-58	0	0	0	0	113.9	P77	T75-P77 VanDerWaalsContact O-CD 3.26Å; T75-P77 WeakPolarHBondContact O-CD 3.26Å
76	E	37	Very low	44.6	Very low	171 Å²	171	132 Å²	132	80%	0.799	80%	0.802	S	S	*	*			trans	-58.3	114.9	159.6	-101.7	-89.5	103.4	0	0	107.8	G74 A78	G74-E76 PolarHBondContact O-N 3.37Å; E76-A78 PolarHBondContact O-N 2.89Å
77	P	42	Very low	45.2	Very low	103 Å²	103	128.9 Å²	128.9	67%	0.669	79%	0.794	S	S	*	*			trans	-68.3	122.6	165.8	27.5	-25.5	0	0	0	107	T75	T75-P77 VanDerWaalsContact O-CD 3.26Å; T75-P77 WeakPolarHBondContact O-CD 3.26Å
78	A	45.2	Very low	46.9	Very low	82 Å²	82	127.6 Å²	127.6	68%	0.678	78%	0.78	S	S	*	*			trans	-44.3	143.7	174.6	0	0	0	0	0	111.2	E76 S80	E76-A78 PolarHBondContact O-N 2.89Å; A78-S80 PolarHBondContact O-N 3.14Å
79	P	46.3	Very low	48.8	Very low	125 Å²	125	125.3 Å²	125.3	81%	0.812	78%	0.775	S	S	*	*			trans	-53.8	121.3	179.7	21.7	-32.1	0	0	0	109.2
80	S	40.7	Very low	50.8	Low	109 Å²	109	120.3 Å²	120.3	76%	0.762	77%	0.766	S	S	*	*			trans	-48.9	142.2	178.1	45.5	0	0	0	0	111	A78	A78-S80 PolarHBondContact O-N 3.14Å
81	A	49	Very low	53	Low	80 Å²	80	116.5 Å²	116.5	66%	0.661	74%	0.74	S	S	*	*			trans	-38.6	151.5	170.5	0	0	0	0	0	112.9	E83	A81-E83 PolarHBondContact O-N 2.81Å; A81-E83 VanDerWaalsContact O-N 3.07Å
82	P	46.2	Very low	55.3	Low	127 Å²	127	113.5 Å²	113.5	83%	0.825	72%	0.722	S	S	*	*			trans	-53.1	122	-179.4	23.5	-33.8	0	0	0	109.2	A84	P82-A84 PolarHBondContact O-N 3.39Å; P82-A84 VanDerWaalsContact O-N 3.16Å
83	E	40.1	Very low	57.5	Low	169 Å²	169	113.8 Å²	113.8	79%	0.79	71%	0.709	S	S	*	*			trans	-45.5	124.4	174.4	-67.1	-177.9	115.2	0	0	108.3	A81 L85	A81-E83 PolarHBondContact O-N 2.81Å; A81-E83 VanDerWaalsContact O-N 3.07Å; E83-L85 PolarHBondContact O-N 2.91Å
84	A	44.3	Very low	59.9	Low	93 Å²	93	106.9 Å²	106.9	77%	0.769	68%	0.681	S	S	*	*			trans	-51.6	110	174.1	0	0	0	0	0	107.2	P82 H86	P82-A84 PolarHBondContact O-N 3.39Å; P82-A84 VanDerWaalsContact O-N 3.16Å; A84-H86 PolarHBondContact O-N 2.93Å
85	L	47.1	Very low	62.8	Low	161 Å²	161	106.2 Å²	106.2	84%	0.843	66%	0.659	S	S	*	*			trans	-40.5	117.1	175	-77.6	166	0	0	0	107.9	E83 S87	E83-L85 PolarHBondContact O-N 2.91Å; L85-S87 PolarHBondContact O-N 3.17Å
86	H	53.3	Low	65.3	Low	163 Å²	163	102.7 Å²	102.7	76%	0.755	63%	0.633	S	S	*	*			trans	-29.8	92.2	-175.7	-46.6	-81.7	0	0	0	111.8	A84 L88	A84-H86 PolarHBondContact O-N 2.93Å; H86-L88 PolarHBondContact O-N 3.14Å
87	S	62.1	Low	68	Low	104 Å²	104	99.4 Å²	99.4	73%	0.727	62%	0.621	S	S	*	*			trans	-68.4	110.3	173.5	-177.8	0	0	0	0	105.5	L85 P89	L85-S87 PolarHBondContact O-N 3.17Å; S87-P89 WeakPolarHBondContact O-CD 3.43Å; S87-P89 VanDerWaalsContact O-N 3.09Å
88	L	74.8	Confident	70.5	Confident	95 Å²	95	101.7 Å²	101.7	50%	0.497	62%	0.616	S	S	.	*			trans	-62.7	112.1	174	-69.1	173.7	0	0	0	106.7	H86 G90 V91 Y137	H86-L88 PolarHBondContact O-N 3.14Å; L88-G90 PolarHBondContact O-N 3.02Å; L88-V91 HydrophobicContact CB-CB 3.89Å; L88-V91 HydrophobicContact CB-CG2 3.45Å; L88-V91 VanDerWaalsContact CB-CG2 3.45Å; L88-V91 HydrophobicContact CD1-CG2 4.09Å; L88-V91 HydrophobicContact CG-CG2 4.43Å; L88-V91 PolarHBondContact O-N 3.07Å; L88-Y137 HydrophobicContact CD1-CE1 4.4Å
89	P	82.1	Confident	73	Confident	127 Å²	127	103.3 Å²	103.3	83%	0.825	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	126	-174.1	23	-31.5	0	0	0	109.6	S87	S87-P89 WeakPolarHBondContact O-CD 3.43Å; S87-P89 VanDerWaalsContact O-N 3.09Å
90	G	87.8	Confident	75.3	Confident	67 Å²	67	100 Å²	100	69%	0.691	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.2	-11.9	-179	0	0	0	0	0	115.5	L88 G130	L88-G90 PolarHBondContact O-N 3.02Å; G90-G130 WeakPolarHBondContact O-CA 3.42Å
91	V	94.6	Very high	77.9	Confident	34 Å²	34	97 Å²	97	21%	0.206	56%	0.557	C	S	.	*			trans	-82.2	131.3	175.1	-177.5	0	0	0	0	110.1	L88 L93 V128 T129 G130 L131	L88-V91 HydrophobicContact CB-CB 3.89Å; L88-V91 HydrophobicContact CB-CG2 3.45Å; L88-V91 VanDerWaalsContact CB-CG2 3.45Å; L88-V91 HydrophobicContact CD1-CG2 4.09Å; L88-V91 HydrophobicContact CG-CG2 4.43Å; L88-V91 PolarHBondContact O-N 3.07Å; V91-L93 HydrophobicContact CG1-CD1 3.99Å; V91-V128 HydrophobicContact CG1-CG1 4.37Å; V91-T129 WeakPolarHBondContact CA-O 3.44Å; V91-G130 WeakPolarHBondContact CG2-O 3.33Å; V91-L131 HydrophobicContact CG1-CD2 3.78Å; V91-L131 HydrophobicContact CG1-CG 4.46Å; V91-L131 HydrophobicContact CG2-CD2 3.88Å
92	S	94.8	Very high	80	Confident	66 Å²	66	98.3 Å²	98.3	46%	0.462	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.3	176.9	-175.7	0	0	0	0	111.1	V128 T129	S92-V128 WeakPolarHBondContact O-CA 3.44Å; S92-T129 PolarHBondContact N-O 3.22Å; S92-T129 PolarHBondContact O-N 3.08Å
93	L	95.2	Very high	82.4	Confident	104 Å²	104	98.1 Å²	98.1	55%	0.545	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.5	178.4	-69.1	89.9	0	0	0	109	V91 V126 S127 V128	V91-L93 HydrophobicContact CG1-CD1 3.99Å; L93-V126 HydrophobicContact CB-CG1 3.73Å; L93-V126 HydrophobicContact CD2-CG1 3.9Å; L93-V126 HydrophobicContact CG-CG1 4.18Å; L93-S127 CarbonylContact C-O 3.34Å; L93-S127 WeakPolarHBondContact CA-O 3.4Å; L93-V128 HydrophobicContact CD2-CG2 4.46Å; L93-V128 HydrophobicContact CG-CG1 4.43Å; L93-V128 HydrophobicContact CG-CG2 4.37Å
94	S	96.1	Very high	84.9	Confident	53 Å²	53	93.3 Å²	93.3	37%	0.371	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.2	175.9	56.6	0	0	0	0	110.9	V126 S127	S94-V126 CarbonylContact O-C 3.58Å; S94-V126 WeakPolarHBondContact O-CA 3.35Å; S94-S127 PolarHBondContact N-O 2.99Å; S94-S127 PolarHBondContact O-N 3.16Å; S94-S127 WeakPolarHBondContact OG-CB 3.42Å
95	L	96.4	Very high	87.1	Confident	60 Å²	60	92.8 Å²	92.8	31%	0.314	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.9	173.9	-179.1	68.3	0	0	0	109.5	R98 W101 R125 V126	L95-R98 HydrophobicContact CB-CG 4.11Å; L95-R98 HydrophobicContact CG-CG 4.44Å; L95-R98 WeakPolarHBondContact O-CD 3.21Å; L95-R98 WeakPolarHBondContact O-CG 3.4Å; L95-W101 HydrophobicContact CD2-CB 4.08Å; L95-W101 HydrophobicContact CD2-CD2 4.19Å; L95-W101 HydrophobicContact CD2-CG 3.7Å; L95-R125 WeakPolarHBondContact CD1-O 3.4Å; L95-V126 HydrophobicContact CD1-CG2 4.49Å
96	E	96.6	Very high	89.3	Confident	63 Å²	63	89.8 Å²	89.8	29%	0.294	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	151.9	171.8	-69.5	-62.6	150.3	0	0	111.1	R98 R125 S127 P189	E96-R98 VanDerWaalsContact C-N 3.3Å; E96-R98 PolarHBondContact O-N 2.86Å; E96-R125 HydrophobicContact CB-CB 3.75Å; E96-R125 WeakPolarHBondContact CB-O 3.42Å; E96-R125 HydrophobicContact CG-CB 4.08Å; E96-R125 PolarHBondContact N-O 3.28Å; E96-S127 WeakPolarHBondContact OE1-CB 3.26Å; E96-S127 PolarHBondContact OE1-OG 2.6Å; E96-P189 HydrophobicContact CG-CB 3.87Å; E96-P189 HydrophobicContact CG-CG 4.14Å
97	N	93.9	Very high	91	Very high	103 Å²	103	87.4 Å²	87.4	55%	0.551	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	42	-178.7	-61.7	-20.6	0	0	0	113.7	E99 L100 W101	N97-E99 PolarHBondContact O-N 2.76Å; N97-L100 HydrophobicContact CB-CB 4.43Å; N97-L100 WeakPolarHBondContact O-CB 3.2Å; N97-L100 PolarHBondContact O-N 3.04Å; N97-L100 VanDerWaalsContact O-N 3.12Å; N97-W101 PolarHBondContact O-N 2.87Å
98	R	94.9	Very high	92.2	Very high	150 Å²	150	83.1 Å²	83.1	57%	0.566	47%	0.465	S	S	*	.	H	α-helix	trans	-55.6	-35.5	-176.5	-57.6	-178.3	65.8	-177.5	-0.1	113.4	L95 E96 W101 K102	L95-R98 HydrophobicContact CB-CG 4.11Å; L95-R98 HydrophobicContact CG-CG 4.44Å; L95-R98 WeakPolarHBondContact O-CD 3.21Å; L95-R98 WeakPolarHBondContact O-CG 3.4Å; E96-R98 VanDerWaalsContact C-N 3.3Å; E96-R98 PolarHBondContact O-N 2.86Å; R98-W101 WeakPolarHBondContact O-CB 3.16Å; R98-W101 PolarHBondContact O-N 3.35Å; R98-K102 WeakPolarHBondContact O-CG 3.48Å; R98-K102 PolarHBondContact O-N 3.14Å
99	E	95.9	Very high	92.9	Very high	116 Å²	116	79 Å²	79	54%	0.542	44%	0.444	S	S	.	.	H	α-helix	trans	-64.4	-41.2	-179.4	-55.7	-49.1	141.6	0	0	111.6	N97 W101 K102 E103	N97-E99 PolarHBondContact O-N 2.76Å; E99-W101 VanDerWaalsContact C-N 3.34Å; E99-W101 PolarHBondContact O-N 2.9Å; E99-K102 VanDerWaalsContact CD-NZ 3.3Å; E99-K102 WeakPolarHBondContact O-CB 3.45Å; E99-K102 PolarHBondContact O-N 3.49Å; E99-K102 VanDerWaalsContact O-N 3.15Å; E99-K102 IonicContact OE1-NZ 3.98Å; E99-K102 PolarHBondContact OE1-NZ 2.96Å; E99-K102 VanDerWaalsContact OE2-CD 3.27Å; E99-K102 WeakPolarHBondContact OE2-CD 3.37Å; E99-K102 IonicContact OE2-NZ 3.49Å; E99-K102 PolarHBondContact OE2-NZ 2.71Å; E99-E103 WeakPolarHBondContact O-CG 3.33Å; E99-E103 PolarHBondContact O-N 3.04Å
100	L	94.9	Very high	93.3	Very high	55 Å²	55	77 Å²	77	29%	0.288	42%	0.423	S	S	.	.	H	α-helix	trans	-62.2	-42.8	173.6	-177.2	64.5	0	0	0	111.4	N97 K102 E103 F104 P122	N97-L100 HydrophobicContact CB-CB 4.43Å; N97-L100 WeakPolarHBondContact O-CB 3.2Å; N97-L100 PolarHBondContact O-N 3.04Å; N97-L100 VanDerWaalsContact O-N 3.12Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.33Å; L100-E103 PolarHBondContact O-N 2.98Å; L100-F104 HydrophobicContact CD1-CD2 3.98Å; L100-F104 HydrophobicContact CD1-CE2 3.75Å; L100-F104 HydrophobicContact CG-CD2 4.25Å; L100-F104 HydrophobicContact CG-CE2 4.33Å; L100-F104 WeakPolarHBondContact O-CD2 3.34Å; L100-F104 PolarHBondContact O-N 3.15Å; L100-F104 VanDerWaalsContact O-N 3.09Å; L100-P122 HydrophobicContact CD2-CB 3.89Å; L100-P122 HydrophobicContact CD2-CG 3.88Å; L100-P122 HydrophobicContact CG-CB 4.36Å; L100-P122 HydrophobicContact CG-CG 3.86Å
101	W	95.2	Very high	93.6	Very high	46 Å²	46	74.8 Å²	74.8	17%	0.174	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-37.9	175.2	-78.6	99.6	0	0	0	112.5	L95 N97 R98 E99 S105 M111 P122 C124	L95-W101 HydrophobicContact CD2-CB 4.08Å; L95-W101 HydrophobicContact CD2-CD2 4.19Å; L95-W101 HydrophobicContact CD2-CG 3.7Å; N97-W101 PolarHBondContact O-N 2.87Å; R98-W101 WeakPolarHBondContact O-CB 3.16Å; R98-W101 PolarHBondContact O-N 3.35Å; E99-W101 VanDerWaalsContact C-N 3.34Å; E99-W101 PolarHBondContact O-N 2.9Å; W101-S105 VanDerWaalsContact O-CB 3.26Å; W101-S105 WeakPolarHBondContact O-CB 3.11Å; W101-S105 PolarHBondContact O-N 2.98Å; W101-M111 HydrophobicContact CH2-CE 4Å; W101-M111 HydrophobicContact CZ3-CE 4.04Å; W101-P122 HydrophobicContact CD2-CB 4.24Å; W101-P122 HydrophobicContact CD2-CG 4.22Å; W101-P122 HydrophobicContact CE3-CG 4.49Å; W101-P122 WeakPolarHBondContact CH2-O 3.29Å; W101-P122 HydrophobicContact CZ2-CB 3.93Å; W101-P122 WeakPolarHBondContact CZ2-O 3.08Å; W101-C124 HydrophobicContact CZ2-CB 4.36Å
