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E3 ubiquitin-protein ligase RING1

Constitutes one of the E3 ubiquitin-protein ligases that mediate monoubiquitination of 'Lys-119' of histone H2A, thereby playing a central role in histone code and gene regulation. H2A 'Lys-119' ubiquitination gives a specific tag for epigenetic transcriptional repression and participates in X chromosome inactivation of female mammals. Essential component of a Polycomb group (PcG) multiprotein PRC1-like complex, a complex class required to maintain the transcriptionally repressive state of many genes, including Hox genes, throughout development. PcG PRC1 complex acts via chromatin remodeling and modification of histones, rendering chromatin heritably changed in its expressibility. Compared to RNF2/RING2, it does not have the main E3 ubiquitin ligase activity on histone H2A, and it may rather act as a modulator of RNF2/RING2 activity.

AlphaFold DB , UniProt , Accession A0A2K6DS39, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene RING1, Length 406 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	34.8	Very low	49.2	Very low	244 Å²	244	120.6 Å²	120.6	100%	1.202	74%	0.743	S	S	*	*				0	99.9	0	-64.6	-174.1	-157	0	0	106.2	T3	M1-T3 PolarHBondContact O-N 3.11Å
2	T	34.6	Very low	52	Low	142 Å²	142	121.3 Å²	121.3	87%	0.871	73%	0.728	S	S	*	*			trans	-82.2	114.9	-175.4	-32.6	0	0	0	0	107.5
3	T	31.6	Very low	54.5	Low	126 Å²	126	117.8 Å²	117.8	77%	0.773	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-60.4	129.3	172.5	27	0	0	0	0	109.1	M1	M1-T3 PolarHBondContact O-N 3.11Å
4	P	45.4	Very low	56.9	Low	121 Å²	121	124.6 Å²	124.6	79%	0.786	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-68.7	145.2	175.8	28.4	-30.5	0	0	0	109.5	N6	P4-N6 PolarHBondContact O-N 3.25Å
5	A	41.9	Very low	59.1	Low	99 Å²	99	125.5 Å²	125.5	82%	0.818	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-47.5	131	-177.9	0	0	0	0	0	111.9	A7	A5-A7 PolarHBondContact O-N 3.15Å
6	N	44	Very low	61	Low	136 Å²	136	123.8 Å²	123.8	73%	0.727	70%	0.698	S	S	*	*			trans	-33.9	105.3	176.8	-165.7	18.7	0	0	0	112.3	P4 Q8	P4-N6 PolarHBondContact O-N 3.25Å; N6-Q8 PolarHBondContact O-N 3.17Å
7	A	51.7	Low	62.4	Low	96 Å²	96	117.3 Å²	117.3	79%	0.793	66%	0.662	S	S	*	*			trans	-64.9	89	160.5	0	0	0	0	0	106.3	A5 N9	A5-A7 PolarHBondContact O-N 3.15Å; A7-N9 PolarHBondContact O-N 3.47Å
8	Q	58.8	Low	63.7	Low	99 Å²	99	114.6 Å²	114.6	46%	0.463	65%	0.645	S	S	.	*			trans	-52.9	134.3	175.8	-69.1	-170.5	-20.3	0	0	108	N6 A10	N6-Q8 PolarHBondContact O-N 3.17Å; Q8-A10 PolarHBondContact O-N 2.93Å
9	N	64.6	Low	65	Low	116 Å²	116	112.7 Å²	112.7	62%	0.62	63%	0.628	S	S	*	*			trans	-47.8	131.7	175.5	-172.1	0.2	0	0	0	108.5	A7 S11 K12 T13	A7-N9 PolarHBondContact O-N 3.47Å; N9-S11 PolarHBondContact ND2-OG 2.98Å; N9-S11 PolarHBondContact O-N 2.85Å; N9-K12 WeakPolarHBondContact O-CA 3.11Å; N9-K12 WeakPolarHBondContact O-CB 3.28Å; N9-K12 PolarHBondContact O-N 3.05Å; N9-T13 PolarHBondContact O-N 2.92Å
10	A	62	Low	66.3	Low	68 Å²	68	110.8 Å²	110.8	56%	0.562	61%	0.614	S	S	*	*	H	α-helix	trans	-54.2	-30.8	-173.6	0	0	0	0	0	112.2	Q8 K12	Q8-A10 PolarHBondContact O-N 2.93Å; A10-K12 VanDerWaalsContact C-N 3.33Å; A10-K12 PolarHBondContact O-N 3.23Å
11	S	72	Confident	67.4	Low	80 Å²	80	110.5 Å²	110.5	56%	0.559	61%	0.61	S	S	*	*	H	α-helix	trans	-63.3	-34.9	174	62.8	0	0	0	0	113.6	N9 E15	N9-S11 PolarHBondContact ND2-OG 2.98Å; N9-S11 PolarHBondContact O-N 2.85Å; S11-E15 PolarHBondContact O-N 2.98Å
12	K	82.6	Confident	69.9	Low	129 Å²	129	103.5 Å²	103.5	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-78.9	-33	-178	-171.5	170.4	-176.1	172.6	0	112.5	N9 A10 W14 E15	N9-K12 WeakPolarHBondContact O-CA 3.11Å; N9-K12 WeakPolarHBondContact O-CB 3.28Å; N9-K12 PolarHBondContact O-N 3.05Å; A10-K12 VanDerWaalsContact C-N 3.33Å; A10-K12 PolarHBondContact O-N 3.23Å; K12-W14 VanDerWaalsContact C-N 3.27Å; K12-W14 PolarHBondContact O-N 3.16Å; K12-E15 PolarHBondContact O-N 3.27Å
13	T	84.9	Confident	72.5	Confident	76 Å²	76	104.4 Å²	104.4	47%	0.466	56%	0.562	S	S	.	*	H	α-helix	trans	-65.9	-30.7	178.7	-58.6	0	0	0	0	112.7	N9	N9-T13 PolarHBondContact O-N 2.92Å
14	W	88.3	Confident	75.2	Confident	212 Å²	212	102.7 Å²	102.7	80%	0.803	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	9.2	-179.2	-55.7	110.9	0	0	0	113.2	K12 L16	K12-W14 VanDerWaalsContact C-N 3.27Å; K12-W14 PolarHBondContact O-N 3.16Å; W14-L16 PolarHBondContact O-N 3.42Å
15	E	89.7	Confident	77.4	Confident	139 Å²	139	101.7 Å²	101.7	65%	0.65	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-72.5	120.7	174.5	-174.7	173.3	-163.7	0	0	109	S11 K12	S11-E15 PolarHBondContact O-N 2.98Å; K12-E15 PolarHBondContact O-N 3.27Å
16	L	88.7	Confident	79.6	Confident	98 Å²	98	104.9 Å²	104.9	51%	0.513	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-79.4	128.8	-179.9	-58.9	-177.8	0	0	0	110.1	W14 E20 L21	W14-L16 PolarHBondContact O-N 3.42Å; L16-E20 HydrophobicContact CB-CB 4.05Å; L16-E20 HydrophobicContact CD2-CB 4.15Å; L16-L21 HydrophobicContact CB-CD2 4.03Å; L16-L21 HydrophobicContact CB-CG 4Å; L16-L21 HydrophobicContact CD1-CD2 3.92Å
17	S	85.9	Confident	81.7	Confident	13 Å²	13	106 Å²	106	9%	0.091	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-61.2	162.8	167.2	60.8	0	0	0	0	111.5	Y19 E20 L21 E263	S17-Y19 PolarHBondContact O-N 3.02Å; S17-E20 WeakPolarHBondContact CB-OE2 3.42Å; S17-E20 PolarHBondContact N-OE2 3.04Å; S17-E20 PolarHBondContact O-N 2.98Å; S17-E20 VanDerWaalsContact O-N 3.08Å; S17-E20 WeakPolarHBondContact OG-CB 3.35Å; S17-E20 VanDerWaalsContact OG-CD 3.29Å; S17-E20 VanDerWaalsContact OG-CG 3.27Å; S17-E20 WeakPolarHBondContact OG-CG 3.47Å; S17-E20 PolarHBondContact OG-N 2.73Å; S17-E20 VanDerWaalsContact OG-N 3.13Å; S17-E20 PolarHBondContact OG-OE2 3.32Å; S17-L21 WeakPolarHBondContact O-CG 3.4Å; S17-L21 PolarHBondContact O-N 2.77Å; S17-E263 WeakPolarHBondContact CB-OE1 3.39Å
18	L	85.5	Confident	83.4	Confident	68 Å²	68	105.1 Å²	105.1	36%	0.356	54%	0.537	S	S	.	.	H	α-helix	trans	-59.2	-32.8	173.6	-67.6	-173.2	0	0	0	111.8	L21 H22 V265 Y283 P394	L18-L21 HydrophobicContact CD2-CD1 4.28Å; L18-H22 PolarHBondContact O-ND1 3.2Å; L18-V265 HydrophobicContact CD1-CG2 4.18Å; L18-Y283 HydrophobicContact CB-CD1 3.96Å; L18-Y283 HydrophobicContact CB-CE1 4.46Å; L18-P394 HydrophobicContact CD1-CB 4.35Å; L18-P394 HydrophobicContact CD1-CG 3.84Å; L18-P394 HydrophobicContact CG-CG 4.42Å
19	Y	88.6	Confident	84.9	Confident	79 Å²	79	106 Å²	106	31%	0.31	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-48.4	172.9	169.6	-106.1	0	0	0	111.6	S17 L21 H22 R23 Y283 K285	S17-Y19 PolarHBondContact O-N 3.02Å; Y19-L21 VanDerWaalsContact C-N 3.26Å; Y19-L21 PolarHBondContact O-N 3.14Å; Y19-H22 CarbonylContact O-C 3.6Å; Y19-H22 PolarHBondContact O-N 3.09Å; Y19-R23 HydrophobicContact CE1-CB 4.38Å; Y19-R23 HydrophobicContact CE2-CB 4.42Å; Y19-R23 PolarHBondContact O-N 3.35Å; Y19-Y283 WeakPolarHBondContact CD2-O 3.47Å; Y19-K285 HydrophobicContact CD1-CB 3.98Å; Y19-K285 HydrophobicContact CD2-CB 4.49Å; Y19-K285 HydrophobicContact CG-CB 3.91Å
20	E	90	Very high	86	Confident	75 Å²	75	108.9 Å²	108.9	35%	0.35	56%	0.555	S	S	.	*	H	α-helix	trans	-66.2	-27.3	-178.2	-72.5	161.1	136.3	0	0	113.5	L16 S17 H22 R23	L16-E20 HydrophobicContact CB-CB 4.05Å; L16-E20 HydrophobicContact CD2-CB 4.15Å; S17-E20 WeakPolarHBondContact CB-OE2 3.42Å; S17-E20 PolarHBondContact N-OE2 3.04Å; S17-E20 PolarHBondContact O-N 2.98Å; S17-E20 VanDerWaalsContact O-N 3.08Å; S17-E20 WeakPolarHBondContact OG-CB 3.35Å; S17-E20 VanDerWaalsContact OG-CD 3.29Å; S17-E20 VanDerWaalsContact OG-CG 3.27Å; S17-E20 WeakPolarHBondContact OG-CG 3.47Å; S17-E20 PolarHBondContact OG-N 2.73Å; S17-E20 VanDerWaalsContact OG-N 3.13Å; S17-E20 PolarHBondContact OG-OE2 3.32Å; E20-H22 PolarHBondContact O-N 3.26Å; E20-R23 WeakPolarHBondContact O-CG 3.35Å
21	L	89.5	Confident	87.1	Confident	104 Å²	104	110.8 Å²	110.8	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-68.6	-23.1	172.5	-71.8	169.8	0	0	0	113.2	L16 S17 L18 Y19	L16-L21 HydrophobicContact CB-CD2 4.03Å; L16-L21 HydrophobicContact CB-CG 4Å; L16-L21 HydrophobicContact CD1-CD2 3.92Å; S17-L21 WeakPolarHBondContact O-CG 3.4Å; S17-L21 PolarHBondContact O-N 2.77Å; L18-L21 HydrophobicContact CD2-CD1 4.28Å; Y19-L21 VanDerWaalsContact C-N 3.26Å; Y19-L21 PolarHBondContact O-N 3.14Å
22	H	88.2	Confident	87.7	Confident	98 Å²	98	110.9 Å²	110.9	45%	0.454	57%	0.569	S	S	.	*	H	α-helix	trans	-120.4	1.4	-174	-59.1	87.7	0	0	0	113.9	L18 Y19 E20 Y283	L18-H22 PolarHBondContact O-ND1 3.2Å; Y19-H22 CarbonylContact O-C 3.6Å; Y19-H22 PolarHBondContact O-N 3.09Å; E20-H22 PolarHBondContact O-N 3.26Å; H22-Y283 HydrophobicContact CB-CD2 3.56Å; H22-Y283 HydrophobicContact CB-CE2 4.18Å; H22-Y283 HydrophobicContact CB-CG 4.12Å; H22-Y283 AromaticContact CD2-CD2 3.78Å; H22-Y283 AromaticContact CD2-CE2 3.44Å; H22-Y283 VanDerWaalsContact CD2-CE2 3.44Å; H22-Y283 WeakPolarHBondContact CD2-CE2 3.49Å; H22-Y283 AromaticContact CE1-CE1 3.94Å; H22-Y283 AromaticContact CE1-CE2 3.74Å; H22-Y283 AromaticContact CE1-CZ 3.63Å; H22-Y283 AromaticContact CG-CD2 3.37Å; H22-Y283 AromaticContact CG-CE2 3.53Å; H22-Y283 AromaticContact CG-CG 3.96Å; H22-Y283 AromaticContact ND1-CD2 3.61Å; H22-Y283 AromaticContact ND1-CE2 3.71Å; H22-Y283 AromaticContact ND1-CG 3.78Å; H22-Y283 AromaticContact ND1-CZ 3.93Å; H22-Y283 AromaticContact NE2-CE2 3.58Å; H22-Y283 AromaticContact NE2-CZ 3.69Å
23	R	89.2	Confident	88	Confident	160 Å²	160	108.4 Å²	108.4	60%	0.604	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-64.1	140.1	179	66.6	-175	-102.3	-110.4	-3.1	110.8	Y19 E20	Y19-R23 HydrophobicContact CE1-CB 4.38Å; Y19-R23 HydrophobicContact CE2-CB 4.42Å; Y19-R23 PolarHBondContact O-N 3.35Å; E20-R23 WeakPolarHBondContact O-CG 3.35Å
24	T	88.3	Confident	87.9	Confident	91 Å²	91	113.7 Å²	113.7	56%	0.558	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-93.1	160.1	171	57.2	0	0	0	0	110.5
25	P	91.8	Very high	87.4	Confident	100 Å²	100	109.7 Å²	109.7	65%	0.649	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-52.4	143.4	169.3	-25.2	35.5	0	0	0	111.4
26	Q	87.9	Confident	86.8	Confident	166 Å²	166	108.1 Å²	108.1	78%	0.776	59%	0.589	S	S	*	*			trans	-85.8	115.7	167.6	-68.9	-67.6	-18.6	0	0	106.8
27	E	88.4	Confident	86	Confident	159 Å²	159	107 Å²	107	74%	0.743	59%	0.586	S	S	*	*			trans	-61.8	136.5	179.5	-63.9	-57.7	144	0	0	110.2
28	A	87.6	Confident	85.5	Confident	77 Å²	77	109 Å²	109	64%	0.636	60%	0.6	S	S	*	*			trans	-70.1	138	177.7	0	0	0	0	0	109.7	M30	A28-M30 HydrophobicContact CB-CG 4.37Å; A28-M30 PolarHBondContact O-N 3.05Å; A28-M30 VanDerWaalsContact O-N 3.16Å
29	I	88.6	Confident	84.7	Confident	117 Å²	117	109 Å²	109	60%	0.6	60%	0.604	S	S	*	*			trans	-70.8	110.8	170.9	-58.6	176.8	0	0	0	107	D31 T33	I29-D31 WeakPolarHBondContact CG2-OD1 3.41Å; I29-T33 HydrophobicContact CG2-CG2 4.48Å
30	M	88.7	Confident	83.8	Confident	178 Å²	178	115.5 Å²	115.5	88%	0.877	63%	0.628	S	S	*	*			trans	-113.6	-5.8	-178.2	-64.7	-173.7	67.5	0	0	113	A28	A28-M30 HydrophobicContact CB-CG 4.37Å; A28-M30 PolarHBondContact O-N 3.05Å; A28-M30 VanDerWaalsContact O-N 3.16Å
31	D	84.7	Confident	83.5	Confident	107 Å²	107	115.5 Å²	115.5	57%	0.572	64%	0.636	S	S	*	*	S	Bend	trans	-71.8	157.7	166.6	57.2	16.5	0	0	0	108.9	I29 T33	I29-D31 WeakPolarHBondContact CG2-OD1 3.41Å; D31-T33 PolarHBondContact O-N 3.48Å; D31-T33 VanDerWaalsContact OD1-CB 3.25Å; D31-T33 WeakPolarHBondContact OD1-CB 3.35Å; D31-T33 PolarHBondContact OD1-OG1 3.28Å; D31-T33 PolarHBondContact OD2-OG1 3.17Å
32	G	84.4	Confident	83.3	Confident	82 Å²	82	112.7 Å²	112.7	85%	0.845	62%	0.621	S	S	*	*			trans	-66.8	27.5	-178.6	0	0	0	0	0	114.4	E34	G32-E34 PolarHBondContact O-N 3.04Å; G32-E34 VanDerWaalsContact O-N 3.14Å
33	T	88.3	Confident	82.9	Confident	78 Å²	78	111.7 Å²	111.7	48%	0.479	62%	0.617	S	S	.	*			trans	-58.6	113.8	179.3	-65.7	0	0	0	0	110.2	I29 D31	I29-T33 HydrophobicContact CG2-CG2 4.48Å; D31-T33 PolarHBondContact O-N 3.48Å; D31-T33 VanDerWaalsContact OD1-CB 3.25Å; D31-T33 WeakPolarHBondContact OD1-CB 3.35Å; D31-T33 PolarHBondContact OD1-OG1 3.28Å; D31-T33 PolarHBondContact OD2-OG1 3.17Å
34	E	82.7	Confident	82.8	Confident	187 Å²	187	108.4 Å²	108.4	87%	0.874	62%	0.618	S	S	*	*			trans	-82	123.2	175.5	-64.7	-171.2	166.2	0	0	110.5	G32	G32-E34 PolarHBondContact O-N 3.04Å; G32-E34 VanDerWaalsContact O-N 3.14Å
35	I	79.2	Confident	82.9	Confident	128 Å²	128	108.9 Å²	108.9	66%	0.656	61%	0.614	S	S	*	*			trans	-98.8	104.5	175.5	-54.7	177.1	0	0	0	108.4	V37	I35-V37 HydrophobicContact CG2-CG2 3.83Å; I35-V37 PolarHBondContact O-N 3.41Å
36	A	76	Confident	83	Confident	106 Å²	106	104.6 Å²	104.6	88%	0.876	59%	0.586	S	S	*	*			trans	-79.6	108.8	172.2	0	0	0	0	0	110
37	V	73.3	Confident	83.3	Confident	75 Å²	75	98.7 Å²	98.7	46%	0.455	56%	0.559	S	S	.	*			trans	-105	127.6	172.6	-167.9	0	0	0	0	109.1	I35 P39 L42	I35-V37 HydrophobicContact CG2-CG2 3.83Å; I35-V37 PolarHBondContact O-N 3.41Å; V37-P39 WeakPolarHBondContact O-CD 3.38Å; V37-L42 HydrophobicContact CB-CD1 4.41Å; V37-L42 HydrophobicContact CG1-CD1 3.82Å; V37-L42 HydrophobicContact CG1-CD2 4.42Å; V37-L42 HydrophobicContact CG1-CG 3.84Å
38	S	75.6	Confident	83.7	Confident	54 Å²	54	91.1 Å²	91.1	38%	0.378	52%	0.523	S	S	.	.			trans	-60.5	129.5	172.8	167.6	0	0	0	0	109.4	R40 S41	S38-R40 PolarHBondContact O-N 3.02Å; S38-R40 PolarHBondContact OG-N 3.48Å; S38-S41 WeakPolarHBondContact O-CB 3.25Å; S38-S41 PolarHBondContact O-N 3.49Å
39	P	67.4	Low	84.1	Confident	69 Å²	69	90.7 Å²	90.7	45%	0.448	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.5	178.9	-27.5	35	0	0	0	114.6	V37 Y111 Y117	V37-P39 WeakPolarHBondContact O-CD 3.38Å; P39-Y111 WeakPolarHBondContact CA-OH 3.39Å; P39-Y111 HydrophobicContact CB-CE1 4.39Å; P39-Y111 PolarHBondContact O-OH 3.33Å; P39-Y117 HydrophobicContact CB-CE2 4.22Å
40	R	70.9	Confident	84.4	Confident	215 Å²	215	88.2 Å²	88.2	81%	0.811	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-26	174.9	-78.1	-177.6	-88.8	-92.8	1	113	S38 L42	S38-R40 PolarHBondContact O-N 3.02Å; S38-R40 PolarHBondContact OG-N 3.48Å; R40-L42 VanDerWaalsContact C-N 3.28Å; R40-L42 PolarHBondContact O-N 2.86Å
41	S	82.6	Confident	84.8	Confident	75 Å²	75	82.6 Å²	82.6	52%	0.524	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-15.5	-174.3	-61.3	0	0	0	0	113.9	S38	S38-S41 WeakPolarHBondContact O-CB 3.25Å; S38-S41 PolarHBondContact O-N 3.49Å
42	L	84.9	Confident	85.1	Confident	44 Å²	44	83.3 Å²	83.3	23%	0.23	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	5.4	-179.8	-61.2	178.6	0	0	0	113.1	V37 R40 E45 L46 I110	V37-L42 HydrophobicContact CB-CD1 4.41Å; V37-L42 HydrophobicContact CG1-CD1 3.82Å; V37-L42 HydrophobicContact CG1-CD2 4.42Å; V37-L42 HydrophobicContact CG1-CG 3.84Å; R40-L42 VanDerWaalsContact C-N 3.28Å; R40-L42 PolarHBondContact O-N 2.86Å; L42-E45 WeakPolarHBondContact CA-OE2 3.38Å; L42-E45 PolarHBondContact O-N 3.48Å; L42-L46 HydrophobicContact CB-CD1 3.85Å; L42-L46 HydrophobicContact CB-CG 4.26Å; L42-L46 HydrophobicContact CD1-CD1 4.41Å; L42-L46 WeakPolarHBondContact O-CB 3.41Å; L42-L46 WeakPolarHBondContact O-CG 3.28Å; L42-L46 PolarHBondContact O-N 2.69Å; L42-L46 VanDerWaalsContact O-N 3.17Å; L42-I110 HydrophobicContact CD1-CD1 4.15Å; L42-I110 HydrophobicContact CD1-CG2 3.99Å
43	H	81.1	Confident	85.5	Confident	78 Å²	78	81.6 Å²	81.6	36%	0.361	45%	0.453	S	S	.	.	H	α-helix	trans	-64	-46.4	-171.4	-171.3	62.2	0	0	0	111	E45 M47	H43-E45 VanDerWaalsContact C-N 3.28Å; H43-E45 PolarHBondContact O-N 3.05Å; H43-M47 PolarHBondContact CD2-SD 3.29Å; H43-M47 PolarHBondContact CE1-SD 2.87Å; H43-M47 PolarHBondContact ND1-SD 3.07Å; H43-M47 WeakPolarHBondContact NE2-CE 3.19Å; H43-M47 PolarHBondContact NE2-SD 2.73Å; H43-M47 WeakPolarHBondContact O-CB 3.4Å; H43-M47 WeakPolarHBondContact O-CG 3.34Å; H43-M47 PolarHBondContact O-N 3.03Å
44	S	85.8	Confident	85.6	Confident	91 Å²	91	78.3 Å²	78.3	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-64.6	-29.8	179	31.4	0	0	0	0	113.9
45	E	91.9	Very high	86.2	Confident	101 Å²	101	69.7 Å²	69.7	47%	0.472	39%	0.392	S	S	.	.	H	α-helix	trans	-84.8	-28.3	-173.4	-63.4	66.2	-141.8	0	0	112.1	L42 H43	L42-E45 WeakPolarHBondContact CA-OE2 3.38Å; L42-E45 PolarHBondContact O-N 3.48Å; H43-E45 VanDerWaalsContact C-N 3.28Å; H43-E45 PolarHBondContact O-N 3.05Å
46	L	92.7	Very high	86.9	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.052	38%	0.378	C	S	.	.	H	α-helix	trans	-105	-2.7	-174.4	-55.9	180	0	0	0	113.4	L42 M54 L55 F103 I107 I110 Y111	L42-L46 HydrophobicContact CB-CD1 3.85Å; L42-L46 HydrophobicContact CB-CG 4.26Å; L42-L46 HydrophobicContact CD1-CD1 4.41Å; L42-L46 WeakPolarHBondContact O-CB 3.41Å; L42-L46 WeakPolarHBondContact O-CG 3.28Å; L42-L46 PolarHBondContact O-N 2.69Å; L42-L46 VanDerWaalsContact O-N 3.17Å; L46-M54 CarbonylContact O-C 3.49Å; L46-M54 WeakPolarHBondContact O-CA 3.34Å; L46-L55 WeakPolarHBondContact O-CG 3.44Å; L46-L55 PolarHBondContact O-N 3.27Å; L46-F103 HydrophobicContact CD2-CE1 3.9Å; L46-F103 HydrophobicContact CD2-CZ 3.63Å; L46-I107 HydrophobicContact CD2-CG1 3.98Å; L46-I110 HydrophobicContact CD1-CD1 4.3Å; L46-Y111 HydrophobicContact CD1-CD2 4.3Å; L46-Y111 HydrophobicContact CD1-CE2 3.65Å
47	M	93.4	Very high	87.9	Confident	42 Å²	42	67.7 Å²	67.7	21%	0.207	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-88.9	144.6	178.8	-79.4	169.9	92	0	0	113.8	H43 P49 L52 D53	H43-M47 PolarHBondContact CD2-SD 3.29Å; H43-M47 PolarHBondContact CE1-SD 2.87Å; H43-M47 PolarHBondContact ND1-SD 3.07Å; H43-M47 WeakPolarHBondContact NE2-CE 3.19Å; H43-M47 PolarHBondContact NE2-SD 2.73Å; H43-M47 WeakPolarHBondContact O-CB 3.4Å; H43-M47 WeakPolarHBondContact O-CG 3.34Å; H43-M47 PolarHBondContact O-N 3.03Å; M47-P49 WeakPolarHBondContact O-CD 3.44Å; M47-L52 HydrophobicContact CE-CB 4.14Å; M47-L52 WeakPolarHBondContact CE-O 3.4Å; M47-D53 WeakPolarHBondContact CA-O 3.33Å
48	C	96.9	Very high	89.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.			trans	-77.7	123.8	167.7	-176.3	0	0	0	0	110.5	I50 C51 L52 D53 L55 C69	C48-I50 PolarHBondContact O-N 2.77Å; C48-C51 VanDerWaalsContact CB-SG 3.52Å; C48-L52 VanDerWaalsContact O-CA 3.3Å; C48-L52 WeakPolarHBondContact O-CA 3.23Å; C48-L52 PolarHBondContact O-N 2.47Å; C48-D53 WeakPolarHBondContact CB-O 3.2Å; C48-D53 PolarHBondContact N-O 3.33Å; C48-L55 HydrophobicContact CB-CD2 3.72Å; C48-L55 HydrophobicContact CB-CG 4.33Å; C48-C69 VanDerWaalsContact CB-SG 3.53Å; C48-C69 PolarHBondContact SG-N 3.43Å; C48-C69 VanDerWaalsContact SG-N 3.4Å
49	P	96.3	Very high	90.2	Very high	67 Å²	67	62.1 Å²	62.1	44%	0.435	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-7.9	178.4	-22.7	33.7	0	0	0	115.4	M47 R67 F68	M47-P49 WeakPolarHBondContact O-CD 3.44Å; P49-R67 WeakPolarHBondContact CD-O 3.49Å; P49-F68 HydrophobicContact CB-CE1 4.17Å; P49-F68 HydrophobicContact CG-CD1 4.34Å; P49-F68 HydrophobicContact CG-CE1 4Å
50	I	96.3	Very high	91.7	Very high	66 Å²	66	59.4 Å²	59.4	34%	0.338	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-54.7	-178	-60.7	166.7	0	0	0	110.6	C48 F68 C72 I73 A76 P85	C48-I50 PolarHBondContact O-N 2.77Å; I50-F68 HydrophobicContact CD1-CB 4.29Å; I50-F68 HydrophobicContact CD1-CD1 3.49Å; I50-F68 VanDerWaalsContact CD1-CD1 3.49Å; I50-F68 HydrophobicContact CD1-CE1 4.13Å; I50-F68 HydrophobicContact CD1-CG 4.09Å; I50-F68 HydrophobicContact CG1-CD1 3.77Å; I50-F68 HydrophobicContact CG1-CE1 4.16Å; I50-C72 HydrophobicContact CB-CB 3.89Å; I50-C72 HydrophobicContact CD1-CB 3.73Å; I50-C72 HydrophobicContact CG1-CB 4.42Å; I50-C72 HydrophobicContact CG2-CB 3.88Å; I50-I73 HydrophobicContact CD1-CD1 4.4Å; I50-A76 HydrophobicContact CD1-CB 4.25Å; I50-P85 HydrophobicContact CD1-CG 4.08Å; I50-P85 HydrophobicContact CG1-CB 4.31Å; I50-P85 HydrophobicContact CG1-CG 4.36Å
51	C	95.3	Very high	92.9	Very high	59 Å²	59	49.2 Å²	49.2	40%	0.399	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-8.3	-178.8	65.9	0	0	0	0	113.8	C48 D53	C48-C51 VanDerWaalsContact CB-SG 3.52Å; C51-D53 PolarHBondContact O-N 2.85Å; C51-D53 VanDerWaalsContact O-N 3.13Å
52	L	92.9	Very high	93.6	Very high	123 Å²	123	50.8 Å²	50.8	64%	0.644	27%	0.269	S	S	*	.	S	Bend	trans	57.3	24.7	-178.5	-47.6	179.7	0	0	0	113.5	M47 C48	M47-L52 HydrophobicContact CE-CB 4.14Å; M47-L52 WeakPolarHBondContact CE-O 3.4Å; C48-L52 VanDerWaalsContact O-CA 3.3Å; C48-L52 WeakPolarHBondContact O-CA 3.23Å; C48-L52 PolarHBondContact O-N 2.47Å
