A0A077ZMT3_TRITR Loading...

Eukaryotic translation initiation factor 3 subunit B

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. RNA-binding component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A077ZMT3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 702 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	43.5	Very low	44.8	Very low	229 Å²	229	120.7 Å²	120.7	100%	1.128	66%	0.658	S	S	*	*				0	34.5	0	-81.6	172.9	165.7	0	0	114.1
2	V	37.4	Very low	45.1	Very low	131 Å²	131	124.3 Å²	124.3	79%	0.794	66%	0.662	S	S	*	*			trans	-132.1	18.4	174	-170.5	0	0	0	0	111.5
3	S	42.2	Very low	45.2	Very low	67 Å²	67	122.8 Å²	122.8	47%	0.469	65%	0.654	S	S	.	*	S	Bend	trans	-124.1	2.8	178.4	70.2	0	0	0	0	114.5	K419	S3-K419 PolarHBondContact OG-NZ 3.3Å
4	G	41.5	Very low	45.1	Very low	45 Å²	45	128.8 Å²	128.8	46%	0.464	66%	0.663	S	S	.	*	S	Bend	trans	-92.6	-30.9	171.9	0	0	0	0	0	112.6	R6 S7	G4-R6 VanDerWaalsContact C-N 3.29Å; G4-R6 PolarHBondContact O-N 3.09Å; G4-S7 PolarHBondContact O-OG 3Å
5	E	43	Very low	45	Very low	155 Å²	155	125.6 Å²	125.6	72%	0.724	66%	0.664	S	S	*	*	H	α-helix	trans	-78	-10.2	-178	-65.9	-179.4	154.2	0	0	114.2
6	R	42.8	Very low	45	Very low	207 Å²	207	129.3 Å²	129.3	78%	0.781	67%	0.673	S	S	*	*	H	α-helix	trans	-92.7	-21.4	178.2	-110.9	178.5	177.5	177.2	-1	113.8	G4 V10	G4-R6 VanDerWaalsContact C-N 3.29Å; G4-R6 PolarHBondContact O-N 3.09Å; R6-V10 WeakPolarHBondContact O-CG2 3.38Å
7	S	48.5	Very low	45	Very low	71 Å²	71	126.8 Å²	126.8	50%	0.497	68%	0.675	S	S	.	*	H	α-helix	trans	-78.8	-35.1	172.9	56.8	0	0	0	0	111.8	G4 K9 V10 A11	G4-S7 PolarHBondContact O-OG 3Å; S7-K9 VanDerWaalsContact C-N 3.32Å; S7-K9 PolarHBondContact O-N 3.18Å; S7-V10 PolarHBondContact O-N 3.29Å; S7-A11 PolarHBondContact O-N 2.79Å
8	D	48.5	Very low	44.9	Very low	109 Å²	109	128.8 Å²	128.8	58%	0.583	68%	0.682	S	S	*	*	H	α-helix	trans	-74	-24.4	-179.2	-69.8	-7.9	0	0	0	113.1	K12	D8-K12 WeakPolarHBondContact O-CB 3.3Å; D8-K12 PolarHBondContact O-N 3.15Å; D8-K12 VanDerWaalsContact O-N 3.16Å
9	K	47.4	Very low	44.5	Very low	147 Å²	147	125.8 Å²	125.8	64%	0.639	69%	0.685	S	S	*	*	H	α-helix	trans	-79.4	-34.2	175.3	-135.7	172.4	-175.4	176.8	0	112.5	S7 K12 D13	S7-K9 VanDerWaalsContact C-N 3.32Å; S7-K9 PolarHBondContact O-N 3.18Å; K9-K12 PolarHBondContact O-N 3.13Å; K9-D13 WeakPolarHBondContact O-CB 3.34Å; K9-D13 PolarHBondContact O-N 2.99Å
10	V	50.8	Low	44	Very low	101 Å²	101	124.3 Å²	124.3	61%	0.612	69%	0.69	S	S	*	*	H	α-helix	trans	-74.4	-30.9	174.7	177	0	0	0	0	111.4	R6 S7 R14	R6-V10 WeakPolarHBondContact O-CG2 3.38Å; S7-V10 PolarHBondContact O-N 3.29Å; V10-R14 WeakPolarHBondContact O-CB 3.45Å; V10-R14 PolarHBondContact O-N 2.88Å
11	A	47.4	Very low	43.9	Very low	66 Å²	66	123.9 Å²	123.9	55%	0.545	69%	0.691	S	S	.	*	H	α-helix	trans	-69.6	-38.7	170.6	0	0	0	0	0	112.5	S7 A15	S7-A11 PolarHBondContact O-N 2.79Å; A11-A15 PolarHBondContact O-N 3.4Å
12	K	47.7	Very low	43.7	Very low	163 Å²	163	120.5 Å²	120.5	71%	0.709	68%	0.677	S	S	*	*	H	α-helix	trans	-72.6	-32.4	176.6	-89.8	178.5	172.2	172.8	0	114.5	D8 K9	D8-K12 WeakPolarHBondContact O-CB 3.3Å; D8-K12 PolarHBondContact O-N 3.15Å; D8-K12 VanDerWaalsContact O-N 3.16Å; K9-K12 PolarHBondContact O-N 3.13Å
13	D	46.3	Very low	43.9	Very low	105 Å²	105	122.4 Å²	122.4	56%	0.561	68%	0.677	S	S	*	*	H	α-helix	trans	-81.3	-22.2	178	-72.6	-26.2	0	0	0	112.7	K9 K16	K9-D13 WeakPolarHBondContact O-CB 3.34Å; K9-D13 PolarHBondContact O-N 2.99Å; D13-K16 PolarHBondContact O-N 3.2Å
14	R	44.9	Very low	44.1	Very low	207 Å²	207	128 Å²	128	78%	0.781	70%	0.696	S	S	*	*	H	α-helix	trans	-77	-28.6	172.6	-143.6	174.5	-176.4	-174.8	-1.3	112.8	V10 K16	V10-R14 WeakPolarHBondContact O-CB 3.45Å; V10-R14 PolarHBondContact O-N 2.88Å; R14-K16 PolarHBondContact O-N 3.18Å
15	A	43.7	Very low	44.7	Very low	81 Å²	81	134.4 Å²	134.4	67%	0.669	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-13.2	171.2	0	0	0	0	0	113.5	A11	A11-A15 PolarHBondContact O-N 3.4Å
16	K	43.8	Very low	45.4	Very low	185 Å²	185	131.3 Å²	131.3	80%	0.804	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-1.7	-178	-130.9	176.2	-175.9	-179.8	0	114.3	D13 R14	D13-K16 PolarHBondContact O-N 3.2Å; R14-K16 PolarHBondContact O-N 3.18Å
17	A	45.1	Very low	46.6	Very low	86 Å²	86	127.6 Å²	127.6	71%	0.711	70%	0.703	S	S	*	*	S	Bend	trans	-112.9	2.6	-177.3	0	0	0	0	0	114
18	M	42.9	Very low	47.4	Very low	163 Å²	163	132.9 Å²	132.9	80%	0.803	72%	0.718	S	S	*	*	S	Bend	trans	-99.7	111.7	165.7	-70.8	176.2	75.7	0	0	107	A20	M18-A20 PolarHBondContact O-N 3.4Å
19	G	37.5	Very low	48.6	Very low	72 Å²	72	131.6 Å²	131.6	74%	0.742	72%	0.717	S	S	*	*			trans	-56.4	130.4	-178.4	0	0	0	0	0	111.1	V21	G19-V21 PolarHBondContact O-N 3.34Å
20	A	35.2	Very low	49.9	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	71%	0.712	S	S	*	*			trans	-53.3	108.4	169.5	0	0	0	0	0	110	M18	M18-A20 PolarHBondContact O-N 3.4Å
21	V	42.4	Very low	51.2	Low	116 Å²	116	128.8 Å²	128.8	70%	0.703	71%	0.71	S	S	*	*			trans	-115.7	107.2	148.6	-177.1	0	0	0	0	102.9	G19 E23	G19-V21 PolarHBondContact O-N 3.34Å; V21-E23 HydrophobicContact CG1-CG 4.23Å; V21-E23 PolarHBondContact O-N 3.09Å
22	D	38.4	Very low	52.3	Low	158 Å²	158	135.3 Å²	135.3	85%	0.845	73%	0.73	S	S	*	*			trans	-64	83.5	170.7	-72.8	-43.7	0	0	0	107.9
23	E	41.9	Very low	53.6	Low	171 Å²	171	134.8 Å²	134.8	80%	0.799	73%	0.734	S	S	*	*			trans	-89.7	100.5	155.4	-74.2	-174.9	175.9	0	0	105.5	V21 E25	V21-E23 HydrophobicContact CG1-CG 4.23Å; V21-E23 PolarHBondContact O-N 3.09Å; E23-E25 PolarHBondContact O-N 2.74Å
24	E	46.5	Very low	54.9	Low	184 Å²	184	135.4 Å²	135.4	86%	0.86	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-47.6	123.4	169.6	-71.7	177.5	156.5	0	0	108.3
25	E	54.6	Low	56.1	Low	181 Å²	181	131 Å²	131	85%	0.846	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-53.3	127.6	170.7	-71.8	-172.6	160.1	0	0	107.4	E23 D27	E23-E25 PolarHBondContact O-N 2.74Å; E25-D27 PolarHBondContact O-N 3.2Å; E25-D27 VanDerWaalsContact O-N 3.12Å
26	P	57.7	Low	57.1	Low	89 Å²	89	131.1 Å²	131.1	58%	0.578	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-57.7	124.9	-178.9	19.8	-28.7	0	0	0	108.7	F28	P26-F28 HydrophobicContact CB-CE2 4.41Å; P26-F28 HydrophobicContact CG-CE2 3.74Å; P26-F28 HydrophobicContact CG-CZ 3.91Å; P26-F28 WeakPolarHBondContact O-CD2 3.31Å; P26-F28 WeakPolarHBondContact O-CE2 3.31Å; P26-F28 PolarHBondContact O-N 3.43Å
27	D	67.7	Low	58.5	Low	129 Å²	129	129.6 Å²	129.6	69%	0.69	72%	0.715	S	S	*	*			trans	-63.3	107.3	173.3	-172.7	7.8	0	0	0	108.1	E25 S29	E25-D27 PolarHBondContact O-N 3.2Å; E25-D27 VanDerWaalsContact O-N 3.12Å; D27-S29 PolarHBondContact O-N 2.93Å; D27-S29 WeakPolarHBondContact OD1-CB 3.24Å; D27-S29 PolarHBondContact OD1-N 2.78Å; D27-S29 PolarHBondContact OD1-OG 2.95Å
28	F	66	Low	59.5	Low	183 Å²	183	128.4 Å²	128.4	80%	0.803	70%	0.7	S	S	*	*			trans	-83.8	8.7	175.5	-71.2	-83.3	0	0	0	112	P26	P26-F28 HydrophobicContact CB-CE2 4.41Å; P26-F28 HydrophobicContact CG-CE2 3.74Å; P26-F28 HydrophobicContact CG-CZ 3.91Å; P26-F28 WeakPolarHBondContact O-CD2 3.31Å; P26-F28 WeakPolarHBondContact O-CE2 3.31Å; P26-F28 PolarHBondContact O-N 3.43Å
29	S	72.2	Confident	60.7	Low	82 Å²	82	124.5 Å²	124.5	57%	0.573	69%	0.685	S	S	*	*	S	Bend	trans	-71.3	129.9	171.6	-48.1	0	0	0	0	109.2	D27	D27-S29 PolarHBondContact O-N 2.93Å; D27-S29 WeakPolarHBondContact OD1-CB 3.24Å; D27-S29 PolarHBondContact OD1-N 2.78Å; D27-S29 PolarHBondContact OD1-OG 2.95Å
30	D	76.1	Confident	61.9	Low	99 Å²	99	126.7 Å²	126.7	53%	0.529	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-60.1	142.7	174	-66.8	-50.4	0	0	0	110.3	Y34	D30-Y34 HydrophobicContact CB-CD1 3.72Å; D30-Y34 HydrophobicContact CB-CD2 4.49Å; D30-Y34 HydrophobicContact CB-CE1 4.45Å; D30-Y34 HydrophobicContact CB-CG 3.75Å
31	P	77.4	Confident	63	Low	89 Å²	89	129.4 Å²	129.4	58%	0.578	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.9	151.5	177.6	-8.5	9.7	0	0	0	111.7	D33 Y34	P31-D33 PolarHBondContact O-N 2.79Å; P31-Y34 WeakPolarHBondContact O-CB 3.39Å; P31-Y34 PolarHBondContact O-N 2.98Å
32	E	71.4	Confident	64	Low	204 Å²	204	130.8 Å²	130.8	95%	0.953	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-19.9	-179.7	-68	-171.5	160.3	0	0	114.1
33	D	74.5	Confident	65.2	Low	151 Å²	151	128.3 Å²	128.3	81%	0.807	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	7.2	179.1	-51.4	-32.7	0	0	0	113.5	P31 V35	P31-D33 PolarHBondContact O-N 2.79Å; D33-V35 PolarHBondContact O-N 3.44Å
34	Y	72.5	Confident	66	Low	119 Å²	119	123.9 Å²	123.9	47%	0.467	64%	0.642	S	S	.	*			trans	-72.8	117.9	-179	-170	-100.5	0	0	0	110.6	D30 P31 D36	D30-Y34 HydrophobicContact CB-CD1 3.72Å; D30-Y34 HydrophobicContact CB-CD2 4.49Å; D30-Y34 HydrophobicContact CB-CE1 4.45Å; D30-Y34 HydrophobicContact CB-CG 3.75Å; P31-Y34 WeakPolarHBondContact O-CB 3.39Å; P31-Y34 PolarHBondContact O-N 2.98Å; Y34-D36 WeakPolarHBondContact CE1-OD1 3.27Å
35	V	71	Confident	66.6	Low	113 Å²	113	116.7 Å²	116.7	69%	0.685	62%	0.618	S	S	*	*			trans	-100.5	109.1	174.2	-178.2	0	0	0	0	107.5	D33 N37	D33-V35 PolarHBondContact O-N 3.44Å; V35-N37 PolarHBondContact O-N 2.92Å
36	D	64.8	Low	66.6	Low	85 Å²	85	115 Å²	115	46%	0.455	61%	0.614	S	S	.	*			trans	-57.9	126.3	174.3	-101.1	-47.8	0	0	0	110.6	Y34 V38	Y34-D36 WeakPolarHBondContact CE1-OD1 3.27Å; D36-V38 PolarHBondContact O-N 3.35Å
37	N	72.8	Confident	66.3	Low	152 Å²	152	116.6 Å²	116.6	81%	0.813	62%	0.617	S	S	*	*	S	Bend	trans	-81.3	4.9	177.8	-71.1	-45.7	0	0	0	112.9	V35	V35-N37 PolarHBondContact O-N 2.92Å
38	V	65	Low	65.5	Low	62 Å²	62	113.9 Å²	113.9	38%	0.376	60%	0.602	S	S	.	*	S	Bend	trans	-123.3	127.2	-178.9	-179.4	0	0	0	0	106.8	D36 E42 L43	D36-V38 PolarHBondContact O-N 3.35Å; V38-E42 HydrophobicContact CG1-CB 3.51Å; V38-L43 HydrophobicContact CB-CD1 3.91Å; V38-L43 HydrophobicContact CG1-CD1 3.89Å; V38-L43 HydrophobicContact CG1-CG 4.25Å
39	T	69.4	Low	65	Low	81 Å²	81	109.3 Å²	109.3	50%	0.497	59%	0.593	S	S	.	*			trans	-67.4	149.1	-178.7	58.8	0	0	0	0	111.1	E41 E42 L43	T39-E41 PolarHBondContact O-N 3.24Å; T39-E42 PolarHBondContact O-N 3.35Å; T39-L43 PolarHBondContact O-N 3.16Å; T39-L43 VanDerWaalsContact O-N 3.11Å
40	D	62	Low	64	Low	118 Å²	118	111.6 Å²	111.6	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-51.4	-29.2	173.4	-71.7	-16.1	0	0	0	112.3	L44	D40-L44 WeakPolarHBondContact O-CB 3.49Å; D40-L44 PolarHBondContact O-N 3.15Å
41	E	58.7	Low	62.7	Low	152 Å²	152	115.5 Å²	115.5	71%	0.71	61%	0.606	S	S	*	*	H	α-helix	trans	-67.2	-33.5	174.7	-76.2	178.5	154.4	0	0	113.8	T39 G45	T39-E41 PolarHBondContact O-N 3.24Å; E41-G45 WeakPolarHBondContact O-CA 3.48Å; E41-G45 PolarHBondContact O-N 3.14Å; E41-G45 VanDerWaalsContact O-N 3.13Å
42	E	64.3	Low	61.3	Low	145 Å²	145	115.2 Å²	115.2	68%	0.678	61%	0.605	S	S	*	*	H	α-helix	trans	-81.2	-34.4	174.4	-87.9	-178.1	144.4	0	0	112.4	V38 T39	V38-E42 HydrophobicContact CG1-CB 3.51Å; T39-E42 PolarHBondContact O-N 3.35Å
43	L	62.4	Low	60.5	Low	106 Å²	106	109 Å²	109	56%	0.555	58%	0.58	S	S	*	*	H	α-helix	trans	-77.9	-34.7	-178.3	-118.1	141.9	0	0	0	112.7	V38 T39	V38-L43 HydrophobicContact CB-CD1 3.91Å; V38-L43 HydrophobicContact CG1-CD1 3.89Å; V38-L43 HydrophobicContact CG1-CG 4.25Å; T39-L43 PolarHBondContact O-N 3.16Å; T39-L43 VanDerWaalsContact O-N 3.11Å
44	L	57.8	Low	59.4	Low	78 Å²	78	110.4 Å²	110.4	41%	0.408	58%	0.582	S	S	.	*	S	Bend	trans	-116.1	15	-178	-68.4	164.8	0	0	0	113.4	D40 N46 L47 L48	D40-L44 WeakPolarHBondContact O-CB 3.49Å; D40-L44 PolarHBondContact O-N 3.15Å; L44-N46 PolarHBondContact O-N 3.35Å; L44-L47 HydrophobicContact CB-CB 4.48Å; L44-L47 HydrophobicContact CD2-CB 4.25Å; L44-L47 HydrophobicContact CD2-CD1 3.59Å; L44-L47 CarbonylContact O-C 3.44Å; L44-L47 WeakPolarHBondContact O-CA 3.27Å; L44-L47 PolarHBondContact O-N 3.04Å; L44-L48 HydrophobicContact CB-CD1 3.89Å; L44-L48 HydrophobicContact CB-CG 4.37Å; L44-L48 PolarHBondContact O-N 2.74Å
45	G	59.3	Low	58.6	Low	33 Å²	33	112.2 Å²	112.2	34%	0.34	60%	0.595	S	S	.	*	H	α-helix	trans	-50.4	-36.7	-175	0	0	0	0	0	115	E41 S49	E41-G45 WeakPolarHBondContact O-CA 3.48Å; E41-G45 PolarHBondContact O-N 3.14Å; E41-G45 VanDerWaalsContact O-N 3.13Å; G45-S49 PolarHBondContact O-N 3.37Å; G45-S49 PolarHBondContact O-OG 2.91Å
46	N	55.8	Low	58	Low	144 Å²	144	109.7 Å²	109.7	77%	0.77	58%	0.578	S	S	*	*	H	α-helix	trans	-75.3	-27.5	176.4	-65.6	-29.3	0	0	0	114	L44 S49	L44-N46 PolarHBondContact O-N 3.35Å; N46-S49 PolarHBondContact O-OG 2.76Å
47	L	50.8	Low	57.7	Low	124 Å²	124	109.9 Å²	109.9	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-86.4	-28.9	176.1	-87	155.7	0	0	0	111.7	L44 D50	L44-L47 HydrophobicContact CB-CB 4.48Å; L44-L47 HydrophobicContact CD2-CB 4.25Å; L44-L47 HydrophobicContact CD2-CD1 3.59Å; L44-L47 CarbonylContact O-C 3.44Å; L44-L47 WeakPolarHBondContact O-CA 3.27Å; L44-L47 PolarHBondContact O-N 3.04Å; L47-D50 PolarHBondContact O-N 2.84Å
48	L	51.7	Low	57.4	Low	71 Å²	71	103.2 Å²	103.2	37%	0.372	55%	0.545	S	S	.	.	H	α-helix	trans	-75.6	-30	173.7	-84.5	155.9	0	0	0	112.2	L44 D50 R51	L44-L48 HydrophobicContact CB-CD1 3.89Å; L44-L48 HydrophobicContact CB-CG 4.37Å; L44-L48 PolarHBondContact O-N 2.74Å; L48-D50 PolarHBondContact O-N 2.83Å; L48-R51 WeakPolarHBondContact O-CB 3.47Å; L48-R51 PolarHBondContact O-N 3.14Å; L48-R51 VanDerWaalsContact O-N 3.12Å
49	S	55.7	Low	57.6	Low	87 Å²	87	102.7 Å²	102.7	61%	0.608	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.3	170.9	57.8	0	0	0	0	113.7	G45 N46 R51	G45-S49 PolarHBondContact O-N 3.37Å; G45-S49 PolarHBondContact O-OG 2.91Å; N46-S49 PolarHBondContact O-OG 2.76Å; S49-R51 VanDerWaalsContact C-N 3.32Å
50	D	50.5	Low	58.2	Low	131 Å²	131	99.8 Å²	99.8	70%	0.701	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.6	173.1	-79	-14	0	0	0	112.7	L47 L48 P52	L47-D50 PolarHBondContact O-N 2.84Å; L48-D50 PolarHBondContact O-N 2.83Å; D50-P52 WeakPolarHBondContact O-CD 3.41Å
51	R	49.5	Very low	59.4	Low	180 Å²	180	95.9 Å²	95.9	68%	0.679	50%	0.5	S	S	*	.	S	Bend	trans	-67.6	119.2	173.9	-171.6	177.4	-179	172.2	0.5	107.8	L48 S49 T53	L48-R51 WeakPolarHBondContact O-CB 3.47Å; L48-R51 PolarHBondContact O-N 3.14Å; L48-R51 VanDerWaalsContact O-N 3.12Å; S49-R51 VanDerWaalsContact C-N 3.32Å; R51-T53 PolarHBondContact O-N 2.87Å
52	P	46.8	Very low	60.9	Low	84 Å²	84	88.6 Å²	88.6	55%	0.545	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-59.3	119.7	-176.2	21	-30.7	0	0	0	109.6	D50 D56 I57	D50-P52 WeakPolarHBondContact O-CD 3.41Å; P52-D56 HydrophobicContact CB-CB 4.1Å; P52-I57 HydrophobicContact CB-CG1 4.33Å
53	T	55.2	Low	62.1	Low	72 Å²	72	82.9 Å²	82.9	44%	0.442	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-69.9	162.3	171.3	59.8	0	0	0	0	109.7	R51 E55 D56 I57	R51-T53 PolarHBondContact O-N 2.87Å; T53-E55 PolarHBondContact O-N 2.7Å; T53-E55 VanDerWaalsContact O-N 3.11Å; T53-D56 PolarHBondContact N-OD2 3.25Å; T53-D56 WeakPolarHBondContact O-CB 3.35Å; T53-D56 PolarHBondContact O-N 3.45Å; T53-D56 PolarHBondContact OG1-N 3.15Å; T53-D56 PolarHBondContact OG1-OD2 2.93Å; T53-I57 PolarHBondContact O-N 2.86Å; T53-I57 VanDerWaalsContact O-N 3.12Å
54	E	51.9	Low	63.5	Low	181 Å²	181	77.9 Å²	77.9	85%	0.846	41%	0.414	S	S	*	.	H	α-helix	trans	-56.7	-27.8	175.3	-70.6	-173.1	160.5	0	0	112	G58	E54-G58 PolarHBondContact O-N 2.88Å
55	E	55.9	Low	64.9	Low	157 Å²	157	78.3 Å²	78.3	73%	0.734	42%	0.416	S	S	*	.	H	α-helix	trans	-69.2	-37.9	172.4	-64.1	-174.7	172.1	0	0	112.7	T53 G58 Q59	T53-E55 PolarHBondContact O-N 2.7Å; T53-E55 VanDerWaalsContact O-N 3.11Å; E55-G58 PolarHBondContact O-N 3.19Å; E55-Q59 PolarHBondContact O-N 2.79Å
56	D	56.7	Low	66.2	Low	60 Å²	60	77.7 Å²	77.7	32%	0.321	41%	0.411	S	S	.	.	H	α-helix	trans	-70.6	-33	178	-63.9	-45.9	0	0	0	112.7	P52 T53 G58 Q59 S60	P52-D56 HydrophobicContact CB-CB 4.1Å; T53-D56 PolarHBondContact N-OD2 3.25Å; T53-D56 WeakPolarHBondContact O-CB 3.35Å; T53-D56 PolarHBondContact O-N 3.45Å; T53-D56 PolarHBondContact OG1-N 3.15Å; T53-D56 PolarHBondContact OG1-OD2 2.93Å; D56-G58 VanDerWaalsContact C-N 3.28Å; D56-G58 PolarHBondContact O-N 3.2Å; D56-Q59 WeakPolarHBondContact O-CB 3.46Å; D56-Q59 PolarHBondContact O-N 3.46Å; D56-Q59 VanDerWaalsContact O-N 3.12Å; D56-S60 PolarHBondContact O-N 2.86Å
57	I	59	Low	67.8	Low	89 Å²	89	71 Å²	71	46%	0.456	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-39.7	173.7	-61	172	0	0	0	109.7	P52 T53 Q59 S60 I61	P52-I57 HydrophobicContact CB-CG1 4.33Å; T53-I57 PolarHBondContact O-N 2.86Å; T53-I57 VanDerWaalsContact O-N 3.12Å; I57-Q59 PolarHBondContact O-N 3.39Å; I57-S60 PolarHBondContact O-N 3.02Å; I57-S60 VanDerWaalsContact O-N 3.12Å; I57-I61 HydrophobicContact CG2-CD1 4.08Å; I57-I61 WeakPolarHBondContact O-CG1 3.43Å; I57-I61 PolarHBondContact O-N 3.44Å
58	G	65.9	Low	69.5	Low	12 Å²	12	65.9 Å²	65.9	12%	0.124	35%	0.349	C	S	.	.	H	α-helix	trans	-59	-31.7	173.8	0	0	0	0	0	113.4	E54 E55 D56 S60 I61 F141	E54-G58 PolarHBondContact O-N 2.88Å; E55-G58 PolarHBondContact O-N 3.19Å; D56-G58 VanDerWaalsContact C-N 3.28Å; D56-G58 PolarHBondContact O-N 3.2Å; G58-S60 VanDerWaalsContact C-N 3.3Å; G58-S60 PolarHBondContact O-N 2.85Å; G58-I61 PolarHBondContact O-N 2.95Å; G58-F141 WeakPolarHBondContact O-CB 3.46Å
59	Q	70.4	Confident	71.2	Confident	51 Å²	51	70 Å²	70	24%	0.238	36%	0.364	C	S	.	.	H	α-helix	trans	-74.9	-19.4	178.8	-60.7	178.4	36.6	0	0	113.3	E55 D56 I57 K115 C142	E55-Q59 PolarHBondContact O-N 2.79Å; D56-Q59 WeakPolarHBondContact O-CB 3.46Å; D56-Q59 PolarHBondContact O-N 3.46Å; D56-Q59 VanDerWaalsContact O-N 3.12Å; I57-Q59 PolarHBondContact O-N 3.39Å; Q59-K115 HydrophobicContact CB-CD 4.03Å; Q59-K115 HydrophobicContact CB-CG 4.26Å; Q59-C142 HydrophobicContact CG-CB 4.35Å
60	S	82	Confident	72.7	Confident	21 Å²	21	67 Å²	67	15%	0.147	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	4.9	178.9	-56.1	0	0	0	0	113.2	D56 I57 G58 Y112 K115	D56-S60 PolarHBondContact O-N 2.86Å; I57-S60 PolarHBondContact O-N 3.02Å; I57-S60 VanDerWaalsContact O-N 3.12Å; G58-S60 VanDerWaalsContact C-N 3.3Å; G58-S60 PolarHBondContact O-N 2.85Å; S60-Y112 WeakPolarHBondContact CB-O 3.47Å; S60-Y112 PolarHBondContact O-N 3.4Å; S60-K115 PolarHBondContact OG-N 3.4Å
61	I	87.6	Confident	74.3	Confident	35 Å²	35	62.1 Å²	62.1	18%	0.179	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.6	178.4	-65	165.7	0	0	0	110.1	I57 G58 F109 A111 F141	I57-I61 HydrophobicContact CG2-CD1 4.08Å; I57-I61 WeakPolarHBondContact O-CG1 3.43Å; I57-I61 PolarHBondContact O-N 3.44Å; G58-I61 PolarHBondContact O-N 2.95Å; I61-F109 HydrophobicContact CG2-CB 4.22Å; I61-F109 HydrophobicContact CG2-CD1 4.08Å; I61-A111 HydrophobicContact CG1-CB 4.06Å; I61-F141 HydrophobicContact CB-CB 3.94Å; I61-F141 HydrophobicContact CG2-CB 3.98Å; I61-F141 HydrophobicContact CG2-CG 4.48Å; I61-F141 WeakPolarHBondContact O-CB 3.04Å; I61-F141 PolarHBondContact O-N 3.12Å
62	V	89.7	Confident	75.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.2	173.7	-177	0	0	0	0	109.3	V64 F109 V110 Y112 A118 A122 V138 L140	V62-V64 HydrophobicContact CG1-CG2 4.25Å; V62-F109 WeakPolarHBondContact O-CA 3.2Å; V62-V110 PolarHBondContact N-O 2.8Å; V62-V110 PolarHBondContact O-N 3.47Å; V62-Y112 HydrophobicContact CG2-CD2 4Å; V62-Y112 HydrophobicContact CG2-CE2 3.95Å; V62-A118 HydrophobicContact CG2-CB 3.62Å; V62-A118 WeakPolarHBondContact CG2-O 3.45Å; V62-A122 HydrophobicContact CG1-CB 4.4Å; V62-V138 HydrophobicContact CG1-CG1 3.07Å; V62-L140 HydrophobicContact CG2-CD2 4.37Å
63	I	90.2	Very high	77.5	Confident	25 Å²	25	60.8 Å²	60.8	13%	0.128	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.6	171.9	-51.5	-179.2	0	0	0	108.3	F109 V138 N139 F141 L144	I63-F109 HydrophobicContact CD1-CE1 4.02Å; I63-F109 HydrophobicContact CG1-CD1 3.87Å; I63-F109 HydrophobicContact CG1-CE1 3.79Å; I63-F109 HydrophobicContact CG2-CE1 4.33Å; I63-V138 WeakPolarHBondContact O-CA 3.42Å; I63-N139 PolarHBondContact N-O 2.91Å; I63-N139 PolarHBondContact O-N 2.83Å; I63-F141 HydrophobicContact CD1-CB 4.28Å; I63-F141 HydrophobicContact CD1-CD2 3.69Å; I63-F141 HydrophobicContact CD1-CG 4.38Å; I63-F141 HydrophobicContact CG1-CB 4.19Å; I63-F141 HydrophobicContact CG1-CD2 4.06Å; I63-L144 HydrophobicContact CD1-CD1 3.4Å
64	V	90.4	Very high	78.9	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	108.8	-179.8	-173.5	0	0	0	0	108	V62 V67 M82 F86 Y107 A108 V110 F136 V138	V62-V64 HydrophobicContact CG1-CG2 4.25Å; V64-V67 HydrophobicContact CB-CG2 4.32Å; V64-V67 HydrophobicContact CG1-CG2 3.86Å; V64-M82 HydrophobicContact CG1-CE 4.2Å; V64-F86 HydrophobicContact CB-CZ 4.18Å; V64-F86 HydrophobicContact CG1-CE2 4.44Å; V64-F86 HydrophobicContact CG1-CZ 3.85Å; V64-F86 HydrophobicContact CG2-CE1 3.51Å; V64-F86 HydrophobicContact CG2-CE2 4.2Å; V64-F86 HydrophobicContact CG2-CZ 3.27Å; V64-Y107 CarbonylContact O-C 3.56Å; V64-Y107 WeakPolarHBondContact O-CA 3.14Å; V64-Y107 WeakPolarHBondContact O-CB 3.22Å; V64-A108 PolarHBondContact N-O 3.25Å; V64-A108 PolarHBondContact O-N 3.45Å; V64-V110 HydrophobicContact CG2-CG2 4.18Å; V64-F136 HydrophobicContact CG1-CB 4.22Å; V64-F136 HydrophobicContact CG1-CD1 4.08Å; V64-F136 HydrophobicContact CG1-CD2 4.32Å; V64-F136 HydrophobicContact CG1-CG 3.97Å; V64-V138 HydrophobicContact CG1-CG2 4.24Å; V64-V138 HydrophobicContact CG2-CG1 4.31Å
65	D	88.2	Confident	80.4	Confident	87 Å²	87	58.9 Å²	58.9	47%	0.465	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	158.5	172.1	-168.1	21.1	0	0	0	110.8	F136 T137	D65-F136 CarbonylContact O-C 3.6Å; D65-F136 VanDerWaalsContact O-CA 3.27Å; D65-F136 WeakPolarHBondContact O-CA 3.13Å; D65-T137 PolarHBondContact N-O 2.83Å; D65-T137 PolarHBondContact O-N 2.81Å
66	G	85.9	Confident	81.8	Confident	21 Å²	21	53.6 Å²	53.6	22%	0.216	30%	0.295	C	S	.	.	S	Bend	trans	83.6	20.4	-177.3	0	0	0	0	0	114.4	G106 H134	G66-G106 PolarHBondContact N-O 2.92Å; G66-G106 VanDerWaalsContact N-O 3.14Å; G66-H134 WeakPolarHBondContact O-CB 3.26Å
67	V	88.9	Confident	83.2	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	31%	0.313	C	S	.	.			trans	-74.2	140.9	174	-174.3	0	0	0	0	109.6	V64 K69 L78 M82 Y97 G106 A108 F136	V64-V67 HydrophobicContact CB-CG2 4.32Å; V64-V67 HydrophobicContact CG1-CG2 3.86Å; V67-K69 PolarHBondContact O-N 2.9Å; V67-L78 HydrophobicContact CG1-CD1 4.11Å; V67-L78 HydrophobicContact CG1-CD2 3.81Å; V67-L78 HydrophobicContact CG1-CG 4.38Å; V67-M82 HydrophobicContact CG1-CE 4.43Å; V67-M82 HydrophobicContact CG1-SD 4.41Å; V67-M82 HydrophobicContact CG2-CE 3.97Å; V67-Y97 HydrophobicContact CG1-CE1 4.45Å; V67-G106 PolarHBondContact N-O 3.27Å; V67-G106 VanDerWaalsContact O-CA 3.24Å; V67-G106 WeakPolarHBondContact O-CA 3.46Å; V67-A108 HydrophobicContact CG2-CB 4.1Å; V67-F136 HydrophobicContact CG2-CE1 4.36Å