102	K	94.4	Very high	93.4	Very high	108 Å²	108	78.1 Å²	78.1	47%	0.47	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-41.3	175.2	-72	170	-174.8	168.7	0	112	R98 E99 L100 S105 S106	R98-K102 WeakPolarHBondContact O-CG 3.48Å; R98-K102 PolarHBondContact O-N 3.14Å; E99-K102 VanDerWaalsContact CD-NZ 3.3Å; E99-K102 WeakPolarHBondContact O-CB 3.45Å; E99-K102 PolarHBondContact O-N 3.49Å; E99-K102 VanDerWaalsContact O-N 3.15Å; E99-K102 IonicContact OE1-NZ 3.98Å; E99-K102 PolarHBondContact OE1-NZ 2.96Å; E99-K102 VanDerWaalsContact OE2-CD 3.27Å; E99-K102 WeakPolarHBondContact OE2-CD 3.37Å; E99-K102 IonicContact OE2-NZ 3.49Å; E99-K102 PolarHBondContact OE2-NZ 2.71Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.33Å; K102-S105 PolarHBondContact O-N 3.21Å; K102-S106 WeakPolarHBondContact O-CB 3.26Å; K102-S106 PolarHBondContact O-N 3.19Å
103	E	95.2	Very high	93.2	Very high	123 Å²	123	76.5 Å²	76.5	58%	0.575	40%	0.396	S	S	*	.	H	α-helix	trans	-57.9	-49.5	175.4	-73.1	175.4	-167.4	0	0	110.9	E99 L100 S105 S106	E99-E103 WeakPolarHBondContact O-CG 3.33Å; E99-E103 PolarHBondContact O-N 3.04Å; L100-E103 PolarHBondContact O-N 2.98Å; E103-S105 PolarHBondContact O-N 3.35Å; E103-S106 PolarHBondContact O-N 3.26Å; E103-S106 PolarHBondContact O-OG 3.02Å
104	F	92.6	Very high	93	Very high	69 Å²	69	73.9 Å²	73.9	30%	0.303	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-44.3	175.2	-86.4	-99.9	0	0	0	112.3	L100 S106 V107 G108 T109 F121 P122	L100-F104 HydrophobicContact CD1-CD2 3.98Å; L100-F104 HydrophobicContact CD1-CE2 3.75Å; L100-F104 HydrophobicContact CG-CD2 4.25Å; L100-F104 HydrophobicContact CG-CE2 4.33Å; L100-F104 WeakPolarHBondContact O-CD2 3.34Å; L100-F104 PolarHBondContact O-N 3.15Å; L100-F104 VanDerWaalsContact O-N 3.09Å; F104-S106 VanDerWaalsContact C-N 3.27Å; F104-S106 PolarHBondContact O-N 2.8Å; F104-V107 PolarHBondContact O-N 3.15Å; F104-G108 CarbonylContact O-C 3.36Å; F104-G108 WeakPolarHBondContact O-CA 3.32Å; F104-G108 PolarHBondContact O-N 3.23Å; F104-T109 HydrophobicContact CB-CG2 4.49Å; F104-T109 PolarHBondContact O-N 2.97Å; F104-F121 HydrophobicContact CE1-CD1 4.1Å; F104-F121 HydrophobicContact CE1-CE1 4.12Å; F104-F121 AromaticContact CE2-CE1 3.94Å; F104-F121 HydrophobicContact CE2-CE1 3.94Å; F104-F121 AromaticContact CZ-CD1 3.91Å; F104-F121 HydrophobicContact CZ-CD1 3.91Å; F104-F121 AromaticContact CZ-CE1 3.45Å; F104-F121 HydrophobicContact CZ-CE1 3.45Å; F104-F121 VanDerWaalsContact CZ-CE1 3.45Å; F104-P122 HydrophobicContact CD2-CG 4Å; F104-P122 HydrophobicContact CE2-CG 4.35Å; F104-P122 HydrophobicContact CG-CG 4.24Å
105	S	91.3	Very high	92.7	Very high	81 Å²	81	79 Å²	79	57%	0.566	40%	0.401	S	S	*	.	H	α-helix	trans	-62.3	-33.5	178.4	-176.1	0	0	0	0	112.7	W101 K102 E103 V107 G108 T109	W101-S105 VanDerWaalsContact O-CB 3.26Å; W101-S105 WeakPolarHBondContact O-CB 3.11Å; W101-S105 PolarHBondContact O-N 2.98Å; K102-S105 PolarHBondContact O-N 3.21Å; E103-S105 PolarHBondContact O-N 3.35Å; S105-V107 VanDerWaalsContact C-N 3.31Å; S105-V107 PolarHBondContact O-N 2.84Å; S105-G108 PolarHBondContact O-N 3.2Å; S105-T109 PolarHBondContact N-OG1 3.36Å
106	S	92.3	Very high	92.4	Very high	98 Å²	98	79.7 Å²	79.7	69%	0.685	42%	0.415	S	S	*	.	H	α-helix	trans	-66.9	-31.7	-178.1	74.6	0	0	0	0	113.1	K102 E103 F104	K102-S106 WeakPolarHBondContact O-CB 3.26Å; K102-S106 PolarHBondContact O-N 3.19Å; E103-S106 PolarHBondContact O-N 3.26Å; E103-S106 PolarHBondContact O-OG 3.02Å; F104-S106 VanDerWaalsContact C-N 3.27Å; F104-S106 PolarHBondContact O-N 2.8Å
107	V	88.9	Confident	92.3	Very high	113 Å²	113	77.2 Å²	77.2	69%	0.685	41%	0.406	S	S	*	.	H	α-helix	trans	-87.3	-28.8	173.5	-176	0	0	0	0	110.8	F104 S105 R217	F104-V107 PolarHBondContact O-N 3.15Å; S105-V107 VanDerWaalsContact C-N 3.31Å; S105-V107 PolarHBondContact O-N 2.84Å; V107-R217 VanDerWaalsContact O-CZ 3.28Å; V107-R217 PolarHBondContact O-NH1 2.9Å; V107-R217 PolarHBondContact O-NH2 3.38Å
108	G	87.5	Confident	92.4	Very high	15 Å²	15	79.2 Å²	79.2	16%	0.155	41%	0.406	C	S	.	.			trans	102.7	106.7	-175.6	0	0	0	0	0	110.1	F104 S105 E110 R217	F104-G108 CarbonylContact O-C 3.36Å; F104-G108 WeakPolarHBondContact O-CA 3.32Å; F104-G108 PolarHBondContact O-N 3.23Å; S105-G108 PolarHBondContact O-N 3.2Å; G108-E110 WeakPolarHBondContact O-CG 3.41Å; G108-R217 VanDerWaalsContact CA-CZ 3.45Å; G108-R217 WeakPolarHBondContact O-CD 3.22Å; G108-R217 PolarHBondContact O-NH1 3.28Å; G108-R217 VanDerWaalsContact O-NH1 3.1Å
109	T	91.3	Very high	92.5	Very high	8 Å²	8	78.9 Å²	78.9	5%	0.049	41%	0.405	C	S	.	.			trans	-58.6	132.1	-175.3	-53.6	0	0	0	0	111	F104 S105 M111 R217	F104-T109 HydrophobicContact CB-CG2 4.49Å; F104-T109 PolarHBondContact O-N 2.97Å; S105-T109 PolarHBondContact N-OG1 3.36Å; T109-M111 HydrophobicContact CG2-CE 3.8Å; T109-R217 WeakPolarHBondContact O-CB 3.48Å
110	E	90.2	Very high	92.4	Very high	86 Å²	86	74.7 Å²	74.7	40%	0.402	39%	0.385	S	S	.	.			trans	-123	134.3	175.9	-47.6	-158.8	167.6	0	0	109.9	G108 W158 R217	G108-E110 WeakPolarHBondContact O-CG 3.41Å; E110-W158 WeakPolarHBondContact OE1-CZ2 3.48Å; E110-W158 PolarHBondContact OE1-NE1 2.93Å; E110-R217 VanDerWaalsContact CA-O 3.32Å; E110-R217 WeakPolarHBondContact CA-O 3.07Å; E110-R217 HydrophobicContact CB-CB 4.15Å; E110-R217 WeakPolarHBondContact CB-O 3.33Å; E110-R217 HydrophobicContact CG-CB 3.65Å; E110-R217 HydrophobicContact CG-CG 4.37Å; E110-R217 IonicContact OE1-NH1 3.38Å; E110-R217 PolarHBondContact OE1-NH1 3.32Å
111	M	92.4	Very high	92.4	Very high	19 Å²	19	78 Å²	78	9%	0.094	40%	0.398	C	S	.	.			trans	-115.5	127.9	179.6	-67.2	-70.6	177.7	0	0	110	W101 T109 M120 F121 L197 R217	W101-M111 HydrophobicContact CH2-CE 4Å; W101-M111 HydrophobicContact CZ3-CE 4.04Å; T109-M111 HydrophobicContact CG2-CE 3.8Å; M111-M120 HydrophobicContact CE-CB 4.35Å; M111-M120 HydrophobicContact SD-CB 4.07Å; M111-M120 HydrophobicContact SD-CG 4.42Å; M111-F121 VanDerWaalsContact CE-O 3.24Å; M111-F121 WeakPolarHBondContact CE-O 3.34Å; M111-L197 HydrophobicContact CB-CD1 3.96Å; M111-L197 HydrophobicContact CG-CD1 4.41Å; M111-R217 PolarHBondContact N-O 2.96Å
112	I	91.3	Very high	92.4	Very high	105 Å²	105	76 Å²	76	54%	0.538	39%	0.391	S	S	.	.			trans	-79.9	128.5	176.5	-60	173	0	0	0	108.7	T114 R118	I112-T114 HydrophobicContact CG2-CG2 3.96Å; I112-R118 HydrophobicContact CB-CG 4.25Å; I112-R118 HydrophobicContact CG2-CG 4.3Å; I112-R118 WeakPolarHBondContact O-CB 3.36Å
113	I	90.4	Very high	92.4	Very high	31 Å²	31	72.7 Å²	72.7	16%	0.159	38%	0.384	C	S	.	.			trans	-113.8	140.3	169.3	72.5	175.5	0	0	0	110.2	L197 N199 P210 V218	I113-L197 HydrophobicContact CB-CB 4.43Å; I113-L197 HydrophobicContact CG2-CB 3.65Å; I113-L197 HydrophobicContact CG2-CD1 4.29Å; I113-N199 HydrophobicContact CD1-CB 3.69Å; I113-N199 HydrophobicContact CG1-CB 4.14Å; I113-P210 HydrophobicContact CG2-CG 4.42Å; I113-V218 HydrophobicContact CB-CG1 4.24Å; I113-V218 HydrophobicContact CD1-CG1 3.51Å; I113-V218 HydrophobicContact CG1-CG1 3.46Å; I113-V218 VanDerWaalsContact CG1-CG1 3.46Å; I113-V218 HydrophobicContact CG2-CG1 3.88Å; I113-V218 HydrophobicContact CG2-CG2 4.19Å
114	T	91.3	Very high	92.4	Very high	50 Å²	50	67.8 Å²	67.8	31%	0.307	36%	0.363	S	S	.	.			trans	-136.6	162.4	-178.6	68.3	0	0	0	0	110.7	I112 A116 G117 R118 T198	I112-T114 HydrophobicContact CG2-CG2 3.96Å; T114-A116 VanDerWaalsContact C-N 3.28Å; T114-A116 PolarHBondContact O-N 3.03Å; T114-G117 PolarHBondContact O-N 3.48Å; T114-G117 VanDerWaalsContact OG1-C 3.31Å; T114-G117 PolarHBondContact OG1-N 3.34Å; T114-G117 PolarHBondContact OG1-O 3.34Å; T114-R118 HydrophobicContact CG2-CB 4.21Å; T114-T198 VanDerWaalsContact O-CA 3.29Å; T114-T198 WeakPolarHBondContact O-CA 3.32Å; T114-T198 WeakPolarHBondContact O-CB 3.42Å; T114-T198 PolarHBondContact O-OG1 3.1Å
115	K	89.4	Confident	92.6	Very high	161 Å²	161	70.2 Å²	70.2	70%	0.7	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-43	177.5	-169.6	-178.4	179.9	178.9	0	112.2	G117 T198 N199	K115-G117 VanDerWaalsContact C-N 3.28Å; K115-G117 PolarHBondContact O-N 3.19Å; K115-T198 PolarHBondContact O-OG1 3.05Å; K115-T198 VanDerWaalsContact O-OG1 3.06Å; K115-N199 WeakPolarHBondContact CA-OD1 3.48Å; K115-N199 PolarHBondContact N-OD1 3.21Å
116	A	91.4	Very high	92.9	Very high	73 Å²	73	67.3 Å²	67.3	60%	0.603	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-5	-179.8	0	0	0	0	0	114.3	T114 H207	T114-A116 VanDerWaalsContact C-N 3.28Å; T114-A116 PolarHBondContact O-N 3.03Å; A116-H207 PolarHBondContact O-CE1 3.29Å; A116-H207 VanDerWaalsContact O-CE1 3.29Å
117	G	93.5	Very high	93.2	Very high	11 Å²	11	63.9 Å²	63.9	11%	0.113	33%	0.325	C	S	.	.			trans	84.7	135.8	-173.5	0	0	0	0	0	113.2	T114 K115 L197	T114-G117 PolarHBondContact O-N 3.48Å; T114-G117 VanDerWaalsContact OG1-C 3.31Å; T114-G117 PolarHBondContact OG1-N 3.34Å; T114-G117 PolarHBondContact OG1-O 3.34Å; K115-G117 VanDerWaalsContact C-N 3.28Å; K115-G117 PolarHBondContact O-N 3.19Å; G117-L197 VanDerWaalsContact CA-O 3.29Å; G117-L197 WeakPolarHBondContact CA-O 3.26Å
118	R	95.9	Very high	93.5	Very high	146 Å²	146	58.8 Å²	58.8	55%	0.551	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.1	175.9	-173.7	69.4	175.1	-161.2	-1.6	110.5	I112 T114 K196 L197	I112-R118 HydrophobicContact CB-CG 4.25Å; I112-R118 HydrophobicContact CG2-CG 4.3Å; I112-R118 WeakPolarHBondContact O-CB 3.36Å; T114-R118 HydrophobicContact CG2-CB 4.21Å; R118-K196 CarbonylContact O-C 3.54Å; R118-K196 VanDerWaalsContact O-CA 3.25Å; R118-K196 WeakPolarHBondContact O-CA 3.43Å; R118-L197 PolarHBondContact N-O 2.86Å; R118-L197 PolarHBondContact O-N 2.88Å