53	D	90.9	Very high	94.1	Very high	46 Å²	46	54.7 Å²	54.7	25%	0.246	29%	0.286	C	S	.	.	S	Bend	trans	-113.8	161.3	172.1	-177.8	9	0	0	0	107.8	M47 C48 C51 K56 R114	M47-D53 WeakPolarHBondContact CA-O 3.33Å; C48-D53 WeakPolarHBondContact CB-O 3.2Å; C48-D53 PolarHBondContact N-O 3.33Å; C51-D53 PolarHBondContact O-N 2.85Å; C51-D53 VanDerWaalsContact O-N 3.13Å; D53-K56 IonicContact OD2-NZ 3.71Å; D53-K56 PolarHBondContact OD2-NZ 2.8Å; D53-R114 IonicContact OD1-NH1 3.42Å; D53-R114 PolarHBondContact OD1-NH1 3.2Å; D53-R114 VanDerWaalsContact OD1-NH1 3.15Å; D53-R114 IonicContact OD2-NH1 2.79Å
54	M	91.1	Very high	94.9	Very high	9 Å²	9	52.2 Å²	52.2	4%	0.044	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-52.7	144	173	176.1	-164.8	-61.1	0	0	110.2	L46 I107 Y111 R114 Y117	L46-M54 CarbonylContact O-C 3.49Å; L46-M54 WeakPolarHBondContact O-CA 3.34Å; M54-I107 HydrophobicContact CG-CG2 4.09Å; M54-I107 HydrophobicContact SD-CG2 3.52Å; M54-I107 VanDerWaalsContact SD-CG2 3.52Å; M54-Y111 HydrophobicContact CE-CD1 4.36Å; M54-Y111 HydrophobicContact CE-CD2 3.45Å; M54-Y111 VanDerWaalsContact CE-CD2 3.45Å; M54-Y111 HydrophobicContact CE-CE2 3.73Å; M54-Y111 HydrophobicContact CE-CG 3.8Å; M54-Y111 HydrophobicContact SD-CD2 4.16Å; M54-R114 PolarHBondContact O-NH2 3.44Å; M54-R114 PolarHBondContact SD-NH2 3.25Å; M54-Y117 HydrophobicContact CE-CD1 3.67Å; M54-Y117 HydrophobicContact CE-CE1 3.58Å; M54-Y117 HydrophobicContact CE-CG 4.33Å
55	L	95.3	Very high	95.4	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.026	28%	0.275	C	S	.	.			trans	-60.2	141.1	-175.4	-72	157.4	0	0	0	112.4	L46 C48 T58 R67 F68 F103 I107 R114	L46-L55 WeakPolarHBondContact O-CG 3.44Å; L46-L55 PolarHBondContact O-N 3.27Å; C48-L55 HydrophobicContact CB-CD2 3.72Å; C48-L55 HydrophobicContact CB-CG 4.33Å; L55-T58 HydrophobicContact CD1-CG2 4.42Å; L55-R67 HydrophobicContact CD1-CB 3.83Å; L55-R67 HydrophobicContact CD2-CB 4.27Å; L55-F68 VanDerWaalsContact CD2-CA 3.43Å; L55-F103 HydrophobicContact CD1-CD1 4.2Å; L55-F103 HydrophobicContact CD1-CE1 3.58Å; L55-F103 HydrophobicContact CD1-CZ 4.5Å; L55-I107 HydrophobicContact CB-CD1 3.88Å; L55-R114 PolarHBondContact O-NH2 3.46Å
56	K	94.5	Very high	95.7	Very high	80 Å²	80	51.2 Å²	51.2	35%	0.348	27%	0.265	S	S	.	.	S	Bend	trans	-133.1	126.1	178.4	-67.4	172.3	178.6	160.3	0	108.9	D53 C69 S70 E118	D53-K56 IonicContact OD2-NZ 3.71Å; D53-K56 PolarHBondContact OD2-NZ 2.8Å; K56-C69 PolarHBondContact N-SG 2.95Å; K56-C69 WeakPolarHBondContact O-CA 3.47Å; K56-C69 WeakPolarHBondContact O-CB 3.15Å; K56-S70 PolarHBondContact O-N 2.93Å; K56-E118 IonicContact NZ-OE1 2.68Å; K56-E118 PolarHBondContact NZ-OE1 3.22Å
57	N	97.3	Very high	96	Very high	113 Å²	113	54.9 Å²	54.9	60%	0.604	28%	0.279	S	S	*	.	S	Bend	trans	48.8	64.7	-175.5	-56.5	102.8	0	0	0	110.6	M59 S70 D104	N57-M59 PolarHBondContact O-N 3.04Å; N57-S70 WeakPolarHBondContact O-CB 3.44Å; N57-S70 PolarHBondContact O-N 3.46Å; N57-S70 VanDerWaalsContact O-N 3.08Å; N57-D104 WeakPolarHBondContact CA-OD2 3.31Å
58	T	98.1	Very high	96.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	128.2	-165.3	-60	0	0	0	0	111.5	L55 R67 P99 D100 F103 D104	L55-T58 HydrophobicContact CD1-CG2 4.42Å; T58-R67 HydrophobicContact CG2-CB 3.92Å; T58-R67 HydrophobicContact CG2-CG 4.07Å; T58-P99 WeakPolarHBondContact O-CA 3.44Å; T58-D100 HydrophobicContact CG2-CB 4.1Å; T58-D100 PolarHBondContact O-N 2.73Å; T58-F103 HydrophobicContact CG2-CB 4.47Å; T58-F103 HydrophobicContact CG2-CD1 4.04Å; T58-D104 WeakPolarHBondContact CB-OD1 2.93Å; T58-D104 PolarHBondContact N-OD1 2.96Å; T58-D104 PolarHBondContact N-OD2 3.42Å; T58-D104 VanDerWaalsContact N-OD2 3.07Å; T58-D104 PolarHBondContact OG1-OD1 2.84Å
59	M	98.2	Very high	96.3	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.059	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.6	171.6	-67.4	-65.7	-70.6	0	0	109.7	N57 R67 F68 I73 L97 R98 P99	N57-M59 PolarHBondContact O-N 3.04Å; M59-R67 WeakPolarHBondContact O-CA 3.17Å; M59-F68 PolarHBondContact N-O 2.83Å; M59-F68 PolarHBondContact O-N 3.5Å; M59-I73 HydrophobicContact CB-CG2 3.77Å; M59-I73 HydrophobicContact CG-CG2 4.11Å; M59-L97 HydrophobicContact CE-CB 3.63Å; M59-L97 HydrophobicContact CE-CD1 4.18Å; M59-R98 CarbonylContact C-O 3.52Å; M59-R98 WeakPolarHBondContact CA-O 3.03Å; M59-P99 HydrophobicContact CE-CG 4.49Å; M59-P99 HydrophobicContact SD-CB 4.12Å; M59-P99 HydrophobicContact SD-CG 3.9Å
60	T	98.3	Very high	96.4	Very high	12 Å²	12	51.4 Å²	51.4	7%	0.074	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133.1	-176.9	-56.8	0	0	0	0	110.6	L65 H66 R67 L97 R98 D100	T60-L65 HydrophobicContact CG2-CB 4.31Å; T60-L65 HydrophobicContact CG2-CD2 4.04Å; T60-H66 WeakPolarHBondContact CA-O 3.44Å; T60-R67 HydrophobicContact CG2-CG 4.36Å; T60-L97 CarbonylContact O-C 3.5Å; T60-L97 WeakPolarHBondContact O-CA 3.44Å; T60-R98 PolarHBondContact N-O 3.15Å; T60-R98 PolarHBondContact O-N 3.12Å; T60-D100 WeakPolarHBondContact OG1-CB 3.34Å; T60-D100 PolarHBondContact OG1-OD2 3.02Å; T60-D100 VanDerWaalsContact OG1-OD2 3.11Å
61	T	98	Very high	96.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133	174	54.5	0	0	0	0	111	E63 C64 L65 H66 F68 L91 L97	T61-E63 VanDerWaalsContact C-N 3.33Å; T61-E63 PolarHBondContact O-N 2.94Å; T61-C64 PolarHBondContact OG1-SG 2.87Å; T61-L65 VanDerWaalsContact O-CA 3.27Å; T61-L65 WeakPolarHBondContact O-CA 3.45Å; T61-L65 PolarHBondContact O-N 3.44Å; T61-L65 PolarHBondContact OG1-N 3.48Å; T61-H66 PolarHBondContact N-O 3.34Å; T61-H66 PolarHBondContact OG1-N 3.45Å; T61-H66 PolarHBondContact OG1-O 3.08Å; T61-F68 HydrophobicContact CG2-CD2 4.4Å; T61-F68 HydrophobicContact CG2-CE2 3.87Å; T61-L91 HydrophobicContact CG2-CD1 3.72Å; T61-L91 HydrophobicContact CG2-CD2 3.86Å; T61-L91 HydrophobicContact CG2-CG 4.43Å; T61-L97 HydrophobicContact CG2-CD2 3.61Å
62	K	96.9	Very high	96.6	Very high	109 Å²	109	52.2 Å²	52.2	47%	0.474	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.6	-176.1	-70.5	175.5	178	174.2	0	114.1	R95 S96 R98	K62-R95 WeakPolarHBondContact CE-O 3.47Å; K62-R95 PolarHBondContact NZ-O 3.47Å; K62-S96 WeakPolarHBondContact CG-O 3.17Å; K62-S96 PolarHBondContact N-O 3.48Å; K62-R98 HydrophobicContact CD-CG 4.26Å; K62-R98 HydrophobicContact CG-CG 4.04Å
63	E	95.2	Very high	96.8	Very high	126 Å²	126	46.4 Å²	46.4	59%	0.589	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-22.3	-170.1	174.4	53.9	-144.9	0	0	113.5	T61 K89	T61-E63 VanDerWaalsContact C-N 3.33Å; T61-E63 PolarHBondContact O-N 2.94Å; E63-K89 HydrophobicContact CG-CD 3.59Å; E63-K89 PolarHBondContact O-NZ 2.91Å; E63-K89 IonicContact OE1-NZ 3.38Å; E63-K89 PolarHBondContact OE1-NZ 3.42Å
64	C	96.6	Very high	97	Very high	26 Å²	26	45.7 Å²	45.7	18%	0.176	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.4	0.9	-178.1	45.7	0	0	0	0	114.5	T61 H66 C87 K89	T61-C64 PolarHBondContact OG1-SG 2.87Å; C64-H66 PolarHBondContact O-N 3.4Å; C64-C87 PolarHBondContact SG-SG 2.97Å; C64-K89 HydrophobicContact CB-CD 3.92Å
65	L	97.3	Very high	97.3	Very high	112 Å²	112	48.6 Å²	48.6	59%	0.586	25%	0.248	S	C	*	.			trans	54.9	16.6	177	-55.5	179.7	0	0	0	115.5	T60 T61	T60-L65 HydrophobicContact CG2-CB 4.31Å; T60-L65 HydrophobicContact CG2-CD2 4.04Å; T61-L65 VanDerWaalsContact O-CA 3.27Å; T61-L65 WeakPolarHBondContact O-CA 3.45Å; T61-L65 PolarHBondContact O-N 3.44Å; T61-L65 PolarHBondContact OG1-N 3.48Å
66	H	97.9	Very high	97.3	Very high	59 Å²	59	49.9 Å²	49.9	27%	0.273	26%	0.259	S	S	.	.			trans	-67.5	140.1	168.4	-68.4	113.5	0	0	0	110.5	T60 T61 C64 F68 T86 C87	T60-H66 WeakPolarHBondContact CA-O 3.44Å; T61-H66 PolarHBondContact N-O 3.34Å; T61-H66 PolarHBondContact OG1-N 3.45Å; T61-H66 PolarHBondContact OG1-O 3.08Å; C64-H66 PolarHBondContact O-N 3.4Å; H66-F68 HydrophobicContact CB-CE2 3.75Å; H66-F68 HydrophobicContact CB-CZ 3.88Å; H66-T86 VanDerWaalsContact CD2-CG2 3.46Å; H66-T86 WeakPolarHBondContact CD2-CG2 3.47Å; H66-T86 WeakPolarHBondContact NE2-CG2 3.15Å; H66-C87 VanDerWaalsContact CE1-CB 3.45Å; H66-C87 WeakPolarHBondContact CE1-CB 3.49Å; H66-C87 PolarHBondContact CE1-SG 2.77Å; H66-C87 PolarHBondContact ND1-SG 2.91Å
67	R	98.4	Very high	97.3	Very high	87 Å²	87	46.7 Å²	46.7	33%	0.328	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.9	-173.6	-64.2	-173.8	174.1	85.1	-0.1	111.3	P49 L55 T58 M59 T60 D100	P49-R67 WeakPolarHBondContact CD-O 3.49Å; L55-R67 HydrophobicContact CD1-CB 3.83Å; L55-R67 HydrophobicContact CD2-CB 4.27Å; T58-R67 HydrophobicContact CG2-CB 3.92Å; T58-R67 HydrophobicContact CG2-CG 4.07Å; M59-R67 WeakPolarHBondContact O-CA 3.17Å; T60-R67 HydrophobicContact CG2-CG 4.36Å; R67-D100 IonicContact NE-OD2 2.83Å; R67-D100 PolarHBondContact NE-OD2 3.13Å; R67-D100 IonicContact NH2-OD2 2.91Å
68	F	98.4	Very high	97.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159	179.6	-54.2	-81.9	0	0	0	110.3	P49 I50 L55 M59 T61 H66 I73 P85 T86	P49-F68 HydrophobicContact CB-CE1 4.17Å; P49-F68 HydrophobicContact CG-CD1 4.34Å; P49-F68 HydrophobicContact CG-CE1 4Å; I50-F68 HydrophobicContact CD1-CB 4.29Å; I50-F68 HydrophobicContact CD1-CD1 3.49Å; I50-F68 VanDerWaalsContact CD1-CD1 3.49Å; I50-F68 HydrophobicContact CD1-CE1 4.13Å; I50-F68 HydrophobicContact CD1-CG 4.09Å; I50-F68 HydrophobicContact CG1-CD1 3.77Å; I50-F68 HydrophobicContact CG1-CE1 4.16Å; L55-F68 VanDerWaalsContact CD2-CA 3.43Å; M59-F68 PolarHBondContact N-O 2.83Å; M59-F68 PolarHBondContact O-N 3.5Å; T61-F68 HydrophobicContact CG2-CD2 4.4Å; T61-F68 HydrophobicContact CG2-CE2 3.87Å; H66-F68 HydrophobicContact CB-CE2 3.75Å; H66-F68 HydrophobicContact CB-CZ 3.88Å; F68-I73 HydrophobicContact CB-CB 3.7Å; F68-I73 HydrophobicContact CB-CG1 4.39Å; F68-I73 HydrophobicContact CB-CG2 4.21Å; F68-I73 HydrophobicContact CD2-CB 4.26Å; F68-I73 HydrophobicContact CD2-CD1 3.79Å; F68-I73 HydrophobicContact CD2-CG1 4Å; F68-I73 HydrophobicContact CE2-CD1 4.06Å; F68-I73 HydrophobicContact CG-CB 4.09Å; F68-I73 HydrophobicContact CG-CD1 4.06Å; F68-I73 HydrophobicContact CG-CG1 4.29Å; F68-P85 HydrophobicContact CE1-CB 3.94Å; F68-P85 HydrophobicContact CE1-CG 4.08Å; F68-P85 HydrophobicContact CZ-CB 4.2Å; F68-P85 HydrophobicContact CZ-CG 4.19Å; F68-T86 VanDerWaalsContact CZ-OG1 3.29Å; F68-T86 WeakPolarHBondContact CZ-OG1 3.26Å
69	C	98.5	Very high	96.7	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.054	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	145.6	166.1	-53.7	0	0	0	0	110	C48 K56 D71 C72 I73	C48-C69 VanDerWaalsContact CB-SG 3.53Å; C48-C69 PolarHBondContact SG-N 3.43Å; C48-C69 VanDerWaalsContact SG-N 3.4Å; K56-C69 PolarHBondContact N-SG 2.95Å; K56-C69 WeakPolarHBondContact O-CA 3.47Å; K56-C69 WeakPolarHBondContact O-CB 3.15Å; C69-D71 VanDerWaalsContact C-N 3.32Å; C69-D71 PolarHBondContact O-N 2.97Å; C69-C72 HydrophobicContact CB-CB 4.02Å; C69-C72 PolarHBondContact O-N 3.44Å; C69-I73 WeakPolarHBondContact O-CG2 3.49Å; C69-I73 PolarHBondContact O-N 3.43Å
70	S	98.1	Very high	96.1	Very high	27 Å²	27	55.8 Å²	55.8	19%	0.189	30%	0.298	C	S	.	.	H	α-helix	trans	-51.4	-50.8	178.7	170	0	0	0	0	112.4	K56 N57 C72 V74	K56-S70 PolarHBondContact O-N 2.93Å; N57-S70 WeakPolarHBondContact O-CB 3.44Å; N57-S70 PolarHBondContact O-N 3.46Å; N57-S70 VanDerWaalsContact O-N 3.08Å; S70-C72 PolarHBondContact O-N 3.17Å; S70-V74 VanDerWaalsContact O-CB 3.31Å; S70-V74 WeakPolarHBondContact O-CB 3.24Å; S70-V74 WeakPolarHBondContact O-CG2 3.32Å; S70-V74 PolarHBondContact O-N 3.01Å
71	D	97.9	Very high	95.7	Very high	117 Å²	117	60.8 Å²	60.8	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-68.9	-37.6	-176	-61.2	-23.1	0	0	0	111.8	C69 T75	C69-D71 VanDerWaalsContact C-N 3.32Å; C69-D71 PolarHBondContact O-N 2.97Å; D71-T75 WeakPolarHBondContact O-CB 3.46Å; D71-T75 PolarHBondContact O-N 3.4Å; D71-T75 PolarHBondContact O-OG1 3.28Å
72	C	98.1	Very high	95.5	Very high	26 Å²	26	65.8 Å²	65.8	18%	0.176	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-51.9	178	-64.1	0	0	0	0	111.7	I50 C69 S70 T75 A76	I50-C72 HydrophobicContact CB-CB 3.89Å; I50-C72 HydrophobicContact CD1-CB 3.73Å; I50-C72 HydrophobicContact CG1-CB 4.42Å; I50-C72 HydrophobicContact CG2-CB 3.88Å; C69-C72 HydrophobicContact CB-CB 4.02Å; C69-C72 PolarHBondContact O-N 3.44Å; S70-C72 PolarHBondContact O-N 3.17Å; C72-T75 PolarHBondContact O-N 3.41Å; C72-A76 WeakPolarHBondContact O-CB 3.43Å; C72-A76 PolarHBondContact O-N 3.33Å
73	I	97.7	Very high	95.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-72.5	-34	-177	-167.9	59.8	0	0	0	112.4	I50 M59 F68 C69 T75 A76 L77 P85 L91 L97	I50-I73 HydrophobicContact CD1-CD1 4.4Å; M59-I73 HydrophobicContact CB-CG2 3.77Å; M59-I73 HydrophobicContact CG-CG2 4.11Å; F68-I73 HydrophobicContact CB-CB 3.7Å; F68-I73 HydrophobicContact CB-CG1 4.39Å; F68-I73 HydrophobicContact CB-CG2 4.21Å; F68-I73 HydrophobicContact CD2-CB 4.26Å; F68-I73 HydrophobicContact CD2-CD1 3.79Å; F68-I73 HydrophobicContact CD2-CG1 4Å; F68-I73 HydrophobicContact CE2-CD1 4.06Å; F68-I73 HydrophobicContact CG-CB 4.09Å; F68-I73 HydrophobicContact CG-CD1 4.06Å; F68-I73 HydrophobicContact CG-CG1 4.29Å; C69-I73 WeakPolarHBondContact O-CG2 3.49Å; C69-I73 PolarHBondContact O-N 3.43Å; I73-T75 VanDerWaalsContact C-N 3.34Å; I73-A76 PolarHBondContact O-N 2.77Å; I73-L77 HydrophobicContact CG1-CD1 4.45Å; I73-L77 HydrophobicContact CG1-CG 4.49Å; I73-L77 WeakPolarHBondContact O-CB 2.95Å; I73-L77 WeakPolarHBondContact O-CG 3.32Å; I73-L77 PolarHBondContact O-N 3.3Å; I73-P85 HydrophobicContact CD1-CG 3.91Å; I73-L91 HydrophobicContact CD1-CD1 4.43Å; I73-L97 HydrophobicContact CB-CD1 4.37Å; I73-L97 HydrophobicContact CG1-CD1 3.7Å; I73-L97 HydrophobicContact CG1-CD2 4.1Å; I73-L97 HydrophobicContact CG2-CD1 3.69Å
74	V	95.9	Very high	95.6	Very high	32 Å²	32	57.4 Å²	57.4	19%	0.194	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-40.3	175.7	171.3	0	0	0	0	110.6	S70 L77 R78 K94	S70-V74 VanDerWaalsContact O-CB 3.31Å; S70-V74 WeakPolarHBondContact O-CB 3.24Å; S70-V74 WeakPolarHBondContact O-CG2 3.32Å; S70-V74 PolarHBondContact O-N 3.01Å; V74-L77 PolarHBondContact O-N 3.17Å; V74-R78 PolarHBondContact O-N 3.36Å; V74-K94 HydrophobicContact CG2-CD 4.26Å
75	T	96.1	Very high	95.6	Very high	69 Å²	69	58.9 Å²	58.9	42%	0.423	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-45.7	175.6	-58.7	0	0	0	0	111.2	D71 C72 I73 L77 R78 S79	D71-T75 WeakPolarHBondContact O-CB 3.46Å; D71-T75 PolarHBondContact O-N 3.4Å; D71-T75 PolarHBondContact O-OG1 3.28Å; C72-T75 PolarHBondContact O-N 3.41Å; I73-T75 VanDerWaalsContact C-N 3.34Å; T75-L77 VanDerWaalsContact C-N 3.32Å; T75-L77 PolarHBondContact O-N 3.05Å; T75-R78 WeakPolarHBondContact O-CB 3.36Å; T75-R78 PolarHBondContact O-N 2.75Å; T75-S79 PolarHBondContact O-N 3.42Å
76	A	95.5	Very high	95.5	Very high	32 Å²	32	56.6 Å²	56.6	26%	0.264	31%	0.308	S	S	.	.	H	α-helix	trans	-58.8	-42.3	175.8	0	0	0	0	0	112.1	I50 C72 I73 R78 G80 P85	I50-A76 HydrophobicContact CD1-CB 4.25Å; C72-A76 WeakPolarHBondContact O-CB 3.43Å; C72-A76 PolarHBondContact O-N 3.33Å; I73-A76 PolarHBondContact O-N 2.77Å; A76-R78 VanDerWaalsContact C-N 3.28Å; A76-R78 PolarHBondContact O-N 2.79Å; A76-G80 VanDerWaalsContact O-CA 3.25Å; A76-G80 WeakPolarHBondContact O-CA 3.25Å; A76-G80 PolarHBondContact O-N 3.45Å; A76-P85 HydrophobicContact CB-CG 4.39Å
77	L	95.2	Very high	95.5	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.068	31%	0.311	C	S	.	.	H	α-helix	trans	-71.1	-19.9	175.8	-72.7	179.9	0	0	0	113.5	I73 V74 T75 K82 L91 L97	I73-L77 HydrophobicContact CG1-CD1 4.45Å; I73-L77 HydrophobicContact CG1-CG 4.49Å; I73-L77 WeakPolarHBondContact O-CB 2.95Å; I73-L77 WeakPolarHBondContact O-CG 3.32Å; I73-L77 PolarHBondContact O-N 3.3Å; V74-L77 PolarHBondContact O-N 3.17Å; T75-L77 VanDerWaalsContact C-N 3.32Å; T75-L77 PolarHBondContact O-N 3.05Å; L77-K82 PolarHBondContact O-NZ 3.01Å; L77-L91 HydrophobicContact CD2-CB 3.89Å; L77-L91 HydrophobicContact CD2-CD1 4.32Å; L77-L97 HydrophobicContact CD1-CD1 3.78Å; L77-L97 HydrophobicContact CD1-CG 4.38Å
78	R	93.1	Very high	95.3	Very high	178 Å²	178	60.5 Å²	60.5	67%	0.672	33%	0.328	S	S	*	.	H	α-helix	trans	-79.8	-50.3	176.2	-170.8	-177.2	-60.8	134.6	1.7	110.9	V74 T75 A76	V74-R78 PolarHBondContact O-N 3.36Å; T75-R78 WeakPolarHBondContact O-CB 3.36Å; T75-R78 PolarHBondContact O-N 2.75Å; A76-R78 VanDerWaalsContact C-N 3.28Å; A76-R78 PolarHBondContact O-N 2.79Å
79	S	88.8	Confident	95.2	Very high	102 Å²	102	64.6 Å²	64.6	71%	0.713	35%	0.346	S	S	*	.	H	α-helix	trans	-93.4	-18.6	-171	-50.3	0	0	0	0	113.9	T75	T75-S79 PolarHBondContact O-N 3.42Å
80	G	86.5	Confident	95.1	Very high	37 Å²	37	71.9 Å²	71.9	38%	0.381	38%	0.376	S	S	.	.	S	Bend	trans	-113.3	-173.5	-172.7	0	0	0	0	0	114.7	A76	A76-G80 VanDerWaalsContact O-CA 3.25Å; A76-G80 WeakPolarHBondContact O-CA 3.25Å; A76-G80 PolarHBondContact O-N 3.45Å
81	N	88.6	Confident	95	Very high	117 Å²	117	70.6 Å²	70.6	63%	0.626	37%	0.368	S	S	*	.			trans	-62.4	145.9	173.6	-64.9	-19.5	0	0	0	110.4	E83	N81-E83 HydrophobicContact CB-CG 3.79Å; N81-E83 WeakPolarHBondContact CB-OE1 3.27Å; N81-E83 PolarHBondContact ND2-OE1 2.87Å; N81-E83 VanDerWaalsContact ND2-OE1 3.14Å; N81-E83 PolarHBondContact O-N 2.73Å
82	K	94.7	Very high	94.8	Very high	105 Å²	105	69.5 Å²	69.5	46%	0.457	37%	0.365	S	S	.	.	S	Bend	trans	-75	58.6	177.3	-58.1	-49.9	-173.4	-141.2	0	111.2	L77 L91	L77-K82 PolarHBondContact O-NZ 3.01Å; K82-L91 CarbonylContact C-O 3.55Å; K82-L91 WeakPolarHBondContact CA-O 3.09Å; K82-L91 VanDerWaalsContact CB-O 3.3Å; K82-L91 WeakPolarHBondContact CB-O 3.5Å; K82-L91 CarbonylContact O-C 3.49Å; K82-L91 PolarHBondContact O-N 2.95Å
83	E	96.4	Very high	94.5	Very high	58 Å²	58	70.7 Å²	70.7	27%	0.271	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-141	159.1	-175.8	71.5	-173.2	160.9	0	0	111.8	N81 P85 R88 K89	N81-E83 HydrophobicContact CB-CG 3.79Å; N81-E83 WeakPolarHBondContact CB-OE1 3.27Å; N81-E83 PolarHBondContact ND2-OE1 2.87Å; N81-E83 VanDerWaalsContact ND2-OE1 3.14Å; N81-E83 PolarHBondContact O-N 2.73Å; E83-P85 WeakPolarHBondContact O-CD 3.41Å; E83-R88 WeakPolarHBondContact OE2-CD 3.37Å; E83-K89 CarbonylContact C-O 3.46Å; E83-K89 WeakPolarHBondContact CA-O 3.21Å
84	C	97.4	Very high	94.3	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.4	C	S	.	.			trans	-70.7	125.7	176.3	176.6	0	0	0	0	110.4	T86 C87 R88 K89 L91	C84-T86 PolarHBondContact O-N 2.77Å; C84-T86 VanDerWaalsContact O-N 3.13Å; C84-C87 PolarHBondContact O-N 2.82Å; C84-R88 VanDerWaalsContact O-CA 3.28Å; C84-R88 WeakPolarHBondContact O-CA 3.47Å; C84-R88 PolarHBondContact O-N 2.87Å; C84-K89 PolarHBondContact N-O 3.16Å; C84-L91 VanDerWaalsContact CA-CD1 3.5Å; C84-L91 HydrophobicContact CB-CD1 3.89Å; C84-L91 HydrophobicContact CB-CG 4.13Å
85	P	96	Very high	94.3	Very high	57 Å²	57	84.8 Å²	84.8	37%	0.37	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.4	179.1	-29.5	37.5	0	0	0	114.6	I50 F68 I73 A76 E83	I50-P85 HydrophobicContact CD1-CG 4.08Å; I50-P85 HydrophobicContact CG1-CB 4.31Å; I50-P85 HydrophobicContact CG1-CG 4.36Å; F68-P85 HydrophobicContact CE1-CB 3.94Å; F68-P85 HydrophobicContact CE1-CG 4.08Å; F68-P85 HydrophobicContact CZ-CB 4.2Å; F68-P85 HydrophobicContact CZ-CG 4.19Å; I73-P85 HydrophobicContact CD1-CG 3.91Å; A76-P85 HydrophobicContact CB-CG 4.39Å; E83-P85 WeakPolarHBondContact O-CD 3.41Å
86	T	96.3	Very high	94.3	Very high	64 Å²	64	82.8 Å²	82.8	39%	0.393	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-46.2	-177.8	-47.9	0	0	0	0	113.2	H66 F68 C84	H66-T86 VanDerWaalsContact CD2-CG2 3.46Å; H66-T86 WeakPolarHBondContact CD2-CG2 3.47Å; H66-T86 WeakPolarHBondContact NE2-CG2 3.15Å; F68-T86 VanDerWaalsContact CZ-OG1 3.29Å; F68-T86 WeakPolarHBondContact CZ-OG1 3.26Å; C84-T86 PolarHBondContact O-N 2.77Å; C84-T86 VanDerWaalsContact O-N 3.13Å
87	C	96.9	Very high	94.4	Very high	49 Å²	49	81.6 Å²	81.6	33%	0.331	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	4.9	-170	66.8	0	0	0	0	115	C64 H66 C84 K89	C64-C87 PolarHBondContact SG-SG 2.97Å; H66-C87 VanDerWaalsContact CE1-CB 3.45Å; H66-C87 WeakPolarHBondContact CE1-CB 3.49Å; H66-C87 PolarHBondContact CE1-SG 2.77Å; H66-C87 PolarHBondContact ND1-SG 2.91Å; C84-C87 PolarHBondContact O-N 2.82Å; C87-K89 PolarHBondContact O-N 2.82Å
88	R	95.9	Very high	94.5	Very high	179 Å²	179	88.8 Å²	88.8	68%	0.675	43%	0.431	S	S	*	.			trans	60.8	6.3	178.6	-50.8	-84.5	-179.5	81.6	1.6	115.3	E83 C84	E83-R88 WeakPolarHBondContact OE2-CD 3.37Å; C84-R88 VanDerWaalsContact O-CA 3.28Å; C84-R88 WeakPolarHBondContact O-CA 3.47Å; C84-R88 PolarHBondContact O-N 2.87Å