68	P	86.8	Confident	84.5	Confident	15 Å²	15	54.6 Å²	54.6	10%	0.097	29%	0.294	C	S	.	.			trans	-57.2	135.2	178	-25.8	32.6	0	0	0	113.9	V70 L78 T104 L130 H134	P68-V70 HydrophobicContact CB-CG1 4.17Å; P68-V70 PolarHBondContact O-N 2.91Å; P68-L78 HydrophobicContact CG-CD1 4.17Å; P68-T104 PolarHBondContact O-OG1 2.92Å; P68-L130 HydrophobicContact CG-CD2 3.54Å; P68-H134 HydrophobicContact CG-CB 4.37Å
69	K	87.3	Confident	85.5	Confident	158 Å²	158	58.2 Å²	58.2	69%	0.687	31%	0.307	S	S	*	.			trans	-78.3	109.1	171.3	-61.1	-167.8	179.5	-174.2	0	110.1	V67 T104 K105	V67-K69 PolarHBondContact O-N 2.9Å; K69-T104 VanDerWaalsContact CA-OG1 3.27Å; K69-T104 WeakPolarHBondContact CA-OG1 3.42Å; K69-T104 WeakPolarHBondContact CG-O 3.32Å; K69-K105 VanDerWaalsContact CE-O 3.31Å; K69-K105 WeakPolarHBondContact CE-O 3.35Å
70	V	86.9	Confident	86.4	Confident	23 Å²	23	60.6 Å²	60.6	14%	0.139	33%	0.325	C	S	.	.			trans	-133.2	142.7	-174.7	-64.4	0	0	0	0	111.5	P68 R74 L78 A103 T104	P68-V70 HydrophobicContact CB-CG1 4.17Å; P68-V70 PolarHBondContact O-N 2.91Å; V70-R74 HydrophobicContact CB-CB 3.96Å; V70-R74 HydrophobicContact CG1-CB 4.26Å; V70-L78 HydrophobicContact CG2-CB 4.19Å; V70-L78 HydrophobicContact CG2-CD2 3.56Å; V70-A103 CarbonylContact O-C 3.49Å; V70-A103 VanDerWaalsContact O-CA 3.31Å; V70-A103 WeakPolarHBondContact O-CA 3.41Å; V70-T104 HydrophobicContact CG2-CG2 4.09Å; V70-T104 PolarHBondContact N-OG1 2.93Å; V70-T104 PolarHBondContact O-N 3.36Å
71	G	85.2	Confident	86.7	Confident	30 Å²	30	63.7 Å²	63.7	31%	0.309	34%	0.339	S	S	.	.			trans	-75.3	179.5	171.7	0	0	0	0	0	113.4	D73 R74 L75	G71-D73 VanDerWaalsContact C-N 3.29Å; G71-D73 PolarHBondContact O-N 2.61Å; G71-R74 PolarHBondContact O-N 3.4Å; G71-R74 VanDerWaalsContact O-N 3.13Å; G71-L75 PolarHBondContact O-N 2.91Å; G71-L75 VanDerWaalsContact O-N 3.15Å
72	P	81.8	Confident	86.7	Confident	83 Å²	83	62 Å²	62	54%	0.539	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-36.8	-169.3	23	-31.8	0	0	0	112.9	R74 L75 D102	P72-R74 PolarHBondContact O-N 2.96Å; P72-L75 WeakPolarHBondContact O-CB 3.34Å; P72-L75 PolarHBondContact O-N 3.28Å; P72-D102 WeakPolarHBondContact CD-O 3.15Å
73	D	81.6	Confident	86.7	Confident	153 Å²	153	64.3 Å²	64.3	82%	0.818	35%	0.346	S	S	*	.	H	α-helix	trans	-63	-26.4	-177.8	-43.2	-27.8	0	0	0	113.5	G71	G71-D73 VanDerWaalsContact C-N 3.29Å; G71-D73 PolarHBondContact O-N 2.61Å
74	R	83.9	Confident	86.6	Confident	181 Å²	181	70.6 Å²	70.6	68%	0.683	37%	0.372	S	S	*	.	H	α-helix	trans	-108.6	-10.8	-177.7	-69.7	-173.3	-177.9	-167.2	1.9	113.2	V70 G71 P72 G76 K77 L78	V70-R74 HydrophobicContact CB-CB 3.96Å; V70-R74 HydrophobicContact CG1-CB 4.26Å; G71-R74 PolarHBondContact O-N 3.4Å; G71-R74 VanDerWaalsContact O-N 3.13Å; P72-R74 PolarHBondContact O-N 2.96Å; R74-G76 VanDerWaalsContact C-N 3.3Å; R74-G76 PolarHBondContact O-N 2.79Å; R74-K77 PolarHBondContact O-N 3.22Å; R74-L78 PolarHBondContact O-N 3.07Å; R74-L78 VanDerWaalsContact O-N 3.09Å
75	L	83.2	Confident	86.6	Confident	32 Å²	32	71.5 Å²	71.5	17%	0.168	38%	0.377	C	S	.	.	H	α-helix	trans	-55.7	-43.7	179.2	-166.2	102.5	0	0	0	112.1	G71 P72 K77 L78 K79 L99 T104	G71-L75 PolarHBondContact O-N 2.91Å; G71-L75 VanDerWaalsContact O-N 3.15Å; P72-L75 WeakPolarHBondContact O-CB 3.34Å; P72-L75 PolarHBondContact O-N 3.28Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.35Å; L75-L78 PolarHBondContact O-N 3.26Å; L75-K79 HydrophobicContact CD2-CD 4.41Å; L75-K79 PolarHBondContact O-N 2.92Å; L75-L99 HydrophobicContact CD1-CD2 3.72Å; L75-T104 HydrophobicContact CD1-CG2 3.4Å
76	G	85.4	Confident	86.6	Confident	45 Å²	45	67.3 Å²	67.3	46%	0.464	36%	0.355	S	S	.	.	H	α-helix	trans	-59.3	-43.4	179	0	0	0	0	0	112.8	R74 K79 T80	R74-G76 VanDerWaalsContact C-N 3.3Å; R74-G76 PolarHBondContact O-N 2.79Å; G76-K79 PolarHBondContact O-N 2.92Å; G76-T80 PolarHBondContact O-N 3.48Å; G76-T80 VanDerWaalsContact O-N 3.16Å; G76-T80 PolarHBondContact O-OG1 3.01Å; G76-T80 VanDerWaalsContact O-OG1 3.04Å
77	K	86.4	Confident	86.7	Confident	158 Å²	158	69.3 Å²	69.3	69%	0.687	37%	0.365	S	S	*	.	H	α-helix	trans	-67.3	-39.5	177.5	-71.5	-177.4	179.6	176.3	0	112.1	R74 L75 T80 I81	R74-K77 PolarHBondContact O-N 3.22Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.35Å; K77-T80 PolarHBondContact O-N 3.17Å; K77-I81 WeakPolarHBondContact O-CG1 3.15Å; K77-I81 PolarHBondContact O-N 3.31Å; K77-I81 VanDerWaalsContact O-N 3.14Å
78	L	86.8	Confident	86.6	Confident	12 Å²	12	76.9 Å²	76.9	6%	0.063	40%	0.398	C	S	.	.	H	α-helix	trans	-61.3	-47.6	176.5	177.7	63.8	0	0	0	110.8	V67 P68 V70 R74 L75 T80 I81 M82 T104	V67-L78 HydrophobicContact CG1-CD1 4.11Å; V67-L78 HydrophobicContact CG1-CD2 3.81Å; V67-L78 HydrophobicContact CG1-CG 4.38Å; P68-L78 HydrophobicContact CG-CD1 4.17Å; V70-L78 HydrophobicContact CG2-CB 4.19Å; V70-L78 HydrophobicContact CG2-CD2 3.56Å; R74-L78 PolarHBondContact O-N 3.07Å; R74-L78 VanDerWaalsContact O-N 3.09Å; L75-L78 PolarHBondContact O-N 3.26Å; L78-T80 VanDerWaalsContact C-N 3.31Å; L78-T80 PolarHBondContact O-N 3.27Å; L78-I81 PolarHBondContact O-N 3.44Å; L78-I81 VanDerWaalsContact O-N 3.15Å; L78-M82 HydrophobicContact CD1-CG 3.95Å; L78-M82 HydrophobicContact CG-CG 4.2Å; L78-M82 WeakPolarHBondContact O-CB 2.91Å; L78-M82 VanDerWaalsContact O-CG 3.27Å; L78-M82 WeakPolarHBondContact O-CG 3.41Å; L78-M82 PolarHBondContact O-N 3.26Å; L78-T104 HydrophobicContact CD2-CG2 4.35Å
79	K	87.6	Confident	86.5	Confident	89 Å²	89	77.8 Å²	77.8	39%	0.387	40%	0.4	S	S	.	.	H	α-helix	trans	-56.2	-43.4	176	-74.3	-171.6	173.9	-171.4	0	112.2	L75 G76 I81 M82 S83 Y97	L75-K79 HydrophobicContact CD2-CD 4.41Å; L75-K79 PolarHBondContact O-N 2.92Å; G76-K79 PolarHBondContact O-N 2.92Å; K79-I81 PolarHBondContact O-N 3.45Å; K79-M82 PolarHBondContact O-N 3.11Å; K79-S83 VanDerWaalsContact O-CB 3.24Å; K79-S83 WeakPolarHBondContact O-CB 3.24Å; K79-S83 PolarHBondContact O-N 3.12Å; K79-Y97 HydrophobicContact CD-CD2 4.38Å; K79-Y97 HydrophobicContact CD-CE2 4.32Å; K79-Y97 HydrophobicContact CG-CD2 4.04Å; K79-Y97 HydrophobicContact CG-CE2 3.7Å
80	T	87.8	Confident	86.3	Confident	101 Å²	101	71.4 Å²	71.4	62%	0.62	38%	0.379	S	S	*	.	H	α-helix	trans	-62.7	-40.7	177.7	-48.7	0	0	0	0	112.7	G76 K77 L78 K84	G76-T80 PolarHBondContact O-N 3.48Å; G76-T80 VanDerWaalsContact O-N 3.16Å; G76-T80 PolarHBondContact O-OG1 3.01Å; G76-T80 VanDerWaalsContact O-OG1 3.04Å; K77-T80 PolarHBondContact O-N 3.17Å; L78-T80 VanDerWaalsContact C-N 3.31Å; L78-T80 PolarHBondContact O-N 3.27Å; T80-K84 WeakPolarHBondContact O-CB 3.27Å; T80-K84 PolarHBondContact O-N 3.12Å
81	I	89	Confident	86.2	Confident	85 Å²	85	76.9 Å²	76.9	44%	0.436	40%	0.404	S	S	.	.	H	α-helix	trans	-67.8	-48.8	178.7	-67.1	167.6	0	0	0	110.3	K77 L78 K79 K84 I85 L130	K77-I81 WeakPolarHBondContact O-CG1 3.15Å; K77-I81 PolarHBondContact O-N 3.31Å; K77-I81 VanDerWaalsContact O-N 3.14Å; L78-I81 PolarHBondContact O-N 3.44Å; L78-I81 VanDerWaalsContact O-N 3.15Å; K79-I81 PolarHBondContact O-N 3.45Å; I81-K84 PolarHBondContact O-N 2.85Å; I81-I85 HydrophobicContact CG2-CD1 3.97Å; I81-I85 WeakPolarHBondContact O-CG1 3.12Å; I81-I85 PolarHBondContact O-N 3.12Å; I81-I85 VanDerWaalsContact O-N 3.15Å; I81-L130 HydrophobicContact CG2-CD1 3.99Å
82	M	88.6	Confident	86.3	Confident	0 Å²	0	77 Å²	77	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-60	-49.7	179.5	-69.7	-68.3	-70.9	0	0	110.8	V64 V67 L78 K79 K84 I85 F86 Y97 A108 F136	V64-M82 HydrophobicContact CG1-CE 4.2Å; V67-M82 HydrophobicContact CG1-CE 4.43Å; V67-M82 HydrophobicContact CG1-SD 4.41Å; V67-M82 HydrophobicContact CG2-CE 3.97Å; L78-M82 HydrophobicContact CD1-CG 3.95Å; L78-M82 HydrophobicContact CG-CG 4.2Å; L78-M82 WeakPolarHBondContact O-CB 2.91Å; L78-M82 VanDerWaalsContact O-CG 3.27Å; L78-M82 WeakPolarHBondContact O-CG 3.41Å; L78-M82 PolarHBondContact O-N 3.26Å; K79-M82 PolarHBondContact O-N 3.11Å; M82-K84 PolarHBondContact O-N 3.4Å; M82-I85 WeakPolarHBondContact O-CA 3.42Å; M82-I85 PolarHBondContact O-N 3.42Å; M82-F86 HydrophobicContact CE-CD2 4.04Å; M82-F86 HydrophobicContact CE-CE2 3.4Å; M82-F86 HydrophobicContact CE-CZ 4.22Å; M82-F86 WeakPolarHBondContact O-CD2 3.38Å; M82-F86 PolarHBondContact O-N 3.46Å; M82-F86 HydrophobicContact SD-CE2 4.13Å; M82-Y97 HydrophobicContact CB-CE1 4.49Å; M82-Y97 WeakPolarHBondContact CB-OH 3.36Å; M82-Y97 HydrophobicContact CE-CE1 4.28Å; M82-Y97 HydrophobicContact CG-CE1 4.03Å; M82-Y97 WeakPolarHBondContact CG-OH 3.44Å; M82-A108 HydrophobicContact CE-CB 4.44Å; M82-F136 HydrophobicContact CE-CZ 4.31Å; M82-F136 HydrophobicContact SD-CE1 4.25Å; M82-F136 HydrophobicContact SD-CE2 4.17Å; M82-F136 HydrophobicContact SD-CZ 3.52Å; M82-F136 VanDerWaalsContact SD-CZ 3.52Å
83	S	88.3	Confident	86.4	Confident	48 Å²	48	78.4 Å²	78.4	34%	0.336	40%	0.401	S	S	.	.	H	α-helix	trans	-57.6	-38.1	178.4	-159.7	0	0	0	0	112.3	K79 I85 S87 E95	K79-S83 VanDerWaalsContact O-CB 3.24Å; K79-S83 WeakPolarHBondContact O-CB 3.24Å; K79-S83 PolarHBondContact O-N 3.12Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 3.47Å; S83-S87 WeakPolarHBondContact O-CB 3.44Å; S83-S87 PolarHBondContact O-N 3.3Å; S83-S87 PolarHBondContact O-OG 3.29Å; S83-E95 WeakPolarHBondContact CA-OE1 3.33Å; S83-E95 WeakPolarHBondContact CB-OE1 3.49Å; S83-E95 PolarHBondContact OG-OE1 3.17Å
84	K	88.5	Confident	86.7	Confident	157 Å²	157	76.1 Å²	76.1	68%	0.683	39%	0.388	S	S	*	.	H	α-helix	trans	-66.8	-28.9	175.1	-166.1	176.8	-175.1	177.8	0	114	T80 I81 M82	T80-K84 WeakPolarHBondContact O-CB 3.27Å; T80-K84 PolarHBondContact O-N 3.12Å; I81-K84 PolarHBondContact O-N 2.85Å; M82-K84 PolarHBondContact O-N 3.4Å
85	I	89.8	Confident	87	Confident	19 Å²	19	69.1 Å²	69.1	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-78.7	-50.4	177.4	-66.1	167.3	0	0	0	109.7	I81 M82 S83 L125 Y128 L130 F136	I81-I85 HydrophobicContact CG2-CD1 3.97Å; I81-I85 WeakPolarHBondContact O-CG1 3.12Å; I81-I85 PolarHBondContact O-N 3.12Å; I81-I85 VanDerWaalsContact O-N 3.15Å; M82-I85 WeakPolarHBondContact O-CA 3.42Å; M82-I85 PolarHBondContact O-N 3.42Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 3.47Å; I85-L125 HydrophobicContact CG2-CD1 4.12Å; I85-L125 HydrophobicContact CG2-CD2 3.7Å; I85-Y128 HydrophobicContact CD1-CE1 4.08Å; I85-L130 HydrophobicContact CD1-CD1 3.66Å; I85-F136 HydrophobicContact CD1-CE2 4.25Å
86	F	88.3	Confident	87.3	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-77.4	-28.8	-172.9	-75.5	-88.4	0	0	0	113.4	V64 M82 K88 F89 V92 V110 Y112 L125 F136	V64-F86 HydrophobicContact CB-CZ 4.18Å; V64-F86 HydrophobicContact CG1-CE2 4.44Å; V64-F86 HydrophobicContact CG1-CZ 3.85Å; V64-F86 HydrophobicContact CG2-CE1 3.51Å; V64-F86 HydrophobicContact CG2-CE2 4.2Å; V64-F86 HydrophobicContact CG2-CZ 3.27Å; M82-F86 HydrophobicContact CE-CD2 4.04Å; M82-F86 HydrophobicContact CE-CE2 3.4Å; M82-F86 HydrophobicContact CE-CZ 4.22Å; M82-F86 WeakPolarHBondContact O-CD2 3.38Å; M82-F86 PolarHBondContact O-N 3.46Å; M82-F86 HydrophobicContact SD-CE2 4.13Å; F86-K88 PolarHBondContact O-N 3.49Å; F86-K88 VanDerWaalsContact O-N 3.15Å; F86-F89 PolarHBondContact O-N 2.93Å; F86-V92 HydrophobicContact CB-CG2 4.2Å; F86-V110 HydrophobicContact CB-CG1 4.1Å; F86-V110 HydrophobicContact CD1-CB 4.23Å; F86-V110 HydrophobicContact CD1-CG1 4.02Å; F86-V110 HydrophobicContact CD1-CG2 3.97Å; F86-V110 HydrophobicContact CD2-CG2 4.37Å; F86-V110 HydrophobicContact CE1-CG2 4.2Å; F86-V110 HydrophobicContact CG-CG1 4.19Å; F86-V110 HydrophobicContact CG-CG2 4.08Å; F86-Y112 WeakPolarHBondContact CA-OH 3.42Å; F86-Y112 WeakPolarHBondContact CB-OH 3.38Å; F86-Y112 WeakPolarHBondContact CD1-OH 3.43Å; F86-Y112 WeakPolarHBondContact O-CE1 3.4Å; F86-Y112 PolarHBondContact O-OH 3.39Å; F86-L125 HydrophobicContact CD1-CD1 3.6Å; F86-L125 HydrophobicContact CE1-CD1 3.29Å; F86-L125 HydrophobicContact CE2-CD1 4.27Å; F86-L125 HydrophobicContact CG-CD1 4.22Å; F86-L125 HydrophobicContact CZ-CD1 3.64Å; F86-F136 HydrophobicContact CE2-CE2 4.35Å
87	S	88.4	Confident	87.5	Confident	62 Å²	62	72.9 Å²	72.9	43%	0.434	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-63.8	-15.6	174.6	54.5	0	0	0	0	114.6	S83 F89 G90	S83-S87 WeakPolarHBondContact O-CB 3.44Å; S83-S87 PolarHBondContact O-N 3.3Å; S83-S87 PolarHBondContact O-OG 3.29Å; S87-F89 PolarHBondContact O-N 2.72Å; S87-G90 PolarHBondContact O-N 3.34Å
88	K	87.5	Confident	87.5	Confident	164 Å²	164	65.8 Å²	65.8	71%	0.713	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-66.1	-24.7	176.8	-70.7	-177	177.3	-178.1	0	113.8	F86	F86-K88 PolarHBondContact O-N 3.49Å; F86-K88 VanDerWaalsContact O-N 3.15Å
89	F	84.2	Confident	87.5	Confident	33 Å²	33	69.4 Å²	69.4	15%	0.145	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-99.4	-1.8	-174.5	-56.3	-82	0	0	0	112.5	F86 S87 Y112 N117 E120 A121 V124 L125	F86-F89 PolarHBondContact O-N 2.93Å; S87-F89 PolarHBondContact O-N 2.72Å; F89-Y112 HydrophobicContact CB-CE1 4.32Å; F89-N117 VanDerWaalsContact O-CB 3.26Å; F89-N117 WeakPolarHBondContact O-CB 3.47Å; F89-N117 PolarHBondContact O-OD1 3.29Å; F89-E120 HydrophobicContact CD1-CG 4.23Å; F89-A121 HydrophobicContact CB-CB 3.93Å; F89-A121 HydrophobicContact CD2-CB 4.13Å; F89-A121 HydrophobicContact CG-CB 3.93Å; F89-V124 HydrophobicContact CE1-CB 3.75Å; F89-V124 HydrophobicContact CE1-CG1 3.72Å; F89-V124 HydrophobicContact CE1-CG2 4.1Å; F89-V124 HydrophobicContact CZ-CB 4.03Å; F89-V124 HydrophobicContact CZ-CG1 3.71Å; F89-L125 HydrophobicContact CD2-CD1 4.01Å; F89-L125 HydrophobicContact CD2-CG 4.47Å; F89-L125 HydrophobicContact CE2-CD1 3.56Å; F89-L125 HydrophobicContact CE2-CD2 3.77Å; F89-L125 HydrophobicContact CE2-CG 3.64Å; F89-L125 HydrophobicContact CZ-CD1 4.31Å; F89-L125 HydrophobicContact CZ-CD2 3.96Å; F89-L125 HydrophobicContact CZ-CG 3.89Å
90	G	83.5	Confident	87.2	Confident	24 Å²	24	70.6 Å²	70.6	25%	0.247	36%	0.359	C	S	.	.	S	Bend	trans	145.7	-177.4	178	0	0	0	0	0	113.3	S87 V92	S87-G90 PolarHBondContact O-N 3.34Å; G90-V92 PolarHBondContact O-N 3.15Å
91	Q	84.9	Confident	86.8	Confident	139 Å²	139	73.3 Å²	73.3	65%	0.65	37%	0.369	S	S	*	.			trans	-70.3	116.8	176.7	-174.3	176.4	0.9	0	0	110.5	A113	Q91-A113 HydrophobicContact CB-CB 4.5Å; Q91-A113 PolarHBondContact O-N 3.49Å
92	V	86	Confident	86.3	Confident	32 Å²	32	75 Å²	75	19%	0.194	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	120.4	172.7	-179.8	0	0	0	0	108.3	F86 G90 E95 V110 Y112	F86-V92 HydrophobicContact CB-CG2 4.2Å; G90-V92 PolarHBondContact O-N 3.15Å; V92-E95 HydrophobicContact CG1-CG 3.56Å; V92-V110 HydrophobicContact CG1-CG1 3.75Å; V92-V110 HydrophobicContact CG2-CG1 4.09Å; V92-Y112 HydrophobicContact CG2-CD1 4.25Å; V92-Y112 HydrophobicContact CG2-CE1 3.76Å
93	L	85.3	Confident	86	Confident	113 Å²	113	76.6 Å²	76.6	59%	0.592	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	-43	178.2	-71.1	175.7	0	0	0	111.5	A111 A113	L93-A111 PolarHBondContact N-O 3.48Å; L93-A113 HydrophobicContact CD1-CB 4.17Å; L93-A113 HydrophobicContact CD2-CB 4.26Å; L93-A113 HydrophobicContact CG-CB 4.04Å
94	N	87.2	Confident	86	Confident	105 Å²	105	74.4 Å²	74.4	56%	0.561	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152	144	-177.3	-162.6	5.7	0	0	0	111.3	A111	N94-A111 HydrophobicContact CB-CB 4.32Å; N94-A111 PolarHBondContact O-N 2.99Å
95	E	89.4	Confident	85.7	Confident	34 Å²	34	70.6 Å²	70.6	16%	0.159	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	115.3	172.3	-60.7	179.7	-156.9	0	0	109.3	S83 V92 Y97 F109	S83-E95 WeakPolarHBondContact CA-OE1 3.33Å; S83-E95 WeakPolarHBondContact CB-OE1 3.49Å; S83-E95 PolarHBondContact OG-OE1 3.17Å; V92-E95 HydrophobicContact CG1-CG 3.56Å; E95-Y97 HydrophobicContact CB-CD2 4.49Å; E95-Y97 HydrophobicContact CB-CE2 3.66Å; E95-Y97 PolarHBondContact OE2-OH 3.42Å; E95-F109 WeakPolarHBondContact CA-O 3.49Å
96	Y	89.9	Confident	85.5	Confident	143 Å²	143	70 Å²	70	56%	0.561	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	123.6	-179.2	-175.4	-108.6	0	0	0	111.3	P98 A108 F109	Y96-P98 HydrophobicContact CE1-CB 4.02Å; Y96-P98 HydrophobicContact CE1-CG 4.34Å; Y96-P98 WeakPolarHBondContact O-CD 3.5Å; Y96-A108 WeakPolarHBondContact O-CA 3.49Å; Y96-F109 AromaticContact CD1-CD2 3.86Å; Y96-F109 HydrophobicContact CD1-CD2 3.86Å; Y96-F109 HydrophobicContact CD1-CE2 4.38Å; Y96-F109 PolarHBondContact N-O 3.21Å; Y96-F109 PolarHBondContact O-N 2.95Å
97	Y	89.9	Confident	85.6	Confident	13 Å²	13	73.5 Å²	73.5	5%	0.051	37%	0.373	C	S	.	.			trans	-116	100	179.6	-62.1	-96.3	0	0	0	108.8	V67 K79 M82 E95 A108	V67-Y97 HydrophobicContact CG1-CE1 4.45Å; K79-Y97 HydrophobicContact CD-CD2 4.38Å; K79-Y97 HydrophobicContact CD-CE2 4.32Å; K79-Y97 HydrophobicContact CG-CD2 4.04Å; K79-Y97 HydrophobicContact CG-CE2 3.7Å; M82-Y97 HydrophobicContact CB-CE1 4.49Å; M82-Y97 WeakPolarHBondContact CB-OH 3.36Å; M82-Y97 HydrophobicContact CE-CE1 4.28Å; M82-Y97 HydrophobicContact CG-CE1 4.03Å; M82-Y97 WeakPolarHBondContact CG-OH 3.44Å; E95-Y97 HydrophobicContact CB-CD2 4.49Å; E95-Y97 HydrophobicContact CB-CE2 3.66Å; E95-Y97 PolarHBondContact OE2-OH 3.42Å; Y97-A108 HydrophobicContact CD1-CB 3.62Å; Y97-A108 HydrophobicContact CE1-CB 3.58Å; Y97-A108 HydrophobicContact CG-CB 4.35Å
98	P	86.4	Confident	85.7	Confident	9 Å²	9	70.6 Å²	70.6	6%	0.058	35%	0.352	C	S	.	.			trans	-64.7	137.7	178.2	17.1	-24.6	0	0	0	111.9	Y96 K105 Y107 F109	Y96-P98 HydrophobicContact CE1-CB 4.02Å; Y96-P98 HydrophobicContact CE1-CG 4.34Å; Y96-P98 WeakPolarHBondContact O-CD 3.5Å; P98-K105 HydrophobicContact CB-CD 4.27Å; P98-K105 PolarHBondContact O-N 3.26Å; P98-Y107 HydrophobicContact CB-CE2 4.26Å; P98-Y107 WeakPolarHBondContact CD-O 3.49Å; P98-Y107 HydrophobicContact CG-CD2 3.7Å; P98-Y107 HydrophobicContact CG-CE1 4.37Å; P98-Y107 HydrophobicContact CG-CE2 3.21Å; P98-Y107 HydrophobicContact CG-CG 4.45Å; P98-F109 HydrophobicContact CG-CE2 4.22Å
99	L	86.4	Confident	85.9	Confident	88 Å²	88	65.2 Å²	65.2	46%	0.461	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	147.3	-176.3	-60.6	170.8	0	0	0	111.1	L75 A103 T104	L75-L99 HydrophobicContact CD1-CD2 3.72Å; L99-A103 CarbonylContact C-O 3.5Å; L99-A103 VanDerWaalsContact CA-O 3.3Å; L99-A103 WeakPolarHBondContact CA-O 3.24Å; L99-T104 HydrophobicContact CD2-CG2 3.92Å
100	E	81.1	Confident	86.2	Confident	114 Å²	114	63.7 Å²	63.7	53%	0.533	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	121	169.7	-165.4	169.5	175.7	0	0	108.5	D102 A103 K105	E100-D102 VanDerWaalsContact C-N 3.27Å; E100-D102 PolarHBondContact O-N 2.85Å; E100-A103 PolarHBondContact N-O 3.34Å; E100-A103 PolarHBondContact O-N 2.91Å; E100-K105 HydrophobicContact CB-CD 4.28Å; E100-K105 HydrophobicContact CB-CG 3.74Å; E100-K105 WeakPolarHBondContact OE2-CE 3.1Å
101	N	80.3	Confident	86.5	Confident	157 Å²	157	63.5 Å²	63.5	84%	0.84	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	48.3	-175.4	-56.1	-34.1	0	0	0	112.5	A103	N101-A103 PolarHBondContact O-N 3.46Å; N101-A103 VanDerWaalsContact O-N 3.09Å
102	D	79.1	Confident	86.7	Confident	120 Å²	120	57 Å²	57	64%	0.642	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	9.6	-176.9	-61.2	-37.9	0	0	0	116.5	P72 E100	P72-D102 WeakPolarHBondContact CD-O 3.15Å; E100-D102 VanDerWaalsContact C-N 3.27Å; E100-D102 PolarHBondContact O-N 2.85Å
103	A	81.9	Confident	86.5	Confident	34 Å²	34	58.2 Å²	58.2	28%	0.281	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	149.2	172.4	0	0	0	0	0	111.9	V70 L99 E100 N101	V70-A103 CarbonylContact O-C 3.49Å; V70-A103 VanDerWaalsContact O-CA 3.31Å; V70-A103 WeakPolarHBondContact O-CA 3.41Å; L99-A103 CarbonylContact C-O 3.5Å; L99-A103 VanDerWaalsContact CA-O 3.3Å; L99-A103 WeakPolarHBondContact CA-O 3.24Å; E100-A103 PolarHBondContact N-O 3.34Å; E100-A103 PolarHBondContact O-N 2.91Å; N101-A103 PolarHBondContact O-N 3.46Å; N101-A103 VanDerWaalsContact O-N 3.09Å
104	T	87	Confident	86.3	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	138	175.1	50.4	0	0	0	0	111.8	P68 K69 V70 L75 L78 L99 G106	P68-T104 PolarHBondContact O-OG1 2.92Å; K69-T104 VanDerWaalsContact CA-OG1 3.27Å; K69-T104 WeakPolarHBondContact CA-OG1 3.42Å; K69-T104 WeakPolarHBondContact CG-O 3.32Å; V70-T104 HydrophobicContact CG2-CG2 4.09Å; V70-T104 PolarHBondContact N-OG1 2.93Å; V70-T104 PolarHBondContact O-N 3.36Å; L75-T104 HydrophobicContact CD1-CG2 3.4Å; L78-T104 HydrophobicContact CD2-CG2 4.35Å; L99-T104 HydrophobicContact CD2-CG2 3.92Å; T104-G106 PolarHBondContact O-N 3.45Å
105	K	83.4	Confident	86	Confident	76 Å²	76	54.2 Å²	54.2	33%	0.33	28%	0.28	S	S	.	.			trans	-70	-11	-178	-74.5	-168.1	173.6	-178.4	0	114.7	K69 P98 E100 Y107	K69-K105 VanDerWaalsContact CE-O 3.31Å; K69-K105 WeakPolarHBondContact CE-O 3.35Å; P98-K105 HydrophobicContact CB-CD 4.27Å; P98-K105 PolarHBondContact O-N 3.26Å; E100-K105 HydrophobicContact CB-CD 4.28Å; E100-K105 HydrophobicContact CB-CG 3.74Å; E100-K105 WeakPolarHBondContact OE2-CE 3.1Å; K105-Y107 HydrophobicContact CB-CD1 3.92Å; K105-Y107 HydrophobicContact CB-CE1 3.44Å; K105-Y107 VanDerWaalsContact CB-CE1 3.44Å; K105-Y107 HydrophobicContact CD-CE1 4Å; K105-Y107 WeakPolarHBondContact CD-OH 3.42Å; K105-Y107 HydrophobicContact CG-CE1 4.35Å
106	G	84.8	Confident	85.5	Confident	6 Å²	6	55.4 Å²	55.4	6%	0.062	30%	0.296	C	S	.	.	S	Bend	trans	99.9	3	178.7	0	0	0	0	0	114.8	G66 V67 T104	G66-G106 PolarHBondContact N-O 2.92Å; G66-G106 VanDerWaalsContact N-O 3.14Å; V67-G106 PolarHBondContact N-O 3.27Å; V67-G106 VanDerWaalsContact O-CA 3.24Å; V67-G106 WeakPolarHBondContact O-CA 3.46Å; T104-G106 PolarHBondContact O-N 3.45Å
107	Y	90.4	Very high	85.2	Confident	75 Å²	75	50.6 Å²	50.6	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.2	172	60.5	-85.6	0	0	0	110.5	V64 P98 K105 F109	V64-Y107 CarbonylContact O-C 3.56Å; V64-Y107 WeakPolarHBondContact O-CA 3.14Å; V64-Y107 WeakPolarHBondContact O-CB 3.22Å; P98-Y107 HydrophobicContact CB-CE2 4.26Å; P98-Y107 WeakPolarHBondContact CD-O 3.49Å; P98-Y107 HydrophobicContact CG-CD2 3.7Å; P98-Y107 HydrophobicContact CG-CE1 4.37Å; P98-Y107 HydrophobicContact CG-CE2 3.21Å; P98-Y107 HydrophobicContact CG-CG 4.45Å; K105-Y107 HydrophobicContact CB-CD1 3.92Å; K105-Y107 HydrophobicContact CB-CE1 3.44Å; K105-Y107 VanDerWaalsContact CB-CE1 3.44Å; K105-Y107 HydrophobicContact CD-CE1 4Å; K105-Y107 WeakPolarHBondContact CD-OH 3.42Å; K105-Y107 HydrophobicContact CG-CE1 4.35Å; Y107-F109 AromaticContact CD2-CE2 3.93Å; Y107-F109 HydrophobicContact CD2-CE2 3.93Å; Y107-F109 HydrophobicContact CD2-CZ 4.19Å; Y107-F109 AromaticContact CE2-CE2 3.7Å; Y107-F109 HydrophobicContact CE2-CE2 3.7Å; Y107-F109 AromaticContact CE2-CZ 3.99Å; Y107-F109 HydrophobicContact CE2-CZ 3.99Å