119	R	96.6	Very high	94	Very high	143 Å²	143	62 Å²	62	54%	0.54	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	145.5	176.7	-68.7	177.9	177.8	174.9	0.7	111	H193 V195 K196	R119-H193 VanDerWaalsContact CD-O 3.28Å; R119-H193 WeakPolarHBondContact CD-O 3.48Å; R119-V195 WeakPolarHBondContact CA-O 2.91Å; R119-K196 HydrophobicContact CG-CG 4.04Å
120	M	95.2	Very high	94.2	Very high	28 Å²	28	63.6 Å²	63.6	14%	0.138	33%	0.329	C	S	.	.			trans	-64.9	146.8	174.3	-60.2	-171.7	-60.9	0	0	111.1	M111 C124 L141 V195 L197	M111-M120 HydrophobicContact CE-CB 4.35Å; M111-M120 HydrophobicContact SD-CB 4.07Å; M111-M120 HydrophobicContact SD-CG 4.42Å; M120-C124 HydrophobicContact CE-CB 3.91Å; M120-L141 HydrophobicContact CE-CD2 3.62Å; M120-L141 HydrophobicContact SD-CD2 4.34Å; M120-V195 HydrophobicContact CE-CB 4.04Å; M120-V195 HydrophobicContact CE-CG1 4.04Å; M120-V195 HydrophobicContact CE-CG2 4.49Å; M120-V195 HydrophobicContact CG-CG1 4.46Å; M120-V195 HydrophobicContact SD-CG1 4.29Å; M120-L197 HydrophobicContact CG-CD1 3.91Å; M120-L197 HydrophobicContact CG-CD2 4.28Å; M120-L197 HydrophobicContact CG-CG 3.99Å; M120-L197 HydrophobicContact SD-CD2 4.4Å
121	F	94.7	Very high	94.5	Very high	124 Å²	124	60 Å²	60	54%	0.544	31%	0.312	S	S	.	.	S	Bend	trans	-140.7	125.6	169	-174.3	-92.6	0	0	0	109.6	F104 M111	F104-F121 HydrophobicContact CE1-CD1 4.1Å; F104-F121 HydrophobicContact CE1-CE1 4.12Å; F104-F121 AromaticContact CE2-CE1 3.94Å; F104-F121 HydrophobicContact CE2-CE1 3.94Å; F104-F121 AromaticContact CZ-CD1 3.91Å; F104-F121 HydrophobicContact CZ-CD1 3.91Å; F104-F121 AromaticContact CZ-CE1 3.45Å; F104-F121 HydrophobicContact CZ-CE1 3.45Å; F104-F121 VanDerWaalsContact CZ-CE1 3.45Å; M111-F121 VanDerWaalsContact CE-O 3.24Å; M111-F121 WeakPolarHBondContact CE-O 3.34Å
122	P	95.1	Very high	94.7	Very high	4 Å²	4	63.1 Å²	63.1	3%	0.026	33%	0.329	C	S	.	.	S	Bend	cis	-63.4	158.8	-2.4	-21.1	34	0	0	0	113.6	L100 W101 F104	L100-P122 HydrophobicContact CD2-CB 3.89Å; L100-P122 HydrophobicContact CD2-CG 3.88Å; L100-P122 HydrophobicContact CG-CB 4.36Å; L100-P122 HydrophobicContact CG-CG 3.86Å; W101-P122 HydrophobicContact CD2-CB 4.24Å; W101-P122 HydrophobicContact CD2-CG 4.22Å; W101-P122 HydrophobicContact CE3-CG 4.49Å; W101-P122 WeakPolarHBondContact CH2-O 3.29Å; W101-P122 HydrophobicContact CZ2-CB 3.93Å; W101-P122 WeakPolarHBondContact CZ2-O 3.08Å; F104-P122 HydrophobicContact CD2-CG 4Å; F104-P122 HydrophobicContact CE2-CG 4.35Å; F104-P122 HydrophobicContact CG-CG 4.24Å
123	A	93.6	Very high	95	Very high	39 Å²	39	61.1 Å²	61.1	32%	0.322	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-72.3	132.1	176.7	0	0	0	0	0	110.2	R125 H193	A123-R125 PolarHBondContact O-N 2.92Å; A123-H193 HydrophobicContact CB-CB 4.19Å
124	C	95.6	Very high	95.3	Very high	20 Å²	20	67.1 Å²	67.1	14%	0.135	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-73.7	121	175.1	-178.3	0	0	0	0	110.1	W101 M120 F192	W101-C124 HydrophobicContact CZ2-CB 4.36Å; M120-C124 HydrophobicContact CE-CB 3.91Å; C124-F192 HydrophobicContact CB-CB 4.2Å; C124-F192 PolarHBondContact O-N 2.88Å
125	R	96.8	Very high	95.6	Very high	120 Å²	120	66.3 Å²	66.3	45%	0.453	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	129	178.5	-82.4	-179.5	163.9	-176.9	-5.3	108.4	L95 E96 A123 V190 S191	L95-R125 WeakPolarHBondContact CD1-O 3.4Å; E96-R125 HydrophobicContact CB-CB 3.75Å; E96-R125 WeakPolarHBondContact CB-O 3.42Å; E96-R125 HydrophobicContact CG-CB 4.08Å; E96-R125 PolarHBondContact N-O 3.28Å; A123-R125 PolarHBondContact O-N 2.92Å; R125-V190 CarbonylContact C-O 3.38Å; R125-V190 VanDerWaalsContact CA-O 3.26Å; R125-V190 WeakPolarHBondContact CA-O 3.19Å; R125-S191 WeakPolarHBondContact CG-OG 3.38Å; R125-S191 PolarHBondContact NE-OG 3.35Å
126	V	97.4	Very high	96	Very high	20 Å²	20	67.3 Å²	67.3	12%	0.121	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.7	-172.5	-176.4	0	0	0	0	109.8	L93 S94 L95 V128 P189 V190	L93-V126 HydrophobicContact CB-CG1 3.73Å; L93-V126 HydrophobicContact CD2-CG1 3.9Å; L93-V126 HydrophobicContact CG-CG1 4.18Å; S94-V126 CarbonylContact O-C 3.58Å; S94-V126 WeakPolarHBondContact O-CA 3.35Å; L95-V126 HydrophobicContact CD1-CG2 4.49Å; V126-V128 HydrophobicContact CG1-CG2 4.39Å; V126-P189 CarbonylContact O-C 3.53Å; V126-P189 WeakPolarHBondContact O-CA 3.47Å; V126-V190 PolarHBondContact N-O 2.9Å; V126-V190 PolarHBondContact O-N 2.78Å
127	S	97.8	Very high	96.2	Very high	26 Å²	26	66.3 Å²	66.3	18%	0.182	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.3	167.8	-77.4	0	0	0	0	109.5	L93 S94 E96 P189	L93-S127 CarbonylContact C-O 3.34Å; L93-S127 WeakPolarHBondContact CA-O 3.4Å; S94-S127 PolarHBondContact N-O 2.99Å; S94-S127 PolarHBondContact O-N 3.16Å; S94-S127 WeakPolarHBondContact OG-CB 3.42Å; E96-S127 WeakPolarHBondContact OE1-CB 3.26Å; E96-S127 PolarHBondContact OE1-OG 2.6Å; S127-P189 WeakPolarHBondContact OG-CG 3.36Å
128	V	97.2	Very high	96.4	Very high	5 Å²	5	69.2 Å²	69.2	3%	0.03	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.5	-173.8	-171.4	0	0	0	0	109.2	V91 S92 L93 V126 L131 F139 M186 V190	V91-V128 HydrophobicContact CG1-CG1 4.37Å; S92-V128 WeakPolarHBondContact O-CA 3.44Å; L93-V128 HydrophobicContact CD2-CG2 4.46Å; L93-V128 HydrophobicContact CG-CG1 4.43Å; L93-V128 HydrophobicContact CG-CG2 4.37Å; V126-V128 HydrophobicContact CG1-CG2 4.39Å; V128-L131 HydrophobicContact CG1-CD1 3.75Å; V128-L131 HydrophobicContact CG1-CD2 4.42Å; V128-L131 HydrophobicContact CG1-CG 3.86Å; V128-F139 HydrophobicContact CB-CZ 4.45Å; V128-F139 HydrophobicContact CG1-CZ 4.15Å; V128-F139 HydrophobicContact CG2-CE1 3.61Å; V128-F139 HydrophobicContact CG2-CZ 3.76Å; V128-M186 WeakPolarHBondContact O-CG 3.34Å; V128-V190 HydrophobicContact CG2-CG2 4.15Å
129	T	97.1	Very high	96.4	Very high	82 Å²	82	63.5 Å²	63.5	50%	0.503	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.5	174	60.5	0	0	0	0	110.9	V91 S92	V91-T129 WeakPolarHBondContact CA-O 3.44Å; S92-T129 PolarHBondContact N-O 3.22Å; S92-T129 PolarHBondContact O-N 3.08Å
130	G	96.3	Very high	96.4	Very high	43 Å²	43	61.1 Å²	61.1	44%	0.443	32%	0.318	S	S	.	.			trans	81.1	11	173.7	0	0	0	0	0	116.1	G90 V91 M186	G90-G130 WeakPolarHBondContact O-CA 3.42Å; V91-G130 WeakPolarHBondContact CG2-O 3.33Å; G130-M186 PolarHBondContact N-SD 2.81Å
131	L	96.6	Very high	96.3	Very high	11 Å²	11	61.3 Å²	61.3	6%	0.058	32%	0.32	C	S	.	.			trans	-72.3	150.7	168.4	-61.9	176.3	0	0	0	110.4	V91 V128 P133 Y137 F139 W185 M186	V91-L131 HydrophobicContact CG1-CD2 3.78Å; V91-L131 HydrophobicContact CG1-CG 4.46Å; V91-L131 HydrophobicContact CG2-CD2 3.88Å; V128-L131 HydrophobicContact CG1-CD1 3.75Å; V128-L131 HydrophobicContact CG1-CD2 4.42Å; V128-L131 HydrophobicContact CG1-CG 3.86Å; L131-P133 WeakPolarHBondContact O-CD 3.45Å; L131-Y137 HydrophobicContact CB-CD2 4.45Å; L131-Y137 HydrophobicContact CB-CE2 3.83Å; L131-Y137 HydrophobicContact CD1-CD2 4.2Å; L131-Y137 HydrophobicContact CD1-CE2 4.39Å; L131-Y137 HydrophobicContact CD1-CG 4.49Å; L131-Y137 HydrophobicContact CD2-CD1 4.05Å; L131-Y137 HydrophobicContact CD2-CD2 4.39Å; L131-Y137 HydrophobicContact CD2-CE1 3.76Å; L131-Y137 HydrophobicContact CD2-CE2 4.13Å; L131-Y137 HydrophobicContact CD2-CG 4.35Å; L131-Y137 HydrophobicContact CG-CE2 4.34Å; L131-F139 HydrophobicContact CD1-CE2 4.23Å; L131-F139 HydrophobicContact CD1-CZ 4.27Å; L131-W185 HydrophobicContact CD1-CB 3.71Å; L131-W185 HydrophobicContact CD1-CG 4.33Å; L131-M186 HydrophobicContact CB-CE 4.01Å; L131-M186 HydrophobicContact CB-CG 4.19Å; L131-M186 HydrophobicContact CB-SD 3.88Å; L131-M186 HydrophobicContact CD1-CG 4.21Å; L131-M186 HydrophobicContact CG-CG 4.33Å; L131-M186 HydrophobicContact CG-SD 4.45Å; L131-M186 PolarHBondContact N-SD 2.85Å; L131-M186 WeakPolarHBondContact O-CE 3.28Å
132	D	96.4	Very high	96.1	Very high	83 Å²	83	57.9 Å²	57.9	44%	0.444	31%	0.307	S	S	.	.			trans	-65.3	120.2	167.7	176.9	-13.2	0	0	0	108.7	E134 A135 Y137 G182	D132-E134 PolarHBondContact O-N 2.81Å; D132-E134 VanDerWaalsContact O-N 3.14Å; D132-E134 PolarHBondContact OD1-N 2.98Å; D132-A135 HydrophobicContact CB-CB 3.78Å; D132-A135 PolarHBondContact O-N 3.04Å; D132-Y137 WeakPolarHBondContact CB-OH 3.48Å; D132-Y137 PolarHBondContact N-OH 2.95Å; D132-G182 VanDerWaalsContact O-CA 3.29Å; D132-G182 WeakPolarHBondContact O-CA 3.34Å; D132-G182 PolarHBondContact O-N 2.96Å
133	P	97.4	Very high	95.8	Very high	63 Å²	63	58.7 Å²	58.7	41%	0.409	31%	0.312	S	S	.	.	S	Bend	trans	-53.6	-32.6	-179	-28	36.8	0	0	0	114.7	L131 T181 A183 M186	L131-P133 WeakPolarHBondContact O-CD 3.45Å; P133-T181 WeakPolarHBondContact O-CB 3.42Å; P133-A183 HydrophobicContact CB-CB 4.14Å; P133-A183 WeakPolarHBondContact O-CB 3.29Å; P133-A183 PolarHBondContact O-N 3.46Å; P133-M186 HydrophobicContact CG-CE 4.36Å
134	E	97.1	Very high	95.4	Very high	158 Å²	158	61.8 Å²	61.8	74%	0.738	32%	0.322	S	S	*	.	S	Bend	trans	-96.5	-23.7	-172.6	-60.2	-55.4	123.9	0	0	113.2	D132	D132-E134 PolarHBondContact O-N 2.81Å; D132-E134 VanDerWaalsContact O-N 3.14Å; D132-E134 PolarHBondContact OD1-N 2.98Å
135	A	96.9	Very high	94.9	Very high	33 Å²	33	62.4 Å²	62.4	27%	0.273	33%	0.326	S	S	.	.	S	Bend	trans	-70.8	150	177.6	0	0	0	0	0	111.9	D132 Y137 T181 G182	D132-A135 HydrophobicContact CB-CB 3.78Å; D132-A135 PolarHBondContact O-N 3.04Å; A135-Y137 HydrophobicContact CB-CE2 3.77Å; A135-Y137 WeakPolarHBondContact O-CD2 3.49Å; A135-Y137 WeakPolarHBondContact O-CE2 3.19Å; A135-T181 CarbonylContact O-C 3.44Å; A135-T181 WeakPolarHBondContact O-CA 3.45Å; A135-G182 PolarHBondContact O-N 2.84Å
136	R	96.9	Very high	94.3	Very high	182 Å²	182	61.3 Å²	61.3	69%	0.687	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	133	177.3	-67.3	-175	178.4	120.4	0.4	111.2	A180 T181	R136-A180 CarbonylContact C-O 3.6Å; R136-A180 WeakPolarHBondContact CA-O 3.38Å; R136-T181 HydrophobicContact CG-CG2 4.44Å