89	K	95.9	Very high	94.8	Very high	86 Å²	86	85 Å²	85	37%	0.374	43%	0.429	S	S	.	.			trans	-60.2	142.6	171.3	-72.1	-160.7	-169	-177.5	0	110.6	E63 C64 E83 C84 C87 L91	E63-K89 HydrophobicContact CG-CD 3.59Å; E63-K89 PolarHBondContact O-NZ 2.91Å; E63-K89 IonicContact OE1-NZ 3.38Å; E63-K89 PolarHBondContact OE1-NZ 3.42Å; C64-K89 HydrophobicContact CB-CD 3.92Å; E83-K89 CarbonylContact C-O 3.46Å; E83-K89 WeakPolarHBondContact CA-O 3.21Å; C84-K89 PolarHBondContact N-O 3.16Å; C87-K89 PolarHBondContact O-N 2.82Å; K89-L91 PolarHBondContact O-N 3.46Å
90	K	96.3	Very high	95.2	Very high	161 Å²	161	81.5 Å²	81.5	70%	0.7	40%	0.403	S	S	*	.	B	Isolated β-bridge	trans	-62.5	128.4	-174.4	-169.4	174.7	-175.6	176.6	0	112.4	V92	K90-V92 HydrophobicContact CG-CG2 4.4Å
91	L	96.1	Very high	95.8	Very high	1 Å²	1	83.8 Å²	83.8	1%	0.005	41%	0.41	C	S	.	.			trans	-122.6	89.9	174.4	-65.3	-177	0	0	0	109.4	T61 I73 L77 K82 C84 K89 S93 L97	T61-L91 HydrophobicContact CG2-CD1 3.72Å; T61-L91 HydrophobicContact CG2-CD2 3.86Å; T61-L91 HydrophobicContact CG2-CG 4.43Å; I73-L91 HydrophobicContact CD1-CD1 4.43Å; L77-L91 HydrophobicContact CD2-CB 3.89Å; L77-L91 HydrophobicContact CD2-CD1 4.32Å; K82-L91 CarbonylContact C-O 3.55Å; K82-L91 WeakPolarHBondContact CA-O 3.09Å; K82-L91 VanDerWaalsContact CB-O 3.3Å; K82-L91 WeakPolarHBondContact CB-O 3.5Å; K82-L91 CarbonylContact O-C 3.49Å; K82-L91 PolarHBondContact O-N 2.95Å; C84-L91 VanDerWaalsContact CA-CD1 3.5Å; C84-L91 HydrophobicContact CB-CD1 3.89Å; C84-L91 HydrophobicContact CB-CG 4.13Å; K89-L91 PolarHBondContact O-N 3.46Å; L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 3.19Å; L91-L97 HydrophobicContact CD1-CD2 4.23Å
92	V	92.4	Very high	96.2	Very high	94 Å²	94	84.5 Å²	84.5	57%	0.57	41%	0.414	S	S	*	.			trans	-55.4	-40.7	-172.4	180	0	0	0	0	112.4	K90 S96	K90-V92 HydrophobicContact CG-CG2 4.4Å; V92-S96 PolarHBondContact N-OG 2.6Å
93	S	92.9	Very high	96.3	Very high	50 Å²	50	80.7 Å²	80.7	35%	0.35	40%	0.398	S	S	.	.	S	Bend	trans	-165.7	-173.3	177.7	65.7	0	0	0	0	111.2	L91 R95 S96	L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 3.19Å; S93-R95 PolarHBondContact O-N 2.72Å; S93-R95 WeakPolarHBondContact OG-CB 3.22Å; S93-R95 PolarHBondContact OG-N 2.57Å; S93-S96 VanDerWaalsContact O-CB 3.31Å; S93-S96 WeakPolarHBondContact O-CB 3.32Å; S93-S96 PolarHBondContact O-N 2.9Å; S93-S96 PolarHBondContact O-OG 3.45Å
94	K	93.7	Very high	96.2	Very high	129 Å²	129	79.9 Å²	79.9	56%	0.561	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-52.5	-25.8	170.6	-169.9	174.7	-179.4	177.1	0	113.1	V74 S96 L97	V74-K94 HydrophobicContact CG2-CD 4.26Å; K94-S96 PolarHBondContact O-N 2.94Å; K94-L97 WeakPolarHBondContact O-CB 3.49Å; K94-L97 PolarHBondContact O-N 3.14Å
95	R	95.2	Very high	96.1	Very high	199 Å²	199	82.4 Å²	82.4	75%	0.751	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-61.2	-25.5	173.9	171	179	-71.1	-80	-0.8	113.5	K62 S93 L97	K62-R95 WeakPolarHBondContact CE-O 3.47Å; K62-R95 PolarHBondContact NZ-O 3.47Å; S93-R95 PolarHBondContact O-N 2.72Å; S93-R95 WeakPolarHBondContact OG-CB 3.22Å; S93-R95 PolarHBondContact OG-N 2.57Å; R95-L97 PolarHBondContact O-N 2.86Å
96	S	96.3	Very high	96	Very high	27 Å²	27	83.8 Å²	83.8	19%	0.189	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-75.8	-3.1	176.6	-58.2	0	0	0	0	112.8	K62 V92 S93 K94	K62-S96 WeakPolarHBondContact CG-O 3.17Å; K62-S96 PolarHBondContact N-O 3.48Å; V92-S96 PolarHBondContact N-OG 2.6Å; S93-S96 VanDerWaalsContact O-CB 3.31Å; S93-S96 WeakPolarHBondContact O-CB 3.32Å; S93-S96 PolarHBondContact O-N 2.9Å; S93-S96 PolarHBondContact O-OG 3.45Å; K94-S96 PolarHBondContact O-N 2.94Å
97	L	97.6	Very high	95.8	Very high	8 Å²	8	81.2 Å²	81.2	4%	0.042	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	162.2	178.9	-50.2	174.4	0	0	0	111	M59 T60 T61 I73 L77 L91 K94 R95	M59-L97 HydrophobicContact CE-CB 3.63Å; M59-L97 HydrophobicContact CE-CD1 4.18Å; T60-L97 CarbonylContact O-C 3.5Å; T60-L97 WeakPolarHBondContact O-CA 3.44Å; T61-L97 HydrophobicContact CG2-CD2 3.61Å; I73-L97 HydrophobicContact CB-CD1 4.37Å; I73-L97 HydrophobicContact CG1-CD1 3.7Å; I73-L97 HydrophobicContact CG1-CD2 4.1Å; I73-L97 HydrophobicContact CG2-CD1 3.69Å; L77-L97 HydrophobicContact CD1-CD1 3.78Å; L77-L97 HydrophobicContact CD1-CG 4.38Å; L91-L97 HydrophobicContact CD1-CD2 4.23Å; K94-L97 WeakPolarHBondContact O-CB 3.49Å; K94-L97 PolarHBondContact O-N 3.14Å; R95-L97 PolarHBondContact O-N 2.86Å
98	R	97.9	Very high	95.5	Very high	164 Å²	164	82.3 Å²	82.3	62%	0.619	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	145.9	165.3	-64	-158.1	-74.1	156.7	-3.7	110.6	M59 T60 K62	M59-R98 CarbonylContact C-O 3.52Å; M59-R98 WeakPolarHBondContact CA-O 3.03Å; T60-R98 PolarHBondContact N-O 3.15Å; T60-R98 PolarHBondContact O-N 3.12Å; K62-R98 HydrophobicContact CD-CG 4.26Å; K62-R98 HydrophobicContact CG-CG 4.04Å
99	P	98.4	Very high	95.2	Very high	97 Å²	97	82.3 Å²	82.3	63%	0.63	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	146.7	164.1	-18.8	31.8	0	0	0	111.1	T58 M59	T58-P99 WeakPolarHBondContact O-CA 3.44Å; M59-P99 HydrophobicContact CE-CG 4.49Å; M59-P99 HydrophobicContact SD-CB 4.12Å; M59-P99 HydrophobicContact SD-CG 3.9Å
100	D	98.2	Very high	94.8	Very high	30 Å²	30	81.2 Å²	81.2	16%	0.16	42%	0.415	C	S	.	.			trans	-126.6	71.9	179.6	-164.3	-12.4	0	0	0	110.8	T58 T60 R67 N102 F103 D104	T58-D100 HydrophobicContact CG2-CB 4.1Å; T58-D100 PolarHBondContact O-N 2.73Å; T60-D100 WeakPolarHBondContact OG1-CB 3.34Å; T60-D100 PolarHBondContact OG1-OD2 3.02Å; T60-D100 VanDerWaalsContact OG1-OD2 3.11Å; R67-D100 IonicContact NE-OD2 2.83Å; R67-D100 PolarHBondContact NE-OD2 3.13Å; R67-D100 IonicContact NH2-OD2 2.91Å; D100-N102 PolarHBondContact O-N 3.04Å; D100-F103 HydrophobicContact CB-CB 4.19Å; D100-F103 PolarHBondContact O-N 3.36Å; D100-F103 VanDerWaalsContact O-N 3.14Å; D100-F103 PolarHBondContact OD1-N 2.95Å; D100-D104 PolarHBondContact O-N 3.31Å
101	P	97.8	Very high	94.3	Very high	84 Å²	84	74.9 Å²	74.9	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-23.6	-176.2	27.9	-35.7	0	0	0	112.9	F103 D104 A105	P101-F103 VanDerWaalsContact C-N 3.32Å; P101-D104 PolarHBondContact O-N 3.08Å; P101-A105 WeakPolarHBondContact O-CB 3.27Å; P101-A105 PolarHBondContact O-N 3.23Å
102	N	97.7	Very high	93.6	Very high	132 Å²	132	80.1 Å²	80.1	71%	0.706	42%	0.42	S	S	*	.	H	α-helix	trans	-66.8	-38.5	175.2	-68.6	-10.4	0	0	0	110.7	D100 A105 L106	D100-N102 PolarHBondContact O-N 3.04Å; N102-A105 PolarHBondContact O-N 3.41Å; N102-L106 PolarHBondContact O-N 2.96Å
103	F	96.9	Very high	93.1	Very high	26 Å²	26	77.8 Å²	77.8	11%	0.114	41%	0.409	C	S	.	.	H	α-helix	trans	-70.6	-39.3	176.3	-158.7	-97.8	0	0	0	111.9	L46 L55 T58 D100 P101 A105 L106 I107	L46-F103 HydrophobicContact CD2-CE1 3.9Å; L46-F103 HydrophobicContact CD2-CZ 3.63Å; L55-F103 HydrophobicContact CD1-CD1 4.2Å; L55-F103 HydrophobicContact CD1-CE1 3.58Å; L55-F103 HydrophobicContact CD1-CZ 4.5Å; T58-F103 HydrophobicContact CG2-CB 4.47Å; T58-F103 HydrophobicContact CG2-CD1 4.04Å; D100-F103 HydrophobicContact CB-CB 4.19Å; D100-F103 PolarHBondContact O-N 3.36Å; D100-F103 VanDerWaalsContact O-N 3.14Å; D100-F103 PolarHBondContact OD1-N 2.95Å; P101-F103 VanDerWaalsContact C-N 3.32Å; F103-A105 VanDerWaalsContact C-N 3.33Å; F103-A105 PolarHBondContact O-N 3.21Å; F103-L106 HydrophobicContact CD2-CD2 4.45Å; F103-L106 HydrophobicContact CE2-CD2 4.46Å; F103-L106 WeakPolarHBondContact O-CB 3.4Å; F103-L106 PolarHBondContact O-N 3.31Å; F103-I107 HydrophobicContact CD1-CD1 3.72Å; F103-I107 HydrophobicContact CD1-CG1 4.26Å; F103-I107 HydrophobicContact CE1-CD1 3.79Å; F103-I107 HydrophobicContact CE1-CG1 4.22Å; F103-I107 WeakPolarHBondContact O-CG1 3.1Å; F103-I107 PolarHBondContact O-N 2.85Å
104	D	95.3	Very high	92.2	Very high	40 Å²	40	78 Å²	78	21%	0.214	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-43.8	172.5	-69.6	-28.2	0	0	0	111.1	N57 T58 D100 P101 L106 I107 S108	N57-D104 WeakPolarHBondContact CA-OD2 3.31Å; T58-D104 WeakPolarHBondContact CB-OD1 2.93Å; T58-D104 PolarHBondContact N-OD1 2.96Å; T58-D104 PolarHBondContact N-OD2 3.42Å; T58-D104 VanDerWaalsContact N-OD2 3.07Å; T58-D104 PolarHBondContact OG1-OD1 2.84Å; D100-D104 PolarHBondContact O-N 3.31Å; P101-D104 PolarHBondContact O-N 3.08Å; D104-L106 VanDerWaalsContact C-N 3.33Å; D104-L106 PolarHBondContact O-N 2.88Å; D104-I107 WeakPolarHBondContact O-CB 3.38Å; D104-I107 PolarHBondContact O-N 2.82Å; D104-S108 PolarHBondContact O-N 2.96Å; D104-S108 PolarHBondContact O-OG 2.92Å
105	A	95.1	Very high	91.4	Very high	54 Å²	54	79.7 Å²	79.7	45%	0.446	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-38.2	176.1	0	0	0	0	0	112.5	P101 N102 F103 S108 K109	P101-A105 WeakPolarHBondContact O-CB 3.27Å; P101-A105 PolarHBondContact O-N 3.23Å; N102-A105 PolarHBondContact O-N 3.41Å; F103-A105 VanDerWaalsContact C-N 3.33Å; F103-A105 PolarHBondContact O-N 3.21Å; A105-S108 PolarHBondContact O-N 3.14Å; A105-K109 WeakPolarHBondContact O-CG 2.85Å; A105-K109 PolarHBondContact O-N 2.69Å
106	L	92.6	Very high	90.6	Very high	85 Å²	85	76.7 Å²	76.7	45%	0.445	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-46	173.8	177.9	63.1	0	0	0	111.2	N102 F103 D104 S108 K109 I110	N102-L106 PolarHBondContact O-N 2.96Å; F103-L106 HydrophobicContact CD2-CD2 4.45Å; F103-L106 HydrophobicContact CE2-CD2 4.46Å; F103-L106 WeakPolarHBondContact O-CB 3.4Å; F103-L106 PolarHBondContact O-N 3.31Å; D104-L106 VanDerWaalsContact C-N 3.33Å; D104-L106 PolarHBondContact O-N 2.88Å; L106-S108 VanDerWaalsContact C-N 3.31Å; L106-S108 PolarHBondContact O-N 3.27Å; L106-K109 PolarHBondContact O-N 2.76Å; L106-K109 VanDerWaalsContact O-N 3.11Å; L106-I110 HydrophobicContact CD1-CD1 3.91Å; L106-I110 HydrophobicContact CD1-CG1 4.32Å; L106-I110 HydrophobicContact CG-CD1 3.87Å; L106-I110 WeakPolarHBondContact O-CG1 3.47Å; L106-I110 PolarHBondContact O-N 3.47Å
107	I	91.7	Very high	89.6	Confident	10 Å²	10	77.1 Å²	77.1	5%	0.051	40%	0.404	C	S	.	.	H	α-helix	trans	-57.3	-46.2	175.1	-69.6	166.6	0	0	0	110.3	L46 M54 L55 F103 D104 K109 I110 Y111	L46-I107 HydrophobicContact CD2-CG1 3.98Å; M54-I107 HydrophobicContact CG-CG2 4.09Å; M54-I107 HydrophobicContact SD-CG2 3.52Å; M54-I107 VanDerWaalsContact SD-CG2 3.52Å; L55-I107 HydrophobicContact CB-CD1 3.88Å; F103-I107 HydrophobicContact CD1-CD1 3.72Å; F103-I107 HydrophobicContact CD1-CG1 4.26Å; F103-I107 HydrophobicContact CE1-CD1 3.79Å; F103-I107 HydrophobicContact CE1-CG1 4.22Å; F103-I107 WeakPolarHBondContact O-CG1 3.1Å; F103-I107 PolarHBondContact O-N 2.85Å; D104-I107 WeakPolarHBondContact O-CB 3.38Å; D104-I107 PolarHBondContact O-N 2.82Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 3.45Å; I107-I110 PolarHBondContact O-N 2.95Å; I107-Y111 PolarHBondContact O-N 3.4Å
108	S	90.9	Very high	88.6	Confident	73 Å²	73	79.4 Å²	79.4	51%	0.51	41%	0.414	S	S	.	.	H	α-helix	trans	-65.2	-26.2	178.1	-61	0	0	0	0	113.8	D104 A105 L106 Y111 P112	D104-S108 PolarHBondContact O-N 2.96Å; D104-S108 PolarHBondContact O-OG 2.92Å; A105-S108 PolarHBondContact O-N 3.14Å; L106-S108 VanDerWaalsContact C-N 3.31Å; L106-S108 PolarHBondContact O-N 3.27Å; S108-Y111 CarbonylContact O-C 3.56Å; S108-P112 WeakPolarHBondContact O-CA 3.46Å
109	K	89.4	Confident	87.8	Confident	179 Å²	179	73.5 Å²	73.5	78%	0.778	40%	0.401	S	S	*	.	H	α-helix	trans	-76.9	-35.9	174	-72.2	-66.3	-175.2	180	0	112.4	A105 L106 I107	A105-K109 WeakPolarHBondContact O-CG 2.85Å; A105-K109 PolarHBondContact O-N 2.69Å; L106-K109 PolarHBondContact O-N 2.76Å; L106-K109 VanDerWaalsContact O-N 3.11Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 3.45Å
110	I	87.6	Confident	87	Confident	62 Å²	62	74.8 Å²	74.8	32%	0.318	40%	0.398	S	S	.	.	H	α-helix	trans	-77.1	-39.3	178.3	-61.5	166.4	0	0	0	110.7	L42 L46 L106 I107	L42-I110 HydrophobicContact CD1-CD1 4.15Å; L42-I110 HydrophobicContact CD1-CG2 3.99Å; L46-I110 HydrophobicContact CD1-CD1 4.3Å; L106-I110 HydrophobicContact CD1-CD1 3.91Å; L106-I110 HydrophobicContact CD1-CG1 4.32Å; L106-I110 HydrophobicContact CG-CD1 3.87Å; L106-I110 WeakPolarHBondContact O-CG1 3.47Å; L106-I110 PolarHBondContact O-N 3.47Å; I107-I110 PolarHBondContact O-N 2.95Å
111	Y	86.3	Confident	85.9	Confident	28 Å²	28	76.7 Å²	76.7	11%	0.11	41%	0.406	C	S	.	.			trans	-125.5	82.1	178.1	-60.2	-75.7	0	0	0	110.1	P39 L46 M54 I107 S108 S113 Y117	P39-Y111 WeakPolarHBondContact CA-OH 3.39Å; P39-Y111 HydrophobicContact CB-CE1 4.39Å; P39-Y111 PolarHBondContact O-OH 3.33Å; L46-Y111 HydrophobicContact CD1-CD2 4.3Å; L46-Y111 HydrophobicContact CD1-CE2 3.65Å; M54-Y111 HydrophobicContact CE-CD1 4.36Å; M54-Y111 HydrophobicContact CE-CD2 3.45Å; M54-Y111 VanDerWaalsContact CE-CD2 3.45Å; M54-Y111 HydrophobicContact CE-CE2 3.73Å; M54-Y111 HydrophobicContact CE-CG 3.8Å; M54-Y111 HydrophobicContact SD-CD2 4.16Å; I107-Y111 PolarHBondContact O-N 3.4Å; S108-Y111 CarbonylContact O-C 3.56Å; Y111-S113 VanDerWaalsContact C-N 3.25Å; Y111-S113 PolarHBondContact O-N 3.36Å; Y111-Y117 AromaticContact CD1-CD2 3.72Å; Y111-Y117 HydrophobicContact CD1-CD2 3.72Å; Y111-Y117 HydrophobicContact CD1-CE2 4.11Å; Y111-Y117 HydrophobicContact CD1-CG 4.15Å; Y111-Y117 AromaticContact CE1-CD2 3.61Å; Y111-Y117 HydrophobicContact CE1-CD2 3.61Å; Y111-Y117 AromaticContact CE1-CE2 3.53Å; Y111-Y117 HydrophobicContact CE1-CE2 3.53Å; Y111-Y117 HydrophobicContact CE1-CG 4.4Å
112	P	81.8	Confident	85.1	Confident	111 Å²	111	77.2 Å²	77.2	72%	0.721	40%	0.404	S	S	*	.	S	Bend	trans	-58.2	-35.6	-179.5	-25.7	35.4	0	0	0	113.7	S108	S108-P112 WeakPolarHBondContact O-CA 3.46Å
113	S	81.6	Confident	84.5	Confident	46 Å²	46	79.9 Å²	79.9	32%	0.322	40%	0.404	S	S	.	.			trans	-116.6	92.1	178.3	50.5	0	0	0	0	110.7	Y111 E115 E116 Y117	Y111-S113 VanDerWaalsContact C-N 3.25Å; Y111-S113 PolarHBondContact O-N 3.36Å; S113-E115 VanDerWaalsContact C-N 3.31Å; S113-E115 PolarHBondContact O-N 3.48Å; S113-E116 VanDerWaalsContact CB-OE2 3.32Å; S113-E116 WeakPolarHBondContact CB-OE2 3.35Å; S113-E116 PolarHBondContact O-N 2.91Å; S113-E116 PolarHBondContact OG-OE2 3.02Å; S113-Y117 PolarHBondContact O-N 3.28Å
114	R	73.8	Confident	83.8	Confident	53 Å²	53	82.3 Å²	82.3	20%	0.2	42%	0.421	C	S	.	.	H	α-helix	trans	-60.6	-41.1	175.5	172.4	175	-96.3	-92.7	17.3	112.3	D53 M54 L55 E116 Y117 E118	D53-R114 IonicContact OD1-NH1 3.42Å; D53-R114 PolarHBondContact OD1-NH1 3.2Å; D53-R114 VanDerWaalsContact OD1-NH1 3.15Å; D53-R114 IonicContact OD2-NH1 2.79Å; M54-R114 PolarHBondContact O-NH2 3.44Å; M54-R114 PolarHBondContact SD-NH2 3.25Å; L55-R114 PolarHBondContact O-NH2 3.46Å; R114-E116 VanDerWaalsContact C-N 3.29Å; R114-E116 PolarHBondContact O-N 3.45Å; R114-Y117 WeakPolarHBondContact O-CB 3.5Å; R114-Y117 PolarHBondContact O-N 2.93Å; R114-Y117 VanDerWaalsContact O-N 3.11Å; R114-E118 WeakPolarHBondContact CD-OE1 3.45Å; R114-E118 HydrophobicContact CG-CG 4.07Å; R114-E118 WeakPolarHBondContact CG-OE1 3.45Å; R114-E118 IonicContact CZ-OE1 3.6Å; R114-E118 IonicContact NE-OE1 2.73Å; R114-E118 IonicContact NH1-OE1 3.63Å; R114-E118 PolarHBondContact NH1-OE1 2.98Å; R114-E118 PolarHBondContact O-N 2.84Å
115	E	76.6	Confident	83.1	Confident	165 Å²	165	85.8 Å²	85.8	77%	0.771	44%	0.439	S	S	*	.	H	α-helix	trans	-62.6	-38.4	-177.7	-170.6	171.6	-169.3	0	0	111.6	S113 A119	S113-E115 VanDerWaalsContact C-N 3.31Å; S113-E115 PolarHBondContact O-N 3.48Å; E115-A119 WeakPolarHBondContact O-CB 3.25Å; E115-A119 PolarHBondContact O-N 2.81Å
116	E	79.1	Confident	82.5	Confident	136 Å²	136	87.2 Å²	87.2	64%	0.636	44%	0.438	S	S	*	.	H	α-helix	trans	-68.1	-37.3	174.4	-65.5	-179.3	164.6	0	0	111.8	S113 R114 H120	S113-E116 VanDerWaalsContact CB-OE2 3.32Å; S113-E116 WeakPolarHBondContact CB-OE2 3.35Å; S113-E116 PolarHBondContact O-N 2.91Å; S113-E116 PolarHBondContact OG-OE2 3.02Å; R114-E116 VanDerWaalsContact C-N 3.29Å; R114-E116 PolarHBondContact O-N 3.45Å; E116-H120 VanDerWaalsContact O-CB 3.23Å; E116-H120 WeakPolarHBondContact O-CB 3.38Å; E116-H120 PolarHBondContact O-N 3.03Å
117	Y	75.5	Confident	81.8	Confident	37 Å²	37	92.1 Å²	92.1	15%	0.145	45%	0.451	C	S	.	.	H	α-helix	trans	-65.5	-49.6	175.5	-178.7	-97.6	0	0	0	112.1	P39 M54 Y111 S113 R114 H120 Q121	P39-Y117 HydrophobicContact CB-CE2 4.22Å; M54-Y117 HydrophobicContact CE-CD1 3.67Å; M54-Y117 HydrophobicContact CE-CE1 3.58Å; M54-Y117 HydrophobicContact CE-CG 4.33Å; Y111-Y117 AromaticContact CD1-CD2 3.72Å; Y111-Y117 HydrophobicContact CD1-CD2 3.72Å; Y111-Y117 HydrophobicContact CD1-CE2 4.11Å; Y111-Y117 HydrophobicContact CD1-CG 4.15Å; Y111-Y117 AromaticContact CE1-CD2 3.61Å; Y111-Y117 HydrophobicContact CE1-CD2 3.61Å; Y111-Y117 AromaticContact CE1-CE2 3.53Å; Y111-Y117 HydrophobicContact CE1-CE2 3.53Å; Y111-Y117 HydrophobicContact CE1-CG 4.4Å; S113-Y117 PolarHBondContact O-N 3.28Å; R114-Y117 WeakPolarHBondContact O-CB 3.5Å; R114-Y117 PolarHBondContact O-N 2.93Å; R114-Y117 VanDerWaalsContact O-N 3.11Å; Y117-H120 WeakPolarHBondContact O-CB 3.29Å; Y117-H120 PolarHBondContact O-N 3.33Å; Y117-Q121 HydrophobicContact CD1-CG 4.38Å; Y117-Q121 HydrophobicContact CE1-CG 4Å; Y117-Q121 WeakPolarHBondContact O-CG 3.38Å; Y117-Q121 PolarHBondContact O-N 3.11Å; Y117-Q121 PolarHBondContact OH-NE2 3.34Å
118	E	77.5	Confident	81.1	Confident	55 Å²	55	96.3 Å²	96.3	26%	0.257	47%	0.473	S	S	.	.	H	α-helix	trans	-60.4	-47.1	176.2	-72.2	178.8	-179.7	0	0	110.3	K56 R114 H120 Q121 D122	K56-E118 IonicContact NZ-OE1 2.68Å; K56-E118 PolarHBondContact NZ-OE1 3.22Å; R114-E118 WeakPolarHBondContact CD-OE1 3.45Å; R114-E118 HydrophobicContact CG-CG 4.07Å; R114-E118 WeakPolarHBondContact CG-OE1 3.45Å; R114-E118 IonicContact CZ-OE1 3.6Å; R114-E118 IonicContact NE-OE1 2.73Å; R114-E118 IonicContact NH1-OE1 3.63Å; R114-E118 PolarHBondContact NH1-OE1 2.98Å; R114-E118 PolarHBondContact O-N 2.84Å; E118-H120 VanDerWaalsContact C-N 3.26Å; E118-H120 PolarHBondContact O-N 3.41Å; E118-Q121 PolarHBondContact O-N 3.04Å; E118-Q121 VanDerWaalsContact O-N 3.13Å; E118-D122 PolarHBondContact O-N 2.81Å
119	A	80.2	Confident	80.3	Confident	41 Å²	41	95.1 Å²	95.1	34%	0.339	47%	0.465	S	S	.	.	H	α-helix	trans	-60.9	-35.2	176.2	0	0	0	0	0	112.5	E115 R123	E115-A119 WeakPolarHBondContact O-CB 3.25Å; E115-A119 PolarHBondContact O-N 2.81Å; A119-R123 WeakPolarHBondContact O-CB 3.4Å; A119-R123 WeakPolarHBondContact O-CD 3.21Å; A119-R123 WeakPolarHBondContact O-CG 3.41Å; A119-R123 PolarHBondContact O-N 3.11Å
120	H	80.6	Confident	79.3	Confident	123 Å²	123	96.1 Å²	96.1	57%	0.569	46%	0.464	S	S	*	.	H	α-helix	trans	-68.7	-43.8	175	-169.3	86.6	0	0	0	111.7	E116 Y117 E118 R123 V124	E116-H120 VanDerWaalsContact O-CB 3.23Å; E116-H120 WeakPolarHBondContact O-CB 3.38Å; E116-H120 PolarHBondContact O-N 3.03Å; Y117-H120 WeakPolarHBondContact O-CB 3.29Å; Y117-H120 PolarHBondContact O-N 3.33Å; E118-H120 VanDerWaalsContact C-N 3.26Å; E118-H120 PolarHBondContact O-N 3.41Å; H120-R123 PolarHBondContact O-N 3.26Å; H120-V124 WeakPolarHBondContact O-CG2 3.49Å; H120-V124 PolarHBondContact O-N 3.09Å; H120-V124 VanDerWaalsContact O-N 3.07Å
121	Q	76.9	Confident	78.2	Confident	70 Å²	70	99.8 Å²	99.8	33%	0.327	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-46.2	175.5	-72.5	-171.4	-53.6	0	0	111.6	Y117 E118 R123 V124 L125	Y117-Q121 HydrophobicContact CD1-CG 4.38Å; Y117-Q121 HydrophobicContact CE1-CG 4Å; Y117-Q121 WeakPolarHBondContact O-CG 3.38Å; Y117-Q121 PolarHBondContact O-N 3.11Å; Y117-Q121 PolarHBondContact OH-NE2 3.34Å; E118-Q121 PolarHBondContact O-N 3.04Å; E118-Q121 VanDerWaalsContact O-N 3.13Å; Q121-R123 VanDerWaalsContact C-N 3.35Å; Q121-R123 PolarHBondContact O-N 3.28Å; Q121-V124 PolarHBondContact O-N 3.01Å; Q121-L125 WeakPolarHBondContact O-CB 3.22Å; Q121-L125 PolarHBondContact O-N 3Å
122	D	80.7	Confident	77.3	Confident	95 Å²	95	104.8 Å²	104.8	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-42.6	177.5	-79.3	-11.7	0	0	0	111.7	E118 V124 L125 I126	E118-D122 PolarHBondContact O-N 2.81Å; D122-V124 VanDerWaalsContact C-N 3.31Å; D122-V124 PolarHBondContact O-N 3.2Å; D122-L125 PolarHBondContact O-N 3.4Å; D122-I126 WeakPolarHBondContact O-CB 3.4Å; D122-I126 WeakPolarHBondContact O-CD1 2.9Å; D122-I126 WeakPolarHBondContact O-CG1 3.47Å; D122-I126 PolarHBondContact O-N 3.14Å
123	R	83.4	Confident	76.7	Confident	188 Å²	188	105 Å²	105	71%	0.709	50%	0.502	S	S	*	.	H	α-helix	trans	-58.9	-42.6	175	-78.6	171.1	179.9	-165.1	2.6	112.1	A119 H120 Q121 R127	A119-R123 WeakPolarHBondContact O-CB 3.4Å; A119-R123 WeakPolarHBondContact O-CD 3.21Å; A119-R123 WeakPolarHBondContact O-CG 3.41Å; A119-R123 PolarHBondContact O-N 3.11Å; H120-R123 PolarHBondContact O-N 3.26Å; Q121-R123 VanDerWaalsContact C-N 3.35Å; Q121-R123 PolarHBondContact O-N 3.28Å; R123-R127 WeakPolarHBondContact O-CB 3.34Å; R123-R127 PolarHBondContact O-N 3.44Å