108	A	91	Very high	85	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.5	179.1	0	0	0	0	0	111.1	V64 V67 M82 Y96 Y97	V64-A108 PolarHBondContact N-O 3.25Å; V64-A108 PolarHBondContact O-N 3.45Å; V67-A108 HydrophobicContact CG2-CB 4.1Å; M82-A108 HydrophobicContact CE-CB 4.44Å; Y96-A108 WeakPolarHBondContact O-CA 3.49Å; Y97-A108 HydrophobicContact CD1-CB 3.62Å; Y97-A108 HydrophobicContact CE1-CB 3.58Å; Y97-A108 HydrophobicContact CG-CB 4.35Å
109	F	92	Very high	84.9	Confident	52 Å²	52	53.9 Å²	53.9	23%	0.228	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.3	172.2	-58.7	-89.6	0	0	0	109.4	I61 V62 I63 E95 Y96 P98 Y107 F141	I61-F109 HydrophobicContact CG2-CB 4.22Å; I61-F109 HydrophobicContact CG2-CD1 4.08Å; V62-F109 WeakPolarHBondContact O-CA 3.2Å; I63-F109 HydrophobicContact CD1-CE1 4.02Å; I63-F109 HydrophobicContact CG1-CD1 3.87Å; I63-F109 HydrophobicContact CG1-CE1 3.79Å; I63-F109 HydrophobicContact CG2-CE1 4.33Å; E95-F109 WeakPolarHBondContact CA-O 3.49Å; Y96-F109 AromaticContact CD1-CD2 3.86Å; Y96-F109 HydrophobicContact CD1-CD2 3.86Å; Y96-F109 HydrophobicContact CD1-CE2 4.38Å; Y96-F109 PolarHBondContact N-O 3.21Å; Y96-F109 PolarHBondContact O-N 2.95Å; P98-F109 HydrophobicContact CG-CE2 4.22Å; Y107-F109 AromaticContact CD2-CE2 3.93Å; Y107-F109 HydrophobicContact CD2-CE2 3.93Å; Y107-F109 HydrophobicContact CD2-CZ 4.19Å; Y107-F109 AromaticContact CE2-CE2 3.7Å; Y107-F109 HydrophobicContact CE2-CE2 3.7Å; Y107-F109 AromaticContact CE2-CZ 3.99Å; Y107-F109 HydrophobicContact CE2-CZ 3.99Å; F109-F141 HydrophobicContact CD1-CD2 4.42Å; F109-F141 HydrophobicContact CE1-CD2 4.09Å; F109-F141 HydrophobicContact CE1-CE2 4.25Å
110	V	90.9	Very high	84.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	115.3	178	-177	0	0	0	0	107.9	V62 V64 F86 V92 Y112	V62-V110 PolarHBondContact N-O 2.8Å; V62-V110 PolarHBondContact O-N 3.47Å; V64-V110 HydrophobicContact CG2-CG2 4.18Å; F86-V110 HydrophobicContact CB-CG1 4.1Å; F86-V110 HydrophobicContact CD1-CB 4.23Å; F86-V110 HydrophobicContact CD1-CG1 4.02Å; F86-V110 HydrophobicContact CD1-CG2 3.97Å; F86-V110 HydrophobicContact CD2-CG2 4.37Å; F86-V110 HydrophobicContact CE1-CG2 4.2Å; F86-V110 HydrophobicContact CG-CG1 4.19Å; F86-V110 HydrophobicContact CG-CG2 4.08Å; V92-V110 HydrophobicContact CG1-CG1 3.75Å; V92-V110 HydrophobicContact CG2-CG1 4.09Å; V110-Y112 HydrophobicContact CG1-CD2 4.35Å; V110-Y112 HydrophobicContact CG1-CE2 3.85Å
111	A	89.9	Confident	85	Confident	21 Å²	21	49.1 Å²	49.1	17%	0.174	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.1	177.2	0	0	0	0	0	109.8	I61 L93 N94	I61-A111 HydrophobicContact CG1-CB 4.06Å; L93-A111 PolarHBondContact N-O 3.48Å; N94-A111 HydrophobicContact CB-CB 4.32Å; N94-A111 PolarHBondContact O-N 2.99Å
112	Y	87.7	Confident	85.3	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	157.5	173.2	-75.2	-81.7	0	0	0	111.3	S60 V62 F86 F89 V92 V110 S114 N117 A118 A121	S60-Y112 WeakPolarHBondContact CB-O 3.47Å; S60-Y112 PolarHBondContact O-N 3.4Å; V62-Y112 HydrophobicContact CG2-CD2 4Å; V62-Y112 HydrophobicContact CG2-CE2 3.95Å; F86-Y112 WeakPolarHBondContact CA-OH 3.42Å; F86-Y112 WeakPolarHBondContact CB-OH 3.38Å; F86-Y112 WeakPolarHBondContact CD1-OH 3.43Å; F86-Y112 WeakPolarHBondContact O-CE1 3.4Å; F86-Y112 PolarHBondContact O-OH 3.39Å; F89-Y112 HydrophobicContact CB-CE1 4.32Å; V92-Y112 HydrophobicContact CG2-CD1 4.25Å; V92-Y112 HydrophobicContact CG2-CE1 3.76Å; V110-Y112 HydrophobicContact CG1-CD2 4.35Å; V110-Y112 HydrophobicContact CG1-CE2 3.85Å; Y112-S114 PolarHBondContact O-N 2.9Å; Y112-N117 HydrophobicContact CD1-CB 3.92Å; Y112-N117 HydrophobicContact CG-CB 4.09Å; Y112-A118 HydrophobicContact CD2-CB 3.93Å; Y112-A118 HydrophobicContact CG-CB 4.5Å; Y112-A121 HydrophobicContact CE2-CB 3.72Å; Y112-A121 WeakPolarHBondContact OH-CB 3.2Å
113	A	82.2	Confident	85.5	Confident	56 Å²	56	40.6 Å²	40.6	46%	0.463	23%	0.233	S	C	.	.	S	Bend	trans	-70	-18.3	171.7	0	0	0	0	0	113.6	Q91 L93	Q91-A113 HydrophobicContact CB-CB 4.5Å; Q91-A113 PolarHBondContact O-N 3.49Å; L93-A113 HydrophobicContact CD1-CB 4.17Å; L93-A113 HydrophobicContact CD2-CB 4.26Å; L93-A113 HydrophobicContact CG-CB 4.04Å
114	S	80.4	Confident	85.7	Confident	50 Å²	50	42.9 Å²	42.9	35%	0.35	24%	0.243	S	C	.	.	S	Bend	trans	-138.4	140.1	-178.5	170.6	0	0	0	0	110.8	Y112 A116 N117 A118	Y112-S114 PolarHBondContact O-N 2.9Å; S114-A116 VanDerWaalsContact C-N 3.31Å; S114-A116 PolarHBondContact O-N 3.35Å; S114-A116 PolarHBondContact OG-N 2.93Å; S114-N117 PolarHBondContact O-N 2.94Å; S114-A118 PolarHBondContact O-N 2.95Å
115	K	82.1	Confident	85.7	Confident	85 Å²	85	43 Å²	43	37%	0.37	24%	0.243	S	C	.	.	H	α-helix	trans	-57.5	-40.9	174	176.7	-179.1	176.6	175.3	0	112.6	Q59 S60 N117 A118 E119	Q59-K115 HydrophobicContact CB-CD 4.03Å; Q59-K115 HydrophobicContact CB-CG 4.26Å; S60-K115 PolarHBondContact OG-N 3.4Å; K115-N117 VanDerWaalsContact C-N 3.28Å; K115-N117 PolarHBondContact O-N 2.92Å; K115-A118 WeakPolarHBondContact O-CB 3.43Å; K115-A118 PolarHBondContact O-N 2.91Å; K115-A118 VanDerWaalsContact O-N 3.08Å; K115-E119 WeakPolarHBondContact CE-OE1 3.49Å; K115-E119 HydrophobicContact CG-CG 4.39Å; K115-E119 PolarHBondContact O-N 3.35Å
116	A	79.3	Confident	85.8	Confident	58 Å²	58	43.2 Å²	43.2	48%	0.479	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-40.3	-179.5	0	0	0	0	0	111.7	S114 A118 E119 E120	S114-A116 VanDerWaalsContact C-N 3.31Å; S114-A116 PolarHBondContact O-N 3.35Å; S114-A116 PolarHBondContact OG-N 2.93Å; A116-A118 VanDerWaalsContact C-N 3.34Å; A116-A118 PolarHBondContact O-N 3.44Å; A116-E119 PolarHBondContact O-N 3.08Å; A116-E120 WeakPolarHBondContact O-CB 3.5Å; A116-E120 PolarHBondContact O-N 3.33Å
117	N	83.9	Confident	85.8	Confident	43 Å²	43	45.1 Å²	45.1	23%	0.23	27%	0.268	C	S	.	.	H	α-helix	trans	-66.1	-37.6	176.4	-63.9	-9	0	0	0	111.5	F89 Y112 S114 K115 A121	F89-N117 VanDerWaalsContact O-CB 3.26Å; F89-N117 WeakPolarHBondContact O-CB 3.47Å; F89-N117 PolarHBondContact O-OD1 3.29Å; Y112-N117 HydrophobicContact CD1-CB 3.92Å; Y112-N117 HydrophobicContact CG-CB 4.09Å; S114-N117 PolarHBondContact O-N 2.94Å; K115-N117 VanDerWaalsContact C-N 3.28Å; K115-N117 PolarHBondContact O-N 2.92Å; N117-A121 WeakPolarHBondContact O-CB 3.41Å; N117-A121 PolarHBondContact O-N 3.38Å
118	A	85.4	Confident	85.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-44.4	175.9	0	0	0	0	0	112	V62 Y112 S114 K115 A116 A121 A122 L140	V62-A118 HydrophobicContact CG2-CB 3.62Å; V62-A118 WeakPolarHBondContact CG2-O 3.45Å; Y112-A118 HydrophobicContact CD2-CB 3.93Å; Y112-A118 HydrophobicContact CG-CB 4.5Å; S114-A118 PolarHBondContact O-N 2.95Å; K115-A118 WeakPolarHBondContact O-CB 3.43Å; K115-A118 PolarHBondContact O-N 2.91Å; K115-A118 VanDerWaalsContact O-N 3.08Å; A116-A118 VanDerWaalsContact C-N 3.34Å; A116-A118 PolarHBondContact O-N 3.44Å; A118-A121 PolarHBondContact O-N 3.28Å; A118-A122 WeakPolarHBondContact O-CB 2.92Å; A118-A122 PolarHBondContact O-N 3.29Å; A118-L140 HydrophobicContact CB-CD2 4.01Å
119	E	83.7	Confident	85.4	Confident	90 Å²	90	53.6 Å²	53.6	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-44.3	176.1	-71.6	-178.8	171.3	0	0	111.9	K115 A116 A122 S123 L140	K115-E119 WeakPolarHBondContact CE-OE1 3.49Å; K115-E119 HydrophobicContact CG-CG 4.39Å; K115-E119 PolarHBondContact O-N 3.35Å; A116-E119 PolarHBondContact O-N 3.08Å; E119-A122 PolarHBondContact O-N 3.49Å; E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.97Å; E119-L140 HydrophobicContact CG-CD1 3.87Å; E119-L140 HydrophobicContact CG-CD2 4.32Å
120	E	82.8	Confident	85.1	Confident	102 Å²	102	53.3 Å²	53.3	48%	0.477	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-49.1	177	-171.5	175.8	-170.4	0	0	110.9	F89 A116 A122 S123 V124	F89-E120 HydrophobicContact CD1-CG 4.23Å; A116-E120 WeakPolarHBondContact O-CB 3.5Å; A116-E120 PolarHBondContact O-N 3.33Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 3.47Å; E120-S123 PolarHBondContact O-N 3.07Å; E120-S123 PolarHBondContact O-OG 3.41Å; E120-V124 HydrophobicContact CG-CG2 4.37Å; E120-V124 WeakPolarHBondContact O-CG2 3.49Å; E120-V124 PolarHBondContact O-N 3.12Å
121	A	86.5	Confident	84.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-44.3	177	0	0	0	0	0	111.7	F89 Y112 N117 A118 V124 L125	F89-A121 HydrophobicContact CB-CB 3.93Å; F89-A121 HydrophobicContact CD2-CB 4.13Å; F89-A121 HydrophobicContact CG-CB 3.93Å; Y112-A121 HydrophobicContact CE2-CB 3.72Å; Y112-A121 WeakPolarHBondContact OH-CB 3.2Å; N117-A121 WeakPolarHBondContact O-CB 3.41Å; N117-A121 PolarHBondContact O-N 3.38Å; A118-A121 PolarHBondContact O-N 3.28Å; A121-V124 PolarHBondContact O-N 3.01Å; A121-L125 HydrophobicContact CB-CD1 4.47Å; A121-L125 WeakPolarHBondContact O-CB 3.32Å; A121-L125 WeakPolarHBondContact O-CG 3.45Å; A121-L125 PolarHBondContact O-N 2.92Å
122	A	87.3	Confident	84.5	Confident	10 Å²	10	66 Å²	66	8%	0.083	36%	0.359	C	S	.	.	H	α-helix	trans	-62	-45.1	177.1	0	0	0	0	0	111.9	V62 A118 E119 E120 V124 N126 V138 L140	V62-A122 HydrophobicContact CG1-CB 4.4Å; A118-A122 WeakPolarHBondContact O-CB 2.92Å; A118-A122 PolarHBondContact O-N 3.29Å; E119-A122 PolarHBondContact O-N 3.49Å; E120-A122 VanDerWaalsContact C-N 3.32Å; E120-A122 PolarHBondContact O-N 3.47Å; A122-V124 PolarHBondContact O-N 2.66Å; A122-N126 VanDerWaalsContact O-CB 3.24Å; A122-N126 WeakPolarHBondContact O-CB 3.47Å; A122-N126 PolarHBondContact O-N 3.33Å; A122-V138 HydrophobicContact CB-CG1 4.15Å; A122-L140 HydrophobicContact CB-CD2 4.35Å; A122-L140 HydrophobicContact CB-CG 4.26Å
123	S	83.5	Confident	84.3	Confident	89 Å²	89	70.1 Å²	70.1	62%	0.622	39%	0.389	S	S	*	.	H	α-helix	trans	-66	-37.9	-179.6	79.5	0	0	0	0	113.4	E119 E120	E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.97Å; E120-S123 PolarHBondContact O-N 3.07Å; E120-S123 PolarHBondContact O-OG 3.41Å
124	V	84.7	Confident	84.4	Confident	81 Å²	81	69.8 Å²	69.8	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-86.5	-37.7	-173.6	176.7	0	0	0	0	112	F89 E120 A121 A122	F89-V124 HydrophobicContact CE1-CB 3.75Å; F89-V124 HydrophobicContact CE1-CG1 3.72Å; F89-V124 HydrophobicContact CE1-CG2 4.1Å; F89-V124 HydrophobicContact CZ-CB 4.03Å; F89-V124 HydrophobicContact CZ-CG1 3.71Å; E120-V124 HydrophobicContact CG-CG2 4.37Å; E120-V124 WeakPolarHBondContact O-CG2 3.49Å; E120-V124 PolarHBondContact O-N 3.12Å; A121-V124 PolarHBondContact O-N 3.01Å; A122-V124 PolarHBondContact O-N 2.66Å
125	L	87.3	Confident	84.8	Confident	5 Å²	5	70.2 Å²	70.2	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-88.4	-11.2	-175.5	-64.7	174.4	0	0	0	113.7	I85 F86 F89 A121 G127 Y128 V138	I85-L125 HydrophobicContact CG2-CD1 4.12Å; I85-L125 HydrophobicContact CG2-CD2 3.7Å; F86-L125 HydrophobicContact CD1-CD1 3.6Å; F86-L125 HydrophobicContact CE1-CD1 3.29Å; F86-L125 HydrophobicContact CE2-CD1 4.27Å; F86-L125 HydrophobicContact CG-CD1 4.22Å; F86-L125 HydrophobicContact CZ-CD1 3.64Å; F89-L125 HydrophobicContact CD2-CD1 4.01Å; F89-L125 HydrophobicContact CD2-CG 4.47Å; F89-L125 HydrophobicContact CE2-CD1 3.56Å; F89-L125 HydrophobicContact CE2-CD2 3.77Å; F89-L125 HydrophobicContact CE2-CG 3.64Å; F89-L125 HydrophobicContact CZ-CD1 4.31Å; F89-L125 HydrophobicContact CZ-CD2 3.96Å; F89-L125 HydrophobicContact CZ-CG 3.89Å; A121-L125 HydrophobicContact CB-CD1 4.47Å; A121-L125 WeakPolarHBondContact O-CB 3.32Å; A121-L125 WeakPolarHBondContact O-CG 3.45Å; A121-L125 PolarHBondContact O-N 2.92Å; L125-G127 PolarHBondContact O-N 3.33Å; L125-Y128 HydrophobicContact CD2-CD2 4.31Å; L125-Y128 HydrophobicContact CD2-CG 4.23Å; L125-Y128 WeakPolarHBondContact O-CB 3.38Å; L125-Y128 PolarHBondContact O-N 3.33Å; L125-V138 HydrophobicContact CB-CG2 3.88Å; L125-V138 WeakPolarHBondContact O-CG2 3.02Å
126	N	86.6	Confident	85.2	Confident	82 Å²	82	66.1 Å²	66.1	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	119.4	173.6	-168	26.7	0	0	0	110.8	A122 T137 V138	A122-N126 VanDerWaalsContact O-CB 3.24Å; A122-N126 WeakPolarHBondContact O-CB 3.47Å; A122-N126 PolarHBondContact O-N 3.33Å; N126-T137 WeakPolarHBondContact OD1-CA 3.1Å; N126-V138 HydrophobicContact CB-CB 4.18Å; N126-V138 PolarHBondContact OD1-N 3.11Å; N126-V138 VanDerWaalsContact OD1-N 3.07Å
127	G	84.5	Confident	85.6	Confident	46 Å²	46	66.5 Å²	66.5	47%	0.474	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	6	-172.8	0	0	0	0	0	115	L125 K129 T135 F136	L125-G127 PolarHBondContact O-N 3.33Å; G127-K129 PolarHBondContact O-N 3.47Å; G127-T135 WeakPolarHBondContact O-CG2 3.34Å; G127-F136 VanDerWaalsContact CA-O 3.32Å; G127-F136 WeakPolarHBondContact CA-O 3.4Å; G127-F136 PolarHBondContact N-O 3.03Å
128	Y	86.4	Confident	85.9	Confident	99 Å²	99	64.6 Å²	64.6	39%	0.388	35%	0.347	S	S	.	.			trans	-68.6	123.3	179.5	-175.7	-95.4	0	0	0	111.7	I85 L125 L130 T135 F136	I85-Y128 HydrophobicContact CD1-CE1 4.08Å; L125-Y128 HydrophobicContact CD2-CD2 4.31Å; L125-Y128 HydrophobicContact CD2-CG 4.23Å; L125-Y128 WeakPolarHBondContact O-CB 3.38Å; L125-Y128 PolarHBondContact O-N 3.33Å; Y128-L130 PolarHBondContact O-N 2.59Å; Y128-T135 CarbonylContact O-C 3.54Å; Y128-T135 WeakPolarHBondContact O-CA 3.35Å; Y128-F136 AromaticContact CD1-CD2 3.77Å; Y128-F136 HydrophobicContact CD1-CD2 3.77Å; Y128-F136 AromaticContact CD1-CE2 3.89Å; Y128-F136 HydrophobicContact CD1-CE2 3.89Å; Y128-F136 HydrophobicContact CE1-CE2 4.47Å; Y128-F136 HydrophobicContact CG-CD2 4.39Å; Y128-F136 PolarHBondContact O-N 3.13Å
129	K	87.4	Confident	86	Confident	154 Å²	154	68.3 Å²	68.3	67%	0.67	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-86.1	110	178	-64.8	-169.7	177.6	-177.4	0	111	G127 T135	G127-K129 PolarHBondContact O-N 3.47Å; K129-T135 HydrophobicContact CG-CG2 4.02Å
130	L	85.9	Confident	86.2	Confident	46 Å²	46	65 Å²	65	24%	0.241	35%	0.352	C	S	.	.	S	Bend	trans	-74.3	-44.9	173.9	-172	72.3	0	0	0	111.2	P68 I81 I85 Y128 H134 F136	P68-L130 HydrophobicContact CG-CD2 3.54Å; I81-L130 HydrophobicContact CG2-CD1 3.99Å; I85-L130 HydrophobicContact CD1-CD1 3.66Å; Y128-L130 PolarHBondContact O-N 2.59Å; L130-H134 HydrophobicContact CB-CB 4.27Å; L130-H134 PolarHBondContact N-O 3.06Å; L130-F136 HydrophobicContact CB-CE1 4.02Å; L130-F136 HydrophobicContact CB-CZ 3.92Å; L130-F136 HydrophobicContact CD1-CE2 4.33Å; L130-F136 HydrophobicContact CD1-CZ 3.82Å; L130-F136 HydrophobicContact CD2-CE1 4Å; L130-F136 HydrophobicContact CD2-CZ 3.88Å; L130-F136 HydrophobicContact CG-CE1 4.45Å; L130-F136 HydrophobicContact CG-CZ 4.09Å
131	D	84.3	Confident	86.3	Confident	68 Å²	68	63.7 Å²	63.7	36%	0.364	35%	0.345	S	S	.	.	S	Bend	trans	-148.2	-167.7	174	66.5	35.6	0	0	0	110.9	S133 H134	D131-S133 PolarHBondContact O-N 3.02Å; D131-S133 WeakPolarHBondContact OD1-CA 3.39Å; D131-S133 PolarHBondContact OD1-N 3.26Å; D131-S133 PolarHBondContact OD1-OG 3.34Å; D131-H134 PolarHBondContact N-O 3.48Å; D131-H134 WeakPolarHBondContact OD1-CB 3.19Å; D131-H134 IonicContact OD1-CE1 3.99Å; D131-H134 IonicContact OD1-CG 3.8Å; D131-H134 PolarHBondContact OD1-N 3.47Å; D131-H134 IonicContact OD1-ND1 2.93Å; D131-H134 PolarHBondContact OD1-ND1 2.91Å; D131-H134 IonicContact OD2-CE1 3.65Å; D131-H134 IonicContact OD2-CG 2.71Å; D131-H134 IonicContact OD2-ND1 2.78Å; D131-H134 PolarHBondContact OD2-ND1 3.29Å
132	K	82.6	Confident	86	Confident	218 Å²	218	65.6 Å²	65.6	95%	0.948	36%	0.358	S	S	*	.	S	Bend	trans	-64.9	-26.7	179.9	-74	-174.7	178.3	-179.9	0	113.7
133	S	82.7	Confident	85.6	Confident	91 Å²	91	66.8 Å²	66.8	64%	0.636	36%	0.363	S	S	*	.	S	Bend	trans	-104.4	-22.6	-174.4	37	0	0	0	0	113.8	D131	D131-S133 PolarHBondContact O-N 3.02Å; D131-S133 WeakPolarHBondContact OD1-CA 3.39Å; D131-S133 PolarHBondContact OD1-N 3.26Å; D131-S133 PolarHBondContact OD1-OG 3.34Å
134	H	85.7	Confident	85.2	Confident	49 Å²	49	67.4 Å²	67.4	23%	0.227	36%	0.358	C	S	.	.			trans	-118	112.3	-171.4	-58.3	102.8	0	0	0	110.6	G66 P68 L130 D131	G66-H134 WeakPolarHBondContact O-CB 3.26Å; P68-H134 HydrophobicContact CG-CB 4.37Å; L130-H134 HydrophobicContact CB-CB 4.27Å; L130-H134 PolarHBondContact N-O 3.06Å; D131-H134 PolarHBondContact N-O 3.48Å; D131-H134 WeakPolarHBondContact OD1-CB 3.19Å; D131-H134 IonicContact OD1-CE1 3.99Å; D131-H134 IonicContact OD1-CG 3.8Å; D131-H134 PolarHBondContact OD1-N 3.47Å; D131-H134 IonicContact OD1-ND1 2.93Å; D131-H134 PolarHBondContact OD1-ND1 2.91Å; D131-H134 IonicContact OD2-CE1 3.65Å; D131-H134 IonicContact OD2-CG 2.71Å; D131-H134 IonicContact OD2-ND1 2.78Å; D131-H134 PolarHBondContact OD2-ND1 3.29Å
135	T	88.3	Confident	84.6	Confident	58 Å²	58	69.1 Å²	69.1	36%	0.356	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-117.8	126.3	172	-53.4	0	0	0	0	107.8	G127 Y128 K129	G127-T135 WeakPolarHBondContact O-CG2 3.34Å; Y128-T135 CarbonylContact O-C 3.54Å; Y128-T135 WeakPolarHBondContact O-CA 3.35Å; K129-T135 HydrophobicContact CG-CG2 4.02Å
136	F	90.4	Very high	83.8	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	39%	0.388	C	S	.	.			trans	-72	136.9	-179.3	-63.3	-23.7	0	0	0	111.1	V64 D65 V67 M82 I85 F86 G127 Y128 L130 V138	V64-F136 HydrophobicContact CG1-CB 4.22Å; V64-F136 HydrophobicContact CG1-CD1 4.08Å; V64-F136 HydrophobicContact CG1-CD2 4.32Å; V64-F136 HydrophobicContact CG1-CG 3.97Å; D65-F136 CarbonylContact O-C 3.6Å; D65-F136 VanDerWaalsContact O-CA 3.27Å; D65-F136 WeakPolarHBondContact O-CA 3.13Å; V67-F136 HydrophobicContact CG2-CE1 4.36Å; M82-F136 HydrophobicContact CE-CZ 4.31Å; M82-F136 HydrophobicContact SD-CE1 4.25Å; M82-F136 HydrophobicContact SD-CE2 4.17Å; M82-F136 HydrophobicContact SD-CZ 3.52Å; M82-F136 VanDerWaalsContact SD-CZ 3.52Å; I85-F136 HydrophobicContact CD1-CE2 4.25Å; F86-F136 HydrophobicContact CE2-CE2 4.35Å; G127-F136 VanDerWaalsContact CA-O 3.32Å; G127-F136 WeakPolarHBondContact CA-O 3.4Å; G127-F136 PolarHBondContact N-O 3.03Å; Y128-F136 AromaticContact CD1-CD2 3.77Å; Y128-F136 HydrophobicContact CD1-CD2 3.77Å; Y128-F136 AromaticContact CD1-CE2 3.89Å; Y128-F136 HydrophobicContact CD1-CE2 3.89Å; Y128-F136 HydrophobicContact CE1-CE2 4.47Å; Y128-F136 HydrophobicContact CG-CD2 4.39Å; Y128-F136 PolarHBondContact O-N 3.13Å; L130-F136 HydrophobicContact CB-CE1 4.02Å; L130-F136 HydrophobicContact CB-CZ 3.92Å; L130-F136 HydrophobicContact CD1-CE2 4.33Å; L130-F136 HydrophobicContact CD1-CZ 3.82Å; L130-F136 HydrophobicContact CD2-CE1 4Å; L130-F136 HydrophobicContact CD2-CZ 3.88Å; L130-F136 HydrophobicContact CG-CE1 4.45Å; L130-F136 HydrophobicContact CG-CZ 4.09Å; F136-V138 HydrophobicContact CB-CG2 3.86Å
137	T	88.5	Confident	83.1	Confident	66 Å²	66	79.2 Å²	79.2	41%	0.405	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	116.9	164.5	-48.3	0	0	0	0	106.7	D65 N126	D65-T137 PolarHBondContact N-O 2.83Å; D65-T137 PolarHBondContact O-N 2.81Å; N126-T137 WeakPolarHBondContact OD1-CA 3.1Å
138	V	89.8	Confident	82.7	Confident	3 Å²	3	87.1 Å²	87.1	2%	0.018	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.6	-166.7	-168.6	0	0	0	0	109.4	V62 I63 V64 A122 L125 N126 F136	V62-V138 HydrophobicContact CG1-CG1 3.07Å; I63-V138 WeakPolarHBondContact O-CA 3.42Å; V64-V138 HydrophobicContact CG1-CG2 4.24Å; V64-V138 HydrophobicContact CG2-CG1 4.31Å; A122-V138 HydrophobicContact CB-CG1 4.15Å; L125-V138 HydrophobicContact CB-CG2 3.88Å; L125-V138 WeakPolarHBondContact O-CG2 3.02Å; N126-V138 HydrophobicContact CB-CB 4.18Å; N126-V138 PolarHBondContact OD1-N 3.11Å; N126-V138 VanDerWaalsContact OD1-N 3.07Å; F136-V138 HydrophobicContact CB-CG2 3.86Å
139	N	87.5	Confident	82.2	Confident	77 Å²	77	88.5 Å²	88.5	41%	0.412	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	157.9	-179.5	-62.5	-58	0	0	0	110.3	I63	I63-N139 PolarHBondContact N-O 2.91Å; I63-N139 PolarHBondContact O-N 2.83Å
140	L	87.7	Confident	81.3	Confident	21 Å²	21	84.1 Å²	84.1	11%	0.11	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	148.5	172.4	-66.2	160.3	0	0	0	110	V62 A118 E119 A122 C142 D143	V62-L140 HydrophobicContact CG2-CD2 4.37Å; A118-L140 HydrophobicContact CB-CD2 4.01Å; E119-L140 HydrophobicContact CG-CD1 3.87Å; E119-L140 HydrophobicContact CG-CD2 4.32Å; A122-L140 HydrophobicContact CB-CD2 4.35Å; A122-L140 HydrophobicContact CB-CG 4.26Å; L140-C142 VanDerWaalsContact C-N 3.3Å; L140-C142 PolarHBondContact O-N 2.86Å; L140-D143 WeakPolarHBondContact O-CB 3.14Å; L140-D143 PolarHBondContact O-N 3.03Å
141	F	85.2	Confident	80.7	Confident	75 Å²	75	88.9 Å²	88.9	33%	0.329	45%	0.445	S	S	.	.	H	α-helix	trans	-64.9	-36.7	177.8	-176.6	-88.6	0	0	0	112	G58 I61 I63 F109 D143 L144	G58-F141 WeakPolarHBondContact O-CB 3.46Å; I61-F141 HydrophobicContact CB-CB 3.94Å; I61-F141 HydrophobicContact CG2-CB 3.98Å; I61-F141 HydrophobicContact CG2-CG 4.48Å; I61-F141 WeakPolarHBondContact O-CB 3.04Å; I61-F141 PolarHBondContact O-N 3.12Å; I63-F141 HydrophobicContact CD1-CB 4.28Å; I63-F141 HydrophobicContact CD1-CD2 3.69Å; I63-F141 HydrophobicContact CD1-CG 4.38Å; I63-F141 HydrophobicContact CG1-CB 4.19Å; I63-F141 HydrophobicContact CG1-CD2 4.06Å; F109-F141 HydrophobicContact CD1-CD2 4.42Å; F109-F141 HydrophobicContact CE1-CD2 4.09Å; F109-F141 HydrophobicContact CE1-CE2 4.25Å; F141-D143 PolarHBondContact O-N 3.21Å; F141-L144 WeakPolarHBondContact O-CB 3.46Å; F141-L144 PolarHBondContact O-N 3.39Å
142	C	80.2	Confident	80.2	Confident	40 Å²	40	94.8 Å²	94.8	27%	0.27	47%	0.471	S	S	.	.	H	α-helix	trans	-63.3	-25.4	176.7	59.3	0	0	0	0	114.1	Q59 L140 L144 E145 K146	Q59-C142 HydrophobicContact CG-CB 4.35Å; L140-C142 VanDerWaalsContact C-N 3.3Å; L140-C142 PolarHBondContact O-N 2.86Å; C142-L144 PolarHBondContact O-N 3.3Å; C142-E145 PolarHBondContact O-N 2.93Å; C142-K146 PolarHBondContact O-N 3.1Å
143	D	77.9	Confident	79.8	Confident	35 Å²	35	91 Å²	91	19%	0.187	46%	0.461	C	S	.	.	H	α-helix	trans	-64	-30.3	177.1	-83.4	-28.8	0	0	0	111.7	L140 F141 E145 K146 Y147	L140-D143 WeakPolarHBondContact O-CB 3.14Å; L140-D143 PolarHBondContact O-N 3.03Å; F141-D143 PolarHBondContact O-N 3.21Å; D143-E145 PolarHBondContact O-N 2.86Å; D143-K146 WeakPolarHBondContact O-CB 3.44Å; D143-K146 PolarHBondContact O-N 3.06Å; D143-Y147 HydrophobicContact CB-CD2 4.09Å; D143-Y147 HydrophobicContact CB-CE2 3.71Å; D143-Y147 WeakPolarHBondContact O-CD2 3.47Å; D143-Y147 PolarHBondContact O-N 3.3Å