137	Y	97.1	Very high	93.6	Very high	51 Å²	51	62.3 Å²	62.3	20%	0.2	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.3	-179	-59.6	-89.4	0	0	0	111.5	L88 L131 D132 A135 A180 W185	L88-Y137 HydrophobicContact CD1-CE1 4.4Å; L131-Y137 HydrophobicContact CB-CD2 4.45Å; L131-Y137 HydrophobicContact CB-CE2 3.83Å; L131-Y137 HydrophobicContact CD1-CD2 4.2Å; L131-Y137 HydrophobicContact CD1-CE2 4.39Å; L131-Y137 HydrophobicContact CD1-CG 4.49Å; L131-Y137 HydrophobicContact CD2-CD1 4.05Å; L131-Y137 HydrophobicContact CD2-CD2 4.39Å; L131-Y137 HydrophobicContact CD2-CE1 3.76Å; L131-Y137 HydrophobicContact CD2-CE2 4.13Å; L131-Y137 HydrophobicContact CD2-CG 4.35Å; L131-Y137 HydrophobicContact CG-CE2 4.34Å; D132-Y137 WeakPolarHBondContact CB-OH 3.48Å; D132-Y137 PolarHBondContact N-OH 2.95Å; A135-Y137 HydrophobicContact CB-CE2 3.77Å; A135-Y137 WeakPolarHBondContact O-CD2 3.49Å; A135-Y137 WeakPolarHBondContact O-CE2 3.19Å; Y137-A180 PolarHBondContact N-O 3.33Å; Y137-A180 PolarHBondContact O-N 2.77Å; Y137-A180 VanDerWaalsContact O-N 3.15Å; Y137-W185 PolarHBondContact O-NE1 3.47Å
138	L	96.6	Very high	92.9	Very high	72 Å²	72	63.3 Å²	63.3	38%	0.377	35%	0.351	S	S	.	.			trans	-103.2	132.7	168.3	-61.7	174.8	0	0	0	108.7	P179	L138-P179 HydrophobicContact CD2-CB 3.7Å; L138-P179 HydrophobicContact CD2-CG 4.45Å
139	F	96.4	Very high	92.3	Very high	26 Å²	26	64.1 Å²	64.1	11%	0.114	36%	0.358	C	S	.	.			trans	-109.3	126.7	171.8	-88.8	-116.8	0	0	0	109.1	V128 L131 H175 S178 W185 V190 F192	V128-F139 HydrophobicContact CB-CZ 4.45Å; V128-F139 HydrophobicContact CG1-CZ 4.15Å; V128-F139 HydrophobicContact CG2-CE1 3.61Å; V128-F139 HydrophobicContact CG2-CZ 3.76Å; L131-F139 HydrophobicContact CD1-CE2 4.23Å; L131-F139 HydrophobicContact CD1-CZ 4.27Å; F139-H175 HydrophobicContact CB-CB 3.94Å; F139-H175 WeakPolarHBondContact O-CB 3.38Å; F139-H175 PolarHBondContact O-N 3.35Å; F139-S178 PolarHBondContact N-OG 2.89Å; F139-S178 PolarHBondContact O-OG 2.83Å; F139-W185 HydrophobicContact CB-CE3 4.5Å; F139-W185 HydrophobicContact CB-CH2 3.7Å; F139-W185 HydrophobicContact CB-CZ2 3.93Å; F139-W185 HydrophobicContact CB-CZ3 4.02Å; F139-W185 HydrophobicContact CD1-CE3 4.41Å; F139-W185 AromaticContact CD2-CD2 3.54Å; F139-W185 HydrophobicContact CD2-CD2 3.54Å; F139-W185 AromaticContact CD2-CE2 3.43Å; F139-W185 VanDerWaalsContact CD2-CE2 3.43Å; F139-W185 HydrophobicContact CD2-CE3 4.01Å; F139-W185 AromaticContact CD2-CG 3.91Å; F139-W185 HydrophobicContact CD2-CG 3.91Å; F139-W185 HydrophobicContact CD2-CH2 4.23Å; F139-W185 AromaticContact CD2-CZ2 3.8Å; F139-W185 HydrophobicContact CD2-CZ2 3.8Å; F139-W185 HydrophobicContact CD2-CZ3 4.34Å; F139-W185 AromaticContact CD2-NE1 3.74Å; F139-W185 HydrophobicContact CE2-CB 4.12Å; F139-W185 AromaticContact CE2-CD1 3.79Å; F139-W185 AromaticContact CE2-CD2 3.76Å; F139-W185 HydrophobicContact CE2-CD2 3.76Å; F139-W185 AromaticContact CE2-CE2 3.99Å; F139-W185 HydrophobicContact CE2-CE3 4.39Å; F139-W185 AromaticContact CE2-CG 3.63Å; F139-W185 HydrophobicContact CE2-CG 3.63Å; F139-W185 AromaticContact CE2-NE1 3.99Å; F139-W185 HydrophobicContact CG-CD2 4.05Å; F139-W185 HydrophobicContact CG-CE3 4.03Å; F139-W185 HydrophobicContact CG-CH2 4.08Å; F139-W185 HydrophobicContact CG-CZ2 4.11Å; F139-W185 HydrophobicContact CG-CZ3 4.05Å; F139-W185 HydrophobicContact CZ-CB 4.31Å; F139-W185 HydrophobicContact CZ-CD2 4.43Å; F139-W185 HydrophobicContact CZ-CG 4.25Å; F139-V190 HydrophobicContact CD1-CB 4.41Å; F139-V190 HydrophobicContact CD1-CG1 3.99Å; F139-V190 HydrophobicContact CD1-CG2 4.19Å; F139-V190 HydrophobicContact CE1-CG2 4.09Å; F139-F192 HydrophobicContact CB-CZ 4.38Å; F139-F192 HydrophobicContact CD1-CZ 4.39Å
140	L	95.3	Very high	91.9	Very high	93 Å²	93	68.5 Å²	68.5	49%	0.487	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	159.7	176.6	64.2	81.1	0	0	0	111.3	Y173 I174	L140-Y173 CarbonylContact C-O 3.42Å; L140-Y173 WeakPolarHBondContact CA-O 3.42Å; L140-Y173 WeakPolarHBondContact CB-O 3.32Å; L140-I174 HydrophobicContact CB-CG1 4.35Å
141	L	94.3	Very high	91.5	Very high	32 Å²	32	69.8 Å²	69.8	17%	0.168	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.8	173.6	-176.7	80.7	0	0	0	108.7	M120 Y173 F192 V195	M120-L141 HydrophobicContact CE-CD2 3.62Å; M120-L141 HydrophobicContact SD-CD2 4.34Å; L141-Y173 PolarHBondContact N-O 3.14Å; L141-Y173 PolarHBondContact O-N 3.04Å; L141-F192 HydrophobicContact CB-CD1 3.76Å; L141-F192 HydrophobicContact CB-CE1 3.86Å; L141-F192 HydrophobicContact CB-CG 4.43Å; L141-F192 HydrophobicContact CD2-CB 4.42Å; L141-V195 HydrophobicContact CD2-CB 4.33Å; L141-V195 HydrophobicContact CD2-CG1 3.98Å; L141-V195 HydrophobicContact CD2-CG2 3.74Å
142	D	90.3	Very high	91.1	Very high	53 Å²	53	75 Å²	75	28%	0.283	38%	0.376	S	S	.	.			trans	-113.6	152.4	166.6	-166.5	10.1	0	0	0	109.8	I144 V172 R211	D142-I144 HydrophobicContact CB-CG2 4.48Å; D142-I144 VanDerWaalsContact OD2-CG2 3.26Å; D142-I144 WeakPolarHBondContact OD2-CG2 3.45Å; D142-V172 HydrophobicContact CB-CG1 3.9Å; D142-R211 IonicContact OD1-NH2 3.48Å; D142-R211 IonicContact OD2-CZ 2.9Å; D142-R211 IonicContact OD2-NH2 3.14Å; D142-R211 PolarHBondContact OD2-NH2 2.85Å
143	V	88.7	Confident	90.7	Very high	21 Å²	21	77.3 Å²	77.3	13%	0.127	38%	0.379	C	S	.	.			trans	-120.1	95.8	176.3	-178.6	0	0	0	0	108.1	V208 P210 L214	V143-V208 HydrophobicContact CB-CG1 4.27Å; V143-V208 HydrophobicContact CG2-CG1 3.97Å; V143-P210 HydrophobicContact CG1-CB 3.85Å; V143-P210 HydrophobicContact CG1-CG 4.29Å; V143-L214 HydrophobicContact CG1-CD1 4.35Å; V143-L214 HydrophobicContact CG1-CD2 3.56Å
144	I	86.2	Confident	90.3	Very high	103 Å²	103	77.7 Å²	77.7	53%	0.528	38%	0.375	S	S	.	.			trans	-99.8	137.7	-173.4	54.8	157.5	0	0	0	112.1	D142 L214	D142-I144 HydrophobicContact CB-CG2 4.48Å; D142-I144 VanDerWaalsContact OD2-CG2 3.26Å; D142-I144 WeakPolarHBondContact OD2-CG2 3.45Å; I144-L214 WeakPolarHBondContact O-CD1 3.27Å
145	P	83.6	Confident	90	Very high	34 Å²	34	73.8 Å²	73.8	22%	0.221	38%	0.378	C	S	.	.			trans	-63.7	141.8	-175.3	28.3	-27.8	0	0	0	111.4	R211 G213	P145-R211 HydrophobicContact CB-CB 4.34Å; P145-R211 HydrophobicContact CG-CB 3.92Å; P145-G213 CarbonylContact C-O 3.51Å; P145-G213 WeakPolarHBondContact CA-O 3.42Å; P145-G213 VanDerWaalsContact CB-CA 3.48Å; P145-G213 WeakPolarHBondContact CB-O 3.47Å
146	V	83.9	Confident	89.5	Confident	96 Å²	96	82.9 Å²	82.9	58%	0.582	41%	0.405	S	S	*	.	S	Bend	trans	-83.5	-35.5	177.5	179.4	0	0	0	0	110.7	G213 L214 Q215	V146-G213 PolarHBondContact N-O 3.07Å; V146-L214 HydrophobicContact CG2-CD1 3.75Å; V146-L214 HydrophobicContact CG2-CG 4.27Å; V146-Q215 HydrophobicContact CB-CB 3.63Å; V146-Q215 HydrophobicContact CG1-CB 3.85Å; V146-Q215 HydrophobicContact CG2-CB 3.88Å
147	D	84.4	Confident	89.1	Confident	42 Å²	42	81.6 Å²	81.6	23%	0.225	40%	0.4	C	S	.	.			trans	-141.7	-178.2	-177.8	65.2	50.7	0	0	0	112.7	A149 Y151 G213 Q215	D147-A149 WeakPolarHBondContact OD1-CB 3.23Å; D147-A149 PolarHBondContact OD1-N 3.43Å; D147-Y151 WeakPolarHBondContact OD2-CE2 3.45Å; D147-Y151 PolarHBondContact OD2-OH 3.31Å; D147-G213 CarbonylContact C-O 3.38Å; D147-G213 PolarHBondContact N-O 3.01Å; D147-G213 CarbonylContact O-C 3.56Å; D147-G213 WeakPolarHBondContact O-CA 3.49Å; D147-Q215 PolarHBondContact OD2-NE2 3.21Å
148	G	82.9	Confident	88.7	Confident	47 Å²	47	81.4 Å²	81.4	49%	0.485	40%	0.399	S	S	.	.	S	Bend	trans	-103.8	18.8	178.3	0	0	0	0	0	113.6	K163 A164	G148-K163 WeakPolarHBondContact O-CA 3.35Å; G148-A164 WeakPolarHBondContact O-CB 3.31Å; G148-A164 PolarHBondContact O-N 3.45Å
149	A	85.1	Confident	88.4	Confident	21 Å²	21	80.1 Å²	80.1	17%	0.174	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145.2	-171.7	0	0	0	0	0	112.4	D147 Y151 G162	D147-A149 WeakPolarHBondContact OD1-CB 3.23Å; D147-A149 PolarHBondContact OD1-N 3.43Å; A149-Y151 HydrophobicContact CB-CD2 4.37Å; A149-Y151 HydrophobicContact CB-CE2 3.65Å; A149-G162 WeakPolarHBondContact CA-O 3.08Å
150	R	86.9	Confident	88.1	Confident	174 Å²	174	83.4 Å²	83.4	66%	0.657	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.4	166.4	-178.2	177.2	179.2	178.5	0.5	108.4	S161 G162	R150-S161 PolarHBondContact O-N 2.89Å; R150-G162 PolarHBondContact N-O 3.01Å
151	Y	87.5	Confident	87.9	Confident	70 Å²	70	82.1 Å²	82.1	28%	0.275	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	150.4	-178.1	-70	-93.2	0	0	0	112.4	D147 A149 W158 E159 P160 Q215	D147-Y151 WeakPolarHBondContact OD2-CE2 3.45Å; D147-Y151 PolarHBondContact OD2-OH 3.31Å; A149-Y151 HydrophobicContact CB-CD2 4.37Å; A149-Y151 HydrophobicContact CB-CE2 3.65Å; Y151-W158 HydrophobicContact CD1-CB 4.25Å; Y151-E159 CarbonylContact C-O 3.58Å; Y151-E159 WeakPolarHBondContact CA-O 3.25Å; Y151-P160 HydrophobicContact CE1-CG 3.99Å; Y151-Q215 PolarHBondContact OH-NE2 3.32Å
152	R	89.5	Confident	87.6	Confident	120 Å²	120	82.6 Å²	82.6	45%	0.453	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.7	167.6	70.4	-176.2	-67.7	-177.5	-3.8	110.7	Q154 W158 E159 S161	R152-Q154 HydrophobicContact CG-CG 4Å; R152-Q154 VanDerWaalsContact NH2-OE1 3.15Å; R152-W158 VanDerWaalsContact C-CE3 3.47Å; R152-E159 PolarHBondContact N-O 2.89Å; R152-E159 PolarHBondContact O-N 2.79Å; R152-S161 WeakPolarHBondContact CD-OG 3.38Å
153	W	87.3	Confident	87.3	Confident	132 Å²	132	88.8 Å²	88.8	50%	0.5	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	115.8	174	-176	-110.2	0	0	0	109.8	R156 R157 W158	W153-R156 WeakPolarHBondContact CH2-O 3.32Å; W153-R156 VanDerWaalsContact CZ2-C 3.42Å; W153-R156 HydrophobicContact CZ2-CB 4.13Å; W153-R157 WeakPolarHBondContact CA-O 3.26Å; W153-R157 VanDerWaalsContact CE3-O 3.3Å; W153-R157 VanDerWaalsContact CZ3-C 3.44Å; W153-R157 VanDerWaalsContact CZ3-CA 3.43Å; W153-W158 HydrophobicContact CB-CD2 4.42Å; W153-W158 HydrophobicContact CB-CE3 4.23Å; W153-W158 HydrophobicContact CB-CH2 4.24Å; W153-W158 HydrophobicContact CB-CZ2 4.35Å; W153-W158 HydrophobicContact CB-CZ3 4.17Å; W153-W158 HydrophobicContact CE3-CB 4.47Å; W153-W158 AromaticContact CE3-CD1 3.27Å; W153-W158 AromaticContact CE3-CD2 3.82Å; W153-W158 HydrophobicContact CE3-CD2 3.82Å; W153-W158 AromaticContact CE3-CE2 3.66Å; W153-W158 AromaticContact CE3-CG 3.66Å; W153-W158 HydrophobicContact CE3-CG 3.66Å; W153-W158 HydrophobicContact CE3-CZ2 4.44Å; W153-W158 AromaticContact CE3-NE1 3.25Å; W153-W158 VanDerWaalsContact CE3-NE1 3.25Å; W153-W158 AromaticContact CZ3-CD1 3.26Å; W153-W158 HydrophobicContact CZ3-CG 4.03Å; W153-W158 AromaticContact CZ3-NE1 3.43Å