124	V	82.6	Confident	76.1	Confident	78 Å²	78	109.3 Å²	109.3	47%	0.473	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-44.6	177.3	173.6	0	0	0	0	110.6	H120 Q121 D122 R127 L128	H120-V124 WeakPolarHBondContact O-CG2 3.49Å; H120-V124 PolarHBondContact O-N 3.09Å; H120-V124 VanDerWaalsContact O-N 3.07Å; Q121-V124 PolarHBondContact O-N 3.01Å; D122-V124 VanDerWaalsContact C-N 3.31Å; D122-V124 PolarHBondContact O-N 3.2Å; V124-R127 WeakPolarHBondContact O-CB 3.37Å; V124-R127 PolarHBondContact O-N 2.97Å; V124-L128 PolarHBondContact O-N 3.34Å
125	L	81.1	Confident	76	Confident	113 Å²	113	114.6 Å²	114.6	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-63.6	-44.2	179.1	-175.3	63.4	0	0	0	111.9	Q121 D122 R127 L128 S129	Q121-L125 WeakPolarHBondContact O-CB 3.22Å; Q121-L125 PolarHBondContact O-N 3Å; D122-L125 PolarHBondContact O-N 3.4Å; L125-R127 VanDerWaalsContact C-N 3.29Å; L125-R127 PolarHBondContact O-N 3.46Å; L125-L128 PolarHBondContact O-N 2.76Å; L125-S129 WeakPolarHBondContact O-CB 3.44Å; L125-S129 PolarHBondContact O-N 3.31Å; L125-S129 PolarHBondContact O-OG 3.4Å
126	I	82.4	Confident	75.9	Confident	83 Å²	83	108.7 Å²	108.7	43%	0.426	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-41.4	174	-70.1	164.6	0	0	0	110.6	D122 L128 S129 R130	D122-I126 WeakPolarHBondContact O-CB 3.4Å; D122-I126 WeakPolarHBondContact O-CD1 2.9Å; D122-I126 WeakPolarHBondContact O-CG1 3.47Å; D122-I126 PolarHBondContact O-N 3.14Å; I126-L128 VanDerWaalsContact C-N 3.35Å; I126-S129 WeakPolarHBondContact CA-OG 3.42Å; I126-S129 PolarHBondContact O-OG 2.91Å; I126-R130 WeakPolarHBondContact O-CB 3.49Å; I126-R130 VanDerWaalsContact O-CG 3.24Å; I126-R130 WeakPolarHBondContact O-CG 3.39Å; I126-R130 PolarHBondContact O-N 3.09Å; I126-R130 VanDerWaalsContact O-N 3.09Å
127	R	79.1	Confident	75.9	Confident	188 Å²	188	107.6 Å²	107.6	71%	0.709	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-41.3	176.7	-172.8	176.9	-176.5	176.7	1.1	111.3	R123 V124 L125 L131	R123-R127 WeakPolarHBondContact O-CB 3.34Å; R123-R127 PolarHBondContact O-N 3.44Å; V124-R127 WeakPolarHBondContact O-CB 3.37Å; V124-R127 PolarHBondContact O-N 2.97Å; L125-R127 VanDerWaalsContact C-N 3.29Å; L125-R127 PolarHBondContact O-N 3.46Å; R127-L131 WeakPolarHBondContact O-CG 3.06Å; R127-L131 PolarHBondContact O-N 3.14Å
128	L	76.2	Confident	76.1	Confident	98 Å²	98	108.8 Å²	108.8	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-70.9	-38.6	-180	-145.9	85.5	0	0	0	112.3	V124 L125 I126 R130 L131 H132	V124-L128 PolarHBondContact O-N 3.34Å; L125-L128 PolarHBondContact O-N 2.76Å; I126-L128 VanDerWaalsContact C-N 3.35Å; L128-R130 VanDerWaalsContact C-N 3.33Å; L128-L131 PolarHBondContact O-N 3.3Å; L128-H132 PolarHBondContact O-N 3.21Å
129	S	74	Confident	76.5	Confident	48 Å²	48	109.1 Å²	109.1	34%	0.336	54%	0.544	S	S	.	.	H	α-helix	trans	-67.2	-34.8	176.9	66.5	0	0	0	0	112	L125 I126 L131 H132	L125-S129 WeakPolarHBondContact O-CB 3.44Å; L125-S129 PolarHBondContact O-N 3.31Å; L125-S129 PolarHBondContact O-OG 3.4Å; I126-S129 WeakPolarHBondContact CA-OG 3.42Å; I126-S129 PolarHBondContact O-OG 2.91Å; S129-L131 VanDerWaalsContact C-N 3.25Å; S129-L131 PolarHBondContact O-N 3.24Å; S129-H132 PolarHBondContact O-N 3.43Å
130	R	68.9	Low	76.8	Confident	201 Å²	201	111.1 Å²	111.1	76%	0.758	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-26.4	172.2	-77.8	175.5	176.9	-171	0.1	114	I126 L128	I126-R130 WeakPolarHBondContact O-CB 3.49Å; I126-R130 VanDerWaalsContact O-CG 3.24Å; I126-R130 WeakPolarHBondContact O-CG 3.39Å; I126-R130 PolarHBondContact O-N 3.09Å; I126-R130 VanDerWaalsContact O-N 3.09Å; L128-R130 VanDerWaalsContact C-N 3.33Å
131	L	64.6	Low	77.1	Confident	138 Å²	138	109.7 Å²	109.7	72%	0.723	55%	0.551	S	S	*	*	H	α-helix	trans	-83.1	-19.1	177.4	-67.2	171.9	0	0	0	112.5	R127 L128 S129	R127-L131 WeakPolarHBondContact O-CG 3.06Å; R127-L131 PolarHBondContact O-N 3.14Å; L128-L131 PolarHBondContact O-N 3.3Å; S129-L131 VanDerWaalsContact C-N 3.25Å; S129-L131 PolarHBondContact O-N 3.24Å
132	H	66.1	Low	77.9	Confident	133 Å²	133	113.3 Å²	113.3	62%	0.616	57%	0.568	S	S	*	*	S	Bend	trans	-77	138.5	166.8	-81.7	110.3	0	0	0	109.5	L128 S129 Q134	L128-H132 PolarHBondContact O-N 3.21Å; S129-H132 PolarHBondContact O-N 3.43Å; H132-Q134 PolarHBondContact O-N 3.38Å
133	N	70.8	Confident	78.3	Confident	115 Å²	115	114 Å²	114	62%	0.615	57%	0.568	S	S	*	*			trans	-71.1	57.4	-179.6	-166.6	-2.9	0	0	0	111.8	Q135 A136 L137	N133-Q135 PolarHBondContact O-N 2.68Å; N133-Q135 VanDerWaalsContact O-N 3.16Å; N133-A136 HydrophobicContact CB-CB 4.44Å; N133-A136 WeakPolarHBondContact ND2-CB 3.26Å; N133-A136 PolarHBondContact O-N 2.87Å; N133-A136 WeakPolarHBondContact OD1-CB 3.4Å; N133-A136 PolarHBondContact OD1-N 2.97Å; N133-L137 PolarHBondContact O-N 3.24Å; N133-L137 VanDerWaalsContact O-N 3.13Å
134	Q	68.8	Low	78.7	Confident	138 Å²	138	106.1 Å²	106.1	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-55.5	-33.6	-179.1	-170.4	174.6	42	0	0	110.4	H132 S138	H132-Q134 PolarHBondContact O-N 3.38Å; Q134-S138 WeakPolarHBondContact O-CB 3.45Å; Q134-S138 PolarHBondContact O-N 3.11Å; Q134-S138 PolarHBondContact O-OG 2.85Å; Q134-S138 VanDerWaalsContact O-OG 3.07Å
135	Q	70.6	Confident	79.2	Confident	163 Å²	163	107.7 Å²	107.7	76%	0.762	55%	0.55	S	S	*	*	H	α-helix	trans	-73.1	-38.5	-178	-149	163.4	14	0	0	113.3	N133 S138 S139	N133-Q135 PolarHBondContact O-N 2.68Å; N133-Q135 VanDerWaalsContact O-N 3.16Å; Q135-S138 WeakPolarHBondContact CA-OG 3.33Å; Q135-S138 PolarHBondContact O-OG 3.34Å; Q135-S139 WeakPolarHBondContact O-CB 3.41Å; Q135-S139 PolarHBondContact O-N 2.86Å; Q135-S139 VanDerWaalsContact O-N 3.09Å; Q135-S139 PolarHBondContact O-OG 2.6Å; Q135-S139 VanDerWaalsContact O-OG 3.12Å
136	A	75.3	Confident	79.7	Confident	41 Å²	41	109.7 Å²	109.7	34%	0.339	55%	0.55	S	S	.	.	H	α-helix	trans	-75	-32.2	173.7	0	0	0	0	0	112.8	N133 S139 S140	N133-A136 HydrophobicContact CB-CB 4.44Å; N133-A136 WeakPolarHBondContact ND2-CB 3.26Å; N133-A136 PolarHBondContact O-N 2.87Å; N133-A136 WeakPolarHBondContact OD1-CB 3.4Å; N133-A136 PolarHBondContact OD1-N 2.97Å; A136-S139 WeakPolarHBondContact CA-OG 3.32Å; A136-S139 PolarHBondContact O-OG 3.24Å; A136-S139 VanDerWaalsContact O-OG 3.12Å; A136-S140 VanDerWaalsContact O-CB 3.28Å; A136-S140 WeakPolarHBondContact O-CB 3.48Å; A136-S140 PolarHBondContact O-N 2.92Å
137	L	78.6	Confident	79.9	Confident	113 Å²	113	110.8 Å²	110.8	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-45.1	173.7	-178.2	60.7	0	0	0	110.7	N133 S140 I141	N133-L137 PolarHBondContact O-N 3.24Å; N133-L137 VanDerWaalsContact O-N 3.13Å; L137-S140 PolarHBondContact O-N 3.2Å; L137-I141 HydrophobicContact CD1-CD1 3.94Å; L137-I141 HydrophobicContact CD1-CG1 4.31Å; L137-I141 HydrophobicContact CG-CD1 3.88Å; L137-I141 VanDerWaalsContact O-CG1 3.25Å; L137-I141 WeakPolarHBondContact O-CG1 3.41Å; L137-I141 PolarHBondContact O-N 2.95Å
138	S	80.5	Confident	80.4	Confident	62 Å²	62	108.3 Å²	108.3	43%	0.434	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-43.5	178.1	60.4	0	0	0	0	112.2	Q134 Q135 I141 E142	Q134-S138 WeakPolarHBondContact O-CB 3.45Å; Q134-S138 PolarHBondContact O-N 3.11Å; Q134-S138 PolarHBondContact O-OG 2.85Å; Q134-S138 VanDerWaalsContact O-OG 3.07Å; Q135-S138 WeakPolarHBondContact CA-OG 3.33Å; Q135-S138 PolarHBondContact O-OG 3.34Å; S138-I141 PolarHBondContact O-N 3.41Å; S138-E142 WeakPolarHBondContact O-CB 3.08Å; S138-E142 PolarHBondContact O-N 3.48Å
139	S	84.3	Confident	80.9	Confident	62 Å²	62	106.5 Å²	106.5	43%	0.434	55%	0.55	S	S	.	*	H	α-helix	trans	-66.9	-38.7	178.6	63.3	0	0	0	0	112.3	Q135 A136 I141 E142 E143	Q135-S139 WeakPolarHBondContact O-CB 3.41Å; Q135-S139 PolarHBondContact O-N 2.86Å; Q135-S139 VanDerWaalsContact O-N 3.09Å; Q135-S139 PolarHBondContact O-OG 2.6Å; Q135-S139 VanDerWaalsContact O-OG 3.12Å; A136-S139 WeakPolarHBondContact CA-OG 3.32Å; A136-S139 PolarHBondContact O-OG 3.24Å; A136-S139 VanDerWaalsContact O-OG 3.12Å; S139-I141 PolarHBondContact O-N 3.39Å; S139-E142 PolarHBondContact O-N 2.91Å; S139-E143 WeakPolarHBondContact O-CB 3.35Å; S139-E143 PolarHBondContact O-N 2.93Å
140	S	86.9	Confident	81.4	Confident	83 Å²	83	108.9 Å²	108.9	58%	0.58	56%	0.557	S	S	*	*	H	α-helix	trans	-65.2	-38.1	175.8	-178.8	0	0	0	0	112.7	A136 L137 G144	A136-S140 VanDerWaalsContact O-CB 3.28Å; A136-S140 WeakPolarHBondContact O-CB 3.48Å; A136-S140 PolarHBondContact O-N 2.92Å; L137-S140 PolarHBondContact O-N 3.2Å; S140-G144 PolarHBondContact O-N 2.8Å; S140-G144 VanDerWaalsContact O-N 3.07Å
141	I	88.5	Confident	82	Confident	94 Å²	94	105.2 Å²	105.2	48%	0.482	55%	0.548	S	S	.	.	H	α-helix	trans	-68.3	-45	176.7	-68.8	167.5	0	0	0	110.5	L137 S138 S139 G144 L145	L137-I141 HydrophobicContact CD1-CD1 3.94Å; L137-I141 HydrophobicContact CD1-CG1 4.31Å; L137-I141 HydrophobicContact CG-CD1 3.88Å; L137-I141 VanDerWaalsContact O-CG1 3.25Å; L137-I141 WeakPolarHBondContact O-CG1 3.41Å; L137-I141 PolarHBondContact O-N 2.95Å; S138-I141 PolarHBondContact O-N 3.41Å; S139-I141 PolarHBondContact O-N 3.39Å; I141-G144 PolarHBondContact O-N 3.37Å; I141-L145 HydrophobicContact CG2-CD1 4.12Å; I141-L145 PolarHBondContact O-N 2.85Å
142	E	92.3	Very high	82.8	Confident	146 Å²	146	108.2 Å²	108.2	68%	0.682	55%	0.55	S	S	*	*	H	α-helix	trans	-63.4	-44.5	179.4	-174.4	171.5	-163.7	0	0	111.9	S138 S139 G144 L145 R146	S138-E142 WeakPolarHBondContact O-CB 3.08Å; S138-E142 PolarHBondContact O-N 3.48Å; S139-E142 PolarHBondContact O-N 2.91Å; E142-G144 VanDerWaalsContact C-N 3.3Å; E142-G144 PolarHBondContact O-N 3.22Å; E142-L145 PolarHBondContact O-N 3Å; E142-R146 WeakPolarHBondContact O-CB 3.46Å; E142-R146 PolarHBondContact O-N 3.2Å
143	E	89.4	Confident	83	Confident	109 Å²	109	104.8 Å²	104.8	51%	0.509	55%	0.545	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.1	-160.8	75	-138.1	0	0	111.2	S139 R146 M147	S139-E143 WeakPolarHBondContact O-CB 3.35Å; S139-E143 PolarHBondContact O-N 2.93Å; E143-R146 PolarHBondContact O-N 3.32Å; E143-M147 HydrophobicContact CG-CE 4Å; E143-M147 WeakPolarHBondContact O-CG 3.47Å; E143-M147 PolarHBondContact O-N 3.37Å
144	G	91.6	Very high	82.8	Confident	22 Å²	22	105.4 Å²	105.4	23%	0.227	54%	0.544	C	S	.	.	H	α-helix	trans	-61	-47.3	174.4	0	0	0	0	0	113	S140 I141 E142 R146 M147 Q148	S140-G144 PolarHBondContact O-N 2.8Å; S140-G144 VanDerWaalsContact O-N 3.07Å; I141-G144 PolarHBondContact O-N 3.37Å; E142-G144 VanDerWaalsContact C-N 3.3Å; E142-G144 PolarHBondContact O-N 3.22Å; G144-R146 VanDerWaalsContact C-N 3.32Å; G144-R146 PolarHBondContact O-N 3.19Å; G144-M147 PolarHBondContact O-N 3.31Å; G144-Q148 VanDerWaalsContact O-CG 3.28Å; G144-Q148 WeakPolarHBondContact O-CG 3.44Å; G144-Q148 PolarHBondContact O-N 3.42Å
145	L	92.5	Very high	82.5	Confident	111 Å²	111	109.4 Å²	109.4	58%	0.581	55%	0.553	S	S	*	*	H	α-helix	trans	-61.2	-41.9	174.7	-102.7	76.7	0	0	0	111.4	I141 E142 Q148 A149	I141-L145 HydrophobicContact CG2-CD1 4.12Å; I141-L145 PolarHBondContact O-N 2.85Å; E142-L145 PolarHBondContact O-N 3Å; L145-Q148 PolarHBondContact O-N 3.17Å; L145-A149 WeakPolarHBondContact O-CB 3.27Å; L145-A149 PolarHBondContact O-N 2.94Å
146	R	91.8	Very high	81.9	Confident	155 Å²	155	107.7 Å²	107.7	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-63.1	-45.9	179.2	-168.2	-178.8	-179.4	86.1	1.6	111.7	E142 E143 G144 A149 M150	E142-R146 WeakPolarHBondContact O-CB 3.46Å; E142-R146 PolarHBondContact O-N 3.2Å; E143-R146 PolarHBondContact O-N 3.32Å; G144-R146 VanDerWaalsContact C-N 3.32Å; G144-R146 PolarHBondContact O-N 3.19Å; R146-A149 PolarHBondContact O-N 2.59Å; R146-M150 HydrophobicContact CG-CE 4.33Å; R146-M150 WeakPolarHBondContact O-CG 3.41Å; R146-M150 PolarHBondContact O-N 3.27Å
147	M	86.4	Confident	81.2	Confident	106 Å²	106	116.2 Å²	116.2	52%	0.522	58%	0.577	S	S	.	*	H	α-helix	trans	-62.5	-42.3	176.3	-76.5	-168.8	-87.3	0	0	112	E143 G144 A149 M150 H151	E143-M147 HydrophobicContact CG-CE 4Å; E143-M147 WeakPolarHBondContact O-CG 3.47Å; E143-M147 PolarHBondContact O-N 3.37Å; G144-M147 PolarHBondContact O-N 3.31Å; M147-A149 PolarHBondContact O-N 3.2Å; M147-M150 PolarHBondContact O-N 3.33Å; M147-H151 PolarHBondContact O-CD2 2.9Å; M147-H151 VanDerWaalsContact O-CD2 3.22Å; M147-H151 PolarHBondContact O-N 2.79Å
148	Q	89.8	Confident	80	Confident	136 Å²	136	121.3 Å²	121.3	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-41.8	176.6	-71.8	174.5	4.4	0	0	112.2	G144 L145 H151 R152	G144-Q148 VanDerWaalsContact O-CG 3.28Å; G144-Q148 WeakPolarHBondContact O-CG 3.44Å; G144-Q148 PolarHBondContact O-N 3.42Å; L145-Q148 PolarHBondContact O-N 3.17Å; Q148-H151 PolarHBondContact O-N 3.35Å; Q148-R152 WeakPolarHBondContact O-CB 3.33Å; Q148-R152 PolarHBondContact O-N 3.29Å
149	A	88.1	Confident	78.6	Confident	60 Å²	60	123.7 Å²	123.7	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-62.6	-42	176.1	0	0	0	0	0	112.1	L145 R146 M147 R152 A153	L145-A149 WeakPolarHBondContact O-CB 3.27Å; L145-A149 PolarHBondContact O-N 2.94Å; R146-A149 PolarHBondContact O-N 2.59Å; M147-A149 PolarHBondContact O-N 3.2Å; A149-R152 PolarHBondContact O-N 3.4Å; A149-A153 PolarHBondContact O-N 3Å
150	M	83.8	Confident	77.2	Confident	99 Å²	99	128.7 Å²	128.7	49%	0.488	62%	0.622	S	S	.	*	H	α-helix	trans	-62.2	-45.5	175.9	-64.7	-123.9	-151.9	0	0	112.1	R146 M147 R152 A153 Q154	R146-M150 HydrophobicContact CG-CE 4.33Å; R146-M150 WeakPolarHBondContact O-CG 3.41Å; R146-M150 PolarHBondContact O-N 3.27Å; M147-M150 PolarHBondContact O-N 3.33Å; M150-R152 VanDerWaalsContact C-N 3.31Å; M150-R152 PolarHBondContact O-N 3.31Å; M150-A153 PolarHBondContact O-N 2.96Å; M150-Q154 WeakPolarHBondContact O-CG 3.48Å; M150-Q154 PolarHBondContact O-N 3.21Å; M150-Q154 VanDerWaalsContact O-N 3.08Å
151	H	80.9	Confident	75.4	Confident	123 Å²	123	130.7 Å²	130.7	57%	0.569	63%	0.633	S	S	*	*	H	α-helix	trans	-66.8	-32.8	178.2	-81.5	-122.7	0	0	0	112.4	M147 Q148 Q154 R155	M147-H151 PolarHBondContact O-CD2 2.9Å; M147-H151 VanDerWaalsContact O-CD2 3.22Å; M147-H151 PolarHBondContact O-N 2.79Å; Q148-H151 PolarHBondContact O-N 3.35Å; H151-Q154 PolarHBondContact O-N 3.08Å; H151-R155 PolarHBondContact O-N 2.98Å
152	R	81.8	Confident	73.2	Confident	202 Å²	202	129.9 Å²	129.9	76%	0.762	65%	0.649	S	S	*	*	H	α-helix	trans	-65.6	-43.9	173.8	-161.9	177.9	-157.8	169.5	5.1	111.4	Q148 A149 M150 Q154 R155	Q148-R152 WeakPolarHBondContact O-CB 3.33Å; Q148-R152 PolarHBondContact O-N 3.29Å; A149-R152 PolarHBondContact O-N 3.4Å; M150-R152 VanDerWaalsContact C-N 3.31Å; M150-R152 PolarHBondContact O-N 3.31Å; R152-Q154 VanDerWaalsContact C-N 3.32Å; R152-Q154 PolarHBondContact O-N 2.8Å; R152-R155 PolarHBondContact O-N 2.91Å
153	A	71.3	Confident	70.7	Confident	60 Å²	60	128.5 Å²	128.5	50%	0.496	66%	0.655	S	S	.	*	H	α-helix	trans	-65.1	-33.7	177.1	0	0	0	0	0	113	A149 M150	A149-A153 PolarHBondContact O-N 3Å; M150-A153 PolarHBondContact O-N 2.96Å
154	Q	66.4	Low	68.3	Low	129 Å²	129	130 Å²	130	60%	0.603	67%	0.667	S	S	*	*	H	α-helix	trans	-72.5	-32.4	177.4	-73.7	176.1	7.5	0	0	113.5	M150 H151 R152 V156 R157	M150-Q154 WeakPolarHBondContact O-CG 3.48Å; M150-Q154 PolarHBondContact O-N 3.21Å; M150-Q154 VanDerWaalsContact O-N 3.08Å; H151-Q154 PolarHBondContact O-N 3.08Å; R152-Q154 VanDerWaalsContact C-N 3.32Å; R152-Q154 PolarHBondContact O-N 2.8Å; Q154-V156 VanDerWaalsContact C-N 3.31Å; Q154-V156 PolarHBondContact O-N 3.33Å; Q154-R157 PolarHBondContact O-N 2.8Å
155	R	60.8	Low	66	Low	221 Å²	221	136.7 Å²	136.7	83%	0.834	69%	0.692	S	S	*	*	H	α-helix	trans	-67	-29.2	176.1	-78.4	-170.8	177.5	-160.2	0.9	113.6	H151 R152 R157	H151-R155 PolarHBondContact O-N 2.98Å; R152-R155 PolarHBondContact O-N 2.91Å; R155-R157 VanDerWaalsContact C-N 3.31Å
156	V	59.4	Low	63.3	Low	128 Å²	128	136.9 Å²	136.9	78%	0.776	70%	0.698	S	S	*	*	H	α-helix	trans	-76.5	-18.2	178.9	179.6	0	0	0	0	112.2	Q154	Q154-V156 VanDerWaalsContact C-N 3.31Å; Q154-V156 PolarHBondContact O-N 3.33Å
157	R	59.4	Low	60.7	Low	219 Å²	219	135.1 Å²	135.1	83%	0.826	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	7.3	-175.2	-79.6	-171.2	170.6	-175.2	-1.5	115.6	Q154 R155 P159	Q154-R157 PolarHBondContact O-N 2.8Å; R155-R157 VanDerWaalsContact C-N 3.31Å; R157-P159 WeakPolarHBondContact O-CD 3.33Å
158	R	53.1	Low	58.2	Low	221 Å²	221	136.2 Å²	136.2	83%	0.834	72%	0.717	S	S	*	*			trans	-78.2	110.8	-176.8	-147.4	174.8	171.7	-173	-4.2	110
159	P	53.1	Low	55.6	Low	112 Å²	112	138.7 Å²	138.7	73%	0.727	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-75.8	138.7	178.1	-7.6	26.5	0	0	0	109.9	R157 P161	R157-P159 WeakPolarHBondContact O-CD 3.33Å; P159-P161 WeakPolarHBondContact O-CD 3.21Å
160	I	53	Low	53.1	Low	166 Å²	166	141.9 Å²	141.9	85%	0.851	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.8	121.9	172.4	-59.6	169.9	0	0	0	108.2
161	P	49.1	Very low	50.8	Low	125 Å²	125	141.3 Å²	141.3	81%	0.812	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-98.1	122.3	171.6	29.9	-18	0	0	0	110.5	P159	P159-P161 WeakPolarHBondContact O-CD 3.21Å
162	G	43.9	Very low	48.5	Very low	78 Å²	78	138.9 Å²	138.9	80%	0.804	78%	0.778	S	S	*	*			trans	156.6	93.7	161.8	0	0	0	0	0	114.6
163	S	40	Very low	46.2	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	79%	0.785	S	S	*	*			trans	-151.6	109.9	150.8	66.9	0	0	0	0	109.7
164	D	38.9	Very low	44.4	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	80%	0.802	S	S	*	*			trans	-138.5	116.7	152.6	-109.4	-23.5	0	0	0	109
165	Q	43.4	Very low	43.1	Very low	162 Å²	162	142.7 Å²	142.7	76%	0.757	82%	0.816	S	S	*	*			trans	70.9	130.5	151.9	-53.8	167.7	68.6	0	0	115.1
166	T	33.9	Very low	42.4	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	81%	0.811	S	S	*	*			cis	-175.5	137.4	47.4	-30.1	0	0	0	0	108.5
167	T	38.4	Very low	41.2	Very low	118 Å²	118	135 Å²	135	72%	0.724	81%	0.811	S	S	*	*			trans	37	129.2	144.4	65.6	0	0	0	0	119.5
168	T	34.2	Very low	40.1	Very low	129 Å²	129	134.1 Å²	134.1	79%	0.791	82%	0.816	S	S	*	*				-171.7	145.2	58.7	56.7	0	0	0	0	108.4
169	M	33.9	Very low	39.2	Very low	188 Å²	188	127.3 Å²	127.3	93%	0.926	82%	0.815	S	S	*	*			trans	-126.3	132.5	162.6	-77.7	-70	-133.6	0	0	107.2
170	S	37	Very low	38.5	Very low	128 Å²	128	131.9 Å²	131.9	90%	0.895	83%	0.826	S	S	*	*			trans	-151.1	116	157.2	-113.1	0	0	0	0	110.5
171	G	33.9	Very low	37.5	Very low	86 Å²	86	127.4 Å²	127.4	89%	0.887	82%	0.821	S	S	*	*			trans	91.6	126.8	139.7	0	0	0	0	0	118.3
172	G	33.6	Very low	36.9	Very low	73 Å²	73	129.6 Å²	129.6	75%	0.753	83%	0.826	S	S	*	*			trans	139.7	88.2	147.9	0	0	0	0	0	116.3
173	E	34.2	Very low	36.4	Very low	197 Å²	197	129.4 Å²	129.4	92%	0.921	82%	0.824	S	S	*	*			trans	-40.1	154.6	161.4	56.3	-137.7	82.7	0	0	118.9
174	G	32.3	Very low	36.2	Very low	82 Å²	82	133.3 Å²	133.3	85%	0.845	83%	0.829	S	S	*	*			trans	151.9	119.9	160	0	0	0	0	0	115.8
175	E	39.4	Very low	36.2	Very low	191 Å²	191	133.3 Å²	133.3	89%	0.893	83%	0.83	S	S	*	*			trans	-83.9	-166.6	-172.1	-148	-170	97.6	0	0	113.6
176	P	47	Very low	35.9	Very low	113 Å²	113	132.3 Å²	132.3	73%	0.734	83%	0.834	S	S	*	*				-102.9	168.1	-109.8	38.8	-22.6	0	0	0	115
177	G	33.5	Very low	36.2	Very low	75 Å²	75	132.6 Å²	132.6	77%	0.773	84%	0.841	S	S	*	*			trans	-156.3	113.4	174.2	0	0	0	0	0	112.7
178	E	36.6	Very low	36.1	Very low	201 Å²	201	132.3 Å²	132.3	94%	0.939	84%	0.843	S	S	*	*			trans	-62	146.4	174.6	55.8	-147.1	120.3	0	0	114.8
179	G	34.1	Very low	36.1	Very low	78 Å²	78	133.3 Å²	133.3	80%	0.804	84%	0.844	S	S	*	*			trans	178	110.9	171.4	0	0	0	0	0	113.2
180	E	37.7	Very low	36.4	Very low	207 Å²	207	128.9 Å²	128.9	97%	0.967	83%	0.832	S	S	*	*			trans	-60	151	178.3	-72.2	159.7	106.8	0	0	114.3
181	G	33.1	Very low	36.4	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	83%	0.826	S	S	*	*			trans	178.1	113.7	167.7	0	0	0	0	0	113.4
182	D	35	Very low	37.1	Very low	170 Å²	170	129 Å²	129	91%	0.909	82%	0.821	S	S	*	*			trans	-45.6	149.1	-177.8	-61	-96.8	0	0	0	117.6
183	G	34.1	Very low	37	Very low	74 Å²	74	132.3 Å²	132.3	76%	0.763	82%	0.822	S	S	*	*			trans	-168.9	93	175.2	0	0	0	0	0	112.7
184	E	36.2	Very low	37	Very low	199 Å²	199	127.8 Å²	127.8	93%	0.93	81%	0.812	S	S	*	*			trans	-62.3	126.5	-175.3	-52	165.6	166.7	0	0	113.4
185	D	38.3	Very low	37	Very low	142 Å²	142	128.5 Å²	128.5	76%	0.759	81%	0.81	S	S	*	*			trans	-123.4	129.5	155.9	77.7	-92.1	0	0	0	108.4
186	V	37.1	Very low	36.9	Very low	140 Å²	140	125.9 Å²	125.9	85%	0.848	81%	0.81	S	S	*	*			trans	-166.4	137	133.8	-84.3	0	0	0	0	110.3
187	S	41.6	Very low	36.1	Very low	120 Å²	120	123.9 Å²	123.9	84%	0.839	81%	0.809	S	S	*	*			trans	-78.8	153.5	179.3	-60.9	0	0	0	0	112.4
188	S	36.1	Very low	36.7	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	81%	0.813	S	S	*	*			trans	-169.7	116.9	139.6	55.7	0	0	0	0	113