144	L	75	Confident	79.5	Confident	101 Å²	101	96.7 Å²	96.7	53%	0.529	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-42.5	179.6	-120	151.8	0	0	0	111.9	I63 F141 C142 R148	I63-L144 HydrophobicContact CD1-CD1 3.4Å; F141-L144 WeakPolarHBondContact O-CB 3.46Å; F141-L144 PolarHBondContact O-N 3.39Å; C142-L144 PolarHBondContact O-N 3.3Å; L144-R148 WeakPolarHBondContact O-CB 3.47Å; L144-R148 PolarHBondContact O-N 3.08Å
145	E	72.7	Confident	79.1	Confident	118 Å²	118	98.8 Å²	98.8	55%	0.551	49%	0.489	S	S	*	.	H	α-helix	trans	-70.1	-39.7	176	-68.4	-171.6	160.6	0	0	111.8	C142 D143 Y147 R148 N149	C142-E145 PolarHBondContact O-N 2.93Å; D143-E145 PolarHBondContact O-N 2.86Å; E145-Y147 PolarHBondContact O-N 3.18Å; E145-R148 PolarHBondContact O-N 3.43Å; E145-N149 WeakPolarHBondContact O-CB 3.47Å; E145-N149 PolarHBondContact O-N 3.2Å
146	K	71.7	Confident	78.8	Confident	139 Å²	139	100.1 Å²	100.1	60%	0.604	50%	0.498	S	S	*	.	H	α-helix	trans	-59.1	-45.5	176.5	-175.7	-177.8	177.6	-176.5	0	112.1	C142 D143 A150	C142-K146 PolarHBondContact O-N 3.1Å; D143-K146 WeakPolarHBondContact O-CB 3.44Å; D143-K146 PolarHBondContact O-N 3.06Å; K146-A150 PolarHBondContact O-N 3.28Å
147	Y	71.4	Confident	78.3	Confident	159 Å²	159	105.6 Å²	105.6	62%	0.624	53%	0.534	S	S	*	.	H	α-helix	trans	-76.8	-28.1	178.4	-63.1	-57.4	0	0	0	112.7	D143 E145 N149	D143-Y147 HydrophobicContact CB-CD2 4.09Å; D143-Y147 HydrophobicContact CB-CE2 3.71Å; D143-Y147 WeakPolarHBondContact O-CD2 3.47Å; D143-Y147 PolarHBondContact O-N 3.3Å; E145-Y147 PolarHBondContact O-N 3.18Å; Y147-N149 VanDerWaalsContact C-N 3.35Å
148	R	75.8	Confident	78	Confident	212 Å²	212	111.3 Å²	111.3	80%	0.8	56%	0.556	S	S	*	*	H	α-helix	trans	-69.4	-33	174.3	-173.6	177.3	179.3	-168.9	-1.9	112.6	L144 E145	L144-R148 WeakPolarHBondContact O-CB 3.47Å; L144-R148 PolarHBondContact O-N 3.08Å; E145-R148 PolarHBondContact O-N 3.43Å
149	N	74.6	Confident	77.6	Confident	129 Å²	129	119.1 Å²	119.1	69%	0.69	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	19.3	179.8	-63.7	-21.4	0	0	0	112.9	E145 Y147 N151	E145-N149 WeakPolarHBondContact O-CB 3.47Å; E145-N149 PolarHBondContact O-N 3.2Å; Y147-N149 VanDerWaalsContact C-N 3.35Å; N149-N151 PolarHBondContact O-N 2.91Å
150	A	70	Confident	77.1	Confident	62 Å²	62	124.2 Å²	124.2	51%	0.512	61%	0.61	S	S	.	*			trans	-66	134.3	175.8	0	0	0	0	0	110.2	K146 E152	K146-A150 PolarHBondContact O-N 3.28Å; A150-E152 PolarHBondContact O-N 2.77Å
151	N	72.4	Confident	76.9	Confident	145 Å²	145	129 Å²	129	78%	0.775	64%	0.643	S	S	*	*			trans	-65.4	124.9	179	-144.3	1.6	0	0	0	109.4	N149 D153	N149-N151 PolarHBondContact O-N 2.91Å; N151-D153 PolarHBondContact O-N 3.19Å
152	E	74	Confident	76.7	Confident	193 Å²	193	135.1 Å²	135.1	90%	0.902	67%	0.665	S	S	*	*	S	Bend	trans	-66.2	-28	-176.1	-68.6	-173.5	164.5	0	0	112.2	A150 W154	A150-E152 PolarHBondContact O-N 2.77Å; E152-W154 PolarHBondContact O-N 3.41Å
153	D	74.1	Confident	76.9	Confident	139 Å²	139	139.7 Å²	139.7	74%	0.743	68%	0.68	S	S	*	*	S	Bend	trans	-87.2	87.9	177.1	-67.5	-35	0	0	0	111.2	N151 S155	N151-D153 PolarHBondContact O-N 3.19Å; D153-S155 PolarHBondContact O-N 3.43Å
154	W	77.6	Confident	77.3	Confident	209 Å²	209	143.5 Å²	143.5	79%	0.792	70%	0.701	S	S	*	*			trans	-72	114.7	170.1	-178.4	84.8	0	0	0	110.4	E152 P156	E152-W154 PolarHBondContact O-N 3.41Å; W154-P156 HydrophobicContact CH2-CB 3.83Å; W154-P156 HydrophobicContact CZ2-CB 4.41Å; W154-P156 HydrophobicContact CZ3-CB 4.15Å; W154-P156 HydrophobicContact CZ3-CG 4.4Å
155	S	76.7	Confident	77.7	Confident	94 Å²	94	141.4 Å²	141.4	66%	0.657	69%	0.688	S	S	*	*			trans	-104.3	133.8	167.9	61	0	0	0	0	110.9	D153	D153-S155 PolarHBondContact O-N 3.43Å
156	P	81.4	Confident	78.4	Confident	85 Å²	85	138 Å²	138	55%	0.552	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-59.3	143.7	174	22.6	-30.7	0	0	0	110.5	W154 E158	W154-P156 HydrophobicContact CH2-CB 3.83Å; W154-P156 HydrophobicContact CZ2-CB 4.41Å; W154-P156 HydrophobicContact CZ3-CB 4.15Å; W154-P156 HydrophobicContact CZ3-CG 4.4Å; P156-E158 PolarHBondContact O-N 3.06Å
157	P	79.8	Confident	79.3	Confident	115 Å²	115	135.2 Å²	135.2	75%	0.747	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.5	132.3	179.4	-19	29.1	0	0	0	111.2	L159	P157-L159 PolarHBondContact O-N 3.44Å
158	E	82	Confident	80.2	Confident	186 Å²	186	129.3 Å²	129.3	87%	0.869	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-65.3	133.1	174	-66.9	-172.2	168.2	0	0	110.5	P156 R160	P156-E158 PolarHBondContact O-N 3.06Å; E158-R160 PolarHBondContact O-N 3.32Å
159	L	81.4	Confident	80.9	Confident	168 Å²	168	122.4 Å²	122.4	88%	0.88	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-64.8	122.7	174.6	-70.8	169.6	0	0	0	108.8	P157	P157-L159 PolarHBondContact O-N 3.44Å
160	R	78	Confident	81.7	Confident	184 Å²	184	117.2 Å²	117.2	69%	0.694	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-55.9	128.9	174.3	-71.3	-172.7	-108	-172.5	0.7	109	E158 Y162 D290	E158-R160 PolarHBondContact O-N 3.32Å; R160-Y162 PolarHBondContact O-N 3.16Å; R160-D290 IonicContact CZ-OD1 2.69Å; R160-D290 IonicContact NH1-OD1 2.72Å; R160-D290 IonicContact NH2-OD1 3.27Å; R160-D290 PolarHBondContact NH2-OD1 2.79Å; R160-D290 IonicContact NH2-OD2 3.08Å
161	P	82.4	Confident	82.7	Confident	122 Å²	122	114.6 Å²	114.6	79%	0.792	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-61.3	133.7	179.1	23.2	-31.6	0	0	0	109.9	K163	P161-K163 PolarHBondContact O-N 3.36Å
162	Y	82.4	Confident	83.5	Confident	203 Å²	203	110.6 Å²	110.6	80%	0.796	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-65	124.3	177.5	176.1	-104.9	0	0	0	109.9	R160 D164	R160-Y162 PolarHBondContact O-N 3.16Å; Y162-D164 HydrophobicContact CE1-CB 3.89Å
163	K	83.8	Confident	84.3	Confident	136 Å²	136	107.3 Å²	107.3	59%	0.591	55%	0.552	S	S	*	*			trans	-99.2	112.1	172.7	-172.7	175.9	177.3	-174.4	0	108.4	P161 H165	P161-K163 PolarHBondContact O-N 3.36Å; K163-H165 PolarHBondContact O-CD2 3.41Å; K163-H165 PolarHBondContact O-N 2.99Å
164	D	85.5	Confident	85	Confident	115 Å²	115	102.5 Å²	102.5	62%	0.615	53%	0.526	S	S	*	.			trans	-72.2	120.5	171.1	-173.1	6.4	0	0	0	109.1	Y162 G166	Y162-D164 HydrophobicContact CE1-CB 3.89Å; D164-G166 WeakPolarHBondContact OD1-CA 3.49Å; D164-G166 PolarHBondContact OD1-N 3.41Å
165	H	84.2	Confident	85.4	Confident	57 Å²	57	98.7 Å²	98.7	26%	0.264	52%	0.521	S	S	.	.			trans	-97.2	5.6	177.3	-67.7	-81.2	0	0	0	112.3	K163 L168 I244	K163-H165 PolarHBondContact O-CD2 3.41Å; K163-H165 PolarHBondContact O-N 2.99Å; H165-L168 HydrophobicContact CB-CD2 4.15Å; H165-I244 HydrophobicContact CB-CD1 3.75Å; H165-I244 VanDerWaalsContact ND1-CD1 3.33Å; H165-I244 WeakPolarHBondContact ND1-CD1 3.4Å
166	G	87.6	Confident	85.7	Confident	46 Å²	46	96.7 Å²	96.7	47%	0.474	50%	0.502	S	S	.	.			trans	69.1	-162.8	-174	0	0	0	0	0	112.5	D164 L168	D164-G166 WeakPolarHBondContact OD1-CA 3.49Å; D164-G166 PolarHBondContact OD1-N 3.41Å; G166-L168 PolarHBondContact O-N 3.36Å
167	N	90	Very high	85.9	Confident	80 Å²	80	95.3 Å²	95.3	43%	0.428	49%	0.493	S	S	.	.			trans	-79.7	102.9	-178.1	-175.1	2.7	0	0	0	111.4	L169 A170 L173	N167-L169 PolarHBondContact O-N 3.27Å; N167-L169 WeakPolarHBondContact OD1-CA 3.49Å; N167-L169 PolarHBondContact OD1-N 3.36Å; N167-A170 HydrophobicContact CB-CB 4.13Å; N167-A170 VanDerWaalsContact O-CB 3.27Å; N167-A170 WeakPolarHBondContact O-CB 3.3Å; N167-A170 PolarHBondContact O-N 2.85Å; N167-A170 PolarHBondContact OD1-N 2.93Å; N167-L173 WeakPolarHBondContact ND2-CD1 3.36Å
168	L	91.3	Very high	86.3	Confident	35 Å²	35	92.1 Å²	92.1	18%	0.183	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.3	176.4	-58	176.8	0	0	0	113.1	H165 G166 T223 Y224 I244	H165-L168 HydrophobicContact CB-CD2 4.15Å; G166-L168 PolarHBondContact O-N 3.36Å; L168-T223 HydrophobicContact CB-CG2 3.59Å; L168-T223 HydrophobicContact CD1-CG2 3.8Å; L168-T223 HydrophobicContact CG-CG2 4.3Å; L168-Y224 HydrophobicContact CD1-CE1 3.95Å; L168-I244 HydrophobicContact CD2-CD1 3.8Å; L168-I244 HydrophobicContact CD2-CG1 4.38Å
169	L	90.4	Very high	86.8	Confident	68 Å²	68	83.3 Å²	83.3	36%	0.356	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	13.3	179	-61	179.4	0	0	0	112.7	N167 W171 L172	N167-L169 PolarHBondContact O-N 3.27Å; N167-L169 WeakPolarHBondContact OD1-CA 3.49Å; N167-L169 PolarHBondContact OD1-N 3.36Å; L169-W171 PolarHBondContact O-N 3.35Å; L169-L172 HydrophobicContact CB-CD1 4.25Å; L169-L172 HydrophobicContact CD2-CD1 4.35Å; L169-L172 WeakPolarHBondContact O-CB 3.35Å; L169-L172 PolarHBondContact O-N 2.82Å
170	A	90.1	Very high	87.5	Confident	19 Å²	19	75.7 Å²	75.7	16%	0.157	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-54.6	-28	-176.9	0	0	0	0	0	113.5	N167 L172 L173 M239	N167-A170 HydrophobicContact CB-CB 4.13Å; N167-A170 VanDerWaalsContact O-CB 3.27Å; N167-A170 WeakPolarHBondContact O-CB 3.3Å; N167-A170 PolarHBondContact O-N 2.85Å; N167-A170 PolarHBondContact OD1-N 2.93Å; A170-L172 PolarHBondContact O-N 3.43Å; A170-L173 WeakPolarHBondContact O-CB 3.5Å; A170-L173 PolarHBondContact O-N 2.79Å; A170-L173 VanDerWaalsContact O-N 3.07Å; A170-M239 HydrophobicContact CB-CG 3.49Å; A170-M239 VanDerWaalsContact CB-CG 3.49Å; A170-M239 HydrophobicContact CB-SD 4.07Å
171	W	90.8	Very high	88.3	Confident	8 Å²	8	67 Å²	67	3%	0.03	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-66.8	-23.6	179.8	68.8	-85.1	0	0	0	113.6	L169 L173 N174 W196 R599 P600 R601	L169-W171 PolarHBondContact O-N 3.35Å; W171-L173 PolarHBondContact O-N 2.86Å; W171-N174 PolarHBondContact O-N 2.81Å; W171-W196 HydrophobicContact CB-CH2 3.8Å; W171-W196 HydrophobicContact CB-CZ3 4.44Å; W171-W196 WeakPolarHBondContact O-CH2 3.45Å; W171-R599 VanDerWaalsContact CD1-NH1 3.34Å; W171-P600 WeakPolarHBondContact CH2-O 3.34Å; W171-P600 VanDerWaalsContact CZ2-O 3.29Å; W171-P600 WeakPolarHBondContact CZ2-O 3.05Å; W171-R601 HydrophobicContact CH2-CB 3.82Å; W171-R601 HydrophobicContact CH2-CG 3.44Å; W171-R601 VanDerWaalsContact CH2-CG 3.44Å; W171-R601 HydrophobicContact CZ3-CG 3.82Å
172	L	90.9	Very high	89	Confident	61 Å²	61	61.1 Å²	61.1	32%	0.319	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-71.7	-18.5	173.2	-71.3	171.8	0	0	0	112.9	L169 A170 N174 P602	L169-L172 HydrophobicContact CB-CD1 4.25Å; L169-L172 HydrophobicContact CD2-CD1 4.35Å; L169-L172 WeakPolarHBondContact O-CB 3.35Å; L169-L172 PolarHBondContact O-N 2.82Å; A170-L172 PolarHBondContact O-N 3.43Å; L172-N174 PolarHBondContact O-N 3.21Å; L172-P602 HydrophobicContact CD1-CG 3.64Å
173	L	90.7	Very high	89.6	Confident	124 Å²	124	51.9 Å²	51.9	65%	0.649	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-89.2	14.3	179.8	-56	176.9	0	0	0	112.4	N167 A170 W171 D175	N167-L173 WeakPolarHBondContact ND2-CD1 3.36Å; A170-L173 WeakPolarHBondContact O-CB 3.5Å; A170-L173 PolarHBondContact O-N 2.79Å; A170-L173 VanDerWaalsContact O-N 3.07Å; W171-L173 PolarHBondContact O-N 2.86Å; L173-D175 PolarHBondContact O-N 3.02Å
174	N	88	Confident	90.2	Very high	37 Å²	37	45.4 Å²	45.4	20%	0.198	25%	0.251	C	S	.	.			trans	-67.1	119.3	175.4	-176	-77.4	0	0	0	110.1	W171 L172 E176 C177 Y178 W196	W171-N174 PolarHBondContact O-N 2.81Å; L172-N174 PolarHBondContact O-N 3.21Å; N174-E176 PolarHBondContact O-N 2.96Å; N174-E176 WeakPolarHBondContact OD1-CA 3.3Å; N174-E176 WeakPolarHBondContact OD1-CB 3.43Å; N174-E176 PolarHBondContact OD1-N 3.09Å; N174-C177 WeakPolarHBondContact O-CA 3.49Å; N174-C177 PolarHBondContact O-N 2.9Å; N174-C177 PolarHBondContact OD1-N 3.13Å; N174-C177 VanDerWaalsContact OD1-N 3.09Å; N174-Y178 PolarHBondContact OD1-N 2.82Å; N174-W196 HydrophobicContact CB-CH2 3.71Å; N174-W196 HydrophobicContact CB-CZ3 3.84Å
175	D	85.6	Confident	90.6	Very high	130 Å²	130	40.6 Å²	40.6	70%	0.695	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-31	-176.8	-69.5	-24.2	0	0	0	113.5	L173 C177	L173-D175 PolarHBondContact O-N 3.02Å; D175-C177 VanDerWaalsContact C-N 3.27Å
176	E	83.4	Confident	90.8	Very high	52 Å²	52	38.4 Å²	38.4	24%	0.243	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-0	177.4	-52.9	-57.7	146.7	0	0	112.5	N174 Y178 R628 N632	N174-E176 PolarHBondContact O-N 2.96Å; N174-E176 WeakPolarHBondContact OD1-CA 3.3Å; N174-E176 WeakPolarHBondContact OD1-CB 3.43Å; N174-E176 PolarHBondContact OD1-N 3.09Å; E176-Y178 HydrophobicContact CB-CD1 4.11Å; E176-Y178 HydrophobicContact CB-CD2 3.69Å; E176-Y178 HydrophobicContact CB-CE1 3.85Å; E176-Y178 HydrophobicContact CB-CE2 3.43Å; E176-Y178 VanDerWaalsContact CB-CE2 3.43Å; E176-Y178 HydrophobicContact CB-CG 4.01Å; E176-Y178 VanDerWaalsContact CB-CZ 3.5Å; E176-Y178 HydrophobicContact CG-CD2 4.35Å; E176-Y178 HydrophobicContact CG-CE2 3.76Å; E176-Y178 PolarHBondContact O-N 2.81Å; E176-Y178 VanDerWaalsContact O-N 3.12Å; E176-R628 VanDerWaalsContact CD-NE 3.29Å; E176-R628 IonicContact OE1-CZ 3.23Å; E176-R628 IonicContact OE1-NE 3.72Å; E176-R628 PolarHBondContact OE1-NE 3.16Å; E176-R628 IonicContact OE1-NH2 3.83Å; E176-R628 PolarHBondContact OE1-NH2 3.25Å; E176-R628 IonicContact OE2-CZ 3.78Å; E176-R628 IonicContact OE2-NE 3.91Å; E176-R628 PolarHBondContact OE2-NE 3.14Å; E176-R628 IonicContact OE2-NH2 2.67Å; E176-N632 PolarHBondContact OE2-ND2 2.93Å
177	C	85.3	Confident	90.4	Very high	55 Å²	55	39.8 Å²	39.8	37%	0.372	22%	0.221	S	C	.	.			trans	56.8	25.6	-179.8	-59.1	0	0	0	0	114.1	N174 D175 R556 R601	N174-C177 WeakPolarHBondContact O-CA 3.49Å; N174-C177 PolarHBondContact O-N 2.9Å; N174-C177 PolarHBondContact OD1-N 3.13Å; N174-C177 VanDerWaalsContact OD1-N 3.09Å; D175-C177 VanDerWaalsContact C-N 3.27Å; C177-R556 PolarHBondContact O-NH2 2.85Å; C177-R601 PolarHBondContact O-NH2 3.3Å; C177-R601 VanDerWaalsContact O-NH2 3.08Å
178	Y	89.1	Confident	90.1	Very high	48 Å²	48	42.6 Å²	42.6	19%	0.188	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-65	139.2	178.3	-64.6	-34.1	0	0	0	111.5	N174 E176 W196	N174-Y178 PolarHBondContact OD1-N 2.82Å; E176-Y178 HydrophobicContact CB-CD1 4.11Å; E176-Y178 HydrophobicContact CB-CD2 3.69Å; E176-Y178 HydrophobicContact CB-CE1 3.85Å; E176-Y178 HydrophobicContact CB-CE2 3.43Å; E176-Y178 VanDerWaalsContact CB-CE2 3.43Å; E176-Y178 HydrophobicContact CB-CG 4.01Å; E176-Y178 VanDerWaalsContact CB-CZ 3.5Å; E176-Y178 HydrophobicContact CG-CD2 4.35Å; E176-Y178 HydrophobicContact CG-CE2 3.76Å; E176-Y178 PolarHBondContact O-N 2.81Å; E176-Y178 VanDerWaalsContact O-N 3.12Å; Y178-W196 WeakPolarHBondContact O-CZ3 3.28Å
179	D	92.4	Very high	89.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-82.3	147.9	171.5	-71.7	-70.4	0	0	0	110.1	N197 R556 W598 R601	D179-N197 WeakPolarHBondContact O-CB 3.25Å; D179-N197 PolarHBondContact O-N 3.37Å; D179-R556 IonicContact OD2-NH2 3.77Å; D179-R556 PolarHBondContact OD2-NH2 3.36Å; D179-R556 VanDerWaalsContact OD2-NH2 3.08Å; D179-W598 HydrophobicContact CB-CE3 4.13Å; D179-W598 HydrophobicContact CB-CZ3 4Å; D179-R601 IonicContact OD1-CZ 3.8Å; D179-R601 IonicContact OD1-NE 2.72Å; D179-R601 PolarHBondContact OD1-NE 3.49Å; D179-R601 IonicContact OD1-NH2 3.72Å; D179-R601 PolarHBondContact OD1-NH2 3.33Å; D179-R601 IonicContact OD2-NH2 2.62Å; D179-R601 PolarHBondContact OD2-NH2 2.98Å
180	Q	94.8	Very high	89.9	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	152.6	174.1	-68.6	-171.6	-8.8	0	0	110.9	Y195 W196 I205 R599	Q180-Y195 VanDerWaalsContact CA-O 3.26Å; Q180-Y195 WeakPolarHBondContact CA-O 3.4Å; Q180-W196 HydrophobicContact CG-CD2 3.77Å; Q180-W196 HydrophobicContact CG-CE3 3.29Å; Q180-W196 HydrophobicContact CG-CH2 3.88Å; Q180-W196 HydrophobicContact CG-CZ2 4.29Å; Q180-W196 HydrophobicContact CG-CZ3 3.35Å; Q180-W196 VanDerWaalsContact NE2-CE2 3.29Å; Q180-I205 HydrophobicContact CG-CD1 3.95Å; Q180-I205 VanDerWaalsContact NE2-CD1 3.29Å; Q180-R599 HydrophobicContact CB-CB 3.82Å; Q180-R599 HydrophobicContact CB-CG 4.49Å; Q180-R599 VanDerWaalsContact O-CB 3.26Å; Q180-R599 WeakPolarHBondContact O-CB 3.41Å; Q180-R599 PolarHBondContact O-N 2.81Å; Q180-R599 VanDerWaalsContact OE1-CD 3.23Å
181	F	96	Very high	90.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	164.5	168.9	62	-91.8	0	0	0	110.5	I183 A194 Y195 N197 P202 F596 S597 W598	F181-I183 HydrophobicContact CD2-CD1 4.25Å; F181-I183 HydrophobicContact CD2-CG1 3.94Å; F181-I183 HydrophobicContact CE2-CD1 3.6Å; F181-I183 HydrophobicContact CE2-CG1 3.82Å; F181-A194 WeakPolarHBondContact O-CA 3.41Å; F181-Y195 HydrophobicContact CD2-CD2 4.18Å; F181-Y195 AromaticContact CE2-CD2 3.62Å; F181-Y195 HydrophobicContact CE2-CD2 3.62Å; F181-Y195 AromaticContact CE2-CG 3.86Å; F181-Y195 HydrophobicContact CE2-CG 3.86Å; F181-Y195 VanDerWaalsContact CZ-CB 3.49Å; F181-Y195 HydrophobicContact CZ-CD2 4.26Å; F181-Y195 HydrophobicContact CZ-CG 4.02Å; F181-Y195 PolarHBondContact N-O 3.46Å; F181-Y195 PolarHBondContact O-N 3.27Å; F181-N197 HydrophobicContact CD1-CB 4.19Å; F181-N197 HydrophobicContact CE1-CB 4.02Å; F181-P202 HydrophobicContact CE1-CB 4.08Å; F181-P202 HydrophobicContact CE1-CG 4.33Å; F181-P202 HydrophobicContact CZ-CB 3.69Å; F181-P202 HydrophobicContact CZ-CG 3.9Å; F181-F596 HydrophobicContact CB-CE1 3.74Å; F181-F596 HydrophobicContact CB-CE2 4.02Å; F181-F596 HydrophobicContact CB-CZ 3.38Å; F181-F596 HydrophobicContact CD1-CE2 4.2Å; F181-F596 AromaticContact CD1-CZ 3.88Å; F181-F596 HydrophobicContact CD1-CZ 3.88Å; F181-F596 AromaticContact CD2-CD2 3.94Å; F181-F596 HydrophobicContact CD2-CD2 3.94Å; F181-F596 HydrophobicContact CD2-CE1 4.46Å; F181-F596 AromaticContact CD2-CE2 3.21Å; F181-F596 HydrophobicContact CD2-CE2 3.21Å; F181-F596 AromaticContact CD2-CZ 3.53Å; F181-F596 HydrophobicContact CD2-CZ 3.53Å; F181-F596 HydrophobicContact CE1-CE2 4.48Å; F181-F596 HydrophobicContact CE2-CD2 4.36Å; F181-F596 AromaticContact CE2-CE2 3.6Å; F181-F596 HydrophobicContact CE2-CE2 3.6Å; F181-F596 HydrophobicContact CE2-CZ 4.24Å; F181-F596 HydrophobicContact CG-CE1 4.17Å; F181-F596 AromaticContact CG-CE2 3.55Å; F181-F596 HydrophobicContact CG-CE2 3.55Å; F181-F596 AromaticContact CG-CZ 3.31Å; F181-F596 HydrophobicContact CG-CZ 3.31Å; F181-F596 HydrophobicContact CZ-CE2 4.2Å; F181-S597 VanDerWaalsContact CA-O 3.31Å; F181-S597 WeakPolarHBondContact CA-O 3.4Å; F181-S597 WeakPolarHBondContact CB-O 3.37Å; F181-W598 HydrophobicContact CB-CD2 4.23Å; F181-W598 HydrophobicContact CB-CE3 3.71Å; F181-W598 HydrophobicContact CB-CZ3 3.95Å; F181-W598 HydrophobicContact CD1-CE3 4.16Å; F181-W598 AromaticContact CD1-CH2 3.83Å; F181-W598 HydrophobicContact CD1-CH2 3.83Å; F181-W598 AromaticContact CD1-CZ3 3.49Å; F181-W598 HydrophobicContact CD1-CZ3 3.49Å; F181-W598 VanDerWaalsContact CD1-CZ3 3.49Å; F181-W598 HydrophobicContact CE1-CH2 4.42Å; F181-W598 HydrophobicContact CE1-CZ3 4.4Å; F181-W598 HydrophobicContact CG-CE3 4.37Å; F181-W598 HydrophobicContact CG-CZ3 4.12Å
182	V	96.6	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.8	171.5	-72.5	0	0	0	0	110.2	G193 A194 I216 W218 L225 F596 S597	V182-G193 CarbonylContact C-O 3.41Å; V182-G193 VanDerWaalsContact CA-O 3.29Å; V182-G193 WeakPolarHBondContact CA-O 3.12Å; V182-A194 HydrophobicContact CG1-CB 3.96Å; V182-I216 HydrophobicContact CB-CD1 3.88Å; V182-I216 HydrophobicContact CG2-CD1 3.5Å; V182-I216 HydrophobicContact CG2-CG1 4.42Å; V182-W218 HydrophobicContact CB-CZ2 4.38Å; V182-W218 HydrophobicContact CG1-CH2 4.25Å; V182-W218 HydrophobicContact CG1-CZ2 3.45Å; V182-W218 VanDerWaalsContact CG1-CZ2 3.45Å; V182-W218 HydrophobicContact CG2-CZ2 4.2Å; V182-W218 VanDerWaalsContact CG2-NE1 3.34Å; V182-L225 HydrophobicContact CG1-CD1 4.47Å; V182-L225 HydrophobicContact CG1-CD2 4.22Å; V182-L225 HydrophobicContact CG2-CD1 4.36Å; V182-F596 WeakPolarHBondContact O-CA 3.33Å; V182-S597 PolarHBondContact N-O 3.07Å; V182-S597 PolarHBondContact O-N 2.81Å
183	I	95.8	Very high	90.6	Very high	9 Å²	9	39.3 Å²	39.3	5%	0.046	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.5	169.9	-61.7	165.4	0	0	0	107.9	F181 I192 G193 Y195 Y575 F593 R595 F596	F181-I183 HydrophobicContact CD2-CD1 4.25Å; F181-I183 HydrophobicContact CD2-CG1 3.94Å; F181-I183 HydrophobicContact CE2-CD1 3.6Å; F181-I183 HydrophobicContact CE2-CG1 3.82Å; I183-I192 VanDerWaalsContact O-CA 3.3Å; I183-I192 WeakPolarHBondContact O-CA 3.39Å; I183-G193 PolarHBondContact N-O 3.2Å; I183-G193 PolarHBondContact O-N 3.03Å; I183-Y195 HydrophobicContact CB-CE2 4.25Å; I183-Y195 HydrophobicContact CD1-CD2 4.09Å; I183-Y195 HydrophobicContact CD1-CE2 3.82Å; I183-Y195 HydrophobicContact CG1-CD2 4.42Å; I183-Y195 HydrophobicContact CG1-CE2 4.26Å; I183-Y575 HydrophobicContact CD1-CD1 4.02Å; I183-Y575 HydrophobicContact CD1-CE1 3.25Å; I183-Y575 HydrophobicContact CG1-CE1 4.24Å; I183-F593 HydrophobicContact CG2-CD2 3.88Å; I183-F593 HydrophobicContact CG2-CE2 3.84Å; I183-R595 WeakPolarHBondContact CA-O 3.32Å; I183-F596 HydrophobicContact CG1-CD2 4Å
184	Q	95.2	Very high	90.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.2	166.4	-177.8	171.8	0.3	0	0	108.5	F190 I192 A214 I216 C594 R595	Q184-F190 HydrophobicContact CG-CB 4.27Å; Q184-F190 HydrophobicContact CG-CD1 3.91Å; Q184-F190 HydrophobicContact CG-CG 4.19Å; Q184-F190 VanDerWaalsContact NE2-CG 3.28Å; Q184-I192 HydrophobicContact CB-CG1 4.1Å; Q184-I192 HydrophobicContact CG-CG1 3.94Å; Q184-A214 PolarHBondContact NE2-O 3.3Å; Q184-A214 VanDerWaalsContact NE2-O 3.13Å; Q184-I216 HydrophobicContact CB-CD1 4.28Å; Q184-C594 HydrophobicContact CB-CB 4.45Å; Q184-C594 HydrophobicContact CG-CB 4.19Å; Q184-C594 WeakPolarHBondContact O-CA 3.39Å; Q184-C594 WeakPolarHBondContact O-CB 3.44Å; Q184-C594 PolarHBondContact O-N 3.36Å; Q184-R595 HydrophobicContact CB-CB 4.4Å; Q184-R595 PolarHBondContact N-O 2.89Å; Q184-R595 PolarHBondContact O-N 2.91Å; Q184-R595 VanDerWaalsContact O-N 3.13Å
185	A	93.5	Very high	91.2	Very high	14 Å²	14	33.1 Å²	33.1	12%	0.116	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	165.6	177.9	0	0	0	0	0	111.1	F190 T191 V590 E592	A185-F190 CarbonylContact O-C 3.51Å; A185-F190 WeakPolarHBondContact O-CA 3.38Å; A185-T191 PolarHBondContact N-O 3.34Å; A185-T191 PolarHBondContact O-N 3.12Å; A185-V590 HydrophobicContact CB-CG1 3.75Å; A185-E592 CarbonylContact C-O 3.57Å; A185-E592 VanDerWaalsContact CA-O 3.32Å; A185-E592 WeakPolarHBondContact CA-O 3.49Å