154	Q	89.9	Confident	87	Confident	71 Å²	71	88.9 Å²	88.9	33%	0.332	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	140.1	177.5	-72.3	-171.7	116.4	0	0	110	R152 R156 R157 E159	R152-Q154 HydrophobicContact CG-CG 4Å; R152-Q154 VanDerWaalsContact NH2-OE1 3.15Å; Q154-R156 PolarHBondContact O-N 3.48Å; Q154-R156 VanDerWaalsContact O-N 3.15Å; Q154-R157 PolarHBondContact N-O 2.91Å; Q154-R157 VanDerWaalsContact O-CG 3.22Å; Q154-R157 WeakPolarHBondContact O-CG 3.43Å; Q154-R157 PolarHBondContact O-N 3.19Å; Q154-E159 PolarHBondContact NE2-OE2 3.45Å
155	G	89.4	Confident	86.5	Confident	77 Å²	77	90.8 Å²	90.8	79%	0.794	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	34.4	174.9	0	0	0	0	0	114.2	R157	G155-R157 PolarHBondContact O-N 3.41Å
156	R	87.8	Confident	85.6	Confident	224 Å²	224	94.6 Å²	94.6	85%	0.845	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	25.5	-174.9	-54.5	-177.1	179.2	-167.6	0.5	114.9	W153 Q154	W153-R156 WeakPolarHBondContact CH2-O 3.32Å; W153-R156 VanDerWaalsContact CZ2-C 3.42Å; W153-R156 HydrophobicContact CZ2-CB 4.13Å; Q154-R156 PolarHBondContact O-N 3.48Å; Q154-R156 VanDerWaalsContact O-N 3.15Å
157	R	88.5	Confident	84.6	Confident	155 Å²	155	99.6 Å²	99.6	59%	0.585	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	159.4	173.4	62	176.8	-173.3	-168.5	4.1	111.3	W153 Q154 G155 E159	W153-R157 WeakPolarHBondContact CA-O 3.26Å; W153-R157 VanDerWaalsContact CE3-O 3.3Å; W153-R157 VanDerWaalsContact CZ3-C 3.44Å; W153-R157 VanDerWaalsContact CZ3-CA 3.43Å; Q154-R157 PolarHBondContact N-O 2.91Å; Q154-R157 VanDerWaalsContact O-CG 3.22Å; Q154-R157 WeakPolarHBondContact O-CG 3.43Å; Q154-R157 PolarHBondContact O-N 3.19Å; G155-R157 PolarHBondContact O-N 3.41Å; R157-E159 HydrophobicContact CG-CG 4.1Å; R157-E159 IonicContact CZ-OE1 3.1Å; R157-E159 IonicContact NE-OE1 2.72Å; R157-E159 PolarHBondContact NE-OE1 3.3Å; R157-E159 IonicContact NH2-OE1 2.69Å; R157-E159 PolarHBondContact NH2-OE1 3.02Å
158	W	87.8	Confident	83.7	Confident	46 Å²	46	101.2 Å²	101.2	17%	0.174	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.1	171.2	-73.4	95.2	0	0	0	109.5	E110 Y151 R152 W153 R217	E110-W158 WeakPolarHBondContact OE1-CZ2 3.48Å; E110-W158 PolarHBondContact OE1-NE1 2.93Å; Y151-W158 HydrophobicContact CD1-CB 4.25Å; R152-W158 VanDerWaalsContact C-CE3 3.47Å; W153-W158 HydrophobicContact CB-CD2 4.42Å; W153-W158 HydrophobicContact CB-CE3 4.23Å; W153-W158 HydrophobicContact CB-CH2 4.24Å; W153-W158 HydrophobicContact CB-CZ2 4.35Å; W153-W158 HydrophobicContact CB-CZ3 4.17Å; W153-W158 HydrophobicContact CE3-CB 4.47Å; W153-W158 AromaticContact CE3-CD1 3.27Å; W153-W158 AromaticContact CE3-CD2 3.82Å; W153-W158 HydrophobicContact CE3-CD2 3.82Å; W153-W158 AromaticContact CE3-CE2 3.66Å; W153-W158 AromaticContact CE3-CG 3.66Å; W153-W158 HydrophobicContact CE3-CG 3.66Å; W153-W158 HydrophobicContact CE3-CZ2 4.44Å; W153-W158 AromaticContact CE3-NE1 3.25Å; W153-W158 VanDerWaalsContact CE3-NE1 3.25Å; W153-W158 AromaticContact CZ3-CD1 3.26Å; W153-W158 HydrophobicContact CZ3-CG 4.03Å; W153-W158 AromaticContact CZ3-NE1 3.43Å; W158-R217 HydrophobicContact CD2-CG 4.1Å; W158-R217 HydrophobicContact CG-CG 4.08Å; W158-R217 HydrophobicContact CZ2-CB 3.84Å; W158-R217 HydrophobicContact CZ2-CG 4.22Å
159	E	90.2	Very high	82.9	Confident	46 Å²	46	103.9 Å²	103.9	22%	0.215	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.7	178.7	-65.6	179.7	159.8	0	0	110.3	Y151 R152 Q154 R157 S161	Y151-E159 CarbonylContact C-O 3.58Å; Y151-E159 WeakPolarHBondContact CA-O 3.25Å; R152-E159 PolarHBondContact N-O 2.89Å; R152-E159 PolarHBondContact O-N 2.79Å; Q154-E159 PolarHBondContact NE2-OE2 3.45Å; R157-E159 HydrophobicContact CG-CG 4.1Å; R157-E159 IonicContact CZ-OE1 3.1Å; R157-E159 IonicContact NE-OE1 2.72Å; R157-E159 PolarHBondContact NE-OE1 3.3Å; R157-E159 IonicContact NH2-OE1 2.69Å; R157-E159 PolarHBondContact NH2-OE1 3.02Å; E159-S161 PolarHBondContact O-N 3.06Å
160	P	90.8	Very high	82.2	Confident	95 Å²	95	107.1 Å²	107.1	62%	0.617	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	133.3	168.5	-20.4	32.4	0	0	0	110.7	Y151	Y151-P160 HydrophobicContact CE1-CG 3.99Å
161	S	90.4	Very high	82.2	Confident	65 Å²	65	101.9 Å²	101.9	46%	0.455	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	0.4	-179.1	-172.6	0	0	0	0	113.3	R150 R152 E159	R150-S161 PolarHBondContact O-N 2.89Å; R152-S161 WeakPolarHBondContact CD-OG 3.38Å; E159-S161 PolarHBondContact O-N 3.06Å
162	G	88.6	Confident	82.3	Confident	43 Å²	43	101.5 Å²	101.5	44%	0.443	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	-165.7	179.5	0	0	0	0	0	112.9	A149 R150	A149-G162 WeakPolarHBondContact CA-O 3.08Å; R150-G162 PolarHBondContact N-O 3.01Å
163	K	84.8	Confident	82.5	Confident	183 Å²	183	97.8 Å²	97.8	80%	0.796	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	143.9	177.4	-165.3	176.4	-179.7	178.2	0	111.2	G148	G148-K163 WeakPolarHBondContact O-CA 3.35Å
164	A	81.9	Confident	82.9	Confident	22 Å²	22	95.1 Å²	95.1	18%	0.182	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-53	145.5	168.4	0	0	0	0	0	111.8	G148 L212	G148-A164 WeakPolarHBondContact O-CB 3.31Å; G148-A164 PolarHBondContact O-N 3.45Å; A164-L212 WeakPolarHBondContact CB-O 3.36Å
165	E	74.2	Confident	83.2	Confident	144 Å²	144	92.5 Å²	92.5	67%	0.673	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-67.3	146.7	178.8	-168.4	171.5	-178.7	0	0	110.9
166	P	65.2	Low	83.6	Confident	113 Å²	113	92.1 Å²	92.1	73%	0.734	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-55.6	148.6	177.6	-25.7	35	0	0	0	113.5	L168	P166-L168 PolarHBondContact O-N 3.29Å
167	R	64.1	Low	84	Confident	201 Å²	201	84.8 Å²	84.8	76%	0.758	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-66	127	-172.1	-63.7	-175.8	172.6	140.1	-2.3	111.7
168	L	65	Low	84.4	Confident	77 Å²	77	78.4 Å²	78.4	40%	0.403	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-91.1	165.4	165	-70.4	174	0	0	0	109.7	P166 D170 T201	P166-L168 PolarHBondContact O-N 3.29Å; L168-D170 PolarHBondContact O-N 2.97Å; L168-T201 HydrophobicContact CD1-CG2 3.57Å
169	P	66.7	Low	84.9	Confident	103 Å²	103	80 Å²	80	67%	0.669	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-53	132.1	-179.3	-25.6	33.6	0	0	0	112.1
170	D	70.6	Confident	85.3	Confident	89 Å²	89	78.5 Å²	78.5	48%	0.476	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-65.9	135.6	-178	-63.9	-23.6	0	0	0	110.2	L168 R211	L168-D170 PolarHBondContact O-N 2.97Å; D170-R211 WeakPolarHBondContact OD1-CD 3.2Å; D170-R211 IonicContact OD1-CZ 2.71Å; D170-R211 IonicContact OD1-NE 2.96Å; D170-R211 PolarHBondContact OD1-NE 3.01Å; D170-R211 VanDerWaalsContact OD1-NE 3.14Å; D170-R211 IonicContact OD1-NH1 3.02Å; D170-R211 PolarHBondContact OD1-NH1 2.8Å; D170-R211 IonicContact OD1-NH2 3.87Å; D170-R211 PolarHBondContact OD1-NH2 3.37Å; D170-R211 IonicContact OD2-CZ 3.22Å; D170-R211 IonicContact OD2-NE 2.84Å; D170-R211 IonicContact OD2-NH1 3.61Å; D170-R211 PolarHBondContact OD2-NH1 3.11Å; D170-R211 IonicContact OD2-NH2 3.46Å; D170-R211 PolarHBondContact OD2-NH2 3.15Å
171	R	85.6	Confident	85.6	Confident	63 Å²	63	76.3 Å²	76.3	24%	0.238	42%	0.416	C	S	.	.			trans	-126.1	112.2	176	-69.4	-173.7	178.1	-160.6	-2.7	109.4	D203 H207	R171-D203 PolarHBondContact NH1-O 2.88Å; R171-D203 IonicContact NH1-OD2 3.54Å; R171-D203 PolarHBondContact NH1-OD2 2.92Å; R171-D203 PolarHBondContact NH2-O 3.33Å; R171-H207 WeakPolarHBondContact CD-O 3.26Å
172	V	90.4	Very high	86	Confident	63 Å²	63	73.2 Å²	73.2	38%	0.382	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-93.5	149.8	172.7	-58.6	0	0	0	0	110.3	D142 I174	D142-V172 HydrophobicContact CB-CG1 3.9Å; V172-I174 HydrophobicContact CG2-CG1 4.33Å
173	Y	93.9	Very high	86.4	Confident	42 Å²	42	73.3 Å²	73.3	17%	0.165	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.4	167.3	173.2	-90.9	0	0	0	109.4	L140 L141 P176 F192 V195	L140-Y173 CarbonylContact C-O 3.42Å; L140-Y173 WeakPolarHBondContact CA-O 3.42Å; L140-Y173 WeakPolarHBondContact CB-O 3.32Å; L141-Y173 PolarHBondContact N-O 3.14Å; L141-Y173 PolarHBondContact O-N 3.04Å; Y173-P176 VanDerWaalsContact OH-CD 3.29Å; Y173-P176 WeakPolarHBondContact OH-CD 3.26Å; Y173-F192 AromaticContact CD1-CD1 3.68Å; Y173-F192 HydrophobicContact CD1-CD1 3.68Å; Y173-F192 HydrophobicContact CD1-CE1 4.11Å; Y173-F192 AromaticContact CE1-CD1 3.73Å; Y173-F192 HydrophobicContact CE1-CD1 3.73Å; Y173-F192 HydrophobicContact CE1-CE1 4.25Å; Y173-V195 HydrophobicContact CD1-CG2 3.47Å; Y173-V195 VanDerWaalsContact CD1-CG2 3.47Å; Y173-V195 HydrophobicContact CD2-CG2 3.87Å; Y173-V195 HydrophobicContact CE1-CG2 3.82Å; Y173-V195 HydrophobicContact CE2-CG2 4.18Å; Y173-V195 HydrophobicContact CG-CG2 3.49Å; Y173-V195 VanDerWaalsContact CG-CG2 3.49Å
174	I	95.4	Very high	87.1	Confident	75 Å²	75	66.6 Å²	66.6	39%	0.385	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.7	172.1	-58	175.1	0	0	0	108.3	L140 V172	L140-I174 HydrophobicContact CB-CG1 4.35Å; V172-I174 HydrophobicContact CG2-CG1 4.33Å
175	H	96.8	Very high	87.9	Confident	16 Å²	16	65.8 Å²	65.8	7%	0.074	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-63.2	133.7	177.1	-169.3	-79.9	0	0	0	109.7	F139 D177 S178 W185 S191 F192	F139-H175 HydrophobicContact CB-CB 3.94Å; F139-H175 WeakPolarHBondContact O-CB 3.38Å; F139-H175 PolarHBondContact O-N 3.35Å; H175-D177 VanDerWaalsContact CE1-CG 3.42Å; H175-D177 IonicContact CE1-OD1 3.6Å; H175-D177 IonicContact CE1-OD2 3.88Å; H175-D177 WeakPolarHBondContact ND1-CB 3.33Å; H175-D177 PolarHBondContact ND1-N 3.45Å; H175-D177 IonicContact ND1-OD1 2.91Å; H175-D177 PolarHBondContact O-N 3.38Å; H175-D177 VanDerWaalsContact O-N 3.15Å; H175-S178 WeakPolarHBondContact O-CB 2.7Å; H175-S178 PolarHBondContact O-N 2.88Å; H175-S178 PolarHBondContact O-OG 3.27Å; H175-W185 HydrophobicContact CB-CH2 3.93Å; H175-W185 HydrophobicContact CB-CZ3 4.41Å; H175-W185 AromaticContact CE1-CZ3 3.89Å; H175-W185 AromaticContact CG-CH2 3.76Å; H175-W185 AromaticContact CG-CZ3 3.87Å; H175-W185 AromaticContact ND1-CH2 3.41Å; H175-W185 WeakPolarHBondContact ND1-CH2 3.4Å; H175-W185 AromaticContact ND1-CZ3 3.52Å; H175-S191 PolarHBondContact NE2-O 2.82Å; H175-F192 HydrophobicContact CB-CE1 4.25Å