189	D	33.8	Very low	36.8	Very low	150 Å²	150	121.9 Å²	121.9	80%	0.802	81%	0.809	S	S	*	*				42.7	134.8	122.6	-151.4	-114	0	0	0	123.4
190	S	39.4	Very low	37.1	Very low	96 Å²	96	123.6 Å²	123.6	67%	0.671	81%	0.806	S	S	*	*			trans	71.1	124.6	150	-72	0	0	0	0	124.1
191	A	37.5	Very low	36.8	Very low	94 Å²	94	123.1 Å²	123.1	78%	0.777	80%	0.801	S	S	*	*			trans	43.3	140.2	151.1	0	0	0	0	0	120.9
192	P	48.6	Very low	36.8	Very low	121 Å²	121	129.4 Å²	129.4	79%	0.786	80%	0.801	S	S	*	*				-154.5	162.2	97.1	32	-8.9	0	0	0	114.4
193	D	32.2	Very low	37.1	Very low	144 Å²	144	127.1 Å²	127.1	77%	0.77	80%	0.796	S	S	*	*				59	119.6	77.1	-139.9	-76.1	0	0	0	117
194	S	32.6	Very low	37.1	Very low	101 Å²	101	134.2 Å²	134.2	71%	0.706	80%	0.8	S	S	*	*			trans	31.3	135.6	153.7	-48.8	0	0	0	0	125.3
195	A	32.7	Very low	36.7	Very low	98 Å²	98	128.4 Å²	128.4	81%	0.81	79%	0.794	S	S	*	*			trans	86.2	129.2	138.1	0	0	0	0	0	120.2
196	P	39.1	Very low	36.2	Very low	136 Å²	136	125.9 Å²	125.9	88%	0.883	80%	0.801	S	S	*	*			trans	-104.7	151.7	172.4	38	-28.9	0	0	0	113.4
197	G	30.2	Very low	35.8	Very low	70 Å²	70	122.8 Å²	122.8	72%	0.722	80%	0.798	S	S	*	*			trans	170.5	163.3	157.3	0	0	0	0	0	111.7
198	P	45.9	Very low	35.3	Very low	132 Å²	132	122.4 Å²	122.4	86%	0.857	80%	0.801	S	S	*	*				-126	162.1	-51.9	35.4	-22.7	0	0	0	112.3
199	A	37	Very low	35	Very low	102 Å²	102	121.1 Å²	121.1	84%	0.843	81%	0.806	S	S	*	*			trans	-89.2	152	177.4	0	0	0	0	0	113.5
200	P	41.2	Very low	34.8	Very low	114 Å²	114	117.4 Å²	117.4	74%	0.74	80%	0.803	S	S	*	*			trans	-113.4	135.6	163.4	34.7	-22.8	0	0	0	114.8
201	K	31.9	Very low	34.4	Very low	198 Å²	198	118.5 Å²	118.5	86%	0.861	81%	0.811	S	S	*	*			trans	52.3	113.8	135	-61.4	-175.2	178.3	177.6	0	122.2
202	R	31.6	Very low	34.2	Very low	204 Å²	204	119 Å²	119	77%	0.77	81%	0.809	S	S	*	*				45.3	150.7	120.6	-95.3	-178.2	159	-128.7	-1.2	120.5
203	P	42.4	Very low	33.5	Very low	123 Å²	123	119.8 Å²	119.8	80%	0.799	81%	0.811	S	S	*	*			cis	-140.8	-160.8	49.6	21.2	5.7	0	0	0	112.7
204	R	33.4	Very low	33.3	Very low	222 Å²	222	115.9 Å²	115.9	84%	0.838	81%	0.805	S	S	*	*			cis	179.3	141.9	-44.6	-168.2	-176.2	-165.1	-140.2	6.8	105.9
205	G	27.7	Very low	33.4	Very low	78 Å²	78	118.2 Å²	118.2	80%	0.804	82%	0.815	S	S	*	*			trans	119.8	107.6	166.5	0	0	0	0	0	112.9
206	G	28.4	Very low	33.2	Very low	89 Å²	89	117.4 Å²	117.4	92%	0.918	82%	0.816	S	S	*	*				100.1	132.3	73.7	0	0	0	0	0	107.8
207	G	28.6	Very low	32.7	Very low	75 Å²	75	114.9 Å²	114.9	77%	0.773	82%	0.815	S	S	*	*			cis	176.7	165.5	0.4	0	0	0	0	0	107.8
208	A	31.9	Very low	32.7	Very low	111 Å²	111	115.8 Å²	115.8	92%	0.917	82%	0.824	S	S	*	*			trans	78.2	125.5	155.6	0	0	0	0	0	123
209	G	28.9	Very low	31.9	Very low	86 Å²	86	112.6 Å²	112.6	89%	0.887	82%	0.816	S	S	*	*			trans	73	141.5	138.9	0	0	0	0	0	118
210	G	28.9	Very low	31.8	Very low	71 Å²	71	114.9 Å²	114.9	73%	0.732	82%	0.819	S	S	*	*			cis	171	145.2	4.6	0	0	0	0	0	108.7
211	S	32.2	Very low	31.3	Very low	119 Å²	119	113.6 Å²	113.6	83%	0.832	83%	0.826	S	S	*	*			trans	46.6	121.7	147	-59.9	0	0	0	0	123.2
212	S	33.1	Very low	31.3	Very low	106 Å²	106	107.9 Å²	107.9	74%	0.741	82%	0.824	S	S	*	*				115.4	142.5	111.7	74.4	0	0	0	0	121.2
213	V	33	Very low	31.4	Very low	136 Å²	136	105.7 Å²	105.7	82%	0.824	83%	0.833	S	S	*	*			trans	70	117.3	156.6	-156.4	0	0	0	0	116.1
214	G	29.1	Very low	30.8	Very low	62 Å²	62	103.5 Å²	103.5	64%	0.639	83%	0.832	S	S	*	*				97.3	114.2	60.5	0	0	0	0	0	107.4
215	T	33.4	Very low	30.7	Very low	150 Å²	150	97 Å²	97	92%	0.92	83%	0.834	S	S	*	*				163.5	138.5	97.1	26	0	0	0	0	103.9
216	G	29.6	Very low	30.9	Very low	82 Å²	82	97.2 Å²	97.2	85%	0.845	84%	0.837	S	S	*	*				120.8	138.3	54.1	0	0	0	0	0	107.9
217	G	28.7	Very low	31.1	Very low	83 Å²	83	98.1 Å²	98.1	86%	0.856	84%	0.836	S	S	*	*			trans	128.1	83.3	158.6	0	0	0	0	0	118.8
218	G	29.3	Very low	31.3	Very low	89 Å²	89	98.4 Å²	98.4	92%	0.918	84%	0.838	S	S	*	*				61.7	135	111.9	0	0	0	0	0	123.1
219	G	30.3	Very low	31.5	Very low	65 Å²	65	98.9 Å²	98.9	67%	0.67	84%	0.835	S	S	*	*			trans	136.9	82.7	154.2	0	0	0	0	0	114.2
220	T	33.5	Very low	31.8	Very low	149 Å²	149	104.1 Å²	104.1	91%	0.914	84%	0.837	S	S	*	*				77.2	128.9	85.1	60.8	0	0	0	0	117.1
221	G	31.8	Very low	31.8	Very low	87 Å²	87	107.9 Å²	107.9	90%	0.897	84%	0.84	S	S	*	*			trans	100.4	133.3	158.7	0	0	0	0	0	114
222	G	31.2	Very low	32.2	Very low	79 Å²	79	107.1 Å²	107.1	81%	0.814	83%	0.834	S	S	*	*			cis	169.2	159	11.2	0	0	0	0	0	108.3
223	V	33.7	Very low	32.2	Very low	158 Å²	158	105.9 Å²	105.9	96%	0.958	84%	0.839	S	S	*	*			trans	-93.5	167.9	-159.4	-69.9	0	0	0	0	115.9
224	G	31.1	Very low	32.1	Very low	76 Å²	76	107.3 Å²	107.3	78%	0.784	84%	0.842	S	S	*	*			trans	131.3	111	155.5	0	0	0	0	0	112.9
225	G	30.8	Very low	32.7	Very low	85 Å²	85	115.7 Å²	115.7	88%	0.876	85%	0.854	S	S	*	*				84.6	119.3	70.2	0	0	0	0	0	108.7
226	G	31.3	Very low	32.6	Very low	84 Å²	84	111.8 Å²	111.8	87%	0.866	84%	0.844	S	S	*	*			cis	111.5	101	29.7	0	0	0	0	0	108.8
227	A	33.3	Very low	33.2	Very low	108 Å²	108	112.1 Å²	112.1	89%	0.893	85%	0.847	S	S	*	*			trans	175	140.1	152.9	0	0	0	0	0	111
228	G	32.6	Very low	33.5	Very low	80 Å²	80	114.4 Å²	114.4	83%	0.825	85%	0.845	S	S	*	*			trans	-97.5	-178.2	-177.3	0	0	0	0	0	115.1
229	S	35.4	Very low	34.2	Very low	121 Å²	121	118.9 Å²	118.9	85%	0.846	85%	0.846	S	S	*	*			trans	-155.1	137.4	158.8	58.1	0	0	0	0	109.8
230	E	35.9	Very low	34.4	Very low	197 Å²	197	119.4 Å²	119.4	92%	0.921	85%	0.852	S	S	*	*			trans	-86.6	142.1	178.6	-48.9	163.7	122.9	0	0	108.8
231	D	29.6	Very low	34.4	Very low	149 Å²	149	115.8 Å²	115.8	80%	0.797	84%	0.844	S	S	*	*			trans	179.9	121.1	133.1	-166.6	39.8	0	0	0	113.6
232	S	39.7	Very low	34.5	Very low	103 Å²	103	115.6 Å²	115.6	72%	0.72	84%	0.843	S	S	*	*			trans	23.6	119	146	-46.6	0	0	0	0	124.6
233	G	33	Very low	34.8	Very low	81 Å²	81	118.3 Å²	118.3	84%	0.835	84%	0.844	S	S	*	*				92.6	108.1	115.7	0	0	0	0	0	120.1
234	D	30.4	Very low	35.1	Very low	165 Å²	165	118.9 Å²	118.9	88%	0.882	84%	0.84	S	S	*	*				-170	150.7	125	-166.1	-133.1	0	0	0	111.8
235	R	42.3	Very low	35.3	Very low	239 Å²	239	118.2 Å²	118.2	90%	0.902	83%	0.833	S	S	*	*			trans	-91.9	135.6	-168.8	-68.4	170.5	153	-168.7	-6.2	112.3
236	G	31.8	Very low	36.3	Very low	68 Å²	68	119.8 Å²	119.8	70%	0.701	83%	0.828	S	S	*	*			trans	-175.8	106.4	164.6	0	0	0	0	0	113.3	T238	G236-T238 PolarHBondContact O-N 2.97Å
237	G	42.3	Very low	36.8	Very low	89 Å²	89	121.9 Å²	121.9	92%	0.918	83%	0.826	S	S	*	*			trans	-61.9	126.2	-174.9	0	0	0	0	0	113.9
238	T	34.9	Very low	37	Very low	131 Å²	131	121.8 Å²	121.8	80%	0.804	82%	0.819	S	S	*	*			trans	-117.2	116.1	173.3	-54.9	0	0	0	0	108.8	G236 G240	G236-T238 PolarHBondContact O-N 2.97Å; T238-G240 PolarHBondContact O-N 3.07Å
239	L	42.7	Very low	37.5	Very low	182 Å²	182	123 Å²	123	95%	0.953	81%	0.812	S	S	*	*			trans	-76.1	115.7	168.8	-67.1	170	0	0	0	108.1
240	G	35.3	Very low	37.7	Very low	76 Å²	76	124 Å²	124	78%	0.784	82%	0.816	S	S	*	*			trans	-64.5	133.5	-171.1	0	0	0	0	0	114.2	T238	T238-G240 PolarHBondContact O-N 3.07Å
241	G	34	Very low	38	Very low	73 Å²	73	118.1 Å²	118.1	75%	0.753	81%	0.808	S	S	*	*			trans	-74.7	136	167.7	0	0	0	0	0	111.6	T243	G241-T243 PolarHBondContact O-N 3.29Å
242	G	34.3	Very low	38.3	Very low	84 Å²	84	114.8 Å²	114.8	87%	0.866	80%	0.802	S	S	*	*			trans	-74.9	107.7	171.2	0	0	0	0	0	110.8
243	T	37.1	Very low	38.2	Very low	136 Å²	136	115.8 Å²	115.8	83%	0.834	81%	0.806	S	S	*	*			trans	-71.5	133.7	164.1	35.5	0	0	0	0	109.9	G241 G245	G241-T243 PolarHBondContact O-N 3.29Å; T243-G245 PolarHBondContact O-N 3.18Å
244	L	38.6	Very low	38.3	Very low	170 Å²	170	116 Å²	116	89%	0.89	80%	0.795	S	S	*	*			trans	-67.8	108.6	167.8	-70.3	166.9	0	0	0	108.3
245	G	36.1	Very low	39	Very low	61 Å²	61	113.5 Å²	113.5	63%	0.629	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.3	159	171	0	0	0	0	0	112.4	T243	T243-G245 PolarHBondContact O-N 3.18Å
246	P	51.8	Low	38.8	Very low	118 Å²	118	107 Å²	107	77%	0.766	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.2	162	173.6	28.3	-34	0	0	0	111.7	S248	P246-S248 PolarHBondContact O-N 3.14Å
247	P	41.1	Very low	39.5	Very low	129 Å²	129	111.4 Å²	111.4	84%	0.838	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.4	-177.1	24.5	-33.9	0	0	0	111.3
248	S	39	Very low	39.8	Very low	105 Å²	105	113 Å²	113	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.2	145.7	-176.6	-50.2	0	0	0	0	112.4	P246	P246-S248 PolarHBondContact O-N 3.14Å
249	P	41.6	Very low	40.7	Very low	105 Å²	105	107.4 Å²	107.4	68%	0.682	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-64.4	154.2	176.6	26.8	-33.8	0	0	0	111.9	G251	P249-G251 PolarHBondContact O-N 2.64Å
250	P	39.3	Very low	42.4	Very low	142 Å²	142	100.7 Å²	100.7	92%	0.922	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	108.1	177.9	29.5	-31.1	0	0	0	108.6
251	G	42.4	Very low	44.9	Very low	74 Å²	74	104 Å²	104	76%	0.763	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	159.4	1.8	-177.1	0	0	0	0	0	116.3	P249	P249-G251 PolarHBondContact O-N 2.64Å
252	A	35.8	Very low	47.5	Very low	80 Å²	80	101.4 Å²	101.4	66%	0.661	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-65.9	130.4	165.5	0	0	0	0	0	108.9	S254	A252-S254 PolarHBondContact O-N 3.15Å
253	P	38.1	Very low	50.2	Low	124 Å²	124	100.1 Å²	100.1	81%	0.805	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-58.8	120	172.2	24.1	-30.1	0	0	0	107
254	S	34.5	Very low	52.8	Low	86 Å²	86	93.8 Å²	93.8	60%	0.601	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-47.4	147.7	164.4	36.6	0	0	0	0	108.8	A252	A252-S254 PolarHBondContact O-N 3.15Å
255	P	45	Very low	55.4	Low	111 Å²	111	85.9 Å²	85.9	72%	0.721	57%	0.571	S	S	*	*	S	Bend	trans	-45.3	137.4	163	-19	29	0	0	0	107.3	E257	P255-E257 PolarHBondContact O-N 3.02Å
256	P	39.8	Very low	58.1	Low	104 Å²	104	83 Å²	83	68%	0.675	54%	0.541	S	S	*	.			trans	-49.8	120.5	178.2	20.6	-30.6	0	0	0	106.6
257	E	45.6	Very low	59.9	Low	159 Å²	159	81.6 Å²	81.6	74%	0.743	52%	0.52	S	S	*	.			trans	-40.2	136.4	167.8	-72.9	-100.4	120.6	0	0	106.6	P255 G259	P255-E257 PolarHBondContact O-N 3.02Å; E257-G259 VanDerWaalsContact C-N 3.28Å; E257-G259 PolarHBondContact O-N 2.73Å
258	P	47.8	Very low	62.3	Low	123 Å²	123	76.6 Å²	76.6	80%	0.799	49%	0.488	S	S	*	.			trans	-54.6	99.2	-177.3	19.6	-29.5	0	0	0	108.3	G260	P258-G260 PolarHBondContact O-N 3.47Å; P258-G260 VanDerWaalsContact O-N 3.14Å
259	G	54.5	Low	64.7	Low	13 Å²	13	72 Å²	72	13%	0.134	46%	0.455	C	S	.	.			trans	-56.5	124.5	-177.3	0	0	0	0	0	105.9	E257 E261 T287	E257-G259 VanDerWaalsContact C-N 3.28Å; E257-G259 PolarHBondContact O-N 2.73Å; G259-E261 PolarHBondContact O-N 3.17Å; G259-T287 PolarHBondContact O-OG1 2.82Å
260	G	78.6	Confident	66.8	Low	42 Å²	42	71.1 Å²	71.1	43%	0.433	45%	0.449	S	S	.	.			trans	-43.7	136.4	-165.3	0	0	0	0	0	111.7	P258 I262 G288	P258-G260 PolarHBondContact O-N 3.47Å; P258-G260 VanDerWaalsContact O-N 3.14Å; G260-I262 PolarHBondContact O-N 3.34Å; G260-G288 WeakPolarHBondContact O-CA 3.18Å; G260-G288 PolarHBondContact O-N 2.96Å
261	E	87.7	Confident	68.9	Low	146 Å²	146	71.2 Å²	71.2	68%	0.682	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	130.3	178.8	-63.3	-179.5	158.1	0	0	109.6	G259 K285 T286	G259-E261 PolarHBondContact O-N 3.17Å; E261-K285 WeakPolarHBondContact OE2-CE 3.14Å; E261-K285 IonicContact OE2-NZ 3.54Å; E261-K285 PolarHBondContact OE2-NZ 2.89Å; E261-T286 WeakPolarHBondContact CA-O 3.23Å
262	I	88.6	Confident	70.8	Confident	17 Å²	17	70.6 Å²	70.6	9%	0.087	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.8	177.3	-63.1	-171.6	0	0	0	108.9	G260 K285 T286 L381 E382 N385 L395	G260-I262 PolarHBondContact O-N 3.34Å; I262-K285 WeakPolarHBondContact O-CA 3.35Å; I262-T286 PolarHBondContact N-O 3.07Å; I262-T286 PolarHBondContact O-N 2.84Å; I262-L381 HydrophobicContact CD1-CB 3.75Å; I262-L381 WeakPolarHBondContact CD1-O 3.45Å; I262-E382 HydrophobicContact CD1-CB 4.38Å; I262-N385 HydrophobicContact CD1-CB 4.37Å; I262-L395 HydrophobicContact CG2-CB 4.42Å; I262-L395 HydrophobicContact CG2-CD2 4.5Å
263	E	91	Very high	72.9	Confident	57 Å²	57	67.6 Å²	67.6	27%	0.266	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.8	169.8	-64.7	-178.4	-170.5	0	0	109.4	S17 K285 P394 L395	S17-E263 WeakPolarHBondContact CB-OE1 3.39Å; E263-K285 HydrophobicContact CG-CD 4.21Å; E263-K285 HydrophobicContact CG-CG 4.12Å; E263-P394 HydrophobicContact CB-CB 4.19Å; E263-P394 HydrophobicContact CB-CG 4.36Å; E263-P394 CarbonylContact O-C 3.46Å; E263-P394 VanDerWaalsContact O-CA 3.31Å; E263-P394 WeakPolarHBondContact O-CA 3.44Å; E263-L395 PolarHBondContact O-N 3.32Å
264	L	92.6	Very high	74.6	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.1	179.3	69.2	87.5	0	0	0	112.6	F266 V284 T286 L295 L381 L395 L397	L264-F266 HydrophobicContact CD1-CB 3.74Å; L264-F266 HydrophobicContact CD1-CD1 4.48Å; L264-F266 HydrophobicContact CD1-CG 4.17Å; L264-V284 HydrophobicContact CD1-CB 3.74Å; L264-V284 HydrophobicContact CD1-CG2 4.11Å; L264-V284 HydrophobicContact CG-CB 3.92Å; L264-V284 PolarHBondContact N-O 3.39Å; L264-V284 PolarHBondContact O-N 2.88Å; L264-T286 HydrophobicContact CD2-CG2 4.45Å; L264-L295 HydrophobicContact CD2-CD1 3.79Å; L264-L295 HydrophobicContact CD2-CD2 3.96Å; L264-L381 HydrophobicContact CD2-CD1 3.98Å; L264-L395 CarbonylContact C-O 3.53Å; L264-L395 WeakPolarHBondContact CA-O 3.36Å; L264-L395 HydrophobicContact CB-CB 3.91Å; L264-L395 WeakPolarHBondContact CB-O 3.32Å; L264-L397 HydrophobicContact CD2-CD1 4.38Å
265	V	91.8	Very high	75.7	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.024	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.7	170.8	-174.2	0	0	0	0	107.2	L18 R267 T281 Y283 P394 L395 E396 L397	L18-V265 HydrophobicContact CD1-CG2 4.18Å; V265-R267 HydrophobicContact CG1-CG 4.02Å; V265-T281 HydrophobicContact CG1-CG2 3.69Å; V265-Y283 HydrophobicContact CG1-CD1 4.41Å; V265-Y283 HydrophobicContact CG1-CE1 4.13Å; V265-Y283 HydrophobicContact CG2-CD1 4.03Å; V265-Y283 HydrophobicContact CG2-CE1 4.11Å; V265-P394 HydrophobicContact CG2-CB 4.23Å; V265-L395 PolarHBondContact N-O 2.64Å; V265-E396 HydrophobicContact CB-CG 4.42Å; V265-E396 WeakPolarHBondContact O-CA 3.4Å; V265-L397 PolarHBondContact O-N 3.39Å
266	F	92.5	Very high	76.1	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	109	-175.2	-150.5	-175.3	0	0	0	110	L264 T281 R282 L295 L299 I363 L397 Y399	L264-F266 HydrophobicContact CD1-CB 3.74Å; L264-F266 HydrophobicContact CD1-CD1 4.48Å; L264-F266 HydrophobicContact CD1-CG 4.17Å; F266-T281 CarbonylContact O-C 3.54Å; F266-T281 WeakPolarHBondContact O-CA 3.44Å; F266-R282 HydrophobicContact CB-CB 4.27Å; F266-R282 PolarHBondContact N-O 3.05Å; F266-R282 PolarHBondContact O-N 2.91Å; F266-L295 HydrophobicContact CE1-CB 4.24Å; F266-L295 HydrophobicContact CZ-CB 4.33Å; F266-L299 HydrophobicContact CE1-CB 4.16Å; F266-L299 HydrophobicContact CE1-CD2 4.24Å; F266-L299 HydrophobicContact CZ-CD2 4.37Å; F266-I363 HydrophobicContact CE2-CD1 4.06Å; F266-I363 HydrophobicContact CE2-CG2 3.96Å; F266-I363 HydrophobicContact CZ-CD1 3.51Å; F266-I363 HydrophobicContact CZ-CG1 4.23Å; F266-I363 HydrophobicContact CZ-CG2 4.21Å; F266-L397 WeakPolarHBondContact CA-O 3.28Å; F266-L397 HydrophobicContact CD2-CB 3.76Å; F266-L397 HydrophobicContact CE2-CB 3.94Å; F266-Y399 HydrophobicContact CD1-CD1 4.37Å; F266-Y399 AromaticContact CD2-CD1 3.76Å; F266-Y399 HydrophobicContact CD2-CD1 3.76Å; F266-Y399 HydrophobicContact CE1-CD1 4.5Å; F266-Y399 AromaticContact CE2-CD1 3.92Å; F266-Y399 HydrophobicContact CE2-CD1 3.92Å; F266-Y399 HydrophobicContact CE2-CG 4.3Å; F266-Y399 HydrophobicContact CG-CD1 4.02Å; F266-Y399 HydrophobicContact CZ-CD1 4.31Å
267	R	91.3	Very high	77.1	Confident	89 Å²	89	74.3 Å²	74.3	34%	0.336	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	152	-174.1	-59	-170.7	-173.1	122.7	5.3	111.7	V265 T281 E396 L397 C398 Y399	V265-R267 HydrophobicContact CG1-CG 4.02Å; R267-T281 HydrophobicContact CG-CG2 3.87Å; R267-E396 IonicContact CZ-OE1 3.47Å; R267-E396 IonicContact CZ-OE2 2.73Å; R267-E396 IonicContact NH1-OE1 3.56Å; R267-E396 PolarHBondContact NH1-OE1 2.85Å; R267-E396 IonicContact NH1-OE2 2.77Å; R267-E396 PolarHBondContact NH1-OE2 3.11Å; R267-E396 VanDerWaalsContact NH2-CD 3.32Å; R267-E396 IonicContact NH2-OE1 3.33Å; R267-E396 PolarHBondContact NH2-OE1 3.4Å; R267-E396 IonicContact NH2-OE2 3.63Å; R267-L397 PolarHBondContact N-O 3.03Å; R267-C398 CarbonylContact O-C 3.57Å; R267-C398 WeakPolarHBondContact O-CA 3.32Å; R267-Y399 VanDerWaalsContact C-CE1 3.49Å; R267-Y399 WeakPolarHBondContact O-CD1 3.46Å; R267-Y399 PolarHBondContact O-N 3.43Å
268	P	90.8	Very high	77.8	Confident	25 Å²	25	69 Å²	69	16%	0.162	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	142.5	166.1	27.6	-34.8	0	0	0	110.2	V273 C279 Y399	P268-V273 HydrophobicContact CB-CB 4.06Å; P268-V273 HydrophobicContact CB-CG1 4.07Å; P268-V273 HydrophobicContact CB-CG2 4.08Å; P268-C279 HydrophobicContact CG-CB 4.24Å; P268-Y399 HydrophobicContact CB-CE2 4.26Å
269	H	89	Confident	78.7	Confident	9 Å²	9	66 Å²	66	4%	0.042	36%	0.358	C	S	.	.			trans	-66.4	122.8	178.8	-173	-71.9	0	0	0	110.3	L271 L272 V273 Y364 F372 C398 Y399 A400	H269-L271 PolarHBondContact ND1-N 3.45Å; H269-L271 PolarHBondContact O-N 3.23Å; H269-L271 VanDerWaalsContact O-N 3.07Å; H269-L272 HydrophobicContact CB-CB 4.06Å; H269-L272 WeakPolarHBondContact ND1-CG 3.16Å; H269-L272 PolarHBondContact ND1-N 2.88Å; H269-L272 PolarHBondContact O-N 3.39Å; H269-V273 HydrophobicContact CB-CG2 4.29Å; H269-V273 PolarHBondContact O-N 2.89Å; H269-V273 VanDerWaalsContact O-N 3.09Å; H269-Y364 AromaticContact CD2-CD2 3.79Å; H269-Y364 AromaticContact CD2-CG 3.78Å; H269-F372 AromaticContact CD2-CD1 3.93Å; H269-F372 AromaticContact CE1-CD2 3.98Å; H269-F372 AromaticContact NE2-CD1 3.71Å; H269-F372 AromaticContact NE2-CD2 3.58Å; H269-F372 AromaticContact NE2-CG 3.34Å; H269-F372 VanDerWaalsContact NE2-CG 3.34Å; H269-F372 WeakPolarHBondContact NE2-CG 3.49Å; H269-C398 HydrophobicContact CB-CB 4.39Å; H269-Y399 VanDerWaalsContact CB-O 3.28Å; H269-Y399 WeakPolarHBondContact CB-O 3.41Å; H269-Y399 PolarHBondContact N-O 2.95Å; H269-A400 HydrophobicContact CB-CB 3.95Å
270	P	85.7	Confident	79.9	Confident	85 Å²	85	70.1 Å²	70.1	55%	0.552	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-21	-165.8	24.8	-34.9	0	0	0	114.7	F372	P270-F372 HydrophobicContact CG-CE1 4.41Å; P270-F372 HydrophobicContact CG-CE2 3.9Å; P270-F372 HydrophobicContact CG-CZ 3.51Å
271	L	83.8	Confident	80.4	Confident	145 Å²	145	70.6 Å²	70.6	76%	0.759	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-14.2	-179.7	-55.7	176.5	0	0	0	114.2	H269	H269-L271 PolarHBondContact ND1-N 3.45Å; H269-L271 PolarHBondContact O-N 3.23Å; H269-L271 VanDerWaalsContact O-N 3.07Å
272	L	83	Confident	80.5	Confident	61 Å²	61	64.3 Å²	64.3	32%	0.319	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-10.9	-170.8	-65.9	176	0	0	0	112.8	H269 Y364 A400	H269-L272 HydrophobicContact CB-CB 4.06Å; H269-L272 WeakPolarHBondContact ND1-CG 3.16Å; H269-L272 PolarHBondContact ND1-N 2.88Å; H269-L272 PolarHBondContact O-N 3.39Å; L272-Y364 HydrophobicContact CD1-CE1 4.37Å; L272-Y364 HydrophobicContact CD1-CE2 4.26Å; L272-A400 HydrophobicContact CB-CB 3.69Å; L272-A400 HydrophobicContact CD1-CB 4.02Å
273	V	79.4	Confident	80.6	Confident	17 Å²	17	67 Å²	67	10%	0.103	35%	0.347	C	S	.	.	S	Bend	trans	-113	117.4	174.4	-175.3	0	0	0	0	107.4	P268 H269 E277 A400	P268-V273 HydrophobicContact CB-CB 4.06Å; P268-V273 HydrophobicContact CB-CG1 4.07Å; P268-V273 HydrophobicContact CB-CG2 4.08Å; H269-V273 HydrophobicContact CB-CG2 4.29Å; H269-V273 PolarHBondContact O-N 2.89Å; H269-V273 VanDerWaalsContact O-N 3.09Å; V273-E277 HydrophobicContact CG1-CB 4.36Å; V273-A400 HydrophobicContact CG2-CB 4.26Å
274	E	72.9	Confident	80.6	Confident	155 Å²	155	64.9 Å²	64.9	72%	0.724	34%	0.338	S	S	*	.			trans	-72.8	149.3	178.5	-67.8	-171.8	173	0	0	111.5	G276 E277 C279	E274-G276 VanDerWaalsContact C-N 3.32Å; E274-G276 PolarHBondContact O-N 2.88Å; E274-E277 PolarHBondContact O-N 2.92Å; E274-C279 PolarHBondContact O-SG 2.99Å
275	K	57.4	Low	80.5	Confident	219 Å²	219	68 Å²	68	95%	0.952	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	88.3	175.6	-71.1	-176.5	179	179.6	0	109.5
276	G	54.5	Low	80.6	Confident	76 Å²	76	69.8 Å²	69.8	78%	0.784	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	155.7	-24	-177.4	0	0	0	0	0	113.2	E274	E274-G276 VanDerWaalsContact C-N 3.32Å; E274-G276 PolarHBondContact O-N 2.88Å