186	G	88.6	Confident	91.6	Very high	11 Å²	11	29.3 Å²	29.3	11%	0.113	16%	0.164	C	C	.	.			trans	91.1	157.9	-178.8	0	0	0	0	0	113.2	F190 E592 C594	G186-F190 WeakPolarHBondContact O-CD1 3.09Å; G186-F190 WeakPolarHBondContact O-CE1 3.29Å; G186-E592 VanDerWaalsContact CA-OE2 3.23Å; G186-E592 WeakPolarHBondContact CA-OE2 3.45Å; G186-E592 PolarHBondContact N-O 2.85Å; G186-C594 PolarHBondContact O-SG 2.92Å; G186-C594 VanDerWaalsContact O-SG 3.4Å
187	C	81.1	Confident	92	Very high	74 Å²	74	27.1 Å²	27.1	50%	0.5	15%	0.154	S	C	.	.	S	Bend	trans	-126	105.6	167.8	-168.5	0	0	0	0	109.4	E592	C187-E592 PolarHBondContact N-OE2 2.83Å
188	N	81.9	Confident	92.1	Very high	139 Å²	139	24.9 Å²	24.9	74%	0.743	14%	0.139	S	C	*	.	S	Bend	trans	57.8	86.5	-179.6	-70.6	-19.9	0	0	0	115.7
189	P	87.3	Confident	91.7	Very high	69 Å²	69	26.4 Å²	26.4	45%	0.448	15%	0.15	S	C	.	.	S	Bend	cis	-89.6	151.2	2.3	33.6	-33.5	0	0	0	112.9	N210	P189-N210 HydrophobicContact CB-CB 3.88Å
190	F	91.9	Very high	91	Very high	17 Å²	17	29.5 Å²	29.5	8%	0.075	17%	0.17	C	C	.	.			trans	-64.4	140.1	166.8	-67.2	-63.8	0	0	0	110.8	Q184 A185 G186 N210 S212 E213 W565	Q184-F190 HydrophobicContact CG-CB 4.27Å; Q184-F190 HydrophobicContact CG-CD1 3.91Å; Q184-F190 HydrophobicContact CG-CG 4.19Å; Q184-F190 VanDerWaalsContact NE2-CG 3.28Å; A185-F190 CarbonylContact O-C 3.51Å; A185-F190 WeakPolarHBondContact O-CA 3.38Å; G186-F190 WeakPolarHBondContact O-CD1 3.09Å; G186-F190 WeakPolarHBondContact O-CE1 3.29Å; F190-N210 WeakPolarHBondContact O-CA 3.35Å; F190-N210 PolarHBondContact O-N 2.79Å; F190-S212 WeakPolarHBondContact CD2-O 3.33Å; F190-E213 WeakPolarHBondContact CE2-O 3.13Å; F190-W565 AromaticContact CE1-CZ2 3.81Å; F190-W565 HydrophobicContact CE1-CZ2 3.81Å; F190-W565 AromaticContact CZ-CZ2 3.8Å; F190-W565 HydrophobicContact CZ-CZ2 3.8Å
191	T	94.7	Very high	90.5	Very high	34 Å²	34	35.8 Å²	35.8	21%	0.209	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.7	165.8	-56.6	0	0	0	0	108.1	A185 E207 K209	A185-T191 PolarHBondContact N-O 3.34Å; A185-T191 PolarHBondContact O-N 3.12Å; T191-E207 HydrophobicContact CG2-CG 3.57Å; T191-K209 HydrophobicContact CG2-CG 4.41Å
192	I	95.6	Very high	90.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124	-179.3	-65.5	153.7	0	0	0	108.7	I183 Q184 E207 K208 W211 I216	I183-I192 VanDerWaalsContact O-CA 3.3Å; I183-I192 WeakPolarHBondContact O-CA 3.39Å; Q184-I192 HydrophobicContact CB-CG1 4.1Å; Q184-I192 HydrophobicContact CG-CG1 3.94Å; I192-E207 WeakPolarHBondContact O-CA 3.37Å; I192-K208 PolarHBondContact N-O 2.85Å; I192-K208 PolarHBondContact O-N 3.26Å; I192-W211 HydrophobicContact CB-CB 4.27Å; I192-W211 HydrophobicContact CB-CE3 3.75Å; I192-W211 HydrophobicContact CD1-CB 3.85Å; I192-W211 HydrophobicContact CG2-CD2 4.44Å; I192-W211 HydrophobicContact CG2-CE3 3.49Å; I192-W211 VanDerWaalsContact CG2-CE3 3.49Å; I192-W211 HydrophobicContact CG2-CZ3 3.82Å; I192-I216 HydrophobicContact CD1-CG2 3.45Å; I192-I216 VanDerWaalsContact CD1-CG2 3.45Å; I192-I216 HydrophobicContact CG1-CD1 4.4Å; I192-I216 HydrophobicContact CG1-CG2 4.29Å; I192-I216 HydrophobicContact CG2-CD1 3.8Å
193	G	94.7	Very high	90	Very high	2 Å²	2	39.2 Å²	39.2	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.9	178.1	0	0	0	0	0	111.1	V182 I183 Y195 C206	V182-G193 CarbonylContact C-O 3.41Å; V182-G193 VanDerWaalsContact CA-O 3.29Å; V182-G193 WeakPolarHBondContact CA-O 3.12Å; I183-G193 PolarHBondContact N-O 3.2Å; I183-G193 PolarHBondContact O-N 3.03Å; G193-Y195 VanDerWaalsContact C-CE2 3.41Å; G193-Y195 WeakPolarHBondContact O-CD2 3.4Å; G193-Y195 VanDerWaalsContact O-CE2 3.28Å; G193-Y195 WeakPolarHBondContact O-CE2 3.48Å; G193-C206 CarbonylContact C-O 3.6Å; G193-C206 WeakPolarHBondContact CA-O 3.24Å
194	A	95.5	Very high	89.9	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.5	169.5	0	0	0	0	0	109.5	F181 V182 I205 C206 F241	F181-A194 WeakPolarHBondContact O-CA 3.41Å; V182-A194 HydrophobicContact CG1-CB 3.96Å; A194-I205 HydrophobicContact CB-CB 4.34Å; A194-I205 HydrophobicContact CB-CD1 4.48Å; A194-I205 WeakPolarHBondContact O-CB 3.16Å; A194-I205 PolarHBondContact O-N 2.81Å; A194-C206 PolarHBondContact N-O 3.45Å; A194-C206 PolarHBondContact O-N 3.23Å; A194-F241 HydrophobicContact CB-CD2 4.39Å; A194-F241 HydrophobicContact CB-CE2 3.63Å; A194-F241 HydrophobicContact CB-CZ 3.84Å
195	Y	95.4	Very high	89.8	Confident	30 Å²	30	45.6 Å²	45.6	12%	0.118	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153	-173.7	-57.3	-94.7	0	0	0	111.5	Q180 F181 I183 G193 P202 S203 L204	Q180-Y195 VanDerWaalsContact CA-O 3.26Å; Q180-Y195 WeakPolarHBondContact CA-O 3.4Å; F181-Y195 HydrophobicContact CD2-CD2 4.18Å; F181-Y195 AromaticContact CE2-CD2 3.62Å; F181-Y195 HydrophobicContact CE2-CD2 3.62Å; F181-Y195 AromaticContact CE2-CG 3.86Å; F181-Y195 HydrophobicContact CE2-CG 3.86Å; F181-Y195 VanDerWaalsContact CZ-CB 3.49Å; F181-Y195 HydrophobicContact CZ-CD2 4.26Å; F181-Y195 HydrophobicContact CZ-CG 4.02Å; F181-Y195 PolarHBondContact N-O 3.46Å; F181-Y195 PolarHBondContact O-N 3.27Å; I183-Y195 HydrophobicContact CB-CE2 4.25Å; I183-Y195 HydrophobicContact CD1-CD2 4.09Å; I183-Y195 HydrophobicContact CD1-CE2 3.82Å; I183-Y195 HydrophobicContact CG1-CD2 4.42Å; I183-Y195 HydrophobicContact CG1-CE2 4.26Å; G193-Y195 VanDerWaalsContact C-CE2 3.41Å; G193-Y195 WeakPolarHBondContact O-CD2 3.4Å; G193-Y195 VanDerWaalsContact O-CE2 3.28Å; G193-Y195 WeakPolarHBondContact O-CE2 3.48Å; Y195-P202 HydrophobicContact CD1-CB 4.39Å; Y195-S203 CarbonylContact C-O 3.59Å; Y195-S203 VanDerWaalsContact CA-O 3.26Å; Y195-S203 WeakPolarHBondContact CA-O 3.36Å; Y195-L204 HydrophobicContact CD1-CB 4.08Å; Y195-L204 HydrophobicContact CD1-CD1 3.87Å; Y195-L204 HydrophobicContact CE1-CB 3.97Å; Y195-L204 HydrophobicContact CE1-CD1 3.35Å; Y195-L204 HydrophobicContact CE1-CG 4.24Å; Y195-L204 HydrophobicContact CE2-CD1 4.36Å
196	W	94	Very high	89.8	Confident	50 Å²	50	45.9 Å²	45.9	19%	0.189	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.9	159.9	-66.8	107.7	0	0	0	109.8	W171 N174 Y178 Q180 S198 P202 S203 I205	W171-W196 HydrophobicContact CB-CH2 3.8Å; W171-W196 HydrophobicContact CB-CZ3 4.44Å; W171-W196 WeakPolarHBondContact O-CH2 3.45Å; N174-W196 HydrophobicContact CB-CH2 3.71Å; N174-W196 HydrophobicContact CB-CZ3 3.84Å; Y178-W196 WeakPolarHBondContact O-CZ3 3.28Å; Q180-W196 HydrophobicContact CG-CD2 3.77Å; Q180-W196 HydrophobicContact CG-CE3 3.29Å; Q180-W196 HydrophobicContact CG-CH2 3.88Å; Q180-W196 HydrophobicContact CG-CZ2 4.29Å; Q180-W196 HydrophobicContact CG-CZ3 3.35Å; Q180-W196 VanDerWaalsContact NE2-CE2 3.29Å; W196-S198 PolarHBondContact O-N 3.07Å; W196-P202 CarbonylContact O-C 3.52Å; W196-P202 WeakPolarHBondContact O-CA 3.09Å; W196-P202 VanDerWaalsContact O-CB 3.32Å; W196-P202 WeakPolarHBondContact O-CB 3.25Å; W196-S203 PolarHBondContact N-O 3.29Å; W196-S203 PolarHBondContact O-N 2.84Å; W196-I205 HydrophobicContact CD2-CD1 4.07Å; W196-I205 HydrophobicContact CG-CD1 3.96Å; W196-I205 HydrophobicContact CG-CG1 4.12Å
197	N	93.1	Very high	90	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.032	28%	0.275	C	S	.	.			trans	-77.5	56.9	171.5	-171	37.1	0	0	0	112	D179 F181 W598	D179-N197 WeakPolarHBondContact O-CB 3.25Å; D179-N197 PolarHBondContact O-N 3.37Å; F181-N197 HydrophobicContact CD1-CB 4.19Å; F181-N197 HydrophobicContact CE1-CB 4.02Å; N197-W598 HydrophobicContact CB-CH2 3.84Å; N197-W598 HydrophobicContact CB-CZ3 3.8Å
198	S	87.9	Confident	90.6	Very high	9 Å²	9	49.9 Å²	49.9	6%	0.063	26%	0.264	C	S	.	.			trans	-74.7	151.8	170.5	50.4	0	0	0	0	110.7	W196 E201 S203	W196-S198 PolarHBondContact O-N 3.07Å; S198-E201 CarbonylContact C-O 3.53Å; S198-E201 CarbonylContact O-C 3.55Å; S198-E201 PolarHBondContact OG-O 3.35Å; S198-S203 WeakPolarHBondContact OG-CB 3.47Å; S198-S203 PolarHBondContact OG-N 3.04Å; S198-S203 PolarHBondContact OG-OG 3.35Å
199	L	79.9	Confident	91.2	Very high	79 Å²	79	51 Å²	51	41%	0.414	26%	0.263	S	S	.	.	S	Bend	trans	-104.2	147.7	170.6	-67.2	173.7	0	0	0	109.7
200	P	77.7	Confident	91.4	Very high	66 Å²	66	52 Å²	52	43%	0.429	26%	0.264	S	S	.	.	S	Bend	cis	-78.8	-20.1	0.9	31.9	-35.7	0	0	0	113.8	A636	P200-A636 VanDerWaalsContact CD-CB 3.44Å; P200-A636 HydrophobicContact CG-CB 4.19Å
201	E	83.7	Confident	91.4	Very high	142 Å²	142	51.6 Å²	51.6	66%	0.664	26%	0.262	S	S	*	.	S	Bend	trans	-123	144.7	178.9	-67.5	-168.6	174.3	0	0	112.1	S198 S203	S198-E201 CarbonylContact C-O 3.53Å; S198-E201 CarbonylContact O-C 3.55Å; S198-E201 PolarHBondContact OG-O 3.35Å; E201-S203 PolarHBondContact O-N 3.46Å
202	P	90.9	Very high	91.3	Very high	13 Å²	13	50 Å²	50	8%	0.084	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-62.2	130.9	175.2	-23.8	32.7	0	0	0	112.6	F181 Y195 W196 Q586	F181-P202 HydrophobicContact CE1-CB 4.08Å; F181-P202 HydrophobicContact CE1-CG 4.33Å; F181-P202 HydrophobicContact CZ-CB 3.69Å; F181-P202 HydrophobicContact CZ-CG 3.9Å; Y195-P202 HydrophobicContact CD1-CB 4.39Å; W196-P202 CarbonylContact O-C 3.52Å; W196-P202 WeakPolarHBondContact O-CA 3.09Å; W196-P202 VanDerWaalsContact O-CB 3.32Å; W196-P202 WeakPolarHBondContact O-CB 3.25Å; P202-Q586 VanDerWaalsContact CD-OE1 3.29Å; P202-Q586 VanDerWaalsContact CG-OE1 3.22Å
203	S	91	Very high	91.1	Very high	59 Å²	59	54.3 Å²	54.3	41%	0.413	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.7	178.8	-60.7	0	0	0	0	110.6	Y195 W196 S198 E201	Y195-S203 CarbonylContact C-O 3.59Å; Y195-S203 VanDerWaalsContact CA-O 3.26Å; Y195-S203 WeakPolarHBondContact CA-O 3.36Å; W196-S203 PolarHBondContact N-O 3.29Å; W196-S203 PolarHBondContact O-N 2.84Å; S198-S203 WeakPolarHBondContact OG-CB 3.47Å; S198-S203 PolarHBondContact OG-N 3.04Å; S198-S203 PolarHBondContact OG-OG 3.35Å; E201-S203 PolarHBondContact O-N 3.46Å
204	L	93.5	Very high	90.8	Very high	94 Å²	94	56.1 Å²	56.1	49%	0.492	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.6	177.1	-180	67.5	0	0	0	111.1	Y195 E207	Y195-L204 HydrophobicContact CD1-CB 4.08Å; Y195-L204 HydrophobicContact CD1-CD1 3.87Å; Y195-L204 HydrophobicContact CE1-CB 3.97Å; Y195-L204 HydrophobicContact CE1-CD1 3.35Å; Y195-L204 HydrophobicContact CE1-CG 4.24Å; Y195-L204 HydrophobicContact CE2-CD1 4.36Å; L204-E207 HydrophobicContact CD1-CB 4.08Å; L204-E207 HydrophobicContact CD2-CB 4.3Å
205	I	93.4	Very high	90.3	Very high	48 Å²	48	58.2 Å²	58.2	25%	0.246	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-55.8	175.5	-54.7	169.9	0	0	0	109.8	Q180 A194 W196 F241	Q180-I205 HydrophobicContact CG-CD1 3.95Å; Q180-I205 VanDerWaalsContact NE2-CD1 3.29Å; A194-I205 HydrophobicContact CB-CB 4.34Å; A194-I205 HydrophobicContact CB-CD1 4.48Å; A194-I205 WeakPolarHBondContact O-CB 3.16Å; A194-I205 PolarHBondContact O-N 2.81Å; W196-I205 HydrophobicContact CD2-CD1 4.07Å; W196-I205 HydrophobicContact CG-CD1 3.96Å; W196-I205 HydrophobicContact CG-CG1 4.12Å; I205-F241 HydrophobicContact CG2-CE2 4.23Å
206	C	93.7	Very high	90.1	Very high	20 Å²	20	57.1 Å²	57.1	14%	0.135	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	145.4	176.6	68	0	0	0	0	110	G193 A194 F241	G193-C206 CarbonylContact C-O 3.6Å; G193-C206 WeakPolarHBondContact CA-O 3.24Å; A194-C206 PolarHBondContact N-O 3.45Å; A194-C206 PolarHBondContact O-N 3.23Å; C206-F241 WeakPolarHBondContact SG-CD2 3.34Å
207	E	94.1	Very high	90.1	Very high	105 Å²	105	57.9 Å²	57.9	49%	0.491	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.5	171.4	-171.9	176.3	-100.5	0	0	108.7	T191 I192 L204	T191-E207 HydrophobicContact CG2-CG 3.57Å; I192-E207 WeakPolarHBondContact O-CA 3.37Å; L204-E207 HydrophobicContact CD1-CB 4.08Å; L204-E207 HydrophobicContact CD2-CB 4.3Å
208	K	93.1	Very high	90.2	Very high	64 Å²	64	58.2 Å²	58.2	28%	0.278	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.5	179.3	-67.1	-179	-171.5	170.4	0	109.7	I192 W211 F241	I192-K208 PolarHBondContact N-O 2.85Å; I192-K208 PolarHBondContact O-N 3.26Å; K208-W211 HydrophobicContact CB-CB 3.77Å; K208-W211 HydrophobicContact CB-CD2 4.02Å; K208-W211 HydrophobicContact CB-CE3 4.01Å; K208-W211 HydrophobicContact CB-CG 3.91Å; K208-W211 HydrophobicContact CD-CD2 3.81Å; K208-W211 HydrophobicContact CD-CE3 4.19Å; K208-W211 HydrophobicContact CD-CG 3.99Å; K208-W211 HydrophobicContact CG-CD2 4.37Å; K208-W211 HydrophobicContact CG-CE3 4.36Å; K208-F241 PolarHBondContact NZ-O 2.93Å
209	K	93.2	Very high	90.5	Very high	164 Å²	164	57.8 Å²	57.8	71%	0.713	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	141.6	168.3	-65.8	-172	178.5	-176.9	0	109.8	T191 W211	T191-K209 HydrophobicContact CG2-CG 4.41Å; K209-W211 PolarHBondContact O-N 2.82Å
210	N	92	Very high	91.1	Very high	89 Å²	89	57.1 Å²	57.1	48%	0.476	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	38.4	-177.6	-158.9	31.8	0	0	0	113.7	P189 F190 S212	P189-N210 HydrophobicContact CB-CB 3.88Å; F190-N210 WeakPolarHBondContact O-CA 3.35Å; F190-N210 PolarHBondContact O-N 2.79Å; N210-S212 VanDerWaalsContact C-N 3.32Å
211	W	93.2	Very high	91.8	Very high	8 Å²	8	56.9 Å²	56.9	3%	0.03	30%	0.298	C	S	.	.	S	Bend	trans	-73.8	-26.6	-179.4	-165.9	6.8	0	0	0	112.3	I192 K208 K209 L225 T227 H229 W236 F241	I192-W211 HydrophobicContact CB-CB 4.27Å; I192-W211 HydrophobicContact CB-CE3 3.75Å; I192-W211 HydrophobicContact CD1-CB 3.85Å; I192-W211 HydrophobicContact CG2-CD2 4.44Å; I192-W211 HydrophobicContact CG2-CE3 3.49Å; I192-W211 VanDerWaalsContact CG2-CE3 3.49Å; I192-W211 HydrophobicContact CG2-CZ3 3.82Å; K208-W211 HydrophobicContact CB-CB 3.77Å; K208-W211 HydrophobicContact CB-CD2 4.02Å; K208-W211 HydrophobicContact CB-CE3 4.01Å; K208-W211 HydrophobicContact CB-CG 3.91Å; K208-W211 HydrophobicContact CD-CD2 3.81Å; K208-W211 HydrophobicContact CD-CE3 4.19Å; K208-W211 HydrophobicContact CD-CG 3.99Å; K208-W211 HydrophobicContact CG-CD2 4.37Å; K208-W211 HydrophobicContact CG-CE3 4.36Å; K209-W211 PolarHBondContact O-N 2.82Å; W211-L225 HydrophobicContact CH2-CD2 3.51Å; W211-L225 HydrophobicContact CZ2-CD2 3.83Å; W211-L225 HydrophobicContact CZ3-CD2 3.91Å; W211-T227 HydrophobicContact CG-CG2 4.36Å; W211-T227 WeakPolarHBondContact O-CB 3.38Å; W211-T227 WeakPolarHBondContact O-CG2 3.45Å; W211-H229 PolarHBondContact O-CE1 3.22Å; W211-W236 AromaticContact CD1-CE2 3.77Å; W211-W236 AromaticContact CD1-CZ2 3.74Å; W211-W236 HydrophobicContact CZ2-CB 3.99Å; W211-W236 HydrophobicContact CZ2-CD2 4.12Å; W211-W236 HydrophobicContact CZ2-CE3 4.48Å; W211-W236 AromaticContact CZ2-CG 3.88Å; W211-W236 HydrophobicContact CZ2-CG 3.88Å; W211-W236 AromaticContact NE1-CD1 3.68Å; W211-W236 AromaticContact NE1-CD2 3.26Å; W211-W236 VanDerWaalsContact NE1-CD2 3.26Å; W211-W236 AromaticContact NE1-CE2 3.07Å; W211-W236 AromaticContact NE1-CE3 3.77Å; W211-W236 AromaticContact NE1-CG 3.66Å; W211-W236 AromaticContact NE1-CH2 3.91Å; W211-W236 AromaticContact NE1-CZ2 3.44Å; W211-W236 AromaticContact NE1-NE1 3.35Å; W211-F241 HydrophobicContact CH2-CB 3.65Å; W211-F241 AromaticContact CH2-CD1 3.75Å; W211-F241 HydrophobicContact CH2-CD1 3.75Å; W211-F241 HydrophobicContact CH2-CD2 4.38Å; W211-F241 HydrophobicContact CH2-CE1 4.47Å; W211-F241 AromaticContact CH2-CG 3.68Å; W211-F241 HydrophobicContact CH2-CG 3.68Å; W211-F241 HydrophobicContact CZ2-CB 3.69Å; W211-F241 HydrophobicContact CZ2-CD1 4.15Å; W211-F241 HydrophobicContact CZ2-CG 4.14Å
212	S	92.4	Very high	92.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.266	C	S	.	.			trans	-142.6	142.8	172.4	-172.8	0	0	0	0	108.5	F190 N210 A214 V228	F190-S212 WeakPolarHBondContact CD2-O 3.33Å; N210-S212 VanDerWaalsContact C-N 3.32Å; S212-A214 WeakPolarHBondContact CB-O 3.41Å; S212-A214 PolarHBondContact OG-N 3.01Å; S212-A214 PolarHBondContact OG-O 3.23Å; S212-V228 PolarHBondContact OG-N 2.8Å; S212-V228 VanDerWaalsContact OG-N 3.09Å; S212-V228 PolarHBondContact OG-O 2.9Å
213	E	90.2	Very high	92.5	Very high	92 Å²	92	50 Å²	50	43%	0.43	27%	0.265	S	S	.	.	S	Bend	trans	-84.9	-15.4	174.2	-67.2	167.2	-153.3	0	0	111.7	F190 V228 A230	F190-E213 WeakPolarHBondContact CE2-O 3.13Å; E213-V228 PolarHBondContact N-O 3.22Å; E213-A230 PolarHBondContact OE2-N 3Å
214	A	89.2	Confident	92.7	Very high	40 Å²	40	48.5 Å²	48.5	33%	0.331	25%	0.251	S	S	.	.	S	Bend	trans	-134.7	-169.6	176.8	0	0	0	0	0	111.8	Q184 S212 I216 V228	Q184-A214 PolarHBondContact NE2-O 3.3Å; Q184-A214 VanDerWaalsContact NE2-O 3.13Å; S212-A214 WeakPolarHBondContact CB-O 3.41Å; S212-A214 PolarHBondContact OG-N 3.01Å; S212-A214 PolarHBondContact OG-O 3.23Å; A214-I216 PolarHBondContact O-N 2.8Å; A214-V228 HydrophobicContact CB-CB 3.92Å; A214-V228 HydrophobicContact CB-CG1 4.19Å; A214-V228 HydrophobicContact CB-CG2 4.33Å
215	A	84.4	Confident	92.8	Very high	44 Å²	44	44 Å²	44	36%	0.364	23%	0.227	S	C	.	.			trans	-58.7	134.3	178.4	0	0	0	0	0	111.9
216	I	91.9	Very high	92.9	Very high	8 Å²	8	41.8 Å²	41.8	4%	0.041	22%	0.216	C	C	.	.			trans	-82.5	153.7	174.2	62.1	-179.2	0	0	0	111.8	V182 Q184 I192 A214 L225 T227	V182-I216 HydrophobicContact CB-CD1 3.88Å; V182-I216 HydrophobicContact CG2-CD1 3.5Å; V182-I216 HydrophobicContact CG2-CG1 4.42Å; Q184-I216 HydrophobicContact CB-CD1 4.28Å; I192-I216 HydrophobicContact CD1-CG2 3.45Å; I192-I216 VanDerWaalsContact CD1-CG2 3.45Å; I192-I216 HydrophobicContact CG1-CD1 4.4Å; I192-I216 HydrophobicContact CG1-CG2 4.29Å; I192-I216 HydrophobicContact CG2-CD1 3.8Å; A214-I216 PolarHBondContact O-N 2.8Å; I216-L225 HydrophobicContact CB-CD1 4.33Å; I216-L225 HydrophobicContact CD1-CD1 4.43Å; I216-T227 HydrophobicContact CG2-CG2 4.35Å
217	Q	93.7	Very high	93	Very high	66 Å²	66	40.8 Å²	40.8	31%	0.308	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	134.9	175.7	-173.5	177.1	-17.9	0	0	110.8	A226 F255	Q217-A226 PolarHBondContact N-O 3.37Å; Q217-A226 WeakPolarHBondContact O-CB 3.34Å; Q217-A226 PolarHBondContact O-N 3.31Å; Q217-F255 HydrophobicContact CB-CE2 3.95Å; Q217-F255 HydrophobicContact CB-CZ 3.65Å
218	W	95.3	Very high	93	Very high	12 Å²	12	36.4 Å²	36.4	5%	0.045	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	144.2	167	-73	115.4	0	0	0	111.3	V182 L225 F241 S597 R599 P600	V182-W218 HydrophobicContact CB-CZ2 4.38Å; V182-W218 HydrophobicContact CG1-CH2 4.25Å; V182-W218 HydrophobicContact CG1-CZ2 3.45Å; V182-W218 VanDerWaalsContact CG1-CZ2 3.45Å; V182-W218 HydrophobicContact CG2-CZ2 4.2Å; V182-W218 VanDerWaalsContact CG2-NE1 3.34Å; W218-L225 HydrophobicContact CD2-CD1 3.77Å; W218-L225 HydrophobicContact CE3-CB 3.93Å; W218-L225 HydrophobicContact CE3-CD1 3.92Å; W218-L225 HydrophobicContact CG-CD1 4.29Å; W218-L225 HydrophobicContact CH2-CB 4.33Å; W218-L225 HydrophobicContact CH2-CD1 4.45Å; W218-L225 HydrophobicContact CZ2-CD1 4.32Å; W218-L225 HydrophobicContact CZ3-CB 3.75Å; W218-L225 HydrophobicContact CZ3-CD1 4.25Å; W218-F241 AromaticContact CH2-CE1 3.46Å; W218-F241 HydrophobicContact CH2-CE1 3.46Å; W218-F241 VanDerWaalsContact CH2-CE1 3.46Å; W218-F241 AromaticContact CH2-CZ 3.7Å; W218-F241 HydrophobicContact CH2-CZ 3.7Å; W218-F241 AromaticContact CZ3-CE1 3.85Å; W218-F241 HydrophobicContact CZ3-CE1 3.85Å; W218-F241 HydrophobicContact CZ3-CZ 4.46Å; W218-S597 PolarHBondContact NE1-O 2.87Å; W218-R599 HydrophobicContact CD2-CB 4.35Å; W218-R599 HydrophobicContact CD2-CG 4.11Å; W218-R599 HydrophobicContact CE3-CG 4.04Å; W218-R599 HydrophobicContact CH2-CB 4.16Å; W218-R599 HydrophobicContact CH2-CG 3.73Å; W218-R599 HydrophobicContact CZ2-CB 3.71Å; W218-R599 HydrophobicContact CZ2-CG 3.8Å; W218-R599 HydrophobicContact CZ3-CG 3.87Å; W218-P600 VanDerWaalsContact CB-CD 3.43Å; W218-P600 HydrophobicContact CB-CG 3.91Å
219	S	94.9	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.			trans	-64.4	152.7	164.6	63.2	0	0	0	0	110.8	Q221 G222 T223 Y224 E261	S219-Q221 PolarHBondContact O-N 3.41Å; S219-G222 WeakPolarHBondContact O-CA 3.35Å; S219-G222 PolarHBondContact O-N 3.09Å; S219-T223 PolarHBondContact OG-N 2.83Å; S219-Y224 WeakPolarHBondContact CB-O 3.44Å; S219-Y224 PolarHBondContact N-O 2.95Å; S219-Y224 PolarHBondContact OG-N 2.69Å; S219-Y224 PolarHBondContact OG-O 2.64Å; S219-E261 WeakPolarHBondContact CB-OE1 3.42Å; S219-E261 PolarHBondContact OG-OE1 3.43Å
220	P	92.1	Very high	92.9	Very high	65 Å²	65	29.4 Å²	29.4	42%	0.422	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.2	-172.9	-31	34	0	0	0	116.7	I257 P600	P220-I257 WeakPolarHBondContact CD-O 3.34Å; P220-I257 WeakPolarHBondContact CG-O 3.43Å; P220-P600 WeakPolarHBondContact O-CB 3.38Å
221	Q	92.4	Very high	92.9	Very high	62 Å²	62	32.2 Å²	32.2	29%	0.29	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	2.4	176	-52.7	-176.9	-17.3	0	0	112.7	S219 T223 E261 P602	S219-Q221 PolarHBondContact O-N 3.41Å; Q221-T223 PolarHBondContact O-N 3.15Å; Q221-E261 VanDerWaalsContact CA-OE1 3.29Å; Q221-E261 WeakPolarHBondContact CA-OE1 2.93Å; Q221-E261 HydrophobicContact CB-CG 4.17Å; Q221-E261 VanDerWaalsContact CB-OE1 3.23Å; Q221-E261 WeakPolarHBondContact CB-OE1 3.21Å; Q221-E261 HydrophobicContact CG-CG 4.05Å; Q221-E261 PolarHBondContact N-OE1 2.91Å; Q221-P602 HydrophobicContact CB-CB 4.15Å; Q221-P602 WeakPolarHBondContact O-CD 3.48Å
222	G	93.6	Very high	92.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	72.1	11.3	-178.8	0	0	0	0	0	114.2	S219 Y224 E261 R599	S219-G222 WeakPolarHBondContact O-CA 3.35Å; S219-G222 PolarHBondContact O-N 3.09Å; G222-Y224 VanDerWaalsContact C-N 3.33Å; G222-E261 PolarHBondContact N-OE1 2.88Å; G222-R599 PolarHBondContact O-NE 2.8Å; G222-R599 PolarHBondContact O-NH2 2.83Å
223	T	94.3	Very high	93.1	Very high	11 Å²	11	31.9 Å²	31.9	7%	0.067	18%	0.175	C	C	.	.	S	Bend	trans	-65.8	-39	178.1	-51.6	0	0	0	0	111.7	L168 S219 Q221 E261	L168-T223 HydrophobicContact CB-CG2 3.59Å; L168-T223 HydrophobicContact CD1-CG2 3.8Å; L168-T223 HydrophobicContact CG-CG2 4.3Å; S219-T223 PolarHBondContact OG-N 2.83Å; Q221-T223 PolarHBondContact O-N 3.15Å; T223-E261 WeakPolarHBondContact CB-OE2 3.4Å; T223-E261 PolarHBondContact N-OE1 3.27Å; T223-E261 VanDerWaalsContact N-OE1 3.11Å; T223-E261 PolarHBondContact OG1-OE1 2.84Å; T223-E261 PolarHBondContact OG1-OE2 2.78Å