176	P	97.1	Very high	89	Confident	70 Å²	70	61.9 Å²	61.9	46%	0.455	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.1	-173	23.3	-35.9	0	0	0	113.9	Y173 S178	Y173-P176 VanDerWaalsContact OH-CD 3.29Å; Y173-P176 WeakPolarHBondContact OH-CD 3.26Å; P176-S178 PolarHBondContact O-N 2.75Å
177	D	96.8	Very high	90.6	Very high	69 Å²	69	63.5 Å²	63.5	37%	0.369	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.8	175.6	-58.6	14.1	0	0	0	113.1	H175 P179 A180 H184 W185	H175-D177 VanDerWaalsContact CE1-CG 3.42Å; H175-D177 IonicContact CE1-OD1 3.6Å; H175-D177 IonicContact CE1-OD2 3.88Å; H175-D177 WeakPolarHBondContact ND1-CB 3.33Å; H175-D177 PolarHBondContact ND1-N 3.45Å; H175-D177 IonicContact ND1-OD1 2.91Å; H175-D177 PolarHBondContact O-N 3.38Å; H175-D177 VanDerWaalsContact O-N 3.15Å; D177-P179 CarbonylContact O-C 3.26Å; D177-P179 VanDerWaalsContact O-C 3.26Å; D177-A180 VanDerWaalsContact O-CB 3.26Å; D177-A180 WeakPolarHBondContact O-CB 3.49Å; D177-H184 WeakPolarHBondContact CB-NE2 3.5Å; D177-H184 IonicContact OD2-CE1 2.89Å; D177-H184 PolarHBondContact OD2-CE1 2.76Å; D177-H184 IonicContact OD2-NE2 3.72Å; D177-H184 PolarHBondContact OD2-NE2 2.85Å; D177-W185 HydrophobicContact CB-CH2 3.75Å; D177-W185 HydrophobicContact CB-CZ2 4.39Å; D177-W185 HydrophobicContact CB-CZ3 4.17Å
178	S	97	Very high	92.1	Very high	22 Å²	22	59.4 Å²	59.4	15%	0.154	32%	0.319	C	S	.	.			trans	-77.3	139.4	178.5	-54.9	0	0	0	0	111.2	F139 H175 P176	F139-S178 PolarHBondContact N-OG 2.89Å; F139-S178 PolarHBondContact O-OG 2.83Å; H175-S178 WeakPolarHBondContact O-CB 2.7Å; H175-S178 PolarHBondContact O-N 2.88Å; H175-S178 PolarHBondContact O-OG 3.27Å; P176-S178 PolarHBondContact O-N 2.75Å
179	P	97.6	Very high	93.7	Very high	79 Å²	79	58.4 Å²	58.4	51%	0.513	32%	0.317	S	S	.	.	S	Bend	cis	-77.7	142.2	-9	30.5	-32.9	0	0	0	112.8	L138 D177	L138-P179 HydrophobicContact CD2-CB 3.7Å; L138-P179 HydrophobicContact CD2-CG 4.45Å; D177-P179 CarbonylContact O-C 3.26Å; D177-P179 VanDerWaalsContact O-C 3.26Å
180	A	98.1	Very high	95.2	Very high	14 Å²	14	53.8 Å²	53.8	12%	0.116	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163.3	172.9	0	0	0	0	0	112.1	R136 Y137 D177 H184 W185	R136-A180 CarbonylContact C-O 3.6Å; R136-A180 WeakPolarHBondContact CA-O 3.38Å; Y137-A180 PolarHBondContact N-O 3.33Å; Y137-A180 PolarHBondContact O-N 2.77Å; Y137-A180 VanDerWaalsContact O-N 3.15Å; D177-A180 VanDerWaalsContact O-CB 3.26Å; D177-A180 WeakPolarHBondContact O-CB 3.49Å; A180-H184 HydrophobicContact CB-CB 3.91Å; A180-H184 WeakPolarHBondContact CB-CD2 3.49Å; A180-W185 HydrophobicContact CB-CZ2 4.06Å; A180-W185 PolarHBondContact O-NE1 2.83Å; A180-W185 VanDerWaalsContact O-NE1 3.14Å
181	T	98.3	Very high	96.4	Very high	49 Å²	49	50.4 Å²	50.4	30%	0.301	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	158.1	-177.7	58.6	0	0	0	0	112.5	P133 A135 R136 A183 H184 W185	P133-T181 WeakPolarHBondContact O-CB 3.42Å; A135-T181 CarbonylContact O-C 3.44Å; A135-T181 WeakPolarHBondContact O-CA 3.45Å; R136-T181 HydrophobicContact CG-CG2 4.44Å; T181-A183 PolarHBondContact O-N 2.85Å; T181-H184 WeakPolarHBondContact O-CA 3.4Å; T181-H184 VanDerWaalsContact O-CB 3.32Å; T181-H184 WeakPolarHBondContact O-CB 3.29Å; T181-H184 PolarHBondContact O-N 3.24Å; T181-H184 PolarHBondContact OG1-N 2.77Å; T181-W185 PolarHBondContact O-N 3.07Å
182	G	97.8	Very high	97	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-38.2	174	0	0	0	0	0	112.2	D132 A135 H184 W185 M186	D132-G182 VanDerWaalsContact O-CA 3.29Å; D132-G182 WeakPolarHBondContact O-CA 3.34Å; D132-G182 PolarHBondContact O-N 2.96Å; A135-G182 PolarHBondContact O-N 2.84Å; G182-H184 PolarHBondContact O-N 3.32Å; G182-W185 PolarHBondContact O-N 3Å; G182-M186 WeakPolarHBondContact O-CG 3.43Å; G182-M186 PolarHBondContact O-N 2.81Å
183	A	98.2	Very high	97.1	Very high	46 Å²	46	48.8 Å²	48.8	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-58.7	-35.2	173.6	0	0	0	0	0	112.4	P133 T181 R187	P133-A183 HydrophobicContact CB-CB 4.14Å; P133-A183 WeakPolarHBondContact O-CB 3.29Å; P133-A183 PolarHBondContact O-N 3.46Å; T181-A183 PolarHBondContact O-N 2.85Å; A183-R187 PolarHBondContact O-N 2.58Å
184	H	98.4	Very high	97.2	Very high	42 Å²	42	53.9 Å²	53.9	19%	0.194	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-46.7	176	175.8	89.1	0	0	0	112.4	D177 A180 T181 G182 R187	D177-H184 WeakPolarHBondContact CB-NE2 3.5Å; D177-H184 IonicContact OD2-CE1 2.89Å; D177-H184 PolarHBondContact OD2-CE1 2.76Å; D177-H184 IonicContact OD2-NE2 3.72Å; D177-H184 PolarHBondContact OD2-NE2 2.85Å; A180-H184 HydrophobicContact CB-CB 3.91Å; A180-H184 WeakPolarHBondContact CB-CD2 3.49Å; T181-H184 WeakPolarHBondContact O-CA 3.4Å; T181-H184 VanDerWaalsContact O-CB 3.32Å; T181-H184 WeakPolarHBondContact O-CB 3.29Å; T181-H184 PolarHBondContact O-N 3.24Å; T181-H184 PolarHBondContact OG1-N 2.77Å; G182-H184 PolarHBondContact O-N 3.32Å; H184-R187 PolarHBondContact CE1-NH2 3.44Å; H184-R187 PolarHBondContact ND1-NH1 3.48Å; H184-R187 PolarHBondContact ND1-NH2 3.2Å; H184-R187 WeakPolarHBondContact O-CB 3.29Å; H184-R187 PolarHBondContact O-N 2.76Å
185	W	98.1	Very high	97.2	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-70.1	-33	-177.5	-65.9	117.8	0	0	0	113.5	L131 Y137 F139 H175 D177 A180 T181 G182 R187 V190	L131-W185 HydrophobicContact CD1-CB 3.71Å; L131-W185 HydrophobicContact CD1-CG 4.33Å; Y137-W185 PolarHBondContact O-NE1 3.47Å; F139-W185 HydrophobicContact CB-CE3 4.5Å; F139-W185 HydrophobicContact CB-CH2 3.7Å; F139-W185 HydrophobicContact CB-CZ2 3.93Å; F139-W185 HydrophobicContact CB-CZ3 4.02Å; F139-W185 HydrophobicContact CD1-CE3 4.41Å; F139-W185 AromaticContact CD2-CD2 3.54Å; F139-W185 HydrophobicContact CD2-CD2 3.54Å; F139-W185 AromaticContact CD2-CE2 3.43Å; F139-W185 VanDerWaalsContact CD2-CE2 3.43Å; F139-W185 HydrophobicContact CD2-CE3 4.01Å; F139-W185 AromaticContact CD2-CG 3.91Å; F139-W185 HydrophobicContact CD2-CG 3.91Å; F139-W185 HydrophobicContact CD2-CH2 4.23Å; F139-W185 AromaticContact CD2-CZ2 3.8Å; F139-W185 HydrophobicContact CD2-CZ2 3.8Å; F139-W185 HydrophobicContact CD2-CZ3 4.34Å; F139-W185 AromaticContact CD2-NE1 3.74Å; F139-W185 HydrophobicContact CE2-CB 4.12Å; F139-W185 AromaticContact CE2-CD1 3.79Å; F139-W185 AromaticContact CE2-CD2 3.76Å; F139-W185 HydrophobicContact CE2-CD2 3.76Å; F139-W185 AromaticContact CE2-CE2 3.99Å; F139-W185 HydrophobicContact CE2-CE3 4.39Å; F139-W185 AromaticContact CE2-CG 3.63Å; F139-W185 HydrophobicContact CE2-CG 3.63Å; F139-W185 AromaticContact CE2-NE1 3.99Å; F139-W185 HydrophobicContact CG-CD2 4.05Å; F139-W185 HydrophobicContact CG-CE3 4.03Å; F139-W185 HydrophobicContact CG-CH2 4.08Å; F139-W185 HydrophobicContact CG-CZ2 4.11Å; F139-W185 HydrophobicContact CG-CZ3 4.05Å; F139-W185 HydrophobicContact CZ-CB 4.31Å; F139-W185 HydrophobicContact CZ-CD2 4.43Å; F139-W185 HydrophobicContact CZ-CG 4.25Å; H175-W185 HydrophobicContact CB-CH2 3.93Å; H175-W185 HydrophobicContact CB-CZ3 4.41Å; H175-W185 AromaticContact CE1-CZ3 3.89Å; H175-W185 AromaticContact CG-CH2 3.76Å; H175-W185 AromaticContact CG-CZ3 3.87Å; H175-W185 AromaticContact ND1-CH2 3.41Å; H175-W185 WeakPolarHBondContact ND1-CH2 3.4Å; H175-W185 AromaticContact ND1-CZ3 3.52Å; D177-W185 HydrophobicContact CB-CH2 3.75Å; D177-W185 HydrophobicContact CB-CZ2 4.39Å; D177-W185 HydrophobicContact CB-CZ3 4.17Å; A180-W185 HydrophobicContact CB-CZ2 4.06Å; A180-W185 PolarHBondContact O-NE1 2.83Å; A180-W185 VanDerWaalsContact O-NE1 3.14Å; T181-W185 PolarHBondContact O-N 3.07Å; G182-W185 PolarHBondContact O-N 3Å; W185-R187 VanDerWaalsContact C-N 3.33Å; W185-V190 HydrophobicContact CE3-CB 4.46Å; W185-V190 HydrophobicContact CE3-CG1 4.06Å; W185-V190 HydrophobicContact CE3-CG2 3.56Å; W185-V190 HydrophobicContact CZ3-CG1 3.72Å; W185-V190 HydrophobicContact CZ3-CG2 4.12Å
186	M	97.9	Very high	97.1	Very high	62 Å²	62	53 Å²	53	31%	0.305	27%	0.273	S	S	.	.	H	α-helix	trans	-82.4	-9.1	178.8	-63.1	-171.9	-69.5	0	0	113.6	V128 G130 L131 P133 G182	V128-M186 WeakPolarHBondContact O-CG 3.34Å; G130-M186 PolarHBondContact N-SD 2.81Å; L131-M186 HydrophobicContact CB-CE 4.01Å; L131-M186 HydrophobicContact CB-CG 4.19Å; L131-M186 HydrophobicContact CB-SD 3.88Å; L131-M186 HydrophobicContact CD1-CG 4.21Å; L131-M186 HydrophobicContact CG-CG 4.33Å; L131-M186 HydrophobicContact CG-SD 4.45Å; L131-M186 PolarHBondContact N-SD 2.85Å; L131-M186 WeakPolarHBondContact O-CE 3.28Å; P133-M186 HydrophobicContact CG-CE 4.36Å; G182-M186 WeakPolarHBondContact O-CG 3.43Å; G182-M186 PolarHBondContact O-N 2.81Å
187	R	97.8	Very high	96.9	Very high	147 Å²	147	50 Å²	50	56%	0.555	25%	0.252	S	S	*	.	S	Bend	trans	-68.1	-35.1	-177.3	-175.8	177.7	62.5	-104.4	-8	113.2	A183 H184 W185	A183-R187 PolarHBondContact O-N 2.58Å; H184-R187 PolarHBondContact CE1-NH2 3.44Å; H184-R187 PolarHBondContact ND1-NH1 3.48Å; H184-R187 PolarHBondContact ND1-NH2 3.2Å; H184-R187 WeakPolarHBondContact O-CB 3.29Å; H184-R187 PolarHBondContact O-N 2.76Å; W185-R187 VanDerWaalsContact C-N 3.33Å
188	Q	97.2	Very high	96.6	Very high	116 Å²	116	46.7 Å²	46.7	54%	0.542	24%	0.235	S	C	.	.	S	Bend	trans	-156.8	161.4	-178.8	66.2	179.7	-0.2	0	0	110.6	V190	Q188-V190 PolarHBondContact O-N 3.37Å
189	P	97.7	Very high	96.2	Very high	56 Å²	56	49.7 Å²	49.7	36%	0.364	25%	0.249	S	C	.	.			trans	-58.1	130.6	178.4	-19	27.3	0	0	0	112.5	E96 V126 S127	E96-P189 HydrophobicContact CG-CB 3.87Å; E96-P189 HydrophobicContact CG-CG 4.14Å; V126-P189 CarbonylContact O-C 3.53Å; V126-P189 WeakPolarHBondContact O-CA 3.47Å; S127-P189 WeakPolarHBondContact OG-CG 3.36Å