277	E	60.2	Low	80.6	Confident	116 Å²	116	72.7 Å²	72.7	54%	0.542	38%	0.381	S	S	.	.	S	Bend	trans	-82.6	177.3	167.6	-65.4	-168.7	148.7	0	0	110.8	V273 E274 C279	V273-E277 HydrophobicContact CG1-CB 4.36Å; E274-E277 PolarHBondContact O-N 2.92Å; E277-C279 PolarHBondContact O-N 3.42Å; E277-C279 PolarHBondContact O-SG 3.28Å
278	Y	61.5	Low	80.6	Confident	47 Å²	47	68.4 Å²	68.4	18%	0.184	37%	0.365	C	S	.	.			trans	-60.5	91.8	-174.4	-168.8	-80.7	0	0	0	112.3	Q280 R282 I303 E306 Y399	Y278-Q280 HydrophobicContact CE1-CB 3.76Å; Y278-Q280 PolarHBondContact OH-OE1 3.25Å; Y278-R282 PolarHBondContact OH-NH1 3.49Å; Y278-R282 PolarHBondContact OH-NH2 3.32Å; Y278-I303 HydrophobicContact CD1-CD1 3.47Å; Y278-I303 VanDerWaalsContact CD1-CD1 3.47Å; Y278-I303 HydrophobicContact CD1-CG1 3.5Å; Y278-I303 VanDerWaalsContact CD1-CG1 3.5Å; Y278-I303 HydrophobicContact CD2-CG1 4.24Å; Y278-I303 HydrophobicContact CD2-CG2 4.03Å; Y278-I303 HydrophobicContact CE1-CD1 4.01Å; Y278-I303 HydrophobicContact CE1-CG1 3.61Å; Y278-I303 HydrophobicContact CE2-CG1 4.26Å; Y278-I303 HydrophobicContact CE2-CG2 4.48Å; Y278-I303 HydrophobicContact CG-CD1 3.97Å; Y278-I303 HydrophobicContact CG-CG1 3.9Å; Y278-I303 HydrophobicContact CG-CG2 4.1Å; Y278-E306 WeakPolarHBondContact CE2-OE2 3.48Å; Y278-E306 PolarHBondContact OH-OE2 3.47Å; Y278-Y399 PolarHBondContact O-OH 3.19Å; Y278-Y399 VanDerWaalsContact O-OH 3.14Å
279	C	65.2	Low	80.7	Confident	60 Å²	60	70.4 Å²	70.4	41%	0.405	37%	0.374	S	S	.	.			trans	-105.6	36.3	-170.2	-66.8	0	0	0	0	114.3	P268 E274 E277	P268-C279 HydrophobicContact CG-CB 4.24Å; E274-C279 PolarHBondContact O-SG 2.99Å; E277-C279 PolarHBondContact O-N 3.42Å; E277-C279 PolarHBondContact O-SG 3.28Å
280	Q	81.4	Confident	80.9	Confident	99 Å²	99	70.3 Å²	70.3	46%	0.463	38%	0.375	S	S	.	.			trans	-86	128	-178.2	-158.1	178.8	47.5	0	0	112.4	Y278 Y399	Y278-Q280 HydrophobicContact CE1-CB 3.76Å; Y278-Q280 PolarHBondContact OH-OE1 3.25Å; Q280-Y399 PolarHBondContact O-OH 3.05Å
281	T	88	Confident	81.4	Confident	52 Å²	52	67.4 Å²	67.4	32%	0.319	36%	0.356	S	S	.	.			trans	-73.4	131.3	164.8	-65.3	0	0	0	0	109.4	V265 F266 R267 Y283	V265-T281 HydrophobicContact CG1-CG2 3.69Å; F266-T281 CarbonylContact O-C 3.54Å; F266-T281 WeakPolarHBondContact O-CA 3.44Å; R267-T281 HydrophobicContact CG-CG2 3.87Å; T281-Y283 HydrophobicContact CG2-CE2 4.31Å
282	R	88.9	Confident	81.9	Confident	14 Å²	14	60.7 Å²	60.7	5%	0.053	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.1	-179	-55.1	-177.1	-177.8	-89	22.8	110.5	F266 Y278 V284 E306	F266-R282 HydrophobicContact CB-CB 4.27Å; F266-R282 PolarHBondContact N-O 3.05Å; F266-R282 PolarHBondContact O-N 2.91Å; Y278-R282 PolarHBondContact OH-NH1 3.49Å; Y278-R282 PolarHBondContact OH-NH2 3.32Å; R282-V284 HydrophobicContact CB-CG2 4.24Å; R282-E306 IonicContact CZ-OE1 3.15Å; R282-E306 IonicContact CZ-OE2 3.61Å; R282-E306 IonicContact NH1-OE1 2.89Å; R282-E306 PolarHBondContact NH1-OE1 2.91Å; R282-E306 IonicContact NH1-OE2 2.64Å; R282-E306 PolarHBondContact NH1-OE2 2.96Å; R282-E306 IonicContact NH2-OE1 3.9Å; R282-E306 IonicContact NH2-OE2 3.58Å; R282-E306 PolarHBondContact NH2-OE2 3.45Å
283	Y	91.5	Very high	82.5	Confident	73 Å²	73	60.8 Å²	60.8	29%	0.286	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.8	171.2	-56.9	-90.2	0	0	0	106.8	L18 Y19 H22 V265 T281	L18-Y283 HydrophobicContact CB-CD1 3.96Å; L18-Y283 HydrophobicContact CB-CE1 4.46Å; Y19-Y283 WeakPolarHBondContact CD2-O 3.47Å; H22-Y283 HydrophobicContact CB-CD2 3.56Å; H22-Y283 HydrophobicContact CB-CE2 4.18Å; H22-Y283 HydrophobicContact CB-CG 4.12Å; H22-Y283 AromaticContact CD2-CD2 3.78Å; H22-Y283 AromaticContact CD2-CE2 3.44Å; H22-Y283 VanDerWaalsContact CD2-CE2 3.44Å; H22-Y283 WeakPolarHBondContact CD2-CE2 3.49Å; H22-Y283 AromaticContact CE1-CE1 3.94Å; H22-Y283 AromaticContact CE1-CE2 3.74Å; H22-Y283 AromaticContact CE1-CZ 3.63Å; H22-Y283 AromaticContact CG-CD2 3.37Å; H22-Y283 AromaticContact CG-CE2 3.53Å; H22-Y283 AromaticContact CG-CG 3.96Å; H22-Y283 AromaticContact ND1-CD2 3.61Å; H22-Y283 AromaticContact ND1-CE2 3.71Å; H22-Y283 AromaticContact ND1-CG 3.78Å; H22-Y283 AromaticContact ND1-CZ 3.93Å; H22-Y283 AromaticContact NE2-CE2 3.58Å; H22-Y283 AromaticContact NE2-CZ 3.69Å; V265-Y283 HydrophobicContact CG1-CD1 4.41Å; V265-Y283 HydrophobicContact CG1-CE1 4.13Å; V265-Y283 HydrophobicContact CG2-CD1 4.03Å; V265-Y283 HydrophobicContact CG2-CE1 4.11Å; T281-Y283 HydrophobicContact CG2-CE2 4.31Å
284	V	91.2	Very high	83.2	Confident	13 Å²	13	65.3 Å²	65.3	8%	0.079	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.1	-173.1	-177.7	0	0	0	0	108.9	L264 R282 Y298	L264-V284 HydrophobicContact CD1-CB 3.74Å; L264-V284 HydrophobicContact CD1-CG2 4.11Å; L264-V284 HydrophobicContact CG-CB 3.92Å; L264-V284 PolarHBondContact N-O 3.39Å; L264-V284 PolarHBondContact O-N 2.88Å; R282-V284 HydrophobicContact CB-CG2 4.24Å; V284-Y298 HydrophobicContact CG2-CE1 3.77Å
285	K	90.8	Very high	84.2	Confident	68 Å²	68	58.2 Å²	58.2	30%	0.296	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.2	170	-170.4	172.6	-179.6	-177.7	0	108.4	Y19 E261 I262 E263	Y19-K285 HydrophobicContact CD1-CB 3.98Å; Y19-K285 HydrophobicContact CD2-CB 4.49Å; Y19-K285 HydrophobicContact CG-CB 3.91Å; E261-K285 WeakPolarHBondContact OE2-CE 3.14Å; E261-K285 IonicContact OE2-NZ 3.54Å; E261-K285 PolarHBondContact OE2-NZ 2.89Å; I262-K285 WeakPolarHBondContact O-CA 3.35Å; E263-K285 HydrophobicContact CG-CD 4.21Å; E263-K285 HydrophobicContact CG-CG 4.12Å
286	T	93.3	Very high	85.9	Confident	42 Å²	42	47.9 Å²	47.9	26%	0.258	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	174.9	-176.5	-171.4	0	0	0	0	110.5	E261 I262 L264 A290 L381	E261-T286 WeakPolarHBondContact CA-O 3.23Å; I262-T286 PolarHBondContact N-O 3.07Å; I262-T286 PolarHBondContact O-N 2.84Å; L264-T286 HydrophobicContact CD2-CG2 4.45Å; T286-A290 HydrophobicContact CG2-CB 4.23Å; T286-L381 HydrophobicContact CG2-CD1 3.4Å
287	T	93.3	Very high	87.7	Confident	61 Å²	61	49.3 Å²	49.3	37%	0.374	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	144.5	173.9	173.7	0	0	0	0	111.2	G259 N289 A290	G259-T287 PolarHBondContact O-OG1 2.82Å; T287-N289 PolarHBondContact O-N 3.39Å; T287-N289 PolarHBondContact OG1-N 3.16Å; T287-A290 HydrophobicContact CG2-CB 4.21Å; T287-A290 VanDerWaalsContact O-CB 3.25Å; T287-A290 WeakPolarHBondContact O-CB 3.48Å; T287-A290 PolarHBondContact O-N 2.95Å
288	G	90.5	Very high	89.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.9	173.8	0	0	0	0	0	114.4	G260 A290 L381 E382	G260-G288 WeakPolarHBondContact O-CA 3.18Å; G260-G288 PolarHBondContact O-N 2.96Å; G288-A290 VanDerWaalsContact C-N 3.26Å; G288-A290 PolarHBondContact O-N 3.33Å; G288-L381 PolarHBondContact O-N 3.13Å; G288-E382 PolarHBondContact O-N 2.95Å
289	N	92.6	Very high	90.7	Very high	66 Å²	66	45.5 Å²	45.5	35%	0.353	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.2	176.2	-65.3	-9.6	0	0	0	113.2	T287	T287-N289 PolarHBondContact O-N 3.39Å; T287-N289 PolarHBondContact OG1-N 3.16Å
290	A	94.4	Very high	91.8	Very high	8 Å²	8	42.9 Å²	42.9	7%	0.066	21%	0.212	C	C	.	.			trans	-62.2	148.6	172.7	0	0	0	0	0	109.7	T286 T287 G288 T380 L381	T286-A290 HydrophobicContact CG2-CB 4.23Å; T287-A290 HydrophobicContact CG2-CB 4.21Å; T287-A290 VanDerWaalsContact O-CB 3.25Å; T287-A290 WeakPolarHBondContact O-CB 3.48Å; T287-A290 PolarHBondContact O-N 2.95Å; G288-A290 VanDerWaalsContact C-N 3.26Å; G288-A290 PolarHBondContact O-N 3.33Å; A290-T380 CarbonylContact O-C 3.6Å; A290-T380 VanDerWaalsContact O-CA 3.29Å; A290-T380 WeakPolarHBondContact O-CA 3.47Å; A290-L381 HydrophobicContact CB-CD1 4Å; A290-L381 HydrophobicContact CB-CG 4.39Å; A290-L381 WeakPolarHBondContact O-CG 3.45Å; A290-L381 PolarHBondContact O-N 3.46Å
291	T	95.8	Very high	92.2	Very high	24 Å²	24	41.4 Å²	41.4	15%	0.147	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-102.9	167.2	-179.5	64.9	0	0	0	0	110.8	D293 H294 L295 G377 L379 T380	T291-D293 PolarHBondContact O-N 3.38Å; T291-H294 PolarHBondContact N-ND1 2.77Å; T291-H294 VanDerWaalsContact N-ND1 3.11Å; T291-H294 WeakPolarHBondContact O-CB 3.35Å; T291-H294 PolarHBondContact O-N 3.02Å; T291-H294 VanDerWaalsContact O-N 3.14Å; T291-H294 PolarHBondContact OG1-N 2.95Å; T291-H294 PolarHBondContact OG1-ND1 2.83Å; T291-L295 PolarHBondContact O-N 2.91Å; T291-G377 WeakPolarHBondContact CB-O 3.36Å; T291-L379 CarbonylContact C-O 3.45Å; T291-L379 WeakPolarHBondContact CA-O 3.25Å; T291-T380 HydrophobicContact CG2-CG2 4.46Å
292	V	94.6	Very high	92.2	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-36	172.8	175.4	0	0	0	0	111.2	H294 L295 S296 I363 L375 N376 G377 L379 V384	V292-H294 VanDerWaalsContact C-N 3.34Å; V292-H294 PolarHBondContact O-N 3.4Å; V292-L295 WeakPolarHBondContact O-CB 3.18Å; V292-L295 PolarHBondContact O-N 3.09Å; V292-L295 VanDerWaalsContact O-N 3.14Å; V292-S296 PolarHBondContact O-N 3.23Å; V292-I363 HydrophobicContact CG1-CB 3.64Å; V292-I363 HydrophobicContact CG1-CG1 3.65Å; V292-I363 HydrophobicContact CG1-CG2 4.23Å; V292-L375 HydrophobicContact CG1-CB 4.01Å; V292-L375 HydrophobicContact CG2-CB 3.9Å; V292-L375 HydrophobicContact CG2-CD1 4.14Å; V292-N376 WeakPolarHBondContact CB-O 3.4Å; V292-G377 PolarHBondContact N-O 3.37Å; V292-L379 HydrophobicContact CG2-CB 4.28Å; V292-L379 PolarHBondContact N-O 3.43Å; V292-V384 HydrophobicContact CG2-CG2 4.07Å
293	D	94.5	Very high	92.1	Very high	63 Å²	63	41.9 Å²	41.9	34%	0.337	20%	0.203	S	C	.	.	H	α-helix	trans	-62.6	-39.1	173.6	-74.8	-24.6	0	0	0	112.2	T291 L295 S296 K297 E358 G377	T291-D293 PolarHBondContact O-N 3.38Å; D293-L295 VanDerWaalsContact C-N 3.3Å; D293-L295 PolarHBondContact O-N 3.21Å; D293-S296 PolarHBondContact O-N 3.25Å; D293-K297 WeakPolarHBondContact O-CB 3.44Å; D293-K297 PolarHBondContact O-N 2.92Å; D293-E358 HydrophobicContact CB-CB 3.98Å; D293-E358 HydrophobicContact CB-CG 4.23Å; D293-G377 VanDerWaalsContact CG-C 3.46Å; D293-G377 PolarHBondContact N-O 3.22Å; D293-G377 WeakPolarHBondContact OD1-CA 3.31Å; D293-G377 VanDerWaalsContact OD2-C 3.26Å; D293-G377 WeakPolarHBondContact OD2-CA 3.46Å
294	H	94.6	Very high	91.8	Very high	112 Å²	112	40 Å²	40	52%	0.519	20%	0.202	S	C	.	.	H	α-helix	trans	-60.8	-39.6	173.2	-63	147.6	0	0	0	111.7	T291 V292 Y298	T291-H294 PolarHBondContact N-ND1 2.77Å; T291-H294 VanDerWaalsContact N-ND1 3.11Å; T291-H294 WeakPolarHBondContact O-CB 3.35Å; T291-H294 PolarHBondContact O-N 3.02Å; T291-H294 VanDerWaalsContact O-N 3.14Å; T291-H294 PolarHBondContact OG1-N 2.95Å; T291-H294 PolarHBondContact OG1-ND1 2.83Å; V292-H294 VanDerWaalsContact C-N 3.34Å; V292-H294 PolarHBondContact O-N 3.4Å; H294-Y298 VanDerWaalsContact O-CB 3.22Å; H294-Y298 WeakPolarHBondContact O-CB 3.45Å; H294-Y298 PolarHBondContact O-N 3.28Å
295	L	93.9	Very high	91.5	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-41.1	176.3	-68.6	-171.7	0	0	0	112.8	L264 F266 T291 V292 D293 Y298 L299 L381 L397	L264-L295 HydrophobicContact CD2-CD1 3.79Å; L264-L295 HydrophobicContact CD2-CD2 3.96Å; F266-L295 HydrophobicContact CE1-CB 4.24Å; F266-L295 HydrophobicContact CZ-CB 4.33Å; T291-L295 PolarHBondContact O-N 2.91Å; V292-L295 WeakPolarHBondContact O-CB 3.18Å; V292-L295 PolarHBondContact O-N 3.09Å; V292-L295 VanDerWaalsContact O-N 3.14Å; D293-L295 VanDerWaalsContact C-N 3.3Å; D293-L295 PolarHBondContact O-N 3.21Å; L295-Y298 PolarHBondContact O-N 3.48Å; L295-L299 WeakPolarHBondContact O-CB 3.32Å; L295-L299 PolarHBondContact O-N 3Å; L295-L381 HydrophobicContact CD1-CD1 4.02Å; L295-L381 HydrophobicContact CD1-CD2 3.46Å; L295-L381 VanDerWaalsContact CD1-CD2 3.46Å; L295-L381 HydrophobicContact CD1-CG 4.34Å; L295-L381 HydrophobicContact CD2-CD1 4.13Å; L295-L381 HydrophobicContact CG-CD1 4.15Å; L295-L381 HydrophobicContact CG-CD2 4.1Å; L295-L397 HydrophobicContact CD1-CD1 3.52Å
296	S	93.1	Very high	91.2	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-47.8	176.1	-179.8	0	0	0	0	111.2	V292 D293 Y298 L299 A300 E358 Y361	V292-S296 PolarHBondContact O-N 3.23Å; D293-S296 PolarHBondContact O-N 3.25Å; S296-Y298 PolarHBondContact O-N 2.87Å; S296-L299 WeakPolarHBondContact O-CB 3.39Å; S296-L299 PolarHBondContact O-N 3.45Å; S296-A300 PolarHBondContact O-N 3.18Å; S296-E358 VanDerWaalsContact CB-O 3.27Å; S296-E358 WeakPolarHBondContact CB-O 3.37Å; S296-E358 PolarHBondContact OG-O 3.41Å; S296-Y361 PolarHBondContact OG-N 3.22Å; S296-Y361 PolarHBondContact OG-O 3.09Å
297	K	91.9	Very high	90.8	Very high	106 Å²	106	43.9 Å²	43.9	46%	0.461	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-41.9	176.7	-170.3	170.8	-175.8	168.3	0	112.2	D293 L299 A300 L301 V356 E358	D293-K297 WeakPolarHBondContact O-CB 3.44Å; D293-K297 PolarHBondContact O-N 2.92Å; K297-L299 VanDerWaalsContact C-N 3.32Å; K297-L299 PolarHBondContact O-N 3.38Å; K297-A300 PolarHBondContact O-N 3.07Å; K297-L301 WeakPolarHBondContact O-CB 3.46Å; K297-L301 PolarHBondContact O-N 3.38Å; K297-V356 HydrophobicContact CG-CG1 4.31Å; K297-E358 HydrophobicContact CB-CB 4.2Å
298	Y	93.4	Very high	90.2	Very high	84 Å²	84	43.9 Å²	43.9	33%	0.329	21%	0.206	S	C	.	.	H	α-helix	trans	-56.2	-47.6	173.1	161.6	-99.3	0	0	0	111.2	V284 H294 L295 S296 L301 R302	V284-Y298 HydrophobicContact CG2-CE1 3.77Å; H294-Y298 VanDerWaalsContact O-CB 3.22Å; H294-Y298 WeakPolarHBondContact O-CB 3.45Å; H294-Y298 PolarHBondContact O-N 3.28Å; L295-Y298 PolarHBondContact O-N 3.48Å; S296-Y298 PolarHBondContact O-N 2.87Å; Y298-L301 PolarHBondContact O-N 3.13Å; Y298-R302 HydrophobicContact CE2-CB 4.39Å; Y298-R302 WeakPolarHBondContact O-CB 3.49Å; Y298-R302 PolarHBondContact O-N 2.87Å
299	L	91	Very high	89.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-46.8	-179.3	-179.7	64.7	0	0	0	111.4	F266 L295 S296 K297 R302 I303 Y361 Y399	F266-L299 HydrophobicContact CE1-CB 4.16Å; F266-L299 HydrophobicContact CE1-CD2 4.24Å; F266-L299 HydrophobicContact CZ-CD2 4.37Å; L295-L299 WeakPolarHBondContact O-CB 3.32Å; L295-L299 PolarHBondContact O-N 3Å; S296-L299 WeakPolarHBondContact O-CB 3.39Å; S296-L299 PolarHBondContact O-N 3.45Å; K297-L299 VanDerWaalsContact C-N 3.32Å; K297-L299 PolarHBondContact O-N 3.38Å; L299-R302 PolarHBondContact O-N 3.45Å; L299-I303 HydrophobicContact CD1-CD1 3.74Å; L299-I303 HydrophobicContact CD1-CG1 4.18Å; L299-I303 HydrophobicContact CG-CD1 3.83Å; L299-I303 WeakPolarHBondContact O-CB 3.41Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.48Å; L299-I303 PolarHBondContact O-N 3.41Å; L299-Y361 HydrophobicContact CD2-CD1 3.61Å; L299-Y361 HydrophobicContact CD2-CD2 4.05Å; L299-Y361 HydrophobicContact CD2-CE1 4.13Å; L299-Y361 HydrophobicContact CD2-CG 3.58Å; L299-Y361 HydrophobicContact CG-CD1 4.42Å; L299-Y361 HydrophobicContact CG-CD2 4.21Å; L299-Y361 HydrophobicContact CG-CE2 4.4Å; L299-Y361 HydrophobicContact CG-CG 4.24Å; L299-Y399 HydrophobicContact CD1-CD1 4.3Å; L299-Y399 HydrophobicContact CD1-CE1 4.11Å; L299-Y399 HydrophobicContact CD1-CE2 4.41Å; L299-Y399 HydrophobicContact CD2-CD1 3.75Å; L299-Y399 HydrophobicContact CD2-CD2 3.4Å; L299-Y399 HydrophobicContact CD2-CE1 4.29Å; L299-Y399 HydrophobicContact CD2-CE2 3.98Å; L299-Y399 HydrophobicContact CD2-CG 3.27Å
300	A	89.8	Confident	89.1	Confident	5 Å²	5	51.9 Å²	51.9	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-47.9	176.9	0	0	0	0	0	112.3	S296 K297 R302 A304 V356 Q360 Y361	S296-A300 PolarHBondContact O-N 3.18Å; K297-A300 PolarHBondContact O-N 3.07Å; A300-R302 PolarHBondContact O-N 3.43Å; A300-A304 WeakPolarHBondContact O-CB 3.01Å; A300-A304 PolarHBondContact O-N 2.96Å; A300-V356 HydrophobicContact CB-CG1 3.8Å; A300-Q360 HydrophobicContact CB-CB 4.33Å; A300-Q360 VanDerWaalsContact CB-OE1 3.27Å; A300-Y361 HydrophobicContact CB-CD2 3.98Å; A300-Y361 HydrophobicContact CB-CE2 3.87Å
301	L	88.8	Confident	88.2	Confident	67 Å²	67	58 Å²	58	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-60.2	-47.7	176.7	-174.8	66.7	0	0	0	111.2	K297 Y298 I303 A304 L305 L353 V356	K297-L301 WeakPolarHBondContact O-CB 3.46Å; K297-L301 PolarHBondContact O-N 3.38Å; Y298-L301 PolarHBondContact O-N 3.13Å; L301-I303 PolarHBondContact O-N 2.77Å; L301-A304 PolarHBondContact O-N 3.42Å; L301-L305 HydrophobicContact CG-CD1 4.12Å; L301-L305 WeakPolarHBondContact O-CG 3.45Å; L301-L305 PolarHBondContact O-N 3.05Å; L301-L353 HydrophobicContact CD1-CD1 4.23Å; L301-L353 HydrophobicContact CD1-CD2 4.24Å; L301-V356 HydrophobicContact CB-CG1 4.01Å; L301-V356 HydrophobicContact CD1-CG1 4.46Å; L301-V356 HydrophobicContact CD1-CG2 4.34Å
302	R	88.9	Confident	87.1	Confident	75 Å²	75	63.4 Å²	63.4	28%	0.283	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-41.4	-175.6	-170.9	68.5	-154.9	173.2	3	111.8	Y298 L299 A300 L305 E306	Y298-R302 HydrophobicContact CE2-CB 4.39Å; Y298-R302 WeakPolarHBondContact O-CB 3.49Å; Y298-R302 PolarHBondContact O-N 2.87Å; L299-R302 PolarHBondContact O-N 3.45Å; A300-R302 PolarHBondContact O-N 3.43Å; R302-L305 PolarHBondContact O-N 3.2Å; R302-E306 WeakPolarHBondContact CG-OE1 3.35Å; R302-E306 IonicContact CZ-OE1 3.68Å; R302-E306 IonicContact NE-OE1 2.87Å; R302-E306 PolarHBondContact NE-OE1 2.8Å; R302-E306 IonicContact NH2-OE1 3.6Å; R302-E306 WeakPolarHBondContact O-CG 3.15Å; R302-E306 PolarHBondContact O-N 3.47Å
303	I	86.7	Confident	85.6	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-63.8	-43.1	174.8	-68.4	172.3	0	0	0	110.8	Y278 L299 L301 L305 E306 R307 Y361	Y278-I303 HydrophobicContact CD1-CD1 3.47Å; Y278-I303 VanDerWaalsContact CD1-CD1 3.47Å; Y278-I303 HydrophobicContact CD1-CG1 3.5Å; Y278-I303 VanDerWaalsContact CD1-CG1 3.5Å; Y278-I303 HydrophobicContact CD2-CG1 4.24Å; Y278-I303 HydrophobicContact CD2-CG2 4.03Å; Y278-I303 HydrophobicContact CE1-CD1 4.01Å; Y278-I303 HydrophobicContact CE1-CG1 3.61Å; Y278-I303 HydrophobicContact CE2-CG1 4.26Å; Y278-I303 HydrophobicContact CE2-CG2 4.48Å; Y278-I303 HydrophobicContact CG-CD1 3.97Å; Y278-I303 HydrophobicContact CG-CG1 3.9Å; Y278-I303 HydrophobicContact CG-CG2 4.1Å; L299-I303 HydrophobicContact CD1-CD1 3.74Å; L299-I303 HydrophobicContact CD1-CG1 4.18Å; L299-I303 HydrophobicContact CG-CD1 3.83Å; L299-I303 WeakPolarHBondContact O-CB 3.41Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.48Å; L299-I303 PolarHBondContact O-N 3.41Å; L301-I303 PolarHBondContact O-N 2.77Å; I303-L305 PolarHBondContact O-N 3.39Å; I303-E306 PolarHBondContact O-N 3.03Å; I303-R307 WeakPolarHBondContact O-CG 3.38Å; I303-R307 PolarHBondContact O-N 3.34Å; I303-Y361 HydrophobicContact CD1-CE1 4.08Å; I303-Y361 HydrophobicContact CD1-CE2 4.21Å; I303-Y361 WeakPolarHBondContact CD1-OH 3.01Å
304	A	85.8	Confident	83.7	Confident	33 Å²	33	66.8 Å²	66.8	27%	0.273	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-43.6	177.7	0	0	0	0	0	111.9	A300 L301 R307 R308 L353 V356	A300-A304 WeakPolarHBondContact O-CB 3.01Å; A300-A304 PolarHBondContact O-N 2.96Å; L301-A304 PolarHBondContact O-N 3.42Å; A304-R307 PolarHBondContact O-N 2.83Å; A304-R308 PolarHBondContact O-N 3.47Å; A304-R308 VanDerWaalsContact O-N 3.17Å; A304-L353 HydrophobicContact CB-CD2 4.36Å; A304-V356 HydrophobicContact CB-CG2 4.34Å
305	L	84.8	Confident	81.2	Confident	48 Å²	48	69.9 Å²	69.9	25%	0.251	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-42.9	177.3	-70.5	173	0	0	0	112.6	L301 R302 I303 R308 Q309	L301-L305 HydrophobicContact CG-CD1 4.12Å; L301-L305 WeakPolarHBondContact O-CG 3.45Å; L301-L305 PolarHBondContact O-N 3.05Å; R302-L305 PolarHBondContact O-N 3.2Å; I303-L305 PolarHBondContact O-N 3.39Å; L305-R308 WeakPolarHBondContact O-CB 3.33Å; L305-R308 PolarHBondContact O-N 3.13Å; L305-Q309 WeakPolarHBondContact O-CG 3.48Å; L305-Q309 PolarHBondContact O-N 2.92Å
306	E	84.7	Confident	78.7	Confident	18 Å²	18	74.9 Å²	74.9	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-70.9	-34.5	-179.7	-72.3	158.5	174.1	0	0	112.7	Y278 R282 R302 I303 R308 Q309 Q310	Y278-E306 WeakPolarHBondContact CE2-OE2 3.48Å; Y278-E306 PolarHBondContact OH-OE2 3.47Å; R282-E306 IonicContact CZ-OE1 3.15Å; R282-E306 IonicContact CZ-OE2 3.61Å; R282-E306 IonicContact NH1-OE1 2.89Å; R282-E306 PolarHBondContact NH1-OE1 2.91Å; R282-E306 IonicContact NH1-OE2 2.64Å; R282-E306 PolarHBondContact NH1-OE2 2.96Å; R282-E306 IonicContact NH2-OE1 3.9Å; R282-E306 IonicContact NH2-OE2 3.58Å; R282-E306 PolarHBondContact NH2-OE2 3.45Å; R302-E306 WeakPolarHBondContact CG-OE1 3.35Å; R302-E306 IonicContact CZ-OE1 3.68Å; R302-E306 IonicContact NE-OE1 2.87Å; R302-E306 PolarHBondContact NE-OE1 2.8Å; R302-E306 IonicContact NH2-OE1 3.6Å; R302-E306 WeakPolarHBondContact O-CG 3.15Å; R302-E306 PolarHBondContact O-N 3.47Å; I303-E306 PolarHBondContact O-N 3.03Å; E306-R308 VanDerWaalsContact C-N 3.29Å; E306-R308 PolarHBondContact O-N 2.71Å; E306-Q309 PolarHBondContact O-N 3.02Å; E306-Q310 WeakPolarHBondContact O-CG 3.45Å; E306-Q310 PolarHBondContact O-N 2.9Å