224	Y	95.3	Very high	93.3	Very high	27 Å²	27	27.5 Å²	27.5	11%	0.106	16%	0.155	C	C	.	.			trans	-120.8	140.9	-176.1	-53	-63.4	0	0	0	112.1	L168 S219 G222 F235 W236 I244 E261	L168-Y224 HydrophobicContact CD1-CE1 3.95Å; S219-Y224 WeakPolarHBondContact CB-O 3.44Å; S219-Y224 PolarHBondContact N-O 2.95Å; S219-Y224 PolarHBondContact OG-N 2.69Å; S219-Y224 PolarHBondContact OG-O 2.64Å; G222-Y224 VanDerWaalsContact C-N 3.33Å; Y224-F235 HydrophobicContact CD1-CB 4.15Å; Y224-F235 HydrophobicContact CD1-CD2 4.39Å; Y224-F235 AromaticContact CD2-CD2 3.85Å; Y224-F235 HydrophobicContact CD2-CD2 3.85Å; Y224-F235 HydrophobicContact CD2-CE2 4.2Å; Y224-F235 HydrophobicContact CE2-CD2 4.39Å; Y224-F235 HydrophobicContact CG-CB 4.16Å; Y224-F235 AromaticContact CG-CD2 3.84Å; Y224-F235 HydrophobicContact CG-CD2 3.84Å; Y224-F235 HydrophobicContact CG-CG 4.22Å; Y224-W236 CarbonylContact C-O 3.52Å; Y224-W236 VanDerWaalsContact CA-O 3.27Å; Y224-W236 WeakPolarHBondContact CA-O 3.45Å; Y224-I244 HydrophobicContact CD1-CG1 4.18Å; Y224-I244 HydrophobicContact CE1-CB 4.25Å; Y224-I244 HydrophobicContact CE1-CG1 4.04Å; Y224-I244 HydrophobicContact CE1-CG2 4.03Å; Y224-E261 HydrophobicContact CE2-CB 4.5Å
225	L	95.6	Very high	93.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.5	160	-175.4	66.6	0	0	0	108.3	V182 W211 I216 W218 F235 W236 F241	V182-L225 HydrophobicContact CG1-CD1 4.47Å; V182-L225 HydrophobicContact CG1-CD2 4.22Å; V182-L225 HydrophobicContact CG2-CD1 4.36Å; W211-L225 HydrophobicContact CH2-CD2 3.51Å; W211-L225 HydrophobicContact CZ2-CD2 3.83Å; W211-L225 HydrophobicContact CZ3-CD2 3.91Å; I216-L225 HydrophobicContact CB-CD1 4.33Å; I216-L225 HydrophobicContact CD1-CD1 4.43Å; W218-L225 HydrophobicContact CD2-CD1 3.77Å; W218-L225 HydrophobicContact CE3-CB 3.93Å; W218-L225 HydrophobicContact CE3-CD1 3.92Å; W218-L225 HydrophobicContact CG-CD1 4.29Å; W218-L225 HydrophobicContact CH2-CB 4.33Å; W218-L225 HydrophobicContact CH2-CD1 4.45Å; W218-L225 HydrophobicContact CZ2-CD1 4.32Å; W218-L225 HydrophobicContact CZ3-CB 3.75Å; W218-L225 HydrophobicContact CZ3-CD1 4.25Å; L225-F235 WeakPolarHBondContact O-CA 3.42Å; L225-W236 HydrophobicContact CB-CB 4.45Å; L225-W236 PolarHBondContact N-O 2.83Å; L225-W236 PolarHBondContact O-N 2.66Å; L225-F241 HydrophobicContact CB-CD1 4.34Å; L225-F241 HydrophobicContact CB-CE1 4.27Å; L225-F241 HydrophobicContact CD2-CD1 4.45Å; L225-F241 HydrophobicContact CD2-CE1 4.42Å
226	A	96.1	Very high	94.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.9	176.7	0	0	0	0	0	111.5	Q217 I233 A234 F235 F255 I257	Q217-A226 PolarHBondContact N-O 3.37Å; Q217-A226 WeakPolarHBondContact O-CB 3.34Å; Q217-A226 PolarHBondContact O-N 3.31Å; A226-I233 HydrophobicContact CB-CG2 4.33Å; A226-A234 WeakPolarHBondContact CA-O 3.17Å; A226-F235 HydrophobicContact CB-CD1 3.76Å; A226-F235 HydrophobicContact CB-CE1 3.66Å; A226-F255 HydrophobicContact CB-CE2 3.59Å; A226-F255 HydrophobicContact CB-CZ 3.84Å; A226-I257 HydrophobicContact CB-CD1 3.77Å
227	T	95.3	Very high	94.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	147.6	175.4	63.1	0	0	0	0	110.4	W211 I216 H229 I233 A234 W236	W211-T227 HydrophobicContact CG-CG2 4.36Å; W211-T227 WeakPolarHBondContact O-CB 3.38Å; W211-T227 WeakPolarHBondContact O-CG2 3.45Å; I216-T227 HydrophobicContact CG2-CG2 4.35Å; T227-H229 PolarHBondContact OG1-NE2 3.01Å; T227-I233 WeakPolarHBondContact O-CA 3.27Å; T227-I233 WeakPolarHBondContact O-CG2 3.34Å; T227-A234 PolarHBondContact N-O 2.96Å; T227-A234 PolarHBondContact O-N 2.98Å; T227-W236 PolarHBondContact OG1-NE1 3.5Å
228	V	94.4	Very high	94.1	Very high	13 Å²	13	22.1 Å²	22.1	8%	0.079	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.7	-179.2	-175	0	0	0	0	109.1	S212 E213 A214 F255	S212-V228 PolarHBondContact OG-N 2.8Å; S212-V228 VanDerWaalsContact OG-N 3.09Å; S212-V228 PolarHBondContact OG-O 2.9Å; E213-V228 PolarHBondContact N-O 3.22Å; A214-V228 HydrophobicContact CB-CB 3.92Å; A214-V228 HydrophobicContact CB-CG1 4.19Å; A214-V228 HydrophobicContact CB-CG2 4.33Å; V228-F255 HydrophobicContact CG2-CD1 3.89Å; V228-F255 HydrophobicContact CG2-CE1 3.39Å; V228-F255 HydrophobicContact CG2-CZ 4.28Å
229	H	93.8	Very high	93.7	Very high	34 Å²	34	28.5 Å²	28.5	16%	0.157	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	159.2	175.9	-53.3	-80.6	0	0	0	109.7	W211 T227 K231 G232	W211-H229 PolarHBondContact O-CE1 3.22Å; T227-H229 PolarHBondContact OG1-NE2 3.01Å; H229-K231 PolarHBondContact O-N 3.03Å; H229-G232 WeakPolarHBondContact CA-O 3.48Å; H229-G232 WeakPolarHBondContact CB-O 2.98Å; H229-G232 PolarHBondContact N-O 3.03Å; H229-G232 WeakPolarHBondContact O-CA 3.3Å; H229-G232 PolarHBondContact O-N 3.37Å; H229-G232 VanDerWaalsContact O-O 3.12Å
230	A	91.4	Very high	93.3	Very high	47 Å²	47	36.1 Å²	36.1	39%	0.388	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-32	177.6	0	0	0	0	0	114	E213 P250 L251	E213-A230 PolarHBondContact OE2-N 3Å; A230-P250 WeakPolarHBondContact O-CA 3.45Å; A230-L251 PolarHBondContact O-N 2.83Å
231	K	92	Very high	93.3	Very high	148 Å²	148	33 Å²	33	64%	0.643	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-5.1	178	-69.1	-177.9	179.8	-176.3	0	114.1	H229	H229-K231 PolarHBondContact O-N 3.03Å
232	G	93.1	Very high	93.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	129.1	-160.7	178.2	0	0	0	0	0	114.9	H229 F247 H249	H229-G232 WeakPolarHBondContact CA-O 3.48Å; H229-G232 WeakPolarHBondContact CB-O 2.98Å; H229-G232 PolarHBondContact N-O 3.03Å; H229-G232 WeakPolarHBondContact O-CA 3.3Å; H229-G232 PolarHBondContact O-N 3.37Å; H229-G232 VanDerWaalsContact O-O 3.12Å; G232-F247 WeakPolarHBondContact CA-O 3.39Å; G232-H249 WeakPolarHBondContact CA-O 3.23Å; G232-H249 PolarHBondContact N-O 2.74Å
233	I	95.9	Very high	93.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	142.7	-169.2	-55.7	-174.4	0	0	0	110.4	A226 T227 F235 R246 F247 V252 F255 L264 T266	A226-I233 HydrophobicContact CB-CG2 4.33Å; T227-I233 WeakPolarHBondContact O-CA 3.27Å; T227-I233 WeakPolarHBondContact O-CG2 3.34Å; I233-F235 HydrophobicContact CG2-CD1 4.19Å; I233-F235 HydrophobicContact CG2-CE1 4Å; I233-R246 CarbonylContact O-C 3.56Å; I233-R246 WeakPolarHBondContact O-CA 3.27Å; I233-F247 HydrophobicContact CB-CD2 4.26Å; I233-F247 HydrophobicContact CG2-CD2 4.41Å; I233-F247 PolarHBondContact N-O 3.02Å; I233-F247 VanDerWaalsContact N-O 3.14Å; I233-F247 PolarHBondContact O-N 2.9Å; I233-V252 HydrophobicContact CD1-CG1 4.13Å; I233-V252 HydrophobicContact CD1-CG2 4.48Å; I233-V252 HydrophobicContact CG1-CB 4.44Å; I233-V252 HydrophobicContact CG1-CG2 4.21Å; I233-F255 HydrophobicContact CD1-CB 3.32Å; I233-F255 HydrophobicContact CD1-CD1 3.82Å; I233-F255 HydrophobicContact CD1-CD2 3.91Å; I233-F255 HydrophobicContact CD1-CG 3.41Å; I233-F255 VanDerWaalsContact CD1-CG 3.41Å; I233-L264 HydrophobicContact CB-CD2 4.38Å; I233-L264 HydrophobicContact CD1-CD1 4.19Å; I233-L264 HydrophobicContact CD1-CD2 4.25Å; I233-L264 HydrophobicContact CG2-CD2 4.34Å; I233-T266 HydrophobicContact CD1-CG2 3.45Å; I233-T266 VanDerWaalsContact CD1-CG2 3.45Å; I233-T266 HydrophobicContact CG1-CG2 4.29Å
234	A	95.6	Very high	93.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.6	171.3	0	0	0	0	0	111	A226 T227 W236 Q243	A226-A234 WeakPolarHBondContact CA-O 3.17Å; T227-A234 PolarHBondContact N-O 2.96Å; T227-A234 PolarHBondContact O-N 2.98Å; A234-W236 HydrophobicContact CB-CZ2 4.46Å; A234-Q243 HydrophobicContact CB-CG 4.43Å
235	F	96.3	Very high	93.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.7	171.5	-73.7	-0.2	0	0	0	110.4	Y224 L225 A226 I233 I244 V245 F247 I257 L264 T286	Y224-F235 HydrophobicContact CD1-CB 4.15Å; Y224-F235 HydrophobicContact CD1-CD2 4.39Å; Y224-F235 AromaticContact CD2-CD2 3.85Å; Y224-F235 HydrophobicContact CD2-CD2 3.85Å; Y224-F235 HydrophobicContact CD2-CE2 4.2Å; Y224-F235 HydrophobicContact CE2-CD2 4.39Å; Y224-F235 HydrophobicContact CG-CB 4.16Å; Y224-F235 AromaticContact CG-CD2 3.84Å; Y224-F235 HydrophobicContact CG-CD2 3.84Å; Y224-F235 HydrophobicContact CG-CG 4.22Å; L225-F235 WeakPolarHBondContact O-CA 3.42Å; A226-F235 HydrophobicContact CB-CD1 3.76Å; A226-F235 HydrophobicContact CB-CE1 3.66Å; I233-F235 HydrophobicContact CG2-CD1 4.19Å; I233-F235 HydrophobicContact CG2-CE1 4Å; F235-I244 PolarHBondContact O-N 2.89Å; F235-V245 HydrophobicContact CB-CG1 3.75Å; F235-V245 HydrophobicContact CD2-CG1 3.76Å; F235-V245 HydrophobicContact CG-CG1 4Å; F235-V245 PolarHBondContact N-O 3.5Å; F235-F247 AromaticContact CD1-CE2 3.95Å; F235-F247 HydrophobicContact CD1-CE2 3.95Å; F235-F247 AromaticContact CD2-CE2 3.83Å; F235-F247 HydrophobicContact CD2-CE2 3.83Å; F235-F247 HydrophobicContact CD2-CZ 4.11Å; F235-F247 AromaticContact CE1-CE2 3.93Å; F235-F247 HydrophobicContact CE1-CE2 3.93Å; F235-F247 AromaticContact CE2-CE2 3.82Å; F235-F247 HydrophobicContact CE2-CE2 3.82Å; F235-F247 AromaticContact CE2-CZ 3.95Å; F235-F247 HydrophobicContact CE2-CZ 3.95Å; F235-F247 AromaticContact CG-CE2 3.9Å; F235-F247 HydrophobicContact CG-CE2 3.9Å; F235-F247 AromaticContact CZ-CE2 3.86Å; F235-F247 HydrophobicContact CZ-CE2 3.86Å; F235-F247 HydrophobicContact CZ-CZ 4.29Å; F235-I257 HydrophobicContact CE1-CD1 3.69Å; F235-I257 HydrophobicContact CE1-CG1 4.13Å; F235-I257 HydrophobicContact CZ-CD1 3.66Å; F235-I257 HydrophobicContact CZ-CG1 3.79Å; F235-I257 HydrophobicContact CZ-CG2 4.32Å; F235-L264 HydrophobicContact CE1-CD1 4.22Å; F235-L264 HydrophobicContact CE1-CD2 4.23Å; F235-L264 HydrophobicContact CZ-CB 4.15Å; F235-L264 HydrophobicContact CZ-CD1 4.02Å; F235-L264 HydrophobicContact CZ-CD2 4.09Å; F235-L264 HydrophobicContact CZ-CG 4.32Å; F235-T286 HydrophobicContact CE2-CG2 3.68Å; F235-T286 HydrophobicContact CZ-CG2 4.27Å
236	W	95.1	Very high	93.1	Very high	36 Å²	36	44.8 Å²	44.8	14%	0.136	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.7	179.9	-52.8	83.3	0	0	0	109.6	W211 Y224 L225 T227 A234 F241 D242 Q243	W211-W236 AromaticContact CD1-CE2 3.77Å; W211-W236 AromaticContact CD1-CZ2 3.74Å; W211-W236 HydrophobicContact CZ2-CB 3.99Å; W211-W236 HydrophobicContact CZ2-CD2 4.12Å; W211-W236 HydrophobicContact CZ2-CE3 4.48Å; W211-W236 AromaticContact CZ2-CG 3.88Å; W211-W236 HydrophobicContact CZ2-CG 3.88Å; W211-W236 AromaticContact NE1-CD1 3.68Å; W211-W236 AromaticContact NE1-CD2 3.26Å; W211-W236 VanDerWaalsContact NE1-CD2 3.26Å; W211-W236 AromaticContact NE1-CE2 3.07Å; W211-W236 AromaticContact NE1-CE3 3.77Å; W211-W236 AromaticContact NE1-CG 3.66Å; W211-W236 AromaticContact NE1-CH2 3.91Å; W211-W236 AromaticContact NE1-CZ2 3.44Å; W211-W236 AromaticContact NE1-NE1 3.35Å; Y224-W236 CarbonylContact C-O 3.52Å; Y224-W236 VanDerWaalsContact CA-O 3.27Å; Y224-W236 WeakPolarHBondContact CA-O 3.45Å; L225-W236 HydrophobicContact CB-CB 4.45Å; L225-W236 PolarHBondContact N-O 2.83Å; L225-W236 PolarHBondContact O-N 2.66Å; T227-W236 PolarHBondContact OG1-NE1 3.5Å; A234-W236 HydrophobicContact CB-CZ2 4.46Å; W236-F241 HydrophobicContact CB-CB 4.37Å; W236-F241 HydrophobicContact CB-CD1 4.44Å; W236-F241 VanDerWaalsContact CE3-O 3.23Å; W236-D242 VanDerWaalsContact CA-O 3.31Å; W236-D242 WeakPolarHBondContact CA-O 3.3Å; W236-Q243 HydrophobicContact CD2-CB 4.35Å; W236-Q243 HydrophobicContact CE3-CB 3.81Å; W236-Q243 HydrophobicContact CH2-CB 4.12Å; W236-Q243 HydrophobicContact CH2-CG 4.47Å; W236-Q243 HydrophobicContact CZ3-CB 3.69Å; W236-Q243 HydrophobicContact CZ3-CG 4.45Å
237	G	93.6	Very high	93	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	179.9	-176.3	0	0	0	0	0	113.2	F241 D242	G237-F241 CarbonylContact O-C 3.59Å; G237-F241 VanDerWaalsContact O-CA 3.29Å; G237-F241 WeakPolarHBondContact O-CA 3.45Å; G237-D242 PolarHBondContact N-O 3.5Å; G237-D242 PolarHBondContact O-N 3.38Å
238	G	90	Very high	92.9	Very high	7 Å²	7	47.3 Å²	47.3	7%	0.072	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	-174.7	-177.5	0	0	0	0	0	113.7	K240	G238-K240 VanDerWaalsContact C-N 3.35Å; G238-K240 PolarHBondContact O-N 2.82Å
239	M	87.1	Confident	92.8	Very high	147 Å²	147	47 Å²	47	72%	0.724	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-32.4	-173.9	-65.4	-179.5	73.8	0	0	113.6	A170	A170-M239 HydrophobicContact CB-CG 3.49Å; A170-M239 VanDerWaalsContact CB-CG 3.49Å; A170-M239 HydrophobicContact CB-SD 4.07Å
240	K	87.2	Confident	92.6	Very high	159 Å²	159	48.9 Å²	48.9	69%	0.691	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	3.9	-177.3	-65.8	-175.9	179.1	179.5	0	113.8	G238	G238-K240 VanDerWaalsContact C-N 3.35Å; G238-K240 PolarHBondContact O-N 2.82Å
241	F	91.8	Very high	92.4	Very high	1 Å²	1	51.3 Å²	51.3	0%	0.004	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	62.9	-171.3	-66.7	-91.6	0	0	0	111.7	A194 I205 C206 K208 W211 W218 L225 W236 G237	A194-F241 HydrophobicContact CB-CD2 4.39Å; A194-F241 HydrophobicContact CB-CE2 3.63Å; A194-F241 HydrophobicContact CB-CZ 3.84Å; I205-F241 HydrophobicContact CG2-CE2 4.23Å; C206-F241 WeakPolarHBondContact SG-CD2 3.34Å; K208-F241 PolarHBondContact NZ-O 2.93Å; W211-F241 HydrophobicContact CH2-CB 3.65Å; W211-F241 AromaticContact CH2-CD1 3.75Å; W211-F241 HydrophobicContact CH2-CD1 3.75Å; W211-F241 HydrophobicContact CH2-CD2 4.38Å; W211-F241 HydrophobicContact CH2-CE1 4.47Å; W211-F241 AromaticContact CH2-CG 3.68Å; W211-F241 HydrophobicContact CH2-CG 3.68Å; W211-F241 HydrophobicContact CZ2-CB 3.69Å; W211-F241 HydrophobicContact CZ2-CD1 4.15Å; W211-F241 HydrophobicContact CZ2-CG 4.14Å; W218-F241 AromaticContact CH2-CE1 3.46Å; W218-F241 HydrophobicContact CH2-CE1 3.46Å; W218-F241 VanDerWaalsContact CH2-CE1 3.46Å; W218-F241 AromaticContact CH2-CZ 3.7Å; W218-F241 HydrophobicContact CH2-CZ 3.7Å; W218-F241 AromaticContact CZ3-CE1 3.85Å; W218-F241 HydrophobicContact CZ3-CE1 3.85Å; W218-F241 HydrophobicContact CZ3-CZ 4.46Å; L225-F241 HydrophobicContact CB-CD1 4.34Å; L225-F241 HydrophobicContact CB-CE1 4.27Å; L225-F241 HydrophobicContact CD2-CD1 4.45Å; L225-F241 HydrophobicContact CD2-CE1 4.42Å; W236-F241 HydrophobicContact CB-CB 4.37Å; W236-F241 HydrophobicContact CB-CD1 4.44Å; W236-F241 VanDerWaalsContact CE3-O 3.23Å; G237-F241 CarbonylContact O-C 3.59Å; G237-F241 VanDerWaalsContact O-CA 3.29Å; G237-F241 WeakPolarHBondContact O-CA 3.45Å
242	D	92	Very high	92.3	Very high	90 Å²	90	44.8 Å²	44.8	48%	0.481	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	149	173.4	-67.2	-46.5	0	0	0	110.1	W236 G237 I244	W236-D242 VanDerWaalsContact CA-O 3.31Å; W236-D242 WeakPolarHBondContact CA-O 3.3Å; G237-D242 PolarHBondContact N-O 3.5Å; G237-D242 PolarHBondContact O-N 3.38Å; D242-I244 PolarHBondContact O-N 3.33Å
243	Q	93.2	Very high	91.9	Very high	84 Å²	84	47.6 Å²	47.6	39%	0.393	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	120.5	179	-167.1	-172.5	-41	0	0	109.9	A234 W236	A234-Q243 HydrophobicContact CB-CG 4.43Å; W236-Q243 HydrophobicContact CD2-CB 4.35Å; W236-Q243 HydrophobicContact CE3-CB 3.81Å; W236-Q243 HydrophobicContact CH2-CB 4.12Å; W236-Q243 HydrophobicContact CH2-CG 4.47Å; W236-Q243 HydrophobicContact CZ3-CB 3.69Å; W236-Q243 HydrophobicContact CZ3-CG 4.45Å
244	I	93.1	Very high	91.7	Very high	31 Å²	31	50.9 Å²	50.9	16%	0.159	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-58.9	-178.1	-50.6	-58.9	0	0	0	110	H165 L168 Y224 F235 D242	H165-I244 HydrophobicContact CB-CD1 3.75Å; H165-I244 VanDerWaalsContact ND1-CD1 3.33Å; H165-I244 WeakPolarHBondContact ND1-CD1 3.4Å; L168-I244 HydrophobicContact CD2-CD1 3.8Å; L168-I244 HydrophobicContact CD2-CG1 4.38Å; Y224-I244 HydrophobicContact CD1-CG1 4.18Å; Y224-I244 HydrophobicContact CE1-CB 4.25Å; Y224-I244 HydrophobicContact CE1-CG1 4.04Å; Y224-I244 HydrophobicContact CE1-CG2 4.03Å; F235-I244 PolarHBondContact O-N 2.89Å; D242-I244 PolarHBondContact O-N 3.33Å
245	V	93.3	Very high	91.6	Very high	21 Å²	21	51.7 Å²	51.7	13%	0.127	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	153.7	-175.6	64.5	0	0	0	0	110.4	F235 F247	F235-V245 HydrophobicContact CB-CG1 3.75Å; F235-V245 HydrophobicContact CD2-CG1 3.76Å; F235-V245 HydrophobicContact CG-CG1 4Å; F235-V245 PolarHBondContact N-O 3.5Å; V245-F247 HydrophobicContact CB-CZ 4.38Å; V245-F247 HydrophobicContact CG1-CE1 4.47Å; V245-F247 HydrophobicContact CG1-CE2 3.6Å; V245-F247 HydrophobicContact CG1-CZ 3.49Å; V245-F247 VanDerWaalsContact CG1-CZ 3.49Å; V245-F247 HydrophobicContact CG2-CE1 4.15Å; V245-F247 HydrophobicContact CG2-CE2 4.4Å; V245-F247 HydrophobicContact CG2-CZ 3.96Å
246	R	94.1	Very high	91.4	Very high	120 Å²	120	53.5 Å²	53.5	45%	0.453	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.4	176.3	-175.3	-177.1	-175	162.6	13.3	109.8	I233	I233-R246 CarbonylContact O-C 3.56Å; I233-R246 WeakPolarHBondContact O-CA 3.27Å
247	F	95.6	Very high	91.3	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112.7	-179.9	-52.3	-84.5	0	0	0	109.1	G232 I233 F235 V245 H249 L264 W284	G232-F247 WeakPolarHBondContact CA-O 3.39Å; I233-F247 HydrophobicContact CB-CD2 4.26Å; I233-F247 HydrophobicContact CG2-CD2 4.41Å; I233-F247 PolarHBondContact N-O 3.02Å; I233-F247 VanDerWaalsContact N-O 3.14Å; I233-F247 PolarHBondContact O-N 2.9Å; F235-F247 AromaticContact CD1-CE2 3.95Å; F235-F247 HydrophobicContact CD1-CE2 3.95Å; F235-F247 AromaticContact CD2-CE2 3.83Å; F235-F247 HydrophobicContact CD2-CE2 3.83Å; F235-F247 HydrophobicContact CD2-CZ 4.11Å; F235-F247 AromaticContact CE1-CE2 3.93Å; F235-F247 HydrophobicContact CE1-CE2 3.93Å; F235-F247 AromaticContact CE2-CE2 3.82Å; F235-F247 HydrophobicContact CE2-CE2 3.82Å; F235-F247 AromaticContact CE2-CZ 3.95Å; F235-F247 HydrophobicContact CE2-CZ 3.95Å; F235-F247 AromaticContact CG-CE2 3.9Å; F235-F247 HydrophobicContact CG-CE2 3.9Å; F235-F247 AromaticContact CZ-CE2 3.86Å; F235-F247 HydrophobicContact CZ-CE2 3.86Å; F235-F247 HydrophobicContact CZ-CZ 4.29Å; V245-F247 HydrophobicContact CB-CZ 4.38Å; V245-F247 HydrophobicContact CG1-CE1 4.47Å; V245-F247 HydrophobicContact CG1-CE2 3.6Å; V245-F247 HydrophobicContact CG1-CZ 3.49Å; V245-F247 VanDerWaalsContact CG1-CZ 3.49Å; V245-F247 HydrophobicContact CG2-CE1 4.15Å; V245-F247 HydrophobicContact CG2-CE2 4.4Å; V245-F247 HydrophobicContact CG2-CZ 3.96Å; F247-H249 VanDerWaalsContact C-N 3.29Å; F247-H249 PolarHBondContact O-N 3.2Å; F247-L264 HydrophobicContact CB-CD2 4.06Å; F247-L264 HydrophobicContact CD1-CD2 3.89Å; F247-L264 HydrophobicContact CD2-CD2 3.21Å; F247-L264 HydrophobicContact CE1-CD2 4.1Å; F247-L264 HydrophobicContact CE2-CD2 3.47Å; F247-L264 VanDerWaalsContact CE2-CD2 3.47Å; F247-L264 HydrophobicContact CG-CD2 3.43Å; F247-L264 VanDerWaalsContact CG-CD2 3.43Å; F247-L264 HydrophobicContact CZ-CD2 3.91Å; F247-W284 HydrophobicContact CB-CD2 4.18Å; F247-W284 HydrophobicContact CB-CE3 4.44Å; F247-W284 HydrophobicContact CB-CG 4.48Å; F247-W284 HydrophobicContact CD1-CB 3.55Å; F247-W284 AromaticContact CD1-CD2 3.85Å; F247-W284 HydrophobicContact CD1-CD2 3.85Å; F247-W284 AromaticContact CD1-CE3 3.99Å; F247-W284 HydrophobicContact CD1-CE3 3.99Å; F247-W284 AromaticContact CD1-CG 3.67Å; F247-W284 HydrophobicContact CD1-CG 3.67Å; F247-W284 HydrophobicContact CE1-CB 3.69Å; F247-W284 HydrophobicContact CE1-CG 4.31Å; F247-W284 HydrophobicContact CG-CD2 4.45Å; F247-W284 HydrophobicContact CG-CG 4.36Å
248	G	92.7	Very high	91	Very high	53 Å²	53	52.8 Å²	52.8	55%	0.546	29%	0.291	S	S	.	.			trans	-77.7	71.6	-176.3	0	0	0	0	0	112.6
249	H	91.2	Very high	90.3	Very high	5 Å²	5	52.8 Å²	52.8	2%	0.023	29%	0.289	C	S	.	.			trans	-118.8	105.6	171.8	-166.9	178.3	0	0	0	109	G232 F247 V252 T266 C280 W284	G232-H249 WeakPolarHBondContact CA-O 3.23Å; G232-H249 PolarHBondContact N-O 2.74Å; F247-H249 VanDerWaalsContact C-N 3.29Å; F247-H249 PolarHBondContact O-N 3.2Å; H249-V252 HydrophobicContact CB-CG2 3.65Å; H249-V252 WeakPolarHBondContact O-CG2 3.5Å; H249-T266 WeakPolarHBondContact ND1-CB 3.38Å; H249-T266 PolarHBondContact ND1-OG1 2.87Å; H249-C280 PolarHBondContact CE1-O 3Å; H249-W284 HydrophobicContact CB-CZ2 3.93Å
250	P	90	Very high	89.9	Confident	74 Å²	74	48.9 Å²	48.9	48%	0.481	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	146.4	-179.5	-23.7	34.5	0	0	0	112.8	A230 V252 N268	A230-P250 WeakPolarHBondContact O-CA 3.45Å; P250-V252 VanDerWaalsContact C-N 3.29Å; P250-V252 PolarHBondContact O-N 2.72Å; P250-N268 PolarHBondContact O-ND2 2.92Å
251	L	87	Confident	90	Very high	99 Å²	99	42 Å²	42	52%	0.518	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	37.6	170.5	-55.3	176.5	0	0	0	114.8	A230 G253 N268	A230-L251 PolarHBondContact O-N 2.83Å; L251-G253 PolarHBondContact O-N 2.92Å; L251-G253 VanDerWaalsContact O-N 3.12Å; L251-N268 PolarHBondContact O-OD1 2.93Å
252	V	89.5	Confident	90.1	Very high	10 Å²	10	46.4 Å²	46.4	6%	0.061	27%	0.267	C	S	.	.			trans	-58.9	120.3	175.3	-174.9	0	0	0	0	110	I233 H249 P250 L254 F255 F267	I233-V252 HydrophobicContact CD1-CG1 4.13Å; I233-V252 HydrophobicContact CD1-CG2 4.48Å; I233-V252 HydrophobicContact CG1-CB 4.44Å; I233-V252 HydrophobicContact CG1-CG2 4.21Å; H249-V252 HydrophobicContact CB-CG2 3.65Å; H249-V252 WeakPolarHBondContact O-CG2 3.5Å; P250-V252 VanDerWaalsContact C-N 3.29Å; P250-V252 PolarHBondContact O-N 2.72Å; V252-L254 WeakPolarHBondContact CG1-O 3.42Å; V252-F255 HydrophobicContact CG1-CB 4.26Å; V252-F267 WeakPolarHBondContact CG1-O 3.16Å
253	G	86.2	Confident	90.2	Very high	59 Å²	59	42.9 Å²	42.9	61%	0.608	25%	0.247	S	C	*	.			trans	-86.5	-39.1	172.9	0	0	0	0	0	112.1	L251 F267	L251-G253 PolarHBondContact O-N 2.92Å; L251-G253 VanDerWaalsContact O-N 3.12Å; G253-F267 PolarHBondContact N-O 2.93Å
254	L	90.3	Very high	90.3	Very high	69 Å²	69	38.9 Å²	38.9	36%	0.361	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.2	-175.6	-59.8	172.1	0	0	0	111.1	V252 F267 W305	V252-L254 WeakPolarHBondContact CG1-O 3.42Å; L254-F267 HydrophobicContact CB-CB 4.33Å; L254-F267 HydrophobicContact CB-CD1 4.28Å; L254-F267 HydrophobicContact CD1-CD1 4.07Å; L254-F267 HydrophobicContact CG-CD1 4.47Å; L254-F267 PolarHBondContact N-O 2.81Å; L254-F267 PolarHBondContact O-N 2.82Å; L254-W305 HydrophobicContact CB-CD2 3.89Å; L254-W305 HydrophobicContact CB-CE3 4.07Å; L254-W305 HydrophobicContact CB-CG 4.38Å; L254-W305 HydrophobicContact CB-CH2 4.48Å; L254-W305 HydrophobicContact CB-CZ2 4.34Å; L254-W305 HydrophobicContact CB-CZ3 4.36Å; L254-W305 HydrophobicContact CD1-CB 3.92Å; L254-W305 HydrophobicContact CD1-CD2 4.01Å; L254-W305 HydrophobicContact CD1-CE3 4.08Å; L254-W305 HydrophobicContact CD1-CG 3.94Å