190	V	97.9	Very high	95.7	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.1	177	-173.7	0	0	0	0	109.4	R125 V126 V128 F139 W185 Q188 F192	R125-V190 CarbonylContact C-O 3.38Å; R125-V190 VanDerWaalsContact CA-O 3.26Å; R125-V190 WeakPolarHBondContact CA-O 3.19Å; V126-V190 PolarHBondContact N-O 2.9Å; V126-V190 PolarHBondContact O-N 2.78Å; V128-V190 HydrophobicContact CG2-CG2 4.15Å; F139-V190 HydrophobicContact CD1-CB 4.41Å; F139-V190 HydrophobicContact CD1-CG1 3.99Å; F139-V190 HydrophobicContact CD1-CG2 4.19Å; F139-V190 HydrophobicContact CE1-CG2 4.09Å; W185-V190 HydrophobicContact CE3-CB 4.46Å; W185-V190 HydrophobicContact CE3-CG1 4.06Å; W185-V190 HydrophobicContact CE3-CG2 3.56Å; W185-V190 HydrophobicContact CZ3-CG1 3.72Å; W185-V190 HydrophobicContact CZ3-CG2 4.12Å; Q188-V190 PolarHBondContact O-N 3.37Å; V190-F192 HydrophobicContact CG1-CE2 3.92Å; V190-F192 HydrophobicContact CG1-CZ 4.15Å
191	S	97.1	Very high	94.9	Very high	17 Å²	17	50.2 Å²	50.2	12%	0.119	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.3	-173	-172.6	0	0	0	0	113.5	R125 H175 H193	R125-S191 WeakPolarHBondContact CG-OG 3.38Å; R125-S191 PolarHBondContact NE-OG 3.35Å; H175-S191 PolarHBondContact NE2-O 2.82Å; S191-H193 VanDerWaalsContact C-N 3.29Å; S191-H193 PolarHBondContact O-N 2.86Å; S191-H193 PolarHBondContact OG-ND1 2.91Å
192	F	96.6	Very high	94.3	Very high	11 Å²	11	54.9 Å²	54.9	5%	0.048	27%	0.273	C	S	.	.			trans	-92.7	26.8	174.8	-65.3	-85.5	0	0	0	112.9	C124 F139 L141 Y173 H175 V190 R194 V195	C124-F192 HydrophobicContact CB-CB 4.2Å; C124-F192 PolarHBondContact O-N 2.88Å; F139-F192 HydrophobicContact CB-CZ 4.38Å; F139-F192 HydrophobicContact CD1-CZ 4.39Å; L141-F192 HydrophobicContact CB-CD1 3.76Å; L141-F192 HydrophobicContact CB-CE1 3.86Å; L141-F192 HydrophobicContact CB-CG 4.43Å; L141-F192 HydrophobicContact CD2-CB 4.42Å; Y173-F192 AromaticContact CD1-CD1 3.68Å; Y173-F192 HydrophobicContact CD1-CD1 3.68Å; Y173-F192 HydrophobicContact CD1-CE1 4.11Å; Y173-F192 AromaticContact CE1-CD1 3.73Å; Y173-F192 HydrophobicContact CE1-CD1 3.73Å; Y173-F192 HydrophobicContact CE1-CE1 4.25Å; H175-F192 HydrophobicContact CB-CE1 4.25Å; V190-F192 HydrophobicContact CG1-CE2 3.92Å; V190-F192 HydrophobicContact CG1-CZ 4.15Å; F192-R194 PolarHBondContact O-N 3.09Å; F192-R194 VanDerWaalsContact O-N 3.15Å; F192-V195 HydrophobicContact CB-CG2 3.87Å; F192-V195 HydrophobicContact CD1-CG2 4.27Å; F192-V195 VanDerWaalsContact O-CB 3.32Å; F192-V195 WeakPolarHBondContact O-CB 3.36Å; F192-V195 VanDerWaalsContact O-CG2 3.26Å; F192-V195 WeakPolarHBondContact O-CG2 3.24Å; F192-V195 PolarHBondContact O-N 3.4Å; F192-V195 VanDerWaalsContact O-N 3.11Å
193	H	94.3	Very high	93.7	Very high	82 Å²	82	55.2 Å²	55.2	38%	0.38	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18	-176.1	72.7	-82.6	0	0	0	114.3	R119 A123 S191	R119-H193 VanDerWaalsContact CD-O 3.28Å; R119-H193 WeakPolarHBondContact CD-O 3.48Å; A123-H193 HydrophobicContact CB-CB 4.19Å; S191-H193 VanDerWaalsContact C-N 3.29Å; S191-H193 PolarHBondContact O-N 2.86Å; S191-H193 PolarHBondContact OG-ND1 2.91Å
194	R	94.6	Very high	93.1	Very high	148 Å²	148	58.4 Å²	58.4	56%	0.558	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.3	177.7	-63.8	178.2	65.8	173.4	-0.8	113	F192 K196	F192-R194 PolarHBondContact O-N 3.09Å; F192-R194 VanDerWaalsContact O-N 3.15Å; R194-K196 PolarHBondContact O-N 2.91Å
195	V	95.2	Very high	92.6	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.006	31%	0.313	C	S	.	.			trans	-58.8	131.4	175.8	174.3	0	0	0	0	109.1	R119 M120 L141 Y173 F192 L197 V208	R119-V195 WeakPolarHBondContact CA-O 2.91Å; M120-V195 HydrophobicContact CE-CB 4.04Å; M120-V195 HydrophobicContact CE-CG1 4.04Å; M120-V195 HydrophobicContact CE-CG2 4.49Å; M120-V195 HydrophobicContact CG-CG1 4.46Å; M120-V195 HydrophobicContact SD-CG1 4.29Å; L141-V195 HydrophobicContact CD2-CB 4.33Å; L141-V195 HydrophobicContact CD2-CG1 3.98Å; L141-V195 HydrophobicContact CD2-CG2 3.74Å; Y173-V195 HydrophobicContact CD1-CG2 3.47Å; Y173-V195 VanDerWaalsContact CD1-CG2 3.47Å; Y173-V195 HydrophobicContact CD2-CG2 3.87Å; Y173-V195 HydrophobicContact CE1-CG2 3.82Å; Y173-V195 HydrophobicContact CE2-CG2 4.18Å; Y173-V195 HydrophobicContact CG-CG2 3.49Å; Y173-V195 VanDerWaalsContact CG-CG2 3.49Å; F192-V195 HydrophobicContact CB-CG2 3.87Å; F192-V195 HydrophobicContact CD1-CG2 4.27Å; F192-V195 VanDerWaalsContact O-CB 3.32Å; F192-V195 WeakPolarHBondContact O-CB 3.36Å; F192-V195 VanDerWaalsContact O-CG2 3.26Å; F192-V195 WeakPolarHBondContact O-CG2 3.24Å; F192-V195 PolarHBondContact O-N 3.4Å; F192-V195 VanDerWaalsContact O-N 3.11Å; V195-L197 HydrophobicContact CG1-CD2 4.13Å; V195-V208 HydrophobicContact CG1-CB 4.49Å; V195-V208 HydrophobicContact CG1-CG2 4.09Å
196	K	94.9	Very high	92	Very high	72 Å²	72	65 Å²	65	31%	0.313	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.1	173.3	-75.9	174.3	169.4	-171.8	0	109.5	R118 R119 R194 H207 V208	R118-K196 CarbonylContact O-C 3.54Å; R118-K196 VanDerWaalsContact O-CA 3.25Å; R118-K196 WeakPolarHBondContact O-CA 3.43Å; R119-K196 HydrophobicContact CG-CG 4.04Å; R194-K196 PolarHBondContact O-N 2.91Å; K196-H207 HydrophobicContact CB-CB 4.4Å; K196-H207 WeakPolarHBondContact CD-NE2 3.5Å; K196-V208 PolarHBondContact O-N 3.3Å
197	L	93	Very high	91.7	Very high	6 Å²	6	63.3 Å²	63.3	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130	177.9	-53.1	-176	0	0	0	110.4	M111 I113 G117 R118 M120 V195 V208 P210	M111-L197 HydrophobicContact CB-CD1 3.96Å; M111-L197 HydrophobicContact CG-CD1 4.41Å; I113-L197 HydrophobicContact CB-CB 4.43Å; I113-L197 HydrophobicContact CG2-CB 3.65Å; I113-L197 HydrophobicContact CG2-CD1 4.29Å; G117-L197 VanDerWaalsContact CA-O 3.29Å; G117-L197 WeakPolarHBondContact CA-O 3.26Å; R118-L197 PolarHBondContact N-O 2.86Å; R118-L197 PolarHBondContact O-N 2.88Å; M120-L197 HydrophobicContact CG-CD1 3.91Å; M120-L197 HydrophobicContact CG-CD2 4.28Å; M120-L197 HydrophobicContact CG-CG 3.99Å; M120-L197 HydrophobicContact SD-CD2 4.4Å; V195-L197 HydrophobicContact CG1-CD2 4.13Å; L197-V208 VanDerWaalsContact CA-O 3.31Å; L197-V208 WeakPolarHBondContact CA-O 3.46Å; L197-V208 HydrophobicContact CD2-CB 4.07Å; L197-V208 HydrophobicContact CD2-CG1 4.11Å; L197-P210 HydrophobicContact CB-CG 4.36Å; L197-P210 HydrophobicContact CD1-CG 4.31Å; L197-P210 HydrophobicContact CD2-CG 4.11Å; L197-P210 HydrophobicContact CG-CG 4.5Å
198	T	91.3	Very high	91.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.3	C	S	.	.			trans	-130.5	150.5	-178.6	-173.4	0	0	0	0	113.3	T114 K115 S200 D203 H207 V208	T114-T198 VanDerWaalsContact O-CA 3.29Å; T114-T198 WeakPolarHBondContact O-CA 3.32Å; T114-T198 WeakPolarHBondContact O-CB 3.42Å; T114-T198 PolarHBondContact O-OG1 3.1Å; K115-T198 PolarHBondContact O-OG1 3.05Å; K115-T198 VanDerWaalsContact O-OG1 3.06Å; T198-S200 WeakPolarHBondContact OG1-CB 3.41Å; T198-S200 PolarHBondContact OG1-N 3.39Å; T198-D203 HydrophobicContact CG2-CB 3.97Å; T198-H207 HydrophobicContact CG2-CB 3.63Å; T198-V208 PolarHBondContact N-O 3.09Å
199	N	87.8	Confident	90.8	Very high	85 Å²	85	52.4 Å²	52.4	46%	0.455	28%	0.279	S	S	.	.			trans	-94.7	-6.6	166.6	66	-15.3	0	0	0	113.3	I113 K115 T201	I113-N199 HydrophobicContact CD1-CB 3.69Å; I113-N199 HydrophobicContact CG1-CB 4.14Å; K115-N199 WeakPolarHBondContact CA-OD1 3.48Å; K115-N199 PolarHBondContact N-OD1 3.21Å; N199-T201 PolarHBondContact O-N 3.44Å
200	S	86.9	Confident	90	Very high	21 Å²	21	50 Å²	50	15%	0.147	26%	0.264	C	S	.	.			trans	-79	107.6	-169.8	178.4	0	0	0	0	113.5	T198 L202 D203 R209	T198-S200 WeakPolarHBondContact OG1-CB 3.41Å; T198-S200 PolarHBondContact OG1-N 3.39Å; S200-L202 PolarHBondContact O-N 3.22Å; S200-L202 VanDerWaalsContact O-N 3.08Å; S200-D203 VanDerWaalsContact O-CB 3.32Å; S200-D203 WeakPolarHBondContact O-CB 3.4Å; S200-D203 PolarHBondContact O-N 3.49Å; S200-D203 PolarHBondContact OG-N 3.27Å; S200-R209 PolarHBondContact O-NH2 3.17Å
201	T	82.6	Confident	88.8	Confident	83 Å²	83	52.2 Å²	52.2	51%	0.509	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-32	-177.9	56.7	0	0	0	0	114	L168 N199 R209	L168-T201 HydrophobicContact CD1-CG2 3.57Å; N199-T201 PolarHBondContact O-N 3.44Å; T201-R209 VanDerWaalsContact CA-CZ 3.47Å
202	L	84.3	Confident	87.1	Confident	148 Å²	148	55.7 Å²	55.7	78%	0.775	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	28.2	-178.9	-54.3	175.6	0	0	0	112.3	S200 P204	S200-L202 PolarHBondContact O-N 3.22Å; S200-L202 VanDerWaalsContact O-N 3.08Å; L202-P204 VanDerWaalsContact O-CD 3.26Å; L202-P204 WeakPolarHBondContact O-CD 3.45Å
203	D	85.6	Confident	84.8	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.032	29%	0.287	C	S	.	.			trans	-59.3	117.3	176.1	173.8	76.9	0	0	0	110.6	R171 T198 S200 H205 G206 H207	R171-D203 PolarHBondContact NH1-O 2.88Å; R171-D203 IonicContact NH1-OD2 3.54Å; R171-D203 PolarHBondContact NH1-OD2 2.92Å; R171-D203 PolarHBondContact NH2-O 3.33Å; T198-D203 HydrophobicContact CG2-CB 3.97Å; S200-D203 VanDerWaalsContact O-CB 3.32Å; S200-D203 WeakPolarHBondContact O-CB 3.4Å; S200-D203 PolarHBondContact O-N 3.49Å; S200-D203 PolarHBondContact OG-N 3.27Å; D203-H205 VanDerWaalsContact C-N 3.29Å; D203-H205 IonicContact OD1-CD2 2.93Å; D203-H205 PolarHBondContact OD2-N 3.43Å; D203-G206 PolarHBondContact OD2-N 3.42Å; D203-H207 IonicContact OD1-CE1 3.8Å; D203-H207 IonicContact OD1-CG 2.8Å; D203-H207 IonicContact OD1-ND1 2.97Å; D203-H207 PolarHBondContact OD1-ND1 3.32Å; D203-H207 WeakPolarHBondContact OD2-CB 3.32Å; D203-H207 IonicContact OD2-CG 4Å; D203-H207 PolarHBondContact OD2-N 3.15Å; D203-H207 IonicContact OD2-ND1 3.79Å; D203-H207 PolarHBondContact OD2-ND1 2.89Å
204	P	86.5	Confident	82.3	Confident	113 Å²	113	53.4 Å²	53.4	73%	0.734	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.4	-177.1	33.7	-35.4	0	0	0	112.6	L202	L202-P204 VanDerWaalsContact O-CD 3.26Å; L202-P204 WeakPolarHBondContact O-CD 3.45Å
205	H	87.3	Confident	79.6	Confident	141 Å²	141	51.5 Å²	51.5	65%	0.653	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.6	-173.7	-61.9	-67.6	0	0	0	113.9	D203 H207	D203-H205 VanDerWaalsContact C-N 3.29Å; D203-H205 IonicContact OD1-CD2 2.93Å; D203-H205 PolarHBondContact OD2-N 3.43Å; H205-H207 VanDerWaalsContact CB-CE1 3.44Å; H205-H207 WeakPolarHBondContact CB-CE1 3.5Å; H205-H207 AromaticContact CD2-CE1 3.96Å; H205-H207 AromaticContact CG-CE1 3.91Å; H205-H207 PolarHBondContact O-N 3.24Å