307	R	84.2	Confident	76.5	Confident	138 Å²	138	78.8 Å²	78.8	52%	0.521	42%	0.421	S	S	.	.	H	α-helix	trans	-61.1	-40.1	171.2	-74.9	178.1	-175.8	179.3	1.5	111.3	I303 A304 Q310 Q311	I303-R307 WeakPolarHBondContact O-CG 3.38Å; I303-R307 PolarHBondContact O-N 3.34Å; A304-R307 PolarHBondContact O-N 2.83Å; R307-Q310 PolarHBondContact O-N 3.13Å; R307-Q311 WeakPolarHBondContact O-CG 3.34Å; R307-Q311 PolarHBondContact O-N 2.81Å; R307-Q311 VanDerWaalsContact O-N 3.16Å
308	R	80.6	Confident	74	Confident	62 Å²	62	76.7 Å²	76.7	23%	0.234	43%	0.43	C	S	.	.	H	α-helix	trans	-62.1	-49.2	174.7	-174.4	-173	-62.7	151.4	-3.2	111.5	A304 L305 E306 Q310 Q311 E312	A304-R308 PolarHBondContact O-N 3.47Å; A304-R308 VanDerWaalsContact O-N 3.17Å; L305-R308 WeakPolarHBondContact O-CB 3.33Å; L305-R308 PolarHBondContact O-N 3.13Å; E306-R308 VanDerWaalsContact C-N 3.29Å; E306-R308 PolarHBondContact O-N 2.71Å; R308-Q310 VanDerWaalsContact C-N 3.26Å; R308-Q310 PolarHBondContact O-N 3.06Å; R308-Q311 WeakPolarHBondContact O-CB 3.3Å; R308-Q311 PolarHBondContact O-N 3.26Å; R308-E312 WeakPolarHBondContact CG-OE1 3.31Å; R308-E312 PolarHBondContact O-N 3.21Å
309	Q	81.3	Confident	72	Confident	103 Å²	103	79.2 Å²	79.2	48%	0.481	46%	0.457	S	S	.	.	H	α-helix	trans	-59.4	-36.3	178.7	-71.4	176.8	0.2	0	0	112.7	L305 E306 A313	L305-Q309 WeakPolarHBondContact O-CG 3.48Å; L305-Q309 PolarHBondContact O-N 2.92Å; E306-Q309 PolarHBondContact O-N 3.02Å; Q309-A313 VanDerWaalsContact O-CB 3.28Å; Q309-A313 WeakPolarHBondContact O-CB 3.33Å; Q309-A313 PolarHBondContact O-N 3.02Å
310	Q	77.5	Confident	69.2	Low	130 Å²	130	83.2 Å²	83.2	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-69.9	-31.9	176.1	-72.4	169.8	27.4	0	0	113.1	E306 R307 R308 G314	E306-Q310 WeakPolarHBondContact O-CG 3.45Å; E306-Q310 PolarHBondContact O-N 2.9Å; R307-Q310 PolarHBondContact O-N 3.13Å; R308-Q310 VanDerWaalsContact C-N 3.26Å; R308-Q310 PolarHBondContact O-N 3.06Å; Q310-G314 PolarHBondContact O-N 3.31Å
311	Q	76.2	Confident	66.5	Low	136 Å²	136	86.9 Å²	86.9	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-71.3	-44	174.5	-70.4	170.4	9.9	0	0	111	R307 R308 A313 G314	R307-Q311 WeakPolarHBondContact O-CG 3.34Å; R307-Q311 PolarHBondContact O-N 2.81Å; R307-Q311 VanDerWaalsContact O-N 3.16Å; R308-Q311 WeakPolarHBondContact O-CB 3.3Å; R308-Q311 PolarHBondContact O-N 3.26Å; Q311-A313 VanDerWaalsContact C-N 3.34Å; Q311-A313 PolarHBondContact O-N 2.9Å; Q311-G314 PolarHBondContact O-N 2.63Å; Q311-G314 VanDerWaalsContact O-N 3.15Å
312	E	72.3	Confident	63.8	Low	139 Å²	139	87.7 Å²	87.7	65%	0.65	56%	0.561	S	S	*	*	H	α-helix	trans	-64.8	-36	176.7	-70.1	169.1	-178.3	0	0	112.4	R308 G314	R308-E312 WeakPolarHBondContact CG-OE1 3.31Å; R308-E312 PolarHBondContact O-N 3.21Å; E312-G314 VanDerWaalsContact C-N 3.29Å
313	A	64.8	Low	61.2	Low	89 Å²	89	89.1 Å²	89.1	74%	0.736	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-8.4	175.4	0	0	0	0	0	113.9	Q309 Q311	Q309-A313 VanDerWaalsContact O-CB 3.28Å; Q309-A313 WeakPolarHBondContact O-CB 3.33Å; Q309-A313 PolarHBondContact O-N 3.02Å; Q311-A313 VanDerWaalsContact C-N 3.34Å; Q311-A313 PolarHBondContact O-N 2.9Å
314	G	53.5	Low	58.8	Low	49 Å²	49	94.5 Å²	94.5	51%	0.505	63%	0.627	S	S	.	*			trans	-101.9	-4	-168.2	0	0	0	0	0	116	Q310 Q311 E312 P316	Q310-G314 PolarHBondContact O-N 3.31Å; Q311-G314 PolarHBondContact O-N 2.63Å; Q311-G314 VanDerWaalsContact O-N 3.15Å; E312-G314 VanDerWaalsContact C-N 3.29Å; G314-P316 WeakPolarHBondContact O-CD 3.4Å
315	E	41.7	Very low	56.5	Low	177 Å²	177	99.9 Å²	99.9	83%	0.827	65%	0.651	S	S	*	*			trans	-71.9	110.7	171.5	-90.8	-136.4	110	0	0	110.5
316	P	42.7	Very low	54.2	Low	110 Å²	110	104.1 Å²	104.1	71%	0.714	68%	0.679	S	S	*	*			trans	-86.1	118.3	168	15.8	4.9	0	0	0	107.6	G314 G318	G314-P316 WeakPolarHBondContact O-CD 3.4Å; P316-G318 PolarHBondContact O-N 2.79Å; P316-G318 VanDerWaalsContact O-N 3.11Å
317	G	45.6	Very low	51.8	Low	83 Å²	83	107 Å²	107	86%	0.856	71%	0.713	S	S	*	*			trans	-55.2	117.4	165.7	0	0	0	0	0	111.5
318	G	40.6	Very low	49.2	Very low	63 Å²	63	104.2 Å²	104.2	65%	0.649	73%	0.727	S	S	*	*			trans	74.7	158	163.4	0	0	0	0	0	116.4	P316	P316-G318 PolarHBondContact O-N 2.79Å; P316-G318 VanDerWaalsContact O-N 3.11Å
319	P	50.4	Low	48.2	Very low	137 Å²	137	107 Å²	107	89%	0.89	75%	0.753	S	S	*	*			cis	-150.2	165.1	45	38	-16.7	0	0	0	118
320	G	33.3	Very low	46	Very low	84 Å²	84	110.2 Å²	110.2	87%	0.866	77%	0.774	S	S	*	*			trans	119.1	121.3	130.1	0	0	0	0	0	119
321	G	31.7	Very low	43.9	Very low	82 Å²	82	107.6 Å²	107.6	85%	0.845	78%	0.782	S	S	*	*			trans	154.6	80.5	157	0	0	0	0	0	114.4
322	G	32.7	Very low	41.8	Very low	83 Å²	83	105.2 Å²	105.2	86%	0.856	79%	0.794	S	S	*	*			trans	-72.6	155.1	176.5	0	0	0	0	0	114
323	A	33.6	Very low	40	Very low	106 Å²	106	102.8 Å²	102.8	88%	0.876	81%	0.806	S	S	*	*			trans	-151.5	143.6	149.7	0	0	0	0	0	109.7
324	S	36.9	Very low	38.5	Very low	115 Å²	115	102.3 Å²	102.3	80%	0.804	81%	0.81	S	S	*	*			trans	-75.5	154.4	-166.9	38.8	0	0	0	0	116
325	D	37.6	Very low	37.7	Very low	146 Å²	146	110 Å²	110	78%	0.781	83%	0.833	S	S	*	*			trans	-19.2	130.7	149.1	-175.7	32	0	0	0	116.8
326	T	36.6	Very low	37.3	Very low	136 Å²	136	105.2 Å²	105.2	83%	0.834	83%	0.831	S	S	*	*			trans	-171	112.7	134.2	27.2	0	0	0	0	112.1
327	G	33.5	Very low	36.8	Very low	79 Å²	79	104.2 Å²	104.2	81%	0.814	84%	0.841	S	S	*	*			trans	31.2	128.3	142	0	0	0	0	0	125.1
328	G	30.2	Very low	36.2	Very low	79 Å²	79	104 Å²	104	81%	0.814	84%	0.839	S	S	*	*				108.7	151.1	118.8	0	0	0	0	0	119.1
329	P	59.5	Low	36.1	Very low	120 Å²	120	106.5 Å²	106.5	78%	0.779	85%	0.854	S	S	*	*			trans	-114.5	166.7	-145	40	-27.4	0	0	0	115.7
330	D	35.6	Very low	35.2	Very low	172 Å²	172	103.5 Å²	103.5	92%	0.92	85%	0.847	S	S	*	*			trans	146.3	139.4	160.4	-84.8	-42.7	0	0	0	106.7
331	G	33.8	Very low	35.7	Very low	75 Å²	75	103.8 Å²	103.8	77%	0.773	85%	0.85	S	S	*	*			cis	148.3	141.9	17	0	0	0	0	0	106.3
332	G	31.9	Very low	35.6	Very low	86 Å²	86	103 Å²	103	89%	0.887	84%	0.843	S	S	*	*			trans	101.5	125.9	161.4	0	0	0	0	0	117.4
333	G	33.3	Very low	35.8	Very low	88 Å²	88	107.1 Å²	107.1	91%	0.907	85%	0.845	S	S	*	*			trans	-84.9	-174.7	-174.9	0	0	0	0	0	116.5
334	G	33.3	Very low	35.8	Very low	79 Å²	79	104.7 Å²	104.7	81%	0.814	83%	0.83	S	S	*	*			trans	168.5	106.9	172.6	0	0	0	0	0	111.7
335	E	36.6	Very low	36	Very low	209 Å²	209	105.5 Å²	105.5	98%	0.977	83%	0.833	S	S	*	*			trans	-67.6	145	162.7	-65.9	168.3	95.3	0	0	110
336	G	33.7	Very low	36.1	Very low	77 Å²	77	107.2 Å²	107.2	79%	0.794	84%	0.836	S	S	*	*			trans	167.1	108.9	170.9	0	0	0	0	0	113
337	G	33.1	Very low	36.2	Very low	89 Å²	89	108.9 Å²	108.9	92%	0.918	83%	0.834	S	S	*	*			trans	-69.9	161.5	180	0	0	0	0	0	114.7
338	G	31.5	Very low	36.5	Very low	80 Å²	80	110.8 Å²	110.8	83%	0.825	83%	0.832	S	S	*	*			trans	-176.3	117	171.6	0	0	0	0	0	110.7
339	A	38.4	Very low	36.9	Very low	115 Å²	115	110.9 Å²	110.9	95%	0.95	83%	0.825	S	S	*	*			trans	-60.7	140.9	175.4	0	0	0	0	0	111.8
340	G	32.4	Very low	35.9	Very low	73 Å²	73	112.3 Å²	112.3	75%	0.753	83%	0.826	S	S	*	*			trans	-159	106.1	170.3	0	0	0	0	0	109
341	G	43.5	Very low	36.3	Very low	90 Å²	90	108.4 Å²	108.4	93%	0.928	81%	0.81	S	S	*	*			trans	-61.3	137.5	165.5	0	0	0	0	0	109.5
342	G	31	Very low	37.1	Very low	67 Å²	67	107.9 Å²	107.9	69%	0.691	79%	0.794	S	S	*	*			trans	-152.9	111.5	174.2	0	0	0	0	0	107.2	G344	G342-G344 PolarHBondContact O-N 3.02Å
343	D	35.8	Very low	38.5	Very low	169 Å²	169	107.4 Å²	107.4	90%	0.904	77%	0.771	S	S	*	*			trans	-32.2	117.5	168.7	-68.1	-99.3	0	0	0	111.6
344	G	33	Very low	39.7	Very low	55 Å²	55	111.8 Å²	111.8	57%	0.567	77%	0.768	S	S	*	*			trans	-58.6	154.7	163.5	0	0	0	0	0	109.2	G342 E346	G342-G344 PolarHBondContact O-N 3.02Å; G344-E346 PolarHBondContact O-N 3.02Å
345	P	42	Very low	41.3	Very low	132 Å²	132	110.8 Å²	110.8	86%	0.857	76%	0.757	S	S	*	*			trans	-55.8	116.1	179.2	25.1	-32	0	0	0	107.8	E347	P345-E347 PolarHBondContact O-N 3.4Å
346	E	39.3	Very low	43.4	Very low	181 Å²	181	102.2 Å²	102.2	85%	0.846	72%	0.719	S	S	*	*			trans	-50.7	107.3	170.9	-166.6	177	108.8	0	0	106.2	G344	G344-E346 PolarHBondContact O-N 3.02Å
347	E	39	Very low	45.8	Very low	172 Å²	172	100.1 Å²	100.1	80%	0.804	69%	0.693	S	S	*	*			trans	-48.2	131.8	163.3	-93.2	-153.2	120.3	0	0	106.3	P345 A349	P345-E347 PolarHBondContact O-N 3.4Å; E347-A349 VanDerWaalsContact C-N 3.31Å; E347-A349 PolarHBondContact O-N 2.85Å
348	P	39.2	Very low	48.2	Very low	119 Å²	119	99.1 Å²	99.1	77%	0.773	66%	0.664	S	S	*	*			trans	-61.4	103.1	178.4	24.9	-30.5	0	0	0	107	L350	P348-L350 PolarHBondContact O-N 3.38Å
349	A	38.4	Very low	50.8	Low	81 Å²	81	100.5 Å²	100.5	67%	0.669	65%	0.647	S	S	*	*			trans	-53.4	115.6	176.3	0	0	0	0	0	106.7	E347 P351	E347-A349 VanDerWaalsContact C-N 3.31Å; E347-A349 PolarHBondContact O-N 2.85Å; A349-P351 WeakPolarHBondContact O-CD 3.46Å
350	L	39.7	Very low	53.1	Low	150 Å²	150	98.6 Å²	98.6	79%	0.785	62%	0.619	S	S	*	*			trans	-41	118.2	175.1	-73.1	160.5	0	0	0	108.7	P348 S352	P348-L350 PolarHBondContact O-N 3.38Å; L350-S352 PolarHBondContact O-N 3.47Å
351	P	44	Very low	55.8	Low	90 Å²	90	96.6 Å²	96.6	58%	0.584	59%	0.589	S	S	*	*			trans	-63.8	109.9	173.3	22.8	-29.1	0	0	0	106.8	A349 L353	A349-P351 WeakPolarHBondContact O-CD 3.46Å; P351-L353 PolarHBondContact O-N 3.14Å
352	S	50.5	Low	58.2	Low	64 Å²	64	94 Å²	94	45%	0.448	56%	0.555	S	S	.	*			trans	-59.1	132.8	-169.1	-171.7	0	0	0	0	111.1	L350 E354	L350-S352 PolarHBondContact O-N 3.47Å; S352-E354 VanDerWaalsContact CB-OE2 3.25Å; S352-E354 WeakPolarHBondContact CB-OE2 3.45Å; S352-E354 PolarHBondContact O-N 3.07Å; S352-E354 WeakPolarHBondContact OG-CB 3.28Å; S352-E354 WeakPolarHBondContact OG-CG 3.2Å; S352-E354 PolarHBondContact OG-N 3.28Å; S352-E354 PolarHBondContact OG-OE2 3.18Å
353	L	60.9	Low	61.1	Low	76 Å²	76	91 Å²	91	40%	0.398	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-68.1	5.7	168.8	-67.6	173.1	0	0	0	112.1	L301 A304 P351 G355 V356	L301-L353 HydrophobicContact CD1-CD1 4.23Å; L301-L353 HydrophobicContact CD1-CD2 4.24Å; A304-L353 HydrophobicContact CB-CD2 4.36Å; P351-L353 PolarHBondContact O-N 3.14Å; L353-G355 PolarHBondContact O-N 2.99Å; L353-V356 HydrophobicContact CD2-CG2 4.42Å; L353-V356 PolarHBondContact O-N 2.83Å
354	E	59.3	Low	63.9	Low	179 Å²	179	84.7 Å²	84.7	84%	0.836	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-56.9	-14.2	179.9	-83.9	162.4	173.4	0	0	114.9	S352	S352-E354 VanDerWaalsContact CB-OE2 3.25Å; S352-E354 WeakPolarHBondContact CB-OE2 3.45Å; S352-E354 PolarHBondContact O-N 3.07Å; S352-E354 WeakPolarHBondContact OG-CB 3.28Å; S352-E354 WeakPolarHBondContact OG-CG 3.2Å; S352-E354 PolarHBondContact OG-N 3.28Å; S352-E354 PolarHBondContact OG-OE2 3.18Å
355	G	65.9	Low	66.7	Low	58 Å²	58	82 Å²	82	60%	0.598	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-94	-2.4	178.1	0	0	0	0	0	116.3	L353 S357 Q360	L353-G355 PolarHBondContact O-N 2.99Å; G355-S357 PolarHBondContact O-N 3.43Å; G355-Q360 PolarHBondContact O-OE1 3.18Å
356	V	80.8	Confident	68.9	Low	30 Å²	30	77 Å²	77	18%	0.182	43%	0.429	C	S	.	.			trans	-79.4	117.1	-175.2	178.1	0	0	0	0	111	K297 A300 L301 A304 L353	K297-V356 HydrophobicContact CG-CG1 4.31Å; A300-V356 HydrophobicContact CB-CG1 3.8Å; L301-V356 HydrophobicContact CB-CG1 4.01Å; L301-V356 HydrophobicContact CD1-CG1 4.46Å; L301-V356 HydrophobicContact CD1-CG2 4.34Å; A304-V356 HydrophobicContact CB-CG2 4.34Å; L353-V356 HydrophobicContact CD2-CG2 4.42Å; L353-V356 PolarHBondContact O-N 2.83Å
357	S	85.1	Confident	70.6	Confident	33 Å²	33	71.1 Å²	71.1	23%	0.231	41%	0.407	C	S	.	.			trans	-135.1	147.2	179.4	175.7	0	0	0	0	112.3	G355 K359 Q360	G355-S357 PolarHBondContact O-N 3.43Å; S357-K359 PolarHBondContact O-N 3.4Å; S357-K359 VanDerWaalsContact O-N 3.12Å; S357-K359 PolarHBondContact OG-N 3.37Å; S357-K359 VanDerWaalsContact OG-N 3.15Å; S357-Q360 WeakPolarHBondContact O-CB 3.29Å; S357-Q360 WeakPolarHBondContact O-CG 3.3Å; S357-Q360 PolarHBondContact O-N 3.21Å; S357-Q360 PolarHBondContact O-OE1 2.69Å
358	E	82.9	Confident	71.9	Confident	68 Å²	68	66.9 Å²	66.9	32%	0.318	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-16.6	168.2	65.3	-75.8	172.5	0	0	113.9	D293 S296 K297 Q360	D293-E358 HydrophobicContact CB-CB 3.98Å; D293-E358 HydrophobicContact CB-CG 4.23Å; S296-E358 VanDerWaalsContact CB-O 3.27Å; S296-E358 WeakPolarHBondContact CB-O 3.37Å; S296-E358 PolarHBondContact OG-O 3.41Å; K297-E358 HydrophobicContact CB-CB 4.2Å; E358-Q360 VanDerWaalsContact C-N 3.34Å
359	K	85.8	Confident	73.1	Confident	109 Å²	109	64.8 Å²	64.8	47%	0.474	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.1	178.2	-64	-179.2	176.1	-178.3	0	114	S357 Y361 T402 K406	S357-K359 PolarHBondContact O-N 3.4Å; S357-K359 VanDerWaalsContact O-N 3.12Å; S357-K359 PolarHBondContact OG-N 3.37Å; S357-K359 VanDerWaalsContact OG-N 3.15Å; K359-Y361 VanDerWaalsContact C-N 3.32Å; K359-Y361 PolarHBondContact O-N 2.95Å; K359-T402 WeakPolarHBondContact O-CB 3.38Å; K359-T402 PolarHBondContact O-OG1 3.3Å; K359-K406 PolarHBondContact NZ-O 3.32Å
360	Q	86.2	Confident	74.5	Confident	74 Å²	74	64.3 Å²	64.3	35%	0.346	41%	0.412	S	S	.	.	S	Bend	trans	-71.3	-27.2	-173.2	-68.1	-179	-82.3	0	0	113.4	A300 G355 S357 E358 T402	A300-Q360 HydrophobicContact CB-CB 4.33Å; A300-Q360 VanDerWaalsContact CB-OE1 3.27Å; G355-Q360 PolarHBondContact O-OE1 3.18Å; S357-Q360 WeakPolarHBondContact O-CB 3.29Å; S357-Q360 WeakPolarHBondContact O-CG 3.3Å; S357-Q360 PolarHBondContact O-N 3.21Å; S357-Q360 PolarHBondContact O-OE1 2.69Å; E358-Q360 VanDerWaalsContact C-N 3.34Å; Q360-T402 PolarHBondContact O-N 3.09Å; Q360-T402 PolarHBondContact O-OG1 3.36Å
361	Y	90.7	Very high	76.5	Confident	31 Å²	31	60.2 Å²	60.2	12%	0.122	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.8	179.9	-65.2	-88	0	0	0	111.3	S296 L299 A300 I303 K359 Y399 A400 P401 T402	S296-Y361 PolarHBondContact OG-N 3.22Å; S296-Y361 PolarHBondContact OG-O 3.09Å; L299-Y361 HydrophobicContact CD2-CD1 3.61Å; L299-Y361 HydrophobicContact CD2-CD2 4.05Å; L299-Y361 HydrophobicContact CD2-CE1 4.13Å; L299-Y361 HydrophobicContact CD2-CG 3.58Å; L299-Y361 HydrophobicContact CG-CD1 4.42Å; L299-Y361 HydrophobicContact CG-CD2 4.21Å; L299-Y361 HydrophobicContact CG-CE2 4.4Å; L299-Y361 HydrophobicContact CG-CG 4.24Å; A300-Y361 HydrophobicContact CB-CD2 3.98Å; A300-Y361 HydrophobicContact CB-CE2 3.87Å; I303-Y361 HydrophobicContact CD1-CE1 4.08Å; I303-Y361 HydrophobicContact CD1-CE2 4.21Å; I303-Y361 WeakPolarHBondContact CD1-OH 3.01Å; K359-Y361 VanDerWaalsContact C-N 3.32Å; K359-Y361 PolarHBondContact O-N 2.95Å; Y361-Y399 HydrophobicContact CD1-CD2 4.11Å; Y361-Y399 HydrophobicContact CE1-CD2 4.41Å; Y361-A400 WeakPolarHBondContact CA-O 3.15Å; Y361-P401 HydrophobicContact CE1-CG 4.24Å; Y361-T402 VanDerWaalsContact C-OG1 3.27Å; Y361-T402 PolarHBondContact N-OG1 3.07Å
362	T	92.1	Very high	78.6	Confident	37 Å²	37	59.6 Å²	59.6	23%	0.227	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.2	171.8	-60.1	0	0	0	0	108.6	Y364 T374 Y399 A400 T402	T362-Y364 HydrophobicContact CG2-CD2 4.42Å; T362-Y364 HydrophobicContact CG2-CE1 4.31Å; T362-Y364 HydrophobicContact CG2-CE2 3.66Å; T362-Y364 WeakPolarHBondContact O-CD2 3.44Å; T362-Y364 VanDerWaalsContact O-CE2 3.24Å; T362-Y364 WeakPolarHBondContact O-CE2 3.17Å; T362-T374 HydrophobicContact CG2-CG2 4.01Å; T362-Y399 WeakPolarHBondContact O-CA 3.44Å; T362-A400 PolarHBondContact N-O 3.38Å; T362-A400 PolarHBondContact O-N 3.22Å; T362-A400 VanDerWaalsContact O-N 3.08Å; T362-T402 PolarHBondContact N-OG1 3.44Å; T362-T402 PolarHBondContact OG1-OG1 3.23Å
363	I	93.7	Very high	80.5	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.8	-174.8	-48.2	-41.6	0	0	0	109.8	F266 V292 L375 L397 C398	F266-I363 HydrophobicContact CE2-CD1 4.06Å; F266-I363 HydrophobicContact CE2-CG2 3.96Å; F266-I363 HydrophobicContact CZ-CD1 3.51Å; F266-I363 HydrophobicContact CZ-CG1 4.23Å; F266-I363 HydrophobicContact CZ-CG2 4.21Å; V292-I363 HydrophobicContact CG1-CB 3.64Å; V292-I363 HydrophobicContact CG1-CG1 3.65Å; V292-I363 HydrophobicContact CG1-CG2 4.23Å; I363-L375 HydrophobicContact CG2-CD1 4.2Å; I363-L375 PolarHBondContact O-N 3.12Å; I363-L397 HydrophobicContact CG2-CB 4.34Å; I363-L397 HydrophobicContact CG2-CD1 4.25Å; I363-C398 CarbonylContact C-O 3.5Å; I363-C398 WeakPolarHBondContact CA-O 3.22Å
364	Y	93.3	Very high	82	Confident	35 Å²	35	59.8 Å²	59.8	14%	0.137	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.6	-175.6	-58.1	-98.9	0	0	0	110.5	H269 L272 T362 F372 T373 T374 L397 C398 A400	H269-Y364 AromaticContact CD2-CD2 3.79Å; H269-Y364 AromaticContact CD2-CG 3.78Å; L272-Y364 HydrophobicContact CD1-CE1 4.37Å; L272-Y364 HydrophobicContact CD1-CE2 4.26Å; T362-Y364 HydrophobicContact CG2-CD2 4.42Å; T362-Y364 HydrophobicContact CG2-CE1 4.31Å; T362-Y364 HydrophobicContact CG2-CE2 3.66Å; T362-Y364 WeakPolarHBondContact O-CD2 3.44Å; T362-Y364 VanDerWaalsContact O-CE2 3.24Å; T362-Y364 WeakPolarHBondContact O-CE2 3.17Å; Y364-F372 HydrophobicContact CD1-CB 4.22Å; Y364-T373 CarbonylContact C-O 3.38Å; Y364-T373 VanDerWaalsContact CA-O 3.26Å; Y364-T373 WeakPolarHBondContact CA-O 3.47Å; Y364-T374 HydrophobicContact CD1-CG2 3.76Å; Y364-T374 HydrophobicContact CE1-CG2 3.32Å; Y364-L397 WeakPolarHBondContact O-CA 3.46Å; Y364-C398 PolarHBondContact N-O 3.34Å; Y364-C398 PolarHBondContact O-N 3.49Å; Y364-A400 HydrophobicContact CE2-CB 3.9Å
365	I	92.1	Very high	83.6	Confident	0 Å²	0	52 Å²	52	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.1	169.1	-171.7	156.4	0	0	0	109.7	P367 F372 T373 L375 V384 F388 W389 L395 L397	I365-P367 VanDerWaalsContact C-CD 3.5Å; I365-P367 WeakPolarHBondContact O-CD 3.33Å; I365-F372 WeakPolarHBondContact O-CA 3.45Å; I365-T373 PolarHBondContact N-O 3.13Å; I365-T373 PolarHBondContact O-N 3.21Å; I365-L375 HydrophobicContact CB-CD1 4.18Å; I365-L375 HydrophobicContact CB-CD2 4.3Å; I365-L375 HydrophobicContact CB-CG 4.28Å; I365-L375 HydrophobicContact CG2-CD1 4.36Å; I365-L375 HydrophobicContact CG2-CD2 3.58Å; I365-L375 HydrophobicContact CG2-CG 3.96Å; I365-V384 HydrophobicContact CD1-CG1 3.93Å; I365-F388 HydrophobicContact CD1-CB 3.65Å; I365-F388 HydrophobicContact CG1-CB 4.43Å; I365-F388 HydrophobicContact CG2-CB 4.27Å; I365-F388 HydrophobicContact CG2-CG 4.38Å; I365-W389 HydrophobicContact CD1-CE3 4.41Å; I365-L395 HydrophobicContact CD1-CD1 3.9Å; I365-L397 HydrophobicContact CB-CD2 4Å; I365-L397 HydrophobicContact CD1-CD2 3.94Å; I365-L397 HydrophobicContact CG1-CD2 4.12Å
366	A	87.3	Confident	84.9	Confident	26 Å²	26	53.9 Å²	53.9	22%	0.215	35%	0.351	C	S	.	.			trans	-117.2	78	177	0	0	0	0	0	110.5	G368 F372	A366-G368 PolarHBondContact O-N 3.16Å; A366-F372 HydrophobicContact CB-CD1 3.9Å; A366-F372 HydrophobicContact CB-CE1 3.77Å; A366-F372 HydrophobicContact CB-CZ 4.39Å
367	P	76.6	Confident	85.3	Confident	57 Å²	57	53.1 Å²	53.1	37%	0.37	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-64.4	111.4	176.7	26.4	-31.1	0	0	0	109.2	I365 F388	I365-P367 VanDerWaalsContact C-CD 3.5Å; I365-P367 WeakPolarHBondContact O-CD 3.33Å; P367-F388 WeakPolarHBondContact CB-O 3.44Å
368	G	66.6	Low	85.7	Confident	84 Å²	84	55.5 Å²	55.5	87%	0.866	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	75.9	22.6	173.8	0	0	0	0	0	116.7	A366 G370	A366-G368 PolarHBondContact O-N 3.16Å; G368-G370 PolarHBondContact O-N 2.91Å
369	G	63.8	Low	86.3	Confident	74 Å²	74	53.9 Å²	53.9	76%	0.763	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	77.7	9.7	161.7	0	0	0	0	0	118.1
370	G	67.8	Low	86.7	Confident	72 Å²	72	50.8 Å²	50.8	74%	0.742	35%	0.349	S	S	*	.	S	Bend	trans	-120.2	-34.7	-176.3	0	0	0	0	0	116.8	G368	G368-G370 PolarHBondContact O-N 2.91Å
371	A	81.8	Confident	87	Confident	63 Å²	63	47.3 Å²	47.3	52%	0.521	33%	0.332	S	S	.	.			trans	-137.7	132.4	-175.3	0	0	0	0	0	111.8
372	F	88	Confident	87.1	Confident	78 Å²	78	49.6 Å²	49.6	34%	0.342	34%	0.344	S	S	.	.			trans	-85.6	125.3	173.9	-68.5	-82.9	0	0	0	109.9	H269 P270 Y364 I365 A366 C398	H269-F372 AromaticContact CD2-CD1 3.93Å; H269-F372 AromaticContact CE1-CD2 3.98Å; H269-F372 AromaticContact NE2-CD1 3.71Å; H269-F372 AromaticContact NE2-CD2 3.58Å; H269-F372 AromaticContact NE2-CG 3.34Å; H269-F372 VanDerWaalsContact NE2-CG 3.34Å; H269-F372 WeakPolarHBondContact NE2-CG 3.49Å; P270-F372 HydrophobicContact CG-CE1 4.41Å; P270-F372 HydrophobicContact CG-CE2 3.9Å; P270-F372 HydrophobicContact CG-CZ 3.51Å; Y364-F372 HydrophobicContact CD1-CB 4.22Å; I365-F372 WeakPolarHBondContact O-CA 3.45Å; A366-F372 HydrophobicContact CB-CD1 3.9Å; A366-F372 HydrophobicContact CB-CE1 3.77Å; A366-F372 HydrophobicContact CB-CZ 4.39Å; F372-C398 HydrophobicContact CD1-CB 4.41Å; F372-C398 HydrophobicContact CE1-CB 4.19Å