255	F	93.8	Very high	90.3	Very high	18 Å²	18	37.6 Å²	37.6	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	162.6	174	74.2	-84.7	0	0	0	111.5	Q217 A226 V228 I233 V252 I257 L264 V265 T266	Q217-F255 HydrophobicContact CB-CE2 3.95Å; Q217-F255 HydrophobicContact CB-CZ 3.65Å; A226-F255 HydrophobicContact CB-CE2 3.59Å; A226-F255 HydrophobicContact CB-CZ 3.84Å; V228-F255 HydrophobicContact CG2-CD1 3.89Å; V228-F255 HydrophobicContact CG2-CE1 3.39Å; V228-F255 HydrophobicContact CG2-CZ 4.28Å; I233-F255 HydrophobicContact CD1-CB 3.32Å; I233-F255 HydrophobicContact CD1-CD1 3.82Å; I233-F255 HydrophobicContact CD1-CD2 3.91Å; I233-F255 HydrophobicContact CD1-CG 3.41Å; I233-F255 VanDerWaalsContact CD1-CG 3.41Å; V252-F255 HydrophobicContact CG1-CB 4.26Å; F255-I257 HydrophobicContact CD2-CG1 4.33Å; F255-I257 HydrophobicContact CE2-CD1 4.29Å; F255-I257 HydrophobicContact CE2-CG1 4.29Å; F255-L264 HydrophobicContact CB-CD1 4.22Å; F255-L264 HydrophobicContact CD2-CD1 3.83Å; F255-L264 HydrophobicContact CG-CD1 4.46Å; F255-V265 CarbonylContact C-O 3.6Å; F255-V265 WeakPolarHBondContact CA-O 3.16Å; F255-V265 WeakPolarHBondContact CB-O 3.41Å; F255-T266 HydrophobicContact CB-CG2 4.32Å
256	D	92.4	Very high	90.4	Very high	38 Å²	38	36.6 Å²	36.6	20%	0.203	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	141.4	176	-166.4	16.6	0	0	0	110.4	I258 V265 W305	D256-I258 HydrophobicContact CB-CD1 4Å; D256-I258 HydrophobicContact CB-CG1 4.04Å; D256-V265 PolarHBondContact N-O 2.87Å; D256-V265 PolarHBondContact O-N 2.85Å; D256-W305 HydrophobicContact CB-CZ2 3.67Å
257	I	93.4	Very high	90.2	Very high	2 Å²	2	31 Å²	31	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.3	-177.6	-53.4	171.9	0	0	0	106.9	P220 A226 F235 F255 L264	P220-I257 WeakPolarHBondContact CD-O 3.34Å; P220-I257 WeakPolarHBondContact CG-O 3.43Å; A226-I257 HydrophobicContact CB-CD1 3.77Å; F235-I257 HydrophobicContact CE1-CD1 3.69Å; F235-I257 HydrophobicContact CE1-CG1 4.13Å; F235-I257 HydrophobicContact CZ-CD1 3.66Å; F235-I257 HydrophobicContact CZ-CG1 3.79Å; F235-I257 HydrophobicContact CZ-CG2 4.32Å; F255-I257 HydrophobicContact CD2-CG1 4.33Å; F255-I257 HydrophobicContact CE2-CD1 4.29Å; F255-I257 HydrophobicContact CE2-CG1 4.29Å; I257-L264 HydrophobicContact CG1-CD1 3.94Å
258	I	87.9	Confident	89.9	Confident	21 Å²	21	33 Å²	33	11%	0.108	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	168.2	-162	-42.5	174.5	0	0	0	110.1	D256 E261 Q262 Y263 V265 W310	D256-I258 HydrophobicContact CB-CD1 4Å; D256-I258 HydrophobicContact CB-CG1 4.04Å; I258-E261 PolarHBondContact O-N 3.47Å; I258-Q262 PolarHBondContact O-N 2.81Å; I258-Y263 PolarHBondContact N-O 3.34Å; I258-Y263 PolarHBondContact O-N 2.87Å; I258-V265 HydrophobicContact CD1-CB 4.33Å; I258-V265 HydrophobicContact CD1-CG2 3.68Å; I258-W310 HydrophobicContact CB-CD2 4.4Å; I258-W310 HydrophobicContact CB-CG 4.19Å; I258-W310 HydrophobicContact CD1-CG 4.11Å; I258-W310 VanDerWaalsContact CD1-NE1 3.26Å; I258-W310 HydrophobicContact CG2-CB 3.37Å; I258-W310 HydrophobicContact CG2-CD2 3.89Å; I258-W310 HydrophobicContact CG2-CG 3.31Å
259	S	74.9	Confident	89.3	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.042	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	46.3	170.5	-54.8	0	0	0	0	113.4	E261 Q262 G314	S259-E261 PolarHBondContact O-N 2.91Å; S259-Q262 WeakPolarHBondContact O-CB 3.48Å; S259-Q262 VanDerWaalsContact O-CG 3.25Å; S259-Q262 WeakPolarHBondContact O-CG 3.36Å; S259-Q262 PolarHBondContact O-N 2.86Å; S259-G314 VanDerWaalsContact CB-CA 3.41Å; S259-G314 WeakPolarHBondContact OG-CA 3.34Å
260	C	78	Confident	88.6	Confident	65 Å²	65	37.7 Å²	37.7	44%	0.439	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	43.5	-175.3	-64.8	0	0	0	0	112.1	Q262	C260-Q262 PolarHBondContact O-N 2.82Å
261	E	90.3	Very high	87.8	Confident	14 Å²	14	43.1 Å²	43.1	7%	0.065	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	21.6	178	-40.4	-179.7	148.7	0	0	115	S219 Q221 G222 T223 Y224 I258 S259 T286	S219-E261 WeakPolarHBondContact CB-OE1 3.42Å; S219-E261 PolarHBondContact OG-OE1 3.43Å; Q221-E261 VanDerWaalsContact CA-OE1 3.29Å; Q221-E261 WeakPolarHBondContact CA-OE1 2.93Å; Q221-E261 HydrophobicContact CB-CG 4.17Å; Q221-E261 VanDerWaalsContact CB-OE1 3.23Å; Q221-E261 WeakPolarHBondContact CB-OE1 3.21Å; Q221-E261 HydrophobicContact CG-CG 4.05Å; Q221-E261 PolarHBondContact N-OE1 2.91Å; G222-E261 PolarHBondContact N-OE1 2.88Å; T223-E261 WeakPolarHBondContact CB-OE2 3.4Å; T223-E261 PolarHBondContact N-OE1 3.27Å; T223-E261 VanDerWaalsContact N-OE1 3.11Å; T223-E261 PolarHBondContact OG1-OE1 2.84Å; T223-E261 PolarHBondContact OG1-OE2 2.78Å; Y224-E261 HydrophobicContact CE2-CB 4.5Å; I258-E261 PolarHBondContact O-N 3.47Å; S259-E261 PolarHBondContact O-N 2.91Å; E261-T286 WeakPolarHBondContact O-CB 3.22Å; E261-T286 WeakPolarHBondContact O-CG2 3.12Å; E261-T286 PolarHBondContact O-OG1 2.94Å
262	Q	92.2	Very high	86.8	Confident	94 Å²	94	41.4 Å²	41.4	44%	0.439	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-33.7	176.1	-69.8	-179.9	1.6	0	0	113.7	I258 S259 C260 T286	I258-Q262 PolarHBondContact O-N 2.81Å; S259-Q262 WeakPolarHBondContact O-CB 3.48Å; S259-Q262 VanDerWaalsContact O-CG 3.25Å; S259-Q262 WeakPolarHBondContact O-CG 3.36Å; S259-Q262 PolarHBondContact O-N 2.86Å; C260-Q262 PolarHBondContact O-N 2.82Å; Q262-T286 VanDerWaalsContact C-OG1 3.3Å; Q262-T286 PolarHBondContact O-N 3.04Å; Q262-T286 PolarHBondContact O-OG1 3.12Å
263	Y	94.8	Very high	85.2	Confident	17 Å²	17	50 Å²	50	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.2	-176.3	-55.8	-66.5	0	0	0	111.7	I258 I283 W284 T286 W310 T330 F333	I258-Y263 PolarHBondContact N-O 3.34Å; I258-Y263 PolarHBondContact O-N 2.87Å; Y263-I283 HydrophobicContact CD1-CG2 4.5Å; Y263-W284 CarbonylContact C-O 3.55Å; Y263-W284 VanDerWaalsContact CA-O 3.23Å; Y263-W284 WeakPolarHBondContact CA-O 3.06Å; Y263-T286 VanDerWaalsContact C-CG2 3.48Å; Y263-W310 AromaticContact CD2-CH2 3.78Å; Y263-W310 HydrophobicContact CD2-CH2 3.78Å; Y263-W310 AromaticContact CD2-CZ3 3.65Å; Y263-W310 HydrophobicContact CD2-CZ3 3.65Å; Y263-W310 HydrophobicContact CE2-CH2 4.43Å; Y263-W310 HydrophobicContact CE2-CZ3 4.1Å; Y263-W310 HydrophobicContact CG-CH2 4.12Å; Y263-W310 HydrophobicContact CG-CZ3 4.44Å; Y263-T330 HydrophobicContact CE2-CG2 3.94Å; Y263-F333 AromaticContact CD1-CZ 3.96Å; Y263-F333 HydrophobicContact CD1-CZ 3.96Å; Y263-F333 HydrophobicContact CE1-CE2 4.3Å; Y263-F333 AromaticContact CE1-CZ 3.6Å; Y263-F333 HydrophobicContact CE1-CZ 3.6Å; Y263-F333 AromaticContact CZ-CZ 3.99Å
264	L	95.1	Very high	83.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129	170.1	168.3	71.6	0	0	0	107.7	I233 F235 F247 F255 I257 T266 I283 W284 T286	I233-L264 HydrophobicContact CB-CD2 4.38Å; I233-L264 HydrophobicContact CD1-CD1 4.19Å; I233-L264 HydrophobicContact CD1-CD2 4.25Å; I233-L264 HydrophobicContact CG2-CD2 4.34Å; F235-L264 HydrophobicContact CE1-CD1 4.22Å; F235-L264 HydrophobicContact CE1-CD2 4.23Å; F235-L264 HydrophobicContact CZ-CB 4.15Å; F235-L264 HydrophobicContact CZ-CD1 4.02Å; F235-L264 HydrophobicContact CZ-CD2 4.09Å; F235-L264 HydrophobicContact CZ-CG 4.32Å; F247-L264 HydrophobicContact CB-CD2 4.06Å; F247-L264 HydrophobicContact CD1-CD2 3.89Å; F247-L264 HydrophobicContact CD2-CD2 3.21Å; F247-L264 HydrophobicContact CE1-CD2 4.1Å; F247-L264 HydrophobicContact CE2-CD2 3.47Å; F247-L264 VanDerWaalsContact CE2-CD2 3.47Å; F247-L264 HydrophobicContact CG-CD2 3.43Å; F247-L264 VanDerWaalsContact CG-CD2 3.43Å; F247-L264 HydrophobicContact CZ-CD2 3.91Å; F255-L264 HydrophobicContact CB-CD1 4.22Å; F255-L264 HydrophobicContact CD2-CD1 3.83Å; F255-L264 HydrophobicContact CG-CD1 4.46Å; I257-L264 HydrophobicContact CG1-CD1 3.94Å; L264-T266 HydrophobicContact CD1-CG2 4.16Å; L264-T266 HydrophobicContact CD2-CG2 3.76Å; L264-T266 HydrophobicContact CG-CG2 3.73Å; L264-I283 CarbonylContact O-C 3.57Å; L264-I283 WeakPolarHBondContact O-CA 3.42Å; L264-W284 HydrophobicContact CB-CB 4.3Å; L264-W284 PolarHBondContact N-O 3.09Å; L264-W284 PolarHBondContact O-N 2.95Å; L264-T286 HydrophobicContact CB-CG2 4.08Å
265	V	94.2	Very high	82	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.7	170.4	-173.8	0	0	0	0	107.9	F255 D256 I258 L281 K282 I283 W305 L308 W310	F255-V265 CarbonylContact C-O 3.6Å; F255-V265 WeakPolarHBondContact CA-O 3.16Å; F255-V265 WeakPolarHBondContact CB-O 3.41Å; D256-V265 PolarHBondContact N-O 2.87Å; D256-V265 PolarHBondContact O-N 2.85Å; I258-V265 HydrophobicContact CD1-CB 4.33Å; I258-V265 HydrophobicContact CD1-CG2 3.68Å; V265-L281 HydrophobicContact CG1-CD1 3.58Å; V265-L281 HydrophobicContact CG1-CG 4.22Å; V265-K282 WeakPolarHBondContact CA-O 3.31Å; V265-I283 HydrophobicContact CG2-CG1 4.28Å; V265-W305 HydrophobicContact CB-CH2 4.48Å; V265-W305 HydrophobicContact CG1-CH2 3.98Å; V265-L308 HydrophobicContact CG1-CD1 4.26Å; V265-W310 HydrophobicContact CG2-CZ2 4.14Å
266	T	94	Very high	80	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.8	179	58.6	0	0	0	0	110.1	I233 H249 F255 L264 L281 K282 W284	I233-T266 HydrophobicContact CD1-CG2 3.45Å; I233-T266 VanDerWaalsContact CD1-CG2 3.45Å; I233-T266 HydrophobicContact CG1-CG2 4.29Å; H249-T266 WeakPolarHBondContact ND1-CB 3.38Å; H249-T266 PolarHBondContact ND1-OG1 2.87Å; F255-T266 HydrophobicContact CB-CG2 4.32Å; L264-T266 HydrophobicContact CD1-CG2 4.16Å; L264-T266 HydrophobicContact CD2-CG2 3.76Å; L264-T266 HydrophobicContact CG-CG2 3.73Å; T266-L281 WeakPolarHBondContact O-CA 3.4Å; T266-K282 PolarHBondContact N-O 2.99Å; T266-K282 PolarHBondContact O-N 2.91Å; T266-K282 PolarHBondContact OG1-O 2.73Å; T266-W284 PolarHBondContact OG1-NE1 2.97Å
267	F	91.3	Very high	78.5	Confident	3 Å²	3	63.4 Å²	63.4	1%	0.013	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.9	-178.4	176.9	-111.4	0	0	0	111.4	V252 G253 L254 E269 C280 L281 F297 W305 Y307	V252-F267 WeakPolarHBondContact CG1-O 3.16Å; G253-F267 PolarHBondContact N-O 2.93Å; L254-F267 HydrophobicContact CB-CB 4.33Å; L254-F267 HydrophobicContact CB-CD1 4.28Å; L254-F267 HydrophobicContact CD1-CD1 4.07Å; L254-F267 HydrophobicContact CG-CD1 4.47Å; L254-F267 PolarHBondContact N-O 2.81Å; L254-F267 PolarHBondContact O-N 2.82Å; F267-E269 HydrophobicContact CE1-CB 3.85Å; F267-E269 HydrophobicContact CE1-CG 4.4Å; F267-E269 HydrophobicContact CZ-CB 4.04Å; F267-E269 HydrophobicContact CZ-CG 4.34Å; F267-C280 WeakPolarHBondContact CA-O 3.38Å; F267-C280 HydrophobicContact CD2-CB 4.32Å; F267-C280 HydrophobicContact CE2-CB 3.97Å; F267-L281 HydrophobicContact CB-CD1 3.89Å; F267-L281 HydrophobicContact CD2-CB 4.35Å; F267-L281 HydrophobicContact CD2-CD1 4.12Å; F267-L281 HydrophobicContact CG-CD1 4.4Å; F267-F297 AromaticContact CE2-CD2 3.52Å; F267-F297 HydrophobicContact CE2-CD2 3.52Å; F267-F297 HydrophobicContact CE2-CE2 4.05Å; F267-F297 HydrophobicContact CE2-CG 4.37Å; F267-F297 AromaticContact CZ-CD2 3.54Å; F267-F297 HydrophobicContact CZ-CD2 3.54Å; F267-F297 AromaticContact CZ-CE2 3.58Å; F267-F297 HydrophobicContact CZ-CE2 3.58Å; F267-F297 HydrophobicContact CZ-CG 4.5Å; F267-W305 HydrophobicContact CB-CE3 4.42Å; F267-W305 HydrophobicContact CB-CH2 4.05Å; F267-W305 HydrophobicContact CB-CZ3 3.62Å; F267-W305 HydrophobicContact CG-CZ3 4.26Å; F267-Y307 AromaticContact CD1-CE2 3.85Å; F267-Y307 HydrophobicContact CD1-CE2 3.85Å; F267-Y307 HydrophobicContact CD2-CE2 4.03Å; F267-Y307 AromaticContact CE1-CE2 3.86Å; F267-Y307 HydrophobicContact CE1-CE2 3.86Å; F267-Y307 HydrophobicContact CE2-CE2 4.07Å; F267-Y307 AromaticContact CG-CE2 3.92Å; F267-Y307 HydrophobicContact CG-CE2 3.92Å; F267-Y307 AromaticContact CZ-CE2 3.98Å; F267-Y307 HydrophobicContact CZ-CE2 3.98Å
268	N	87.8	Confident	77.1	Confident	43 Å²	43	66.3 Å²	66.3	23%	0.23	36%	0.356	C	S	.	.			trans	-114	125.3	168	-178.9	7.7	0	0	0	108.1	P250 L251 C280	P250-N268 PolarHBondContact O-ND2 2.92Å; L251-N268 PolarHBondContact O-OD1 2.93Å; N268-C280 PolarHBondContact N-O 3.14Å; N268-C280 WeakPolarHBondContact O-CB 3.14Å
269	E	80.8	Confident	76.4	Confident	129 Å²	129	69.1 Å²	69.1	60%	0.603	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-78.2	122.2	177.7	-169.5	172.9	-170.6	0	0	109.2	F267 K271	F267-E269 HydrophobicContact CE1-CB 3.85Å; F267-E269 HydrophobicContact CE1-CG 4.4Å; F267-E269 HydrophobicContact CZ-CB 4.04Å; F267-E269 HydrophobicContact CZ-CG 4.34Å; E269-K271 PolarHBondContact O-N 2.84Å
270	P	77	Confident	76.9	Confident	27 Å²	27	69 Å²	69	18%	0.175	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-63.7	131	-178	24.1	-30.2	0	0	0	110.3	V277 F297	P270-V277 HydrophobicContact CB-CB 4.29Å; P270-V277 HydrophobicContact CB-CG2 3.99Å; P270-F297 HydrophobicContact CG-CB 4.12Å; P270-F297 HydrophobicContact CG-CD1 3.56Å; P270-F297 HydrophobicContact CG-CE1 4.16Å; P270-F297 HydrophobicContact CG-CG 3.99Å
271	K	72	Confident	77.5	Confident	188 Å²	188	66.3 Å²	66.3	82%	0.817	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-91.1	116.1	175.1	-64.2	-175.1	-179.1	-177.9	0	109	E269	E269-K271 PolarHBondContact O-N 2.84Å
272	G	66	Low	77.6	Confident	63 Å²	63	67 Å²	67	65%	0.649	36%	0.355	S	S	*	.	S	Bend	trans	126.6	-169.9	174.5	0	0	0	0	0	114.4
273	Q	56.4	Low	77.7	Confident	192 Å²	192	62.5 Å²	62.5	90%	0.897	33%	0.334	S	S	*	.	S	Bend	trans	-82.8	-16.8	178.4	-75.1	-172.9	0.4	0	0	113.7	K275	Q273-K275 VanDerWaalsContact C-N 3.31Å; Q273-K275 PolarHBondContact O-N 3.36Å
274	D	54.8	Low	77.7	Confident	135 Å²	135	62.7 Å²	62.7	72%	0.722	33%	0.334	S	S	*	.			trans	-73.3	88.2	171.6	-86.7	-31.7	0	0	0	109.9	D276 V277	D274-D276 VanDerWaalsContact C-N 3.27Å; D274-V277 HydrophobicContact CB-CG2 4.39Å; D274-V277 WeakPolarHBondContact O-CG2 3.21Å
275	K	53.9	Low	77.6	Confident	127 Å²	127	63.7 Å²	63.7	55%	0.552	34%	0.34	S	S	*	.			trans	-77.5	-14.5	178.8	-68.6	-177.1	180	179.7	0	112.9	Q273	Q273-K275 VanDerWaalsContact C-N 3.31Å; Q273-K275 PolarHBondContact O-N 3.36Å
276	D	53.5	Low	77.6	Confident	139 Å²	139	63.9 Å²	63.9	74%	0.743	34%	0.341	S	S	*	.			trans	-102.4	42.5	-178.2	-69.1	-28.1	0	0	0	112.3	D274 A278	D274-D276 VanDerWaalsContact C-N 3.27Å; D276-A278 PolarHBondContact O-N 3.32Å
277	V	60.2	Low	77.3	Confident	63 Å²	63	73.3 Å²	73.3	38%	0.382	38%	0.377	S	S	.	.			trans	-70.3	115.6	167.7	-176.3	0	0	0	0	107.9	P270 D274 D279 C280	P270-V277 HydrophobicContact CB-CB 4.29Å; P270-V277 HydrophobicContact CB-CG2 3.99Å; D274-V277 HydrophobicContact CB-CG2 4.39Å; D274-V277 WeakPolarHBondContact O-CG2 3.21Å; V277-D279 PolarHBondContact O-N 2.95Å; V277-C280 PolarHBondContact O-SG 2.83Å; V277-C280 VanDerWaalsContact O-SG 3.36Å
278	A	64.1	Low	77.1	Confident	63 Å²	63	75.2 Å²	75.2	52%	0.521	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.3	-172.8	0	0	0	0	0	114.3	D276 V294 F295 P296	D276-A278 PolarHBondContact O-N 3.32Å; A278-V294 VanDerWaalsContact O-CG1 3.3Å; A278-V294 WeakPolarHBondContact O-CG1 3.07Å; A278-F295 CarbonylContact O-C 3.54Å; A278-P296 WeakPolarHBondContact O-CA 3.14Å
279	D	73.3	Confident	77.3	Confident	80 Å²	80	74 Å²	74	43%	0.428	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	20.3	-160.8	-96.4	36.8	0	0	0	115.6	V277 K282	V277-D279 PolarHBondContact O-N 2.95Å; D279-K282 WeakPolarHBondContact O-CE 3.45Å; D279-K282 IonicContact OD2-NZ 3.51Å; D279-K282 PolarHBondContact OD2-NZ 2.79Å; D279-K282 VanDerWaalsContact OD2-NZ 3.09Å
280	C	85.4	Confident	77.8	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.034	37%	0.372	C	S	.	.	S	Bend	trans	-77	-36.6	-172.2	-63.8	0	0	0	0	114.5	H249 F267 N268 V277 F297	H249-C280 PolarHBondContact CE1-O 3Å; F267-C280 WeakPolarHBondContact CA-O 3.38Å; F267-C280 HydrophobicContact CD2-CB 4.32Å; F267-C280 HydrophobicContact CE2-CB 3.97Å; N268-C280 PolarHBondContact N-O 3.14Å; N268-C280 WeakPolarHBondContact O-CB 3.14Å; V277-C280 PolarHBondContact O-SG 2.83Å; V277-C280 VanDerWaalsContact O-SG 3.36Å; C280-F297 HydrophobicContact CB-CB 3.68Å
281	L	89.8	Confident	78.5	Confident	8 Å²	8	73 Å²	73	4%	0.042	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.5	-176	-173.5	73.2	0	0	0	110.3	V265 T266 F267 V294 F295 W305 Y307 L308	V265-L281 HydrophobicContact CG1-CD1 3.58Å; V265-L281 HydrophobicContact CG1-CG 4.22Å; T266-L281 WeakPolarHBondContact O-CA 3.4Å; F267-L281 HydrophobicContact CB-CD1 3.89Å; F267-L281 HydrophobicContact CD2-CB 4.35Å; F267-L281 HydrophobicContact CD2-CD1 4.12Å; F267-L281 HydrophobicContact CG-CD1 4.4Å; L281-V294 CarbonylContact O-C 3.6Å; L281-V294 WeakPolarHBondContact O-CA 3.4Å; L281-F295 HydrophobicContact CB-CB 4.11Å; L281-F295 WeakPolarHBondContact CB-O 3.18Å; L281-F295 HydrophobicContact CD2-CB 4.01Å; L281-F295 HydrophobicContact CD2-CD2 4.34Å; L281-F295 HydrophobicContact CD2-CG 4.48Å; L281-F295 HydrophobicContact CG-CB 4.47Å; L281-F295 PolarHBondContact N-O 2.89Å; L281-F295 VanDerWaalsContact N-O 3.13Å; L281-F295 PolarHBondContact O-N 2.86Å; L281-W305 HydrophobicContact CD1-CH2 4.41Å; L281-W305 HydrophobicContact CD1-CZ3 4.09Å; L281-Y307 HydrophobicContact CD1-CD2 4.49Å; L281-L308 HydrophobicContact CD2-CD1 3.76Å; L281-L308 HydrophobicContact CD2-CD2 4.27Å; L281-L308 HydrophobicContact CD2-CG 3.89Å
282	K	92.3	Very high	79.5	Confident	28 Å²	28	68 Å²	68	12%	0.122	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.2	-175.1	-61.6	-172.7	-176.7	-166.1	0	111	V265 T266 D279 W284 L291 V294	V265-K282 WeakPolarHBondContact CA-O 3.31Å; T266-K282 PolarHBondContact N-O 2.99Å; T266-K282 PolarHBondContact O-N 2.91Å; T266-K282 PolarHBondContact OG1-O 2.73Å; D279-K282 WeakPolarHBondContact O-CE 3.45Å; D279-K282 IonicContact OD2-NZ 3.51Å; D279-K282 PolarHBondContact OD2-NZ 2.79Å; D279-K282 VanDerWaalsContact OD2-NZ 3.09Å; K282-W284 HydrophobicContact CB-CZ2 3.88Å; K282-W284 HydrophobicContact CD-CH2 4.33Å; K282-W284 HydrophobicContact CD-CZ2 3.7Å; K282-W284 HydrophobicContact CG-CZ2 4.39Å; K282-L291 HydrophobicContact CB-CD1 3.69Å; K282-L291 HydrophobicContact CD-CD1 4.18Å; K282-L291 HydrophobicContact CG-CD1 4.12Å; K282-V294 HydrophobicContact CG-CG1 4.36Å; K282-V294 HydrophobicContact CG-CG2 4.28Å
283	I	94.2	Very high	80.7	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.6	174.4	-50.5	179.3	0	0	0	109	Y263 L264 V265 K292 R293 F295 L308 W310 F317 F333	Y263-I283 HydrophobicContact CD1-CG2 4.5Å; L264-I283 CarbonylContact O-C 3.57Å; L264-I283 WeakPolarHBondContact O-CA 3.42Å; V265-I283 HydrophobicContact CG2-CG1 4.28Å; I283-K292 PolarHBondContact O-N 2.93Å; I283-R293 HydrophobicContact CB-CB 4.32Å; I283-R293 HydrophobicContact CD1-CB 4.26Å; I283-R293 HydrophobicContact CG1-CB 4.47Å; I283-R293 PolarHBondContact N-O 2.96Å; I283-R293 PolarHBondContact O-N 2.88Å; I283-F295 HydrophobicContact CD1-CD2 4.27Å; I283-F295 HydrophobicContact CD1-CE2 3.75Å; I283-L308 HydrophobicContact CD1-CD1 3.79Å; I283-L308 HydrophobicContact CG1-CD1 4.28Å; I283-W310 HydrophobicContact CD1-CZ2 4.13Å; I283-W310 HydrophobicContact CG2-CH2 4.4Å; I283-W310 HydrophobicContact CG2-CZ2 4.31Å; I283-F317 HydrophobicContact CD1-CE1 4.45Å; I283-F317 HydrophobicContact CD1-CE2 4.35Å; I283-F317 HydrophobicContact CD1-CZ 4.07Å; I283-F333 HydrophobicContact CB-CE1 4.4Å; I283-F333 HydrophobicContact CD1-CD1 4.19Å; I283-F333 HydrophobicContact CD1-CE1 4.17Å; I283-F333 HydrophobicContact CG2-CE1 3.78Å; I283-F333 HydrophobicContact CG2-CZ 4.28Å
284	W	94.9	Very high	82.3	Confident	20 Å²	20	63 Å²	63	8%	0.076	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148	-177.6	-46.4	82	0	0	0	110.2	F247 H249 Y263 L264 T266 K282 D290 L291	F247-W284 HydrophobicContact CB-CD2 4.18Å; F247-W284 HydrophobicContact CB-CE3 4.44Å; F247-W284 HydrophobicContact CB-CG 4.48Å; F247-W284 HydrophobicContact CD1-CB 3.55Å; F247-W284 AromaticContact CD1-CD2 3.85Å; F247-W284 HydrophobicContact CD1-CD2 3.85Å; F247-W284 AromaticContact CD1-CE3 3.99Å; F247-W284 HydrophobicContact CD1-CE3 3.99Å; F247-W284 AromaticContact CD1-CG 3.67Å; F247-W284 HydrophobicContact CD1-CG 3.67Å; F247-W284 HydrophobicContact CE1-CB 3.69Å; F247-W284 HydrophobicContact CE1-CG 4.31Å; F247-W284 HydrophobicContact CG-CD2 4.45Å; F247-W284 HydrophobicContact CG-CG 4.36Å; H249-W284 HydrophobicContact CB-CZ2 3.93Å; Y263-W284 CarbonylContact C-O 3.55Å; Y263-W284 VanDerWaalsContact CA-O 3.23Å; Y263-W284 WeakPolarHBondContact CA-O 3.06Å; L264-W284 HydrophobicContact CB-CB 4.3Å; L264-W284 PolarHBondContact N-O 3.09Å; L264-W284 PolarHBondContact O-N 2.95Å; T266-W284 PolarHBondContact OG1-NE1 2.97Å; K282-W284 HydrophobicContact CB-CZ2 3.88Å; K282-W284 HydrophobicContact CD-CH2 4.33Å; K282-W284 HydrophobicContact CD-CZ2 3.7Å; K282-W284 HydrophobicContact CG-CZ2 4.39Å; W284-D290 WeakPolarHBondContact CA-O 3.26Å; W284-L291 HydrophobicContact CD2-CD1 4Å; W284-L291 HydrophobicContact CE3-CB 3.87Å; W284-L291 HydrophobicContact CE3-CD1 4.07Å; W284-L291 HydrophobicContact CH2-CB 4.4Å; W284-L291 HydrophobicContact CH2-CD1 4.08Å; W284-L291 HydrophobicContact CZ2-CD1 3.99Å; W284-L291 HydrophobicContact CZ3-CB 3.77Å; W284-L291 HydrophobicContact CZ3-CD1 4.12Å; W284-L291 HydrophobicContact CZ3-CG 4.44Å
285	D	94.1	Very high	83.7	Confident	22 Å²	22	57.3 Å²	57.3	12%	0.118	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	122.6	165	173.3	-47.3	0	0	0	108.8	R287 T288 G289 D290 K292	D285-R287 VanDerWaalsContact C-N 3.32Å; D285-R287 PolarHBondContact O-N 3.01Å; D285-R287 PolarHBondContact OD1-N 2.87Å; D285-T288 VanDerWaalsContact CB-OG1 3.27Å; D285-T288 WeakPolarHBondContact CB-OG1 3.23Å; D285-T288 PolarHBondContact OD1-N 3.03Å; D285-T288 PolarHBondContact OD1-OG1 3.2Å; D285-T288 PolarHBondContact OD2-OG1 2.8Å; D285-G289 VanDerWaalsContact O-CA 3.27Å; D285-G289 WeakPolarHBondContact O-CA 3.38Å; D285-G289 PolarHBondContact O-N 2.81Å; D285-D290 PolarHBondContact N-O 3.03Å; D285-K292 HydrophobicContact CB-CD 4.27Å; D285-K292 HydrophobicContact CB-CG 3.97Å; D285-K292 WeakPolarHBondContact OD2-CE 3.27Å; D285-K292 IonicContact OD2-NZ 2.82Å
286	T	93.1	Very high	85	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.037	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.5	-171.1	55.2	0	0	0	0	113.1	F235 E261 Q262 Y263 L264	F235-T286 HydrophobicContact CE2-CG2 3.68Å; F235-T286 HydrophobicContact CZ-CG2 4.27Å; E261-T286 WeakPolarHBondContact O-CB 3.22Å; E261-T286 WeakPolarHBondContact O-CG2 3.12Å; E261-T286 PolarHBondContact O-OG1 2.94Å; Q262-T286 VanDerWaalsContact C-OG1 3.3Å; Q262-T286 PolarHBondContact O-N 3.04Å; Q262-T286 PolarHBondContact O-OG1 3.12Å; Y263-T286 VanDerWaalsContact C-CG2 3.48Å; L264-T286 HydrophobicContact CB-CG2 4.08Å
287	R	88.1	Confident	86.1	Confident	199 Å²	199	48.2 Å²	48.2	75%	0.751	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-40.9	-176.5	-177.9	176.8	62	94.9	3.4	111.1	D285	D285-R287 VanDerWaalsContact C-N 3.32Å; D285-R287 PolarHBondContact O-N 3.01Å; D285-R287 PolarHBondContact OD1-N 2.87Å