206	G	85.7	Confident	76.9	Confident	44 Å²	44	54.1 Å²	54.1	45%	0.454	29%	0.291	S	S	.	.			trans	67.8	23.3	-179.4	0	0	0	0	0	113.5	D203	D203-G206 PolarHBondContact OD2-N 3.42Å
207	H	91.4	Very high	74.7	Confident	27 Å²	27	53.8 Å²	53.8	13%	0.125	29%	0.288	C	S	.	.			trans	-60.3	149.2	175.3	-62.3	134.6	0	0	0	110.8	A116 R171 K196 T198 D203 H205 R209	A116-H207 PolarHBondContact O-CE1 3.29Å; A116-H207 VanDerWaalsContact O-CE1 3.29Å; R171-H207 WeakPolarHBondContact CD-O 3.26Å; K196-H207 HydrophobicContact CB-CB 4.4Å; K196-H207 WeakPolarHBondContact CD-NE2 3.5Å; T198-H207 HydrophobicContact CG2-CB 3.63Å; D203-H207 IonicContact OD1-CE1 3.8Å; D203-H207 IonicContact OD1-CG 2.8Å; D203-H207 IonicContact OD1-ND1 2.97Å; D203-H207 PolarHBondContact OD1-ND1 3.32Å; D203-H207 WeakPolarHBondContact OD2-CB 3.32Å; D203-H207 IonicContact OD2-CG 4Å; D203-H207 PolarHBondContact OD2-N 3.15Å; D203-H207 IonicContact OD2-ND1 3.79Å; D203-H207 PolarHBondContact OD2-ND1 2.89Å; H205-H207 VanDerWaalsContact CB-CE1 3.44Å; H205-H207 WeakPolarHBondContact CB-CE1 3.5Å; H205-H207 AromaticContact CD2-CE1 3.96Å; H205-H207 AromaticContact CG-CE1 3.91Å; H205-H207 PolarHBondContact O-N 3.24Å; H207-R209 PolarHBondContact O-N 2.93Å
208	V	89.1	Confident	72.1	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.012	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-66.4	126.4	-179.7	177.4	0	0	0	0	108.4	V143 V195 K196 L197 T198 P210	V143-V208 HydrophobicContact CB-CG1 4.27Å; V143-V208 HydrophobicContact CG2-CG1 3.97Å; V195-V208 HydrophobicContact CG1-CB 4.49Å; V195-V208 HydrophobicContact CG1-CG2 4.09Å; K196-V208 PolarHBondContact O-N 3.3Å; L197-V208 VanDerWaalsContact CA-O 3.31Å; L197-V208 WeakPolarHBondContact CA-O 3.46Å; L197-V208 HydrophobicContact CD2-CB 4.07Å; L197-V208 HydrophobicContact CD2-CG1 4.11Å; T198-V208 PolarHBondContact N-O 3.09Å; V208-P210 WeakPolarHBondContact O-CD 3.46Å
209	R	86.7	Confident	69.4	Low	31 Å²	31	56.5 Å²	56.5	12%	0.117	31%	0.311	C	S	.	.			trans	-98.5	110.6	165.6	170.4	-175.3	-78.7	103.3	47	106.9	S200 T201 H207 R211	S200-R209 PolarHBondContact O-NH2 3.17Å; T201-R209 VanDerWaalsContact CA-CZ 3.47Å; H207-R209 PolarHBondContact O-N 2.93Å; R209-R211 PolarHBondContact O-N 3.12Å
210	P	80.6	Confident	66.7	Low	6 Å²	6	55.5 Å²	55.5	4%	0.039	32%	0.32	C	S	.	.			trans	-56.1	131.5	167.3	-23.5	34.4	0	0	0	109.5	I113 V143 L197 V208 L212	I113-P210 HydrophobicContact CG2-CG 4.42Å; V143-P210 HydrophobicContact CG1-CB 3.85Å; V143-P210 HydrophobicContact CG1-CG 4.29Å; L197-P210 HydrophobicContact CB-CG 4.36Å; L197-P210 HydrophobicContact CD1-CG 4.31Å; L197-P210 HydrophobicContact CD2-CG 4.11Å; L197-P210 HydrophobicContact CG-CG 4.5Å; V208-P210 WeakPolarHBondContact O-CD 3.46Å; P210-L212 PolarHBondContact O-N 2.97Å; P210-L212 VanDerWaalsContact O-N 3.14Å
211	R	72.9	Confident	64.1	Low	53 Å²	53	59.9 Å²	59.9	20%	0.2	35%	0.349	C	S	.	.			trans	-68.2	114.9	170	-40.5	-171.5	-151	-163.9	-3.3	105.7	D142 P145 D170 R209 G213 L214	D142-R211 IonicContact OD1-NH2 3.48Å; D142-R211 IonicContact OD2-CZ 2.9Å; D142-R211 IonicContact OD2-NH2 3.14Å; D142-R211 PolarHBondContact OD2-NH2 2.85Å; P145-R211 HydrophobicContact CB-CB 4.34Å; P145-R211 HydrophobicContact CG-CB 3.92Å; D170-R211 WeakPolarHBondContact OD1-CD 3.2Å; D170-R211 IonicContact OD1-CZ 2.71Å; D170-R211 IonicContact OD1-NE 2.96Å; D170-R211 PolarHBondContact OD1-NE 3.01Å; D170-R211 VanDerWaalsContact OD1-NE 3.14Å; D170-R211 IonicContact OD1-NH1 3.02Å; D170-R211 PolarHBondContact OD1-NH1 2.8Å; D170-R211 IonicContact OD1-NH2 3.87Å; D170-R211 PolarHBondContact OD1-NH2 3.37Å; D170-R211 IonicContact OD2-CZ 3.22Å; D170-R211 IonicContact OD2-NE 2.84Å; D170-R211 IonicContact OD2-NH1 3.61Å; D170-R211 PolarHBondContact OD2-NH1 3.11Å; D170-R211 IonicContact OD2-NH2 3.46Å; D170-R211 PolarHBondContact OD2-NH2 3.15Å; R209-R211 PolarHBondContact O-N 3.12Å; R211-G213 PolarHBondContact O-N 2.8Å; R211-L214 PolarHBondContact O-N 2.99Å
212	L	61.2	Low	61.4	Low	89 Å²	89	67.1 Å²	67.1	47%	0.466	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	77.6	-175.9	-80.1	158.7	0	0	0	110.6	A164 P210 V218	A164-L212 WeakPolarHBondContact CB-O 3.36Å; P210-L212 PolarHBondContact O-N 2.97Å; P210-L212 VanDerWaalsContact O-N 3.14Å; L212-V218 HydrophobicContact CD2-CB 4.29Å
213	G	49.7	Very low	58.7	Low	3 Å²	3	69.3 Å²	69.3	3%	0.031	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153	19.4	159	0	0	0	0	0	108.8	P145 V146 D147 R211	P145-G213 CarbonylContact C-O 3.51Å; P145-G213 WeakPolarHBondContact CA-O 3.42Å; P145-G213 VanDerWaalsContact CB-CA 3.48Å; P145-G213 WeakPolarHBondContact CB-O 3.47Å; V146-G213 PolarHBondContact N-O 3.07Å; D147-G213 CarbonylContact C-O 3.38Å; D147-G213 PolarHBondContact N-O 3.01Å; D147-G213 CarbonylContact O-C 3.56Å; D147-G213 WeakPolarHBondContact O-CA 3.49Å; R211-G213 PolarHBondContact O-N 2.8Å
214	L	41.7	Very low	55.9	Low	43 Å²	43	72 Å²	72	23%	0.225	40%	0.4	C	S	.	.			trans	-79.9	123.4	177.5	-166.5	80.1	0	0	0	108	V143 I144 V146 R211 D216	V143-L214 HydrophobicContact CG1-CD1 4.35Å; V143-L214 HydrophobicContact CG1-CD2 3.56Å; I144-L214 WeakPolarHBondContact O-CD1 3.27Å; V146-L214 HydrophobicContact CG2-CD1 3.75Å; V146-L214 HydrophobicContact CG2-CG 4.27Å; R211-L214 PolarHBondContact O-N 2.99Å; L214-D216 HydrophobicContact CD2-CB 3.81Å; L214-D216 HydrophobicContact CG-CB 4.2Å; L214-D216 PolarHBondContact O-N 3Å
215	Q	36.9	Very low	53	Low	108 Å²	108	69.9 Å²	69.9	51%	0.505	40%	0.399	S	S	.	.	S	Bend	trans	-66.9	79.9	154.1	-154.5	150	101.4	0	0	107	V146 D147 Y151	V146-Q215 HydrophobicContact CB-CB 3.63Å; V146-Q215 HydrophobicContact CG1-CB 3.85Å; V146-Q215 HydrophobicContact CG2-CB 3.88Å; D147-Q215 PolarHBondContact OD2-NE2 3.21Å; Y151-Q215 PolarHBondContact OH-NE2 3.32Å
216	D	38.2	Very low	50.2	Low	55 Å²	55	73 Å²	73	29%	0.294	41%	0.414	S	S	.	.	S	Bend	trans	-164	80.8	151.4	-106.3	-4.4	0	0	0	104.3	L214 V218	L214-D216 HydrophobicContact CD2-CB 3.81Å; L214-D216 HydrophobicContact CG-CB 4.2Å; L214-D216 PolarHBondContact O-N 3Å; D216-V218 VanDerWaalsContact C-N 3.32Å; D216-V218 PolarHBondContact O-N 2.72Å
217	R	50.5	Low	47.6	Very low	66 Å²	66	78.1 Å²	78.1	25%	0.249	47%	0.467	C	S	.	.			trans	18.2	69.4	143.4	-55	174.6	167.9	-155.2	4.5	114.6	V107 G108 T109 E110 M111 W158 G219	V107-R217 VanDerWaalsContact O-CZ 3.28Å; V107-R217 PolarHBondContact O-NH1 2.9Å; V107-R217 PolarHBondContact O-NH2 3.38Å; G108-R217 VanDerWaalsContact CA-CZ 3.45Å; G108-R217 WeakPolarHBondContact O-CD 3.22Å; G108-R217 PolarHBondContact O-NH1 3.28Å; G108-R217 VanDerWaalsContact O-NH1 3.1Å; T109-R217 WeakPolarHBondContact O-CB 3.48Å; E110-R217 VanDerWaalsContact CA-O 3.32Å; E110-R217 WeakPolarHBondContact CA-O 3.07Å; E110-R217 HydrophobicContact CB-CB 4.15Å; E110-R217 WeakPolarHBondContact CB-O 3.33Å; E110-R217 HydrophobicContact CG-CB 3.65Å; E110-R217 HydrophobicContact CG-CG 4.37Å; E110-R217 IonicContact OE1-NH1 3.38Å; E110-R217 PolarHBondContact OE1-NH1 3.32Å; M111-R217 PolarHBondContact N-O 2.96Å; W158-R217 HydrophobicContact CD2-CG 4.1Å; W158-R217 HydrophobicContact CG-CG 4.08Å; W158-R217 HydrophobicContact CZ2-CB 3.84Å; W158-R217 HydrophobicContact CZ2-CG 4.22Å; R217-G219 PolarHBondContact O-N 2.69Å; R217-G219 VanDerWaalsContact O-N 3.09Å
218	V	38.2	Very low	45.4	Very low	34 Å²	34	80.7 Å²	80.7	21%	0.206	48%	0.484	C	S	.	.			trans	-83.4	83.7	161.4	178.6	0	0	0	0	106.5	I113 L212 D216 G220	I113-V218 HydrophobicContact CB-CG1 4.24Å; I113-V218 HydrophobicContact CD1-CG1 3.51Å; I113-V218 HydrophobicContact CG1-CG1 3.46Å; I113-V218 VanDerWaalsContact CG1-CG1 3.46Å; I113-V218 HydrophobicContact CG2-CG1 3.88Å; I113-V218 HydrophobicContact CG2-CG2 4.19Å; L212-V218 HydrophobicContact CD2-CB 4.29Å; D216-V218 VanDerWaalsContact C-N 3.32Å; D216-V218 PolarHBondContact O-N 2.72Å; V218-G220 VanDerWaalsContact C-N 3.29Å; V218-G220 PolarHBondContact O-N 2.96Å
219	G	33.2	Very low	43.1	Very low	29 Å²	29	84.8 Å²	84.8	30%	0.299	51%	0.509	S	S	.	.			trans	-61.7	93.5	163.4	0	0	0	0	0	109.7	R217 C221	R217-G219 PolarHBondContact O-N 2.69Å; R217-G219 VanDerWaalsContact O-N 3.09Å; G219-C221 PolarHBondContact O-N 3.15Å
220	G	32.6	Very low	40.6	Very low	63 Å²	63	87.8 Å²	87.8	65%	0.649	53%	0.53	S	S	*	.			trans	-63.1	79.5	148	0	0	0	0	0	108.3	V218 W222	V218-G220 VanDerWaalsContact C-N 3.29Å; V218-G220 PolarHBondContact O-N 2.96Å; G220-W222 PolarHBondContact O-N 3.33Å
221	C	30.9	Very low	38.3	Very low	113 Å²	113	92.6 Å²	92.6	76%	0.764	56%	0.559	S	S	*	*			trans	-68.8	82.8	161.5	-169.5	0	0	0	0	106.8	G219 K223	G219-C221 PolarHBondContact O-N 3.15Å; C221-K223 PolarHBondContact O-N 2.89Å
222	W	26.4	Very low	36.1	Very low	235 Å²	235	95.1 Å²	95.1	89%	0.89	58%	0.582	S	S	*	*			trans	-69	87.7	155.1	-90.1	71.6	0	0	0	106.4	G220 G224	G220-W222 PolarHBondContact O-N 3.33Å; W222-G224 PolarHBondContact O-N 2.68Å
223	K	27.2	Very low	34.5	Very low	194 Å²	194	95.5 Å²	95.5	84%	0.843	59%	0.589	S	S	*	*			trans	-68.5	87.6	146.1	-112.7	-161.3	177.3	-165	0	105.6	C221 G225	C221-K223 PolarHBondContact O-N 2.89Å; K223-G225 PolarHBondContact O-N 3.28Å; K223-G225 VanDerWaalsContact O-N 3.07Å
224	G	26.5	Very low	33.4	Very low	62 Å²	62	102.1 Å²	102.1	64%	0.639	63%	0.629	S	S	*	*			trans	-59.2	106.6	157	0	0	0	0	0	106.8	W222	W222-G224 PolarHBondContact O-N 2.68Å
225	G	26.1	Very low	32.7	Very low	69 Å²	69	106.7 Å²	106.7	71%	0.711	66%	0.66	S	S	*	*			trans	-74.4	132.6	168.5	0	0	0	0	0	109.8	K223	K223-G225 PolarHBondContact O-N 3.28Å; K223-G225 VanDerWaalsContact O-N 3.07Å
226	Q	28.6	Very low	32.4	Very low	207 Å²	207	106.6 Å²	106.6	97%	0.967	67%	0.673	S	S	*	*			trans	62.9	130.2	154.5	-67.4	180	31.7	0	0	119.5
227	G	30.2	Very low	31.8	Very low	152 Å²	152	111.3 Å²	111.3	100%	1.567	71%	0.708	S	S	*	*			trans	166.3	0	174.7	0	0	0	0	0	106.6

Retrieved 227 of 227 residues in 76.2 ms (Link to these results)

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