373	T	90.6	Very high	87	Confident	57 Å²	57	51.2 Å²	51.2	35%	0.35	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130	176.2	-55.8	0	0	0	0	109.4	Y364 I365	Y364-T373 CarbonylContact C-O 3.38Å; Y364-T373 VanDerWaalsContact CA-O 3.26Å; Y364-T373 WeakPolarHBondContact CA-O 3.47Å; I365-T373 PolarHBondContact N-O 3.13Å; I365-T373 PolarHBondContact O-N 3.21Å
374	T	92.3	Very high	86.9	Confident	87 Å²	87	51 Å²	51	53%	0.534	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.7	173	50.6	0	0	0	0	110.4	T362 Y364	T362-T374 HydrophobicContact CG2-CG2 4.01Å; Y364-T374 HydrophobicContact CD1-CG2 3.76Å; Y364-T374 HydrophobicContact CE1-CG2 3.32Å
375	L	92.6	Very high	86.7	Confident	14 Å²	14	51.6 Å²	51.6	7%	0.073	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-90.3	140.5	174.7	-65.9	178.9	0	0	0	110.7	V292 I363 I365 V384 F388 L397	V292-L375 HydrophobicContact CG1-CB 4.01Å; V292-L375 HydrophobicContact CG2-CB 3.9Å; V292-L375 HydrophobicContact CG2-CD1 4.14Å; I363-L375 HydrophobicContact CG2-CD1 4.2Å; I363-L375 PolarHBondContact O-N 3.12Å; I365-L375 HydrophobicContact CB-CD1 4.18Å; I365-L375 HydrophobicContact CB-CD2 4.3Å; I365-L375 HydrophobicContact CB-CG 4.28Å; I365-L375 HydrophobicContact CG2-CD1 4.36Å; I365-L375 HydrophobicContact CG2-CD2 3.58Å; I365-L375 HydrophobicContact CG2-CG 3.96Å; L375-V384 HydrophobicContact CD1-CG1 3.74Å; L375-V384 HydrophobicContact CD1-CG2 4.15Å; L375-V384 HydrophobicContact CD2-CG1 4.19Å; L375-V384 HydrophobicContact CD2-CG2 4.24Å; L375-F388 HydrophobicContact CD2-CD2 4.09Å; L375-F388 HydrophobicContact CD2-CE2 4.05Å; L375-F388 HydrophobicContact CD2-CZ 4.49Å; L375-L397 HydrophobicContact CD1-CD2 3.8Å
376	N	92.3	Very high	86.5	Confident	99 Å²	99	57.3 Å²	57.3	53%	0.529	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-76.1	135.1	173.9	-178	-48.2	0	0	0	109.9	V292 S378 L379	V292-N376 WeakPolarHBondContact CB-O 3.4Å; N376-S378 PolarHBondContact O-N 3.05Å; N376-S378 PolarHBondContact OD1-N 3.04Å; N376-S378 PolarHBondContact OD1-OG 3Å; N376-L379 HydrophobicContact CB-CD1 3.97Å; N376-L379 HydrophobicContact CB-CG 3.99Å; N376-L379 WeakPolarHBondContact O-CB 3.47Å; N376-L379 WeakPolarHBondContact O-CG 3.41Å; N376-L379 PolarHBondContact O-N 3.12Å; N376-L379 VanDerWaalsContact O-N 3.09Å
377	G	90.6	Very high	86.4	Confident	13 Å²	13	62.1 Å²	62.1	13%	0.134	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-36.4	-178	0	0	0	0	0	115.6	T291 V292 D293 L379	T291-G377 WeakPolarHBondContact CB-O 3.36Å; V292-G377 PolarHBondContact N-O 3.37Å; D293-G377 VanDerWaalsContact CG-C 3.46Å; D293-G377 PolarHBondContact N-O 3.22Å; D293-G377 WeakPolarHBondContact OD1-CA 3.31Å; D293-G377 VanDerWaalsContact OD2-C 3.26Å; D293-G377 WeakPolarHBondContact OD2-CA 3.46Å; G377-L379 VanDerWaalsContact C-N 3.32Å; G377-L379 PolarHBondContact O-N 3.4Å
378	S	93.3	Very high	86.7	Confident	83 Å²	83	61.8 Å²	61.8	58%	0.58	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.7	-177.3	66.7	0	0	0	0	114.5	N376	N376-S378 PolarHBondContact O-N 3.05Å; N376-S378 PolarHBondContact OD1-N 3.04Å; N376-S378 PolarHBondContact OD1-OG 3Å
379	L	94	Very high	87.6	Confident	34 Å²	34	59.7 Å²	59.7	18%	0.178	36%	0.357	C	S	.	.			trans	-70.8	133.2	179.3	-63	174.1	0	0	0	110.3	T291 V292 N376 G377 L383 V384 F388	T291-L379 CarbonylContact C-O 3.45Å; T291-L379 WeakPolarHBondContact CA-O 3.25Å; V292-L379 HydrophobicContact CG2-CB 4.28Å; V292-L379 PolarHBondContact N-O 3.43Å; N376-L379 HydrophobicContact CB-CD1 3.97Å; N376-L379 HydrophobicContact CB-CG 3.99Å; N376-L379 WeakPolarHBondContact O-CB 3.47Å; N376-L379 WeakPolarHBondContact O-CG 3.41Å; N376-L379 PolarHBondContact O-N 3.12Å; N376-L379 VanDerWaalsContact O-N 3.09Å; G377-L379 VanDerWaalsContact C-N 3.32Å; G377-L379 PolarHBondContact O-N 3.4Å; L379-L383 HydrophobicContact CD2-CD2 3.74Å; L379-V384 HydrophobicContact CB-CG2 3.9Å; L379-V384 HydrophobicContact CD1-CG2 4.42Å; L379-F388 HydrophobicContact CD1-CE2 4.36Å
380	T	95	Very high	88.2	Confident	45 Å²	45	64 Å²	64	28%	0.276	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-73.1	151.1	170.8	60.6	0	0	0	0	110.7	A290 T291 E382 L383 V384	A290-T380 CarbonylContact O-C 3.6Å; A290-T380 VanDerWaalsContact O-CA 3.29Å; A290-T380 WeakPolarHBondContact O-CA 3.47Å; T291-T380 HydrophobicContact CG2-CG2 4.46Å; T380-E382 PolarHBondContact O-N 3.42Å; T380-L383 PolarHBondContact O-N 3.47Å; T380-L383 WeakPolarHBondContact OG1-CB 3.37Å; T380-L383 PolarHBondContact OG1-N 3.31Å; T380-V384 WeakPolarHBondContact O-CG2 3.41Å; T380-V384 PolarHBondContact O-N 2.98Å
381	L	92.8	Very high	88.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.5	-30.6	178.6	-63.4	-177.3	0	0	0	112.2	I262 L264 T286 G288 A290 L295 V384 N385 L397	I262-L381 HydrophobicContact CD1-CB 3.75Å; I262-L381 WeakPolarHBondContact CD1-O 3.45Å; L264-L381 HydrophobicContact CD2-CD1 3.98Å; T286-L381 HydrophobicContact CG2-CD1 3.4Å; G288-L381 PolarHBondContact O-N 3.13Å; A290-L381 HydrophobicContact CB-CD1 4Å; A290-L381 HydrophobicContact CB-CG 4.39Å; A290-L381 WeakPolarHBondContact O-CG 3.45Å; A290-L381 PolarHBondContact O-N 3.46Å; L295-L381 HydrophobicContact CD1-CD1 4.02Å; L295-L381 HydrophobicContact CD1-CD2 3.46Å; L295-L381 VanDerWaalsContact CD1-CD2 3.46Å; L295-L381 HydrophobicContact CD1-CG 4.34Å; L295-L381 HydrophobicContact CD2-CD1 4.13Å; L295-L381 HydrophobicContact CG-CD1 4.15Å; L295-L381 HydrophobicContact CG-CD2 4.1Å; L381-V384 PolarHBondContact O-N 2.93Å; L381-N385 VanDerWaalsContact O-CB 3.26Å; L381-N385 WeakPolarHBondContact O-CB 3.4Å; L381-N385 PolarHBondContact O-N 3.25Å; L381-L397 HydrophobicContact CD2-CD1 4.5Å
382	E	91.8	Very high	88.3	Confident	80 Å²	80	67.1 Å²	67.1	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-50.7	171.1	-173.5	168.7	-145.2	0	0	111	I262 G288 T380 V384 N385 E386	I262-E382 HydrophobicContact CD1-CB 4.38Å; G288-E382 PolarHBondContact O-N 2.95Å; T380-E382 PolarHBondContact O-N 3.42Å; E382-V384 VanDerWaalsContact C-N 3.32Å; E382-V384 PolarHBondContact O-N 3.07Å; E382-N385 PolarHBondContact O-N 2.95Å; E382-E386 WeakPolarHBondContact O-CG 3.24Å; E382-E386 PolarHBondContact O-N 3.49Å
383	L	91.3	Very high	88	Confident	70 Å²	70	71.7 Å²	71.7	37%	0.366	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-36.7	177.5	-176.8	60.1	0	0	0	112	L379 T380 K387	L379-L383 HydrophobicContact CD2-CD2 3.74Å; T380-L383 PolarHBondContact O-N 3.47Å; T380-L383 WeakPolarHBondContact OG1-CB 3.37Å; T380-L383 PolarHBondContact OG1-N 3.31Å; L383-K387 WeakPolarHBondContact O-CB 3.43Å; L383-K387 PolarHBondContact O-N 2.96Å
384	V	90.8	Very high	87.7	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-46.3	174.8	171.4	0	0	0	0	110.6	V292 I365 L375 L379 T380 L381 E382 K387 F388 L395 L397	V292-V384 HydrophobicContact CG2-CG2 4.07Å; I365-V384 HydrophobicContact CD1-CG1 3.93Å; L375-V384 HydrophobicContact CD1-CG1 3.74Å; L375-V384 HydrophobicContact CD1-CG2 4.15Å; L375-V384 HydrophobicContact CD2-CG1 4.19Å; L375-V384 HydrophobicContact CD2-CG2 4.24Å; L379-V384 HydrophobicContact CB-CG2 3.9Å; L379-V384 HydrophobicContact CD1-CG2 4.42Å; T380-V384 WeakPolarHBondContact O-CG2 3.41Å; T380-V384 PolarHBondContact O-N 2.98Å; L381-V384 PolarHBondContact O-N 2.93Å; E382-V384 VanDerWaalsContact C-N 3.32Å; E382-V384 PolarHBondContact O-N 3.07Å; V384-K387 PolarHBondContact O-N 3.36Å; V384-F388 HydrophobicContact CG1-CD2 4.37Å; V384-F388 WeakPolarHBondContact O-CB 3.34Å; V384-F388 PolarHBondContact O-N 2.91Å; V384-L395 HydrophobicContact CG1-CD1 4.49Å; V384-L395 HydrophobicContact CG1-CD2 4.13Å; V384-L397 HydrophobicContact CG1-CD2 4.5Å
385	N	88.5	Confident	87.6	Confident	48 Å²	48	66.4 Å²	66.4	26%	0.257	34%	0.342	S	S	.	.	I	π-helix	trans	-62.7	-46.6	179.4	-174.5	49.2	0	0	0	111.6	I262 L381 E382 W389 K390	I262-N385 HydrophobicContact CD1-CB 4.37Å; L381-N385 VanDerWaalsContact O-CB 3.26Å; L381-N385 WeakPolarHBondContact O-CB 3.4Å; L381-N385 PolarHBondContact O-N 3.25Å; E382-N385 PolarHBondContact O-N 2.95Å; N385-W389 WeakPolarHBondContact O-CB 3.08Å; N385-W389 PolarHBondContact O-N 3.28Å; N385-K390 PolarHBondContact O-N 3.05Å
386	E	88.4	Confident	87.5	Confident	120 Å²	120	68.8 Å²	68.8	56%	0.561	35%	0.352	S	S	*	.	I	π-helix	trans	-66.6	-39.7	178.4	-71.9	-174.8	161.1	0	0	113.2	E382 K390	E382-E386 WeakPolarHBondContact O-CG 3.24Å; E382-E386 PolarHBondContact O-N 3.49Å; E386-K390 WeakPolarHBondContact O-CE 3.25Å; E386-K390 WeakPolarHBondContact O-CG 3.15Å
387	K	86.5	Confident	87.6	Confident	126 Å²	126	64 Å²	64	55%	0.548	33%	0.327	S	S	.	.	I	π-helix	trans	-84.7	-40.5	-172.2	-172.3	170.4	178.2	178.8	0	112.7	L383 V384 K390	L383-K387 WeakPolarHBondContact O-CB 3.43Å; L383-K387 PolarHBondContact O-N 2.96Å; V384-K387 PolarHBondContact O-N 3.36Å; K387-K390 WeakPolarHBondContact O-CE 3.42Å
388	F	81.9	Confident	87.7	Confident	51 Å²	51	64.1 Å²	64.1	22%	0.224	33%	0.325	C	S	.	.	I	π-helix	trans	-115.2	-28.5	-168	-59.3	-81.7	0	0	0	114.1	I365 P367 L375 L379 V384	I365-F388 HydrophobicContact CD1-CB 3.65Å; I365-F388 HydrophobicContact CG1-CB 4.43Å; I365-F388 HydrophobicContact CG2-CB 4.27Å; I365-F388 HydrophobicContact CG2-CG 4.38Å; P367-F388 WeakPolarHBondContact CB-O 3.44Å; L375-F388 HydrophobicContact CD2-CD2 4.09Å; L375-F388 HydrophobicContact CD2-CE2 4.05Å; L375-F388 HydrophobicContact CD2-CZ 4.49Å; L379-F388 HydrophobicContact CD1-CE2 4.36Å; V384-F388 HydrophobicContact CG1-CD2 4.37Å; V384-F388 WeakPolarHBondContact O-CB 3.34Å; V384-F388 PolarHBondContact O-N 2.91Å
389	W	85.1	Confident	87.6	Confident	40 Å²	40	60.3 Å²	60.3	15%	0.152	30%	0.298	C	S	.	.	I	π-helix	trans	-94.6	-60.1	-176.8	-164.1	-122.6	0	0	0	112.3	I365 N385 V391 R393 P394 L395 E396	I365-W389 HydrophobicContact CD1-CE3 4.41Å; N385-W389 WeakPolarHBondContact O-CB 3.08Å; N385-W389 PolarHBondContact O-N 3.28Å; W389-V391 WeakPolarHBondContact O-CG2 3.28Å; W389-V391 PolarHBondContact O-N 3.44Å; W389-V391 VanDerWaalsContact O-N 3.09Å; W389-R393 PolarHBondContact NE1-O 3.03Å; W389-P394 WeakPolarHBondContact CZ2-O 3.33Å; W389-P394 PolarHBondContact NE1-O 3.03Å; W389-L395 HydrophobicContact CB-CD1 3.42Å; W389-L395 VanDerWaalsContact CB-CD1 3.42Å; W389-L395 HydrophobicContact CD2-CD1 3.84Å; W389-L395 HydrophobicContact CE3-CD1 4.27Å; W389-L395 HydrophobicContact CG-CD1 3.46Å; W389-L395 VanDerWaalsContact CG-CD1 3.46Å; W389-E396 HydrophobicContact CH2-CB 3.51Å; W389-E396 HydrophobicContact CH2-CG 3.56Å; W389-E396 HydrophobicContact CZ2-CB 4.08Å; W389-E396 HydrophobicContact CZ2-CG 3.76Å; W389-E396 HydrophobicContact CZ3-CB 4.03Å
390	K	76.3	Confident	87.5	Confident	164 Å²	164	58.8 Å²	58.8	71%	0.713	29%	0.29	S	S	*	.			trans	54.6	23.6	178	-59.5	179.8	179.8	179.6	0	114.8	N385 E386 K387	N385-K390 PolarHBondContact O-N 3.05Å; E386-K390 WeakPolarHBondContact O-CE 3.25Å; E386-K390 WeakPolarHBondContact O-CG 3.15Å; K387-K390 WeakPolarHBondContact O-CE 3.42Å
391	V	76.1	Confident	87.2	Confident	70 Å²	70	59.1 Å²	59.1	42%	0.424	29%	0.293	S	S	.	.	S	Bend	trans	-118.2	141.2	176.9	-175.5	0	0	0	0	109.3	W389 R393	W389-V391 WeakPolarHBondContact O-CG2 3.28Å; W389-V391 PolarHBondContact O-N 3.44Å; W389-V391 VanDerWaalsContact O-N 3.09Å; V391-R393 HydrophobicContact CG1-CB 3.84Å; V391-R393 HydrophobicContact CG1-CG 3.71Å; V391-R393 PolarHBondContact O-N 2.91Å
392	S	75.3	Confident	86.8	Confident	130 Å²	130	60.9 Å²	60.9	91%	0.909	30%	0.304	S	S	*	.	S	Bend	trans	-75.9	41.4	173	68	0	0	0	0	112.7
393	R	81.7	Confident	85.9	Confident	175 Å²	175	65 Å²	65	66%	0.66	32%	0.321	S	S	*	.	S	Bend	trans	-128.4	156.5	178.7	-68.9	-176.6	83.7	-169.4	4.3	108.7	W389 V391 L395	W389-R393 PolarHBondContact NE1-O 3.03Å; V391-R393 HydrophobicContact CG1-CB 3.84Å; V391-R393 HydrophobicContact CG1-CG 3.71Å; V391-R393 PolarHBondContact O-N 2.91Å; R393-L395 PolarHBondContact O-N 3.33Å
394	P	85.1	Confident	84.2	Confident	32 Å²	32	68.2 Å²	68.2	21%	0.208	34%	0.339	C	S	.	.			trans	-49.4	134.9	175.8	-29.5	37.8	0	0	0	111.4	L18 E263 V265 W389 E396	L18-P394 HydrophobicContact CD1-CB 4.35Å; L18-P394 HydrophobicContact CD1-CG 3.84Å; L18-P394 HydrophobicContact CG-CG 4.42Å; E263-P394 HydrophobicContact CB-CB 4.19Å; E263-P394 HydrophobicContact CB-CG 4.36Å; E263-P394 CarbonylContact O-C 3.46Å; E263-P394 VanDerWaalsContact O-CA 3.31Å; E263-P394 WeakPolarHBondContact O-CA 3.44Å; V265-P394 HydrophobicContact CG2-CB 4.23Å; W389-P394 WeakPolarHBondContact CZ2-O 3.33Å; W389-P394 PolarHBondContact NE1-O 3.03Å; P394-E396 PolarHBondContact O-N 3.33Å
395	L	89.6	Confident	82.4	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	122	-176.5	-178.9	66.2	0	0	0	109.4	I262 E263 L264 V265 I365 V384 W389 R393 L397	I262-L395 HydrophobicContact CG2-CB 4.42Å; I262-L395 HydrophobicContact CG2-CD2 4.5Å; E263-L395 PolarHBondContact O-N 3.32Å; L264-L395 CarbonylContact C-O 3.53Å; L264-L395 WeakPolarHBondContact CA-O 3.36Å; L264-L395 HydrophobicContact CB-CB 3.91Å; L264-L395 WeakPolarHBondContact CB-O 3.32Å; V265-L395 PolarHBondContact N-O 2.64Å; I365-L395 HydrophobicContact CD1-CD1 3.9Å; V384-L395 HydrophobicContact CG1-CD1 4.49Å; V384-L395 HydrophobicContact CG1-CD2 4.13Å; W389-L395 HydrophobicContact CB-CD1 3.42Å; W389-L395 VanDerWaalsContact CB-CD1 3.42Å; W389-L395 HydrophobicContact CD2-CD1 3.84Å; W389-L395 HydrophobicContact CE3-CD1 4.27Å; W389-L395 HydrophobicContact CG-CD1 3.46Å; W389-L395 VanDerWaalsContact CG-CD1 3.46Å; R393-L395 PolarHBondContact O-N 3.33Å; L395-L397 HydrophobicContact CD1-CD2 4.39Å; L395-L397 HydrophobicContact CD2-CD1 3.94Å; L395-L397 HydrophobicContact CD2-CD2 4.08Å; L395-L397 HydrophobicContact CD2-CG 4.03Å; L395-L397 HydrophobicContact CG-CD1 4.41Å; L395-L397 HydrophobicContact CG-CD2 3.99Å; L395-L397 HydrophobicContact CG-CG 3.96Å
396	E	92	Very high	79.9	Confident	63 Å²	63	81.9 Å²	81.9	29%	0.294	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	114.3	177.2	-59	-168.2	162.4	0	0	110.5	V265 R267 W389 P394	V265-E396 HydrophobicContact CB-CG 4.42Å; V265-E396 WeakPolarHBondContact O-CA 3.4Å; R267-E396 IonicContact CZ-OE1 3.47Å; R267-E396 IonicContact CZ-OE2 2.73Å; R267-E396 IonicContact NH1-OE1 3.56Å; R267-E396 PolarHBondContact NH1-OE1 2.85Å; R267-E396 IonicContact NH1-OE2 2.77Å; R267-E396 PolarHBondContact NH1-OE2 3.11Å; R267-E396 VanDerWaalsContact NH2-CD 3.32Å; R267-E396 IonicContact NH2-OE1 3.33Å; R267-E396 PolarHBondContact NH2-OE1 3.4Å; R267-E396 IonicContact NH2-OE2 3.63Å; W389-E396 HydrophobicContact CH2-CB 3.51Å; W389-E396 HydrophobicContact CH2-CG 3.56Å; W389-E396 HydrophobicContact CZ2-CB 4.08Å; W389-E396 HydrophobicContact CZ2-CG 3.76Å; W389-E396 HydrophobicContact CZ3-CB 4.03Å; P394-E396 PolarHBondContact O-N 3.33Å
397	L	93.2	Very high	79.5	Confident	0 Å²	0	80 Å²	80	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.9	177.6	-60.7	-179.3	0	0	0	110	L264 V265 F266 R267 L295 I363 Y364 I365 L375 L381 V384 L395	L264-L397 HydrophobicContact CD2-CD1 4.38Å; V265-L397 PolarHBondContact O-N 3.39Å; F266-L397 WeakPolarHBondContact CA-O 3.28Å; F266-L397 HydrophobicContact CD2-CB 3.76Å; F266-L397 HydrophobicContact CE2-CB 3.94Å; R267-L397 PolarHBondContact N-O 3.03Å; L295-L397 HydrophobicContact CD1-CD1 3.52Å; I363-L397 HydrophobicContact CG2-CB 4.34Å; I363-L397 HydrophobicContact CG2-CD1 4.25Å; Y364-L397 WeakPolarHBondContact O-CA 3.46Å; I365-L397 HydrophobicContact CB-CD2 4Å; I365-L397 HydrophobicContact CD1-CD2 3.94Å; I365-L397 HydrophobicContact CG1-CD2 4.12Å; L375-L397 HydrophobicContact CD1-CD2 3.8Å; L381-L397 HydrophobicContact CD2-CD1 4.5Å; V384-L397 HydrophobicContact CG1-CD2 4.5Å; L395-L397 HydrophobicContact CD1-CD2 4.39Å; L395-L397 HydrophobicContact CD2-CD1 3.94Å; L395-L397 HydrophobicContact CD2-CD2 4.08Å; L395-L397 HydrophobicContact CD2-CG 4.03Å; L395-L397 HydrophobicContact CG-CD1 4.41Å; L395-L397 HydrophobicContact CG-CD2 3.99Å; L395-L397 HydrophobicContact CG-CG 3.96Å
398	C	92.6	Very high	79.1	Confident	15 Å²	15	77.5 Å²	77.5	10%	0.101	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150	173.8	-67.1	0	0	0	0	110.7	R267 H269 I363 Y364 F372	R267-C398 CarbonylContact O-C 3.57Å; R267-C398 WeakPolarHBondContact O-CA 3.32Å; H269-C398 HydrophobicContact CB-CB 4.39Å; I363-C398 CarbonylContact C-O 3.5Å; I363-C398 WeakPolarHBondContact CA-O 3.22Å; Y364-C398 PolarHBondContact N-O 3.34Å; Y364-C398 PolarHBondContact O-N 3.49Å; F372-C398 HydrophobicContact CD1-CB 4.41Å; F372-C398 HydrophobicContact CE1-CB 4.19Å
399	Y	92.1	Very high	78.9	Confident	2 Å²	2	79 Å²	79	1%	0.008	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149.1	175.4	65.6	-99.4	0	0	0	111.8	F266 R267 P268 H269 Y278 Q280 L299 Y361 T362	F266-Y399 HydrophobicContact CD1-CD1 4.37Å; F266-Y399 AromaticContact CD2-CD1 3.76Å; F266-Y399 HydrophobicContact CD2-CD1 3.76Å; F266-Y399 HydrophobicContact CE1-CD1 4.5Å; F266-Y399 AromaticContact CE2-CD1 3.92Å; F266-Y399 HydrophobicContact CE2-CD1 3.92Å; F266-Y399 HydrophobicContact CE2-CG 4.3Å; F266-Y399 HydrophobicContact CG-CD1 4.02Å; F266-Y399 HydrophobicContact CZ-CD1 4.31Å; R267-Y399 VanDerWaalsContact C-CE1 3.49Å; R267-Y399 WeakPolarHBondContact O-CD1 3.46Å; R267-Y399 PolarHBondContact O-N 3.43Å; P268-Y399 HydrophobicContact CB-CE2 4.26Å; H269-Y399 VanDerWaalsContact CB-O 3.28Å; H269-Y399 WeakPolarHBondContact CB-O 3.41Å; H269-Y399 PolarHBondContact N-O 2.95Å; Y278-Y399 PolarHBondContact O-OH 3.19Å; Y278-Y399 VanDerWaalsContact O-OH 3.14Å; Q280-Y399 PolarHBondContact O-OH 3.05Å; L299-Y399 HydrophobicContact CD1-CD1 4.3Å; L299-Y399 HydrophobicContact CD1-CE1 4.11Å; L299-Y399 HydrophobicContact CD1-CE2 4.41Å; L299-Y399 HydrophobicContact CD2-CD1 3.75Å; L299-Y399 HydrophobicContact CD2-CD2 3.4Å; L299-Y399 HydrophobicContact CD2-CE1 4.29Å; L299-Y399 HydrophobicContact CD2-CE2 3.98Å; L299-Y399 HydrophobicContact CD2-CG 3.27Å; Y361-Y399 HydrophobicContact CD1-CD2 4.11Å; Y361-Y399 HydrophobicContact CE1-CD2 4.41Å; T362-Y399 WeakPolarHBondContact O-CA 3.44Å
400	A	90.4	Very high	78.6	Confident	2 Å²	2	81.3 Å²	81.3	2%	0.017	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.5	168.1	0	0	0	0	0	110.1	H269 L272 V273 Y361 T362 Y364 T402	H269-A400 HydrophobicContact CB-CB 3.95Å; L272-A400 HydrophobicContact CB-CB 3.69Å; L272-A400 HydrophobicContact CD1-CB 4.02Å; V273-A400 HydrophobicContact CG2-CB 4.26Å; Y361-A400 WeakPolarHBondContact CA-O 3.15Å; T362-A400 PolarHBondContact N-O 3.38Å; T362-A400 PolarHBondContact O-N 3.22Å; T362-A400 VanDerWaalsContact O-N 3.08Å; Y364-A400 HydrophobicContact CE2-CB 3.9Å; A400-T402 PolarHBondContact O-N 3.45Å
401	P	88.8	Confident	78.7	Confident	52 Å²	52	76.1 Å²	76.1	34%	0.338	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	135.7	169.3	-22.3	32.8	0	0	0	111	Y361 K403	Y361-P401 HydrophobicContact CE1-CG 4.24Å; P401-K403 PolarHBondContact O-N 3.08Å
402	T	86	Confident	78.9	Confident	37 Å²	37	76.5 Å²	76.5	23%	0.227	39%	0.393	C	S	.	.			trans	-70.9	125.6	175.9	-56.6	0	0	0	0	109.3	K359 Q360 Y361 T362 A400 D404	K359-T402 WeakPolarHBondContact O-CB 3.38Å; K359-T402 PolarHBondContact O-OG1 3.3Å; Q360-T402 PolarHBondContact O-N 3.09Å; Q360-T402 PolarHBondContact O-OG1 3.36Å; Y361-T402 VanDerWaalsContact C-OG1 3.27Å; Y361-T402 PolarHBondContact N-OG1 3.07Å; T362-T402 PolarHBondContact N-OG1 3.44Å; T362-T402 PolarHBondContact OG1-OG1 3.23Å; A400-T402 PolarHBondContact O-N 3.45Å; T402-D404 VanDerWaalsContact C-N 3.27Å; T402-D404 PolarHBondContact O-N 3.48Å
403	K	71.3	Confident	79.2	Confident	167 Å²	167	72.7 Å²	72.7	73%	0.726	36%	0.356	S	S	*	.	S	Bend	trans	-70.5	-16.6	-174.5	-67.6	-173.4	177.1	-174.8	0	114.6	P401	P401-K403 PolarHBondContact O-N 3.08Å
404	D	56.6	Low	79	Confident	138 Å²	138	64.8 Å²	64.8	74%	0.738	33%	0.332	S	S	*	.			trans	-146.6	92.6	175.1	-66.1	-64.6	0	0	0	111	T402 K406	T402-D404 VanDerWaalsContact C-N 3.27Å; T402-D404 PolarHBondContact O-N 3.48Å; D404-K406 PolarHBondContact O-N 3.43Å
405	P	52.5	Low	78.5	Confident	97 Å²	97	67.6 Å²	67.6	63%	0.63	34%	0.343	S	S	*	.			trans	-74.7	96.1	173.5	29.4	-30.8	0	0	0	109
406	K	36.5	Very low	77.4	Confident	237 Å²	237	73.6 Å²	73.6	100%	1.03	37%	0.374	S	S	*	.			trans	-84.7	0	178.8	-154.1	178.7	-170.9	175.3	0	113.3	K359 D404	K359-K406 PolarHBondContact NZ-O 3.32Å; D404-K406 PolarHBondContact O-N 3.43Å

Retrieved 406 of 406 residues in 58.8 ms (Link to these results)

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