288	T	88.2	Confident	86.7	Confident	42 Å²	42	46.6 Å²	46.6	26%	0.258	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-25.4	-177.3	56.7	0	0	0	0	113.1	D285 D290	D285-T288 VanDerWaalsContact CB-OG1 3.27Å; D285-T288 WeakPolarHBondContact CB-OG1 3.23Å; D285-T288 PolarHBondContact OD1-N 3.03Å; D285-T288 PolarHBondContact OD1-OG1 3.2Å; D285-T288 PolarHBondContact OD2-OG1 2.8Å; T288-D290 PolarHBondContact O-N 3.18Å; T288-D290 PolarHBondContact OG1-N 2.62Å
289	G	90.6	Very high	87.1	Confident	17 Å²	17	46.8 Å²	46.8	18%	0.175	23%	0.234	C	C	.	.			trans	77.9	2	-169.8	0	0	0	0	0	113.6	D285	D285-G289 VanDerWaalsContact O-CA 3.27Å; D285-G289 WeakPolarHBondContact O-CA 3.38Å; D285-G289 PolarHBondContact O-N 2.81Å
290	D	91.2	Very high	86.8	Confident	57 Å²	57	46.5 Å²	46.5	31%	0.305	23%	0.232	S	C	.	.			trans	-78.8	138.8	-172.8	-63.9	-22.3	0	0	0	111.4	R160 W284 D285 T288 K292	R160-D290 IonicContact CZ-OD1 2.69Å; R160-D290 IonicContact NH1-OD1 2.72Å; R160-D290 IonicContact NH2-OD1 3.27Å; R160-D290 PolarHBondContact NH2-OD1 2.79Å; R160-D290 IonicContact NH2-OD2 3.08Å; W284-D290 WeakPolarHBondContact CA-O 3.26Å; D285-D290 PolarHBondContact N-O 3.03Å; T288-D290 PolarHBondContact O-N 3.18Å; T288-D290 PolarHBondContact OG1-N 2.62Å; D290-K292 PolarHBondContact O-N 2.6Å
291	L	93.4	Very high	86	Confident	78 Å²	78	47.4 Å²	47.4	41%	0.408	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	120.7	171.5	-178.4	64.4	0	0	0	109.5	K282 W284 V294	K282-L291 HydrophobicContact CB-CD1 3.69Å; K282-L291 HydrophobicContact CD-CD1 4.18Å; K282-L291 HydrophobicContact CG-CD1 4.12Å; W284-L291 HydrophobicContact CD2-CD1 4Å; W284-L291 HydrophobicContact CE3-CB 3.87Å; W284-L291 HydrophobicContact CE3-CD1 4.07Å; W284-L291 HydrophobicContact CH2-CB 4.4Å; W284-L291 HydrophobicContact CH2-CD1 4.08Å; W284-L291 HydrophobicContact CZ2-CD1 3.99Å; W284-L291 HydrophobicContact CZ3-CB 3.77Å; W284-L291 HydrophobicContact CZ3-CD1 4.12Å; W284-L291 HydrophobicContact CZ3-CG 4.44Å; L291-V294 HydrophobicContact CD1-CG2 4.16Å; L291-V294 HydrophobicContact CD2-CG2 3.8Å; L291-V294 HydrophobicContact CG-CG2 4.22Å
292	K	92.7	Very high	84.8	Confident	83 Å²	83	47.7 Å²	47.7	36%	0.361	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-40.5	-177.9	-64.3	-61.5	-178	-173.5	0	113.3	I283 D285 D290 F333	I283-K292 PolarHBondContact O-N 2.93Å; D285-K292 HydrophobicContact CB-CD 4.27Å; D285-K292 HydrophobicContact CB-CG 3.97Å; D285-K292 WeakPolarHBondContact OD2-CE 3.27Å; D285-K292 IonicContact OD2-NZ 2.82Å; D290-K292 PolarHBondContact O-N 2.6Å; K292-F333 HydrophobicContact CB-CD2 3.93Å; K292-F333 HydrophobicContact CB-CE1 4.28Å; K292-F333 HydrophobicContact CB-CE2 3.43Å; K292-F333 VanDerWaalsContact CB-CE2 3.43Å; K292-F333 HydrophobicContact CB-CZ 3.62Å; K292-F333 HydrophobicContact CD-CE2 4.21Å; K292-F333 HydrophobicContact CG-CE2 3.78Å; K292-F333 HydrophobicContact CG-CZ 3.98Å
293	R	90.7	Very high	83.9	Confident	107 Å²	107	53.2 Å²	53.2	40%	0.404	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	147.9	-176.1	-163.4	67.2	-178.7	-173.6	3.5	111.3	I283 F295 F333	I283-R293 HydrophobicContact CB-CB 4.32Å; I283-R293 HydrophobicContact CD1-CB 4.26Å; I283-R293 HydrophobicContact CG1-CB 4.47Å; I283-R293 PolarHBondContact N-O 2.96Å; I283-R293 PolarHBondContact O-N 2.88Å; R293-F295 HydrophobicContact CB-CE2 4.37Å; R293-F295 HydrophobicContact CG-CD2 4.17Å; R293-F295 HydrophobicContact CG-CE2 3.59Å; R293-F295 HydrophobicContact CG-CZ 3.93Å; R293-F333 HydrophobicContact CB-CB 4.11Å; R293-F333 HydrophobicContact CB-CD1 3.96Å; R293-F333 HydrophobicContact CB-CG 4.05Å; R293-F333 HydrophobicContact CG-CB 4.09Å
294	V	89.8	Confident	83	Confident	43 Å²	43	61.4 Å²	61.4	26%	0.261	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141	172.7	-173.4	0	0	0	0	108.3	A278 L281 K282 L291	A278-V294 VanDerWaalsContact O-CG1 3.3Å; A278-V294 WeakPolarHBondContact O-CG1 3.07Å; L281-V294 CarbonylContact O-C 3.6Å; L281-V294 WeakPolarHBondContact O-CA 3.4Å; K282-V294 HydrophobicContact CG-CG1 4.36Å; K282-V294 HydrophobicContact CG-CG2 4.28Å; L291-V294 HydrophobicContact CD1-CG2 4.16Å; L291-V294 HydrophobicContact CD2-CG2 3.8Å; L291-V294 HydrophobicContact CG-CG2 4.22Å
295	F	85.5	Confident	82.5	Confident	17 Å²	17	63.9 Å²	63.9	8%	0.075	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.9	171.5	-69.8	-83.9	0	0	0	109.4	A278 L281 I283 R293 L308 F317 F319 F328	A278-F295 CarbonylContact O-C 3.54Å; L281-F295 HydrophobicContact CB-CB 4.11Å; L281-F295 WeakPolarHBondContact CB-O 3.18Å; L281-F295 HydrophobicContact CD2-CB 4.01Å; L281-F295 HydrophobicContact CD2-CD2 4.34Å; L281-F295 HydrophobicContact CD2-CG 4.48Å; L281-F295 HydrophobicContact CG-CB 4.47Å; L281-F295 PolarHBondContact N-O 2.89Å; L281-F295 VanDerWaalsContact N-O 3.13Å; L281-F295 PolarHBondContact O-N 2.86Å; I283-F295 HydrophobicContact CD1-CD2 4.27Å; I283-F295 HydrophobicContact CD1-CE2 3.75Å; R293-F295 HydrophobicContact CB-CE2 4.37Å; R293-F295 HydrophobicContact CG-CD2 4.17Å; R293-F295 HydrophobicContact CG-CE2 3.59Å; R293-F295 HydrophobicContact CG-CZ 3.93Å; F295-L308 HydrophobicContact CD2-CD1 4.47Å; F295-L308 HydrophobicContact CE2-CD1 4.46Å; F295-F317 AromaticContact CE2-CE2 3.89Å; F295-F317 HydrophobicContact CE2-CE2 3.89Å; F295-F317 AromaticContact CE2-CZ 4Å; F295-F317 HydrophobicContact CE2-CZ 4Å; F295-F317 AromaticContact CZ-CE2 3.76Å; F295-F317 HydrophobicContact CZ-CE2 3.76Å; F295-F317 AromaticContact CZ-CZ 3.88Å; F295-F317 HydrophobicContact CZ-CZ 3.88Å; F295-F319 HydrophobicContact CE1-CE1 4.11Å; F295-F328 HydrophobicContact CE1-CE1 4.1Å; F295-F328 HydrophobicContact CE1-CE2 4.41Å; F295-F328 AromaticContact CE1-CZ 3.87Å; F295-F328 HydrophobicContact CE1-CZ 3.87Å; F295-F328 HydrophobicContact CZ-CD1 4.39Å; F295-F328 HydrophobicContact CZ-CE1 4.09Å; F295-F328 HydrophobicContact CZ-CE2 4.48Å; F295-F328 HydrophobicContact CZ-CZ 4.15Å
296	P	80.8	Confident	82.2	Confident	55 Å²	55	65.3 Å²	65.3	36%	0.357	32%	0.32	S	S	.	.			trans	-66.8	154.9	173.4	29.8	-35.2	0	0	0	110.4	A278	A278-P296 WeakPolarHBondContact O-CA 3.14Å
297	F	76.5	Confident	81.8	Confident	20 Å²	20	66.6 Å²	66.6	9%	0.088	32%	0.324	C	S	.	.			trans	-70.3	133.3	168.2	179.6	-117.3	0	0	0	110	F267 P270 C280 C302	F267-F297 AromaticContact CE2-CD2 3.52Å; F267-F297 HydrophobicContact CE2-CD2 3.52Å; F267-F297 HydrophobicContact CE2-CE2 4.05Å; F267-F297 HydrophobicContact CE2-CG 4.37Å; F267-F297 AromaticContact CZ-CD2 3.54Å; F267-F297 HydrophobicContact CZ-CD2 3.54Å; F267-F297 AromaticContact CZ-CE2 3.58Å; F267-F297 HydrophobicContact CZ-CE2 3.58Å; F267-F297 HydrophobicContact CZ-CG 4.5Å; P270-F297 HydrophobicContact CG-CB 4.12Å; P270-F297 HydrophobicContact CG-CD1 3.56Å; P270-F297 HydrophobicContact CG-CE1 4.16Å; P270-F297 HydrophobicContact CG-CG 3.99Å; C280-F297 HydrophobicContact CB-CB 3.68Å; F297-C302 HydrophobicContact CD2-CB 3.91Å; F297-C302 HydrophobicContact CE2-CB 3.5Å; F297-C302 HydrophobicContact CZ-CB 4.45Å
298	M	72.7	Confident	81.9	Confident	28 Å²	28	57.6 Å²	57.6	14%	0.138	29%	0.291	C	S	.	.			trans	-133.9	102.3	177.8	-73.2	178.9	-73.7	0	0	108	N300 V301 C302 F319	M298-N300 PolarHBondContact O-N 3Å; M298-N300 VanDerWaalsContact O-N 3.12Å; M298-V301 HydrophobicContact CB-CB 3.92Å; M298-V301 HydrophobicContact CB-CG2 3.85Å; M298-V301 HydrophobicContact CE-CG2 4.22Å; M298-V301 WeakPolarHBondContact O-CB 3.48Å; M298-V301 PolarHBondContact O-N 3.3Å; M298-V301 HydrophobicContact SD-CG2 4.22Å; M298-C302 WeakPolarHBondContact O-CB 3.03Å; M298-C302 PolarHBondContact O-N 3.19Å; M298-F319 HydrophobicContact CE-CE2 4.38Å
299	S	71.2	Confident	82.1	Confident	68 Å²	68	58 Å²	58	48%	0.476	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.3	-172.3	60.3	0	0	0	0	114.3
300	N	68.6	Low	82.3	Confident	73 Å²	73	58.4 Å²	58.4	39%	0.39	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-27.8	173.8	58	-32.3	0	0	0	113.2	M298 K303 D322	M298-N300 PolarHBondContact O-N 3Å; M298-N300 VanDerWaalsContact O-N 3.12Å; N300-K303 WeakPolarHBondContact O-CE 3.25Å; N300-D322 PolarHBondContact ND2-OD1 3.19Å; N300-D322 PolarHBondContact ND2-OD2 3.34Å
301	V	67.1	Low	82.4	Confident	24 Å²	24	56 Å²	56	15%	0.145	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-45.1	179.4	175.1	0	0	0	0	110.7	M298 K303 F319 I320 R321	M298-V301 HydrophobicContact CB-CB 3.92Å; M298-V301 HydrophobicContact CB-CG2 3.85Å; M298-V301 HydrophobicContact CE-CG2 4.22Å; M298-V301 WeakPolarHBondContact O-CB 3.48Å; M298-V301 PolarHBondContact O-N 3.3Å; M298-V301 HydrophobicContact SD-CG2 4.22Å; V301-K303 VanDerWaalsContact C-N 3.3Å; V301-K303 PolarHBondContact O-N 3.43Å; V301-F319 HydrophobicContact CG1-CD2 3.7Å; V301-F319 HydrophobicContact CG1-CE2 4.32Å; V301-F319 HydrophobicContact CG1-CG 4.42Å; V301-I320 WeakPolarHBondContact CG1-O 3.35Å; V301-R321 HydrophobicContact CG2-CB 3.67Å; V301-R321 HydrophobicContact CG2-CG 3.7Å
302	C	66.1	Low	82.3	Confident	15 Å²	15	55.7 Å²	55.7	10%	0.101	27%	0.269	C	S	.	.			trans	-85.1	57.9	-169.9	-68.5	0	0	0	0	112.9	F297 M298 Y307	F297-C302 HydrophobicContact CD2-CB 3.91Å; F297-C302 HydrophobicContact CE2-CB 3.5Å; F297-C302 HydrophobicContact CZ-CB 4.45Å; M298-C302 WeakPolarHBondContact O-CB 3.03Å; M298-C302 PolarHBondContact O-N 3.19Å; C302-Y307 HydrophobicContact CB-CD1 3.77Å; C302-Y307 HydrophobicContact CB-CD2 4.11Å; C302-Y307 HydrophobicContact CB-CE1 3.53Å; C302-Y307 HydrophobicContact CB-CE2 3.88Å; C302-Y307 HydrophobicContact CB-CG 4.06Å; C302-Y307 VanDerWaalsContact O-CE1 3.22Å; C302-Y307 WeakPolarHBondContact O-CE1 3.01Å
303	K	71.8	Confident	82.2	Confident	144 Å²	144	54.6 Å²	54.6	63%	0.626	27%	0.267	S	S	*	.	S	Bend	trans	-81.9	-41.7	-178.3	-63.6	-170.8	-178.3	-178.4	0	114.4	N300 V301	N300-K303 WeakPolarHBondContact O-CE 3.25Å; V301-K303 VanDerWaalsContact C-N 3.3Å; V301-K303 PolarHBondContact O-N 3.43Å
304	F	77	Confident	82.2	Confident	171 Å²	171	49.5 Å²	49.5	75%	0.75	25%	0.248	S	C	*	.	S	Bend	trans	-138.1	133.9	-176.1	-55.9	-74.9	0	0	0	110.5	P306 Y307	F304-P306 CarbonylContact O-C 3.59Å; F304-Y307 WeakPolarHBondContact O-CD1 3.39Å
305	W	84.4	Confident	82.4	Confident	73 Å²	73	51.3 Å²	51.3	28%	0.277	25%	0.252	S	S	.	.	S	Bend	trans	-78.8	141.7	174	-175.1	-98.5	0	0	0	110.9	L254 D256 V265 F267 L281 Y307	L254-W305 HydrophobicContact CB-CD2 3.89Å; L254-W305 HydrophobicContact CB-CE3 4.07Å; L254-W305 HydrophobicContact CB-CG 4.38Å; L254-W305 HydrophobicContact CB-CH2 4.48Å; L254-W305 HydrophobicContact CB-CZ2 4.34Å; L254-W305 HydrophobicContact CB-CZ3 4.36Å; L254-W305 HydrophobicContact CD1-CB 3.92Å; L254-W305 HydrophobicContact CD1-CD2 4.01Å; L254-W305 HydrophobicContact CD1-CE3 4.08Å; L254-W305 HydrophobicContact CD1-CG 3.94Å; D256-W305 HydrophobicContact CB-CZ2 3.67Å; V265-W305 HydrophobicContact CB-CH2 4.48Å; V265-W305 HydrophobicContact CG1-CH2 3.98Å; F267-W305 HydrophobicContact CB-CE3 4.42Å; F267-W305 HydrophobicContact CB-CH2 4.05Å; F267-W305 HydrophobicContact CB-CZ3 3.62Å; F267-W305 HydrophobicContact CG-CZ3 4.26Å; L281-W305 HydrophobicContact CD1-CH2 4.41Å; L281-W305 HydrophobicContact CD1-CZ3 4.09Å; W305-Y307 AromaticContact CE3-CD2 3.6Å; W305-Y307 HydrophobicContact CE3-CD2 3.6Å; W305-Y307 AromaticContact CE3-CE2 3.64Å; W305-Y307 HydrophobicContact CE3-CE2 3.64Å; W305-Y307 HydrophobicContact CE3-CG 4.16Å; W305-Y307 AromaticContact CZ3-CD2 3.69Å; W305-Y307 HydrophobicContact CZ3-CD2 3.69Å; W305-Y307 AromaticContact CZ3-CE2 3.95Å; W305-Y307 HydrophobicContact CZ3-CE2 3.95Å; W305-Y307 HydrophobicContact CZ3-CG 4.48Å
306	P	87.6	Confident	82.8	Confident	52 Å²	52	50.8 Å²	50.8	34%	0.338	25%	0.25	S	C	.	.			cis	-74.6	136.1	-6.9	29.3	-33.6	0	0	0	113.1	F304	F304-P306 CarbonylContact O-C 3.59Å
307	Y	84.5	Confident	83.5	Confident	32 Å²	32	48.2 Å²	48.2	13%	0.125	23%	0.233	C	C	.	.			trans	-72.4	-41.1	-179.5	-54	-49.6	0	0	0	112.7	F267 L281 C302 F304 W305	F267-Y307 AromaticContact CD1-CE2 3.85Å; F267-Y307 HydrophobicContact CD1-CE2 3.85Å; F267-Y307 HydrophobicContact CD2-CE2 4.03Å; F267-Y307 AromaticContact CE1-CE2 3.86Å; F267-Y307 HydrophobicContact CE1-CE2 3.86Å; F267-Y307 HydrophobicContact CE2-CE2 4.07Å; F267-Y307 AromaticContact CG-CE2 3.92Å; F267-Y307 HydrophobicContact CG-CE2 3.92Å; F267-Y307 AromaticContact CZ-CE2 3.98Å; F267-Y307 HydrophobicContact CZ-CE2 3.98Å; L281-Y307 HydrophobicContact CD1-CD2 4.49Å; C302-Y307 HydrophobicContact CB-CD1 3.77Å; C302-Y307 HydrophobicContact CB-CD2 4.11Å; C302-Y307 HydrophobicContact CB-CE1 3.53Å; C302-Y307 HydrophobicContact CB-CE2 3.88Å; C302-Y307 HydrophobicContact CB-CG 4.06Å; C302-Y307 VanDerWaalsContact O-CE1 3.22Å; C302-Y307 WeakPolarHBondContact O-CE1 3.01Å; F304-Y307 WeakPolarHBondContact O-CD1 3.39Å; W305-Y307 AromaticContact CE3-CD2 3.6Å; W305-Y307 HydrophobicContact CE3-CD2 3.6Å; W305-Y307 AromaticContact CE3-CE2 3.64Å; W305-Y307 HydrophobicContact CE3-CE2 3.64Å; W305-Y307 HydrophobicContact CE3-CG 4.16Å; W305-Y307 AromaticContact CZ3-CD2 3.69Å; W305-Y307 HydrophobicContact CZ3-CD2 3.69Å; W305-Y307 AromaticContact CZ3-CE2 3.95Å; W305-Y307 HydrophobicContact CZ3-CE2 3.95Å; W305-Y307 HydrophobicContact CZ3-CG 4.48Å
308	L	90.3	Very high	84.3	Confident	10 Å²	10	47.2 Å²	47.2	5%	0.052	23%	0.229	C	C	.	.	S	Bend	trans	-92.5	116.6	176.2	-57.7	179.8	0	0	0	108	V265 L281 I283 F295 F317 F319	V265-L308 HydrophobicContact CG1-CD1 4.26Å; L281-L308 HydrophobicContact CD2-CD1 3.76Å; L281-L308 HydrophobicContact CD2-CD2 4.27Å; L281-L308 HydrophobicContact CD2-CG 3.89Å; I283-L308 HydrophobicContact CD1-CD1 3.79Å; I283-L308 HydrophobicContact CG1-CD1 4.28Å; F295-L308 HydrophobicContact CD2-CD1 4.47Å; F295-L308 HydrophobicContact CE2-CD1 4.46Å; L308-F317 HydrophobicContact CB-CD2 4.45Å; L308-F317 HydrophobicContact CD1-CD2 4.26Å; L308-F317 HydrophobicContact CD1-CE2 4.31Å; L308-F317 HydrophobicContact CD2-CD2 4.12Å; L308-F317 HydrophobicContact CD2-CE2 4.3Å; L308-F319 HydrophobicContact CD2-CB 4.1Å; L308-F319 HydrophobicContact CD2-CD1 3.5Å; L308-F319 VanDerWaalsContact CD2-CD1 3.5Å; L308-F319 HydrophobicContact CD2-CE1 4.25Å; L308-F319 HydrophobicContact CD2-CG 4.12Å
309	K	92.6	Very high	85.2	Confident	52 Å²	52	46.6 Å²	46.6	23%	0.226	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.8	174.2	-57.7	-176.3	177.1	-178.5	0	108.7	F317 A318 D348 F349 W351	K309-F317 CarbonylContact O-C 3.49Å; K309-F317 WeakPolarHBondContact O-CA 3.37Å; K309-A318 PolarHBondContact N-O 3.01Å; K309-A318 PolarHBondContact O-N 3.23Å; K309-D348 IonicContact NZ-OD1 2.84Å; K309-D348 PolarHBondContact NZ-OD1 3.37Å; K309-D348 IonicContact NZ-OD2 3.03Å; K309-F349 HydrophobicContact CB-CE2 3.74Å; K309-F349 HydrophobicContact CB-CZ 3.64Å; K309-F349 HydrophobicContact CD-CD1 4.3Å; K309-F349 HydrophobicContact CD-CD2 4.43Å; K309-F349 HydrophobicContact CD-CE1 3.89Å; K309-F349 HydrophobicContact CD-CE2 4.02Å; K309-F349 HydrophobicContact CD-CZ 3.73Å; K309-F349 WeakPolarHBondContact CD-O 3.3Å; K309-F349 HydrophobicContact CG-CE1 4.36Å; K309-F349 HydrophobicContact CG-CE2 4.32Å; K309-F349 HydrophobicContact CG-CZ 3.88Å; K309-F349 PolarHBondContact NZ-O 2.88Å; K309-W351 PolarHBondContact O-NE1 3.19Å
310	W	93.7	Very high	86.1	Confident	24 Å²	24	45 Å²	45	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	149.9	-177.1	-67	71.2	0	0	0	111.2	I258 Y263 V265 I283 Y316 F317 T330 F333	I258-W310 HydrophobicContact CB-CD2 4.4Å; I258-W310 HydrophobicContact CB-CG 4.19Å; I258-W310 HydrophobicContact CD1-CG 4.11Å; I258-W310 VanDerWaalsContact CD1-NE1 3.26Å; I258-W310 HydrophobicContact CG2-CB 3.37Å; I258-W310 HydrophobicContact CG2-CD2 3.89Å; I258-W310 HydrophobicContact CG2-CG 3.31Å; Y263-W310 AromaticContact CD2-CH2 3.78Å; Y263-W310 HydrophobicContact CD2-CH2 3.78Å; Y263-W310 AromaticContact CD2-CZ3 3.65Å; Y263-W310 HydrophobicContact CD2-CZ3 3.65Å; Y263-W310 HydrophobicContact CE2-CH2 4.43Å; Y263-W310 HydrophobicContact CE2-CZ3 4.1Å; Y263-W310 HydrophobicContact CG-CH2 4.12Å; Y263-W310 HydrophobicContact CG-CZ3 4.44Å; V265-W310 HydrophobicContact CG2-CZ2 4.14Å; I283-W310 HydrophobicContact CD1-CZ2 4.13Å; I283-W310 HydrophobicContact CG2-CH2 4.4Å; I283-W310 HydrophobicContact CG2-CZ2 4.31Å; W310-Y316 WeakPolarHBondContact CA-O 3.41Å; W310-F317 HydrophobicContact CD2-CB 3.44Å; W310-F317 VanDerWaalsContact CD2-CB 3.44Å; W310-F317 HydrophobicContact CD2-CD1 4.5Å; W310-F317 HydrophobicContact CD2-CG 4.26Å; W310-F317 HydrophobicContact CE3-CB 3.71Å; W310-F317 HydrophobicContact CE3-CD1 4.2Å; W310-F317 HydrophobicContact CE3-CG 4.36Å; W310-F317 HydrophobicContact CG-CB 3.8Å; W310-F317 HydrophobicContact CH2-CB 4.34Å; W310-F317 AromaticContact CH2-CD1 3.61Å; W310-F317 HydrophobicContact CH2-CD1 3.61Å; W310-F317 HydrophobicContact CH2-CE1 4.19Å; W310-F317 HydrophobicContact CH2-CG 4.16Å; W310-F317 HydrophobicContact CZ2-CB 4.08Å; W310-F317 AromaticContact CZ2-CD1 3.9Å; W310-F317 HydrophobicContact CZ2-CD1 3.9Å; W310-F317 AromaticContact CZ2-CG 4Å; W310-F317 HydrophobicContact CZ2-CG 4Å; W310-F317 HydrophobicContact CZ3-CB 4.16Å; W310-F317 AromaticContact CZ3-CD1 3.77Å; W310-F317 HydrophobicContact CZ3-CD1 3.77Å; W310-F317 HydrophobicContact CZ3-CG 4.33Å; W310-T330 HydrophobicContact CH2-CG2 3.99Å; W310-T330 HydrophobicContact CZ3-CG2 3.58Å; W310-F333 HydrophobicContact CH2-CE1 4.17Å
311	N	94.5	Very high	87	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.037	22%	0.215	C	C	.	.			trans	-73.4	168.5	170.1	76	-26.6	0	0	0	111.1	D313 G314 K315 Y316 W351 N356	N311-D313 VanDerWaalsContact C-N 3.3Å; N311-D313 PolarHBondContact ND2-OD1 3.49Å; N311-D313 PolarHBondContact O-N 3.4Å; N311-D313 PolarHBondContact OD1-OD1 2.74Å; N311-G314 PolarHBondContact O-N 2.7Å; N311-G314 VanDerWaalsContact OD1-C 3.27Å; N311-G314 VanDerWaalsContact OD1-CA 3.23Å; N311-G314 WeakPolarHBondContact OD1-CA 3.35Å; N311-G314 PolarHBondContact OD1-N 3.02Å; N311-K315 PolarHBondContact OD1-N 3.02Å; N311-Y316 VanDerWaalsContact CG-N 3.34Å; N311-Y316 PolarHBondContact N-O 3.24Å; N311-Y316 WeakPolarHBondContact ND2-CD2 3.46Å; N311-Y316 PolarHBondContact ND2-N 3.32Å; N311-Y316 PolarHBondContact OD1-N 3.5Å; N311-Y316 PolarHBondContact OD1-O 3.27Å; N311-W351 HydrophobicContact CB-CD2 3.61Å; N311-W351 HydrophobicContact CB-CE3 3.43Å; N311-W351 VanDerWaalsContact CB-CE3 3.43Å; N311-W351 HydrophobicContact CB-CG 4.12Å; N311-W351 HydrophobicContact CB-CH2 4.22Å; N311-W351 HydrophobicContact CB-CZ2 4.38Å; N311-W351 HydrophobicContact CB-CZ3 3.76Å; N311-N356 PolarHBondContact ND2-OD1 3.28Å
312	H	91.2	Very high	87.8	Confident	71 Å²	71	51.1 Å²	51.1	33%	0.329	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.1	-172.1	72.3	-33.3	0	0	0	116.4	P353 T354 N356	H312-P353 WeakPolarHBondContact CB-O 3.32Å; H312-T354 VanDerWaalsContact CD2-CA 3.47Å; H312-T354 WeakPolarHBondContact CD2-CA 3.23Å; H312-T354 PolarHBondContact CD2-O 2.84Å; H312-T354 PolarHBondContact NE2-O 2.63Å; H312-T354 VanDerWaalsContact NE2-O 3.09Å; H312-N356 PolarHBondContact CE1-OD1 3.29Å; H312-N356 PolarHBondContact ND1-OD1 2.82Å
313	D	90.3	Very high	88.9	Confident	60 Å²	60	52.9 Å²	52.9	32%	0.321	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-5.7	-175.2	64.5	9.1	0	0	0	112.2	N311 K315	N311-D313 VanDerWaalsContact C-N 3.3Å; N311-D313 PolarHBondContact ND2-OD1 3.49Å; N311-D313 PolarHBondContact O-N 3.4Å; N311-D313 PolarHBondContact OD1-OD1 2.74Å; D313-K315 VanDerWaalsContact C-N 3.32Å; D313-K315 WeakPolarHBondContact OD1-CB 3.41Å; D313-K315 PolarHBondContact OD1-N 2.53Å
314	G	90.8	Very high	89.9	Confident	0 Å²	0	48 Å²	48	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	79.1	5.3	-177.9	0	0	0	0	0	116.8	S259 N311 Y316 T330	S259-G314 VanDerWaalsContact CB-CA 3.41Å; S259-G314 WeakPolarHBondContact OG-CA 3.34Å; N311-G314 PolarHBondContact O-N 2.7Å; N311-G314 VanDerWaalsContact OD1-C 3.27Å; N311-G314 VanDerWaalsContact OD1-CA 3.23Å; N311-G314 WeakPolarHBondContact OD1-CA 3.35Å; N311-G314 PolarHBondContact OD1-N 3.02Å; G314-Y316 VanDerWaalsContact C-N 3.28Å; G314-Y316 PolarHBondContact O-N 3.2Å; G314-T330 PolarHBondContact O-OG1 2.67Å
315	K	92.8	Very high	90.7	Very high	82 Å²	82	39.8 Å²	39.8	36%	0.357	19%	0.188	S	C	.	.	S	Bend	trans	-66	-32.1	176.5	-173.3	173.8	179.3	-175.8	0	112.5	N311 D313 E329 T330	N311-K315 PolarHBondContact OD1-N 3.02Å; D313-K315 VanDerWaalsContact C-N 3.32Å; D313-K315 WeakPolarHBondContact OD1-CB 3.41Å; D313-K315 PolarHBondContact OD1-N 2.53Å; K315-E329 WeakPolarHBondContact CE-OE1 2.96Å; K315-E329 IonicContact NZ-OE1 3.09Å; K315-E329 CarbonylContact O-C 3.52Å; K315-E329 WeakPolarHBondContact O-CA 3.33Å; K315-T330 WeakPolarHBondContact CA-OG1 3.14Å; K315-T330 PolarHBondContact O-N 2.82Å; K315-T330 PolarHBondContact O-OG1 2.89Å
316	Y	95.1	Very high	91.2	Very high	6 Å²	6	36.8 Å²	36.8	2%	0.024	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.7	-177.6	-52.9	-68.4	0	0	0	112	W310 N311 G314 F328 E329 V336 W351 N356 V377	W310-Y316 WeakPolarHBondContact CA-O 3.41Å; N311-Y316 VanDerWaalsContact CG-N 3.34Å; N311-Y316 PolarHBondContact N-O 3.24Å; N311-Y316 WeakPolarHBondContact ND2-CD2 3.46Å; N311-Y316 PolarHBondContact ND2-N 3.32Å; N311-Y316 PolarHBondContact OD1-N 3.5Å; N311-Y316 PolarHBondContact OD1-O 3.27Å; G314-Y316 VanDerWaalsContact C-N 3.28Å; G314-Y316 PolarHBondContact O-N 3.2Å; Y316-F328 VanDerWaalsContact CA-O 3.24Å; Y316-F328 WeakPolarHBondContact CA-O 3.24Å; Y316-E329 HydrophobicContact CD1-CB 4.03Å; Y316-E329 HydrophobicContact CD1-CG 4.23Å; Y316-E329 HydrophobicContact CE1-CB 4.03Å; Y316-E329 HydrophobicContact CE1-CG 3.89Å; Y316-V336 HydrophobicContact CD1-CG2 4.02Å; Y316-V336 HydrophobicContact CE1-CG2 4.14Å; Y316-W351 HydrophobicContact CD2-CH2 4.49Å; Y316-W351 HydrophobicContact CG-CH2 4.34Å; Y316-N356 HydrophobicContact CE2-CB 4.38Å; Y316-V377 HydrophobicContact CD1-CG1 4.42Å; Y316-V377 HydrophobicContact CD2-CG1 3.94Å; Y316-V377 HydrophobicContact CE2-CG1 4.04Å; Y316-V377 HydrophobicContact CG-CG1 4.15Å
317	F	94.4	Very high	91.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	155	165.5	68.1	-87.8	0	0	0	110.2	I283 F295 L308 K309 W310 F328 T330 F333	I283-F317 HydrophobicContact CD1-CE1 4.45Å; I283-F317 HydrophobicContact CD1-CE2 4.35Å; I283-F317 HydrophobicContact CD1-CZ 4.07Å; F295-F317 AromaticContact CE2-CE2 3.89Å; F295-F317 HydrophobicContact CE2-CE2 3.89Å; F295-F317 AromaticContact CE2-CZ 4Å; F295-F317 HydrophobicContact CE2-CZ 4Å; F295-F317 AromaticContact CZ-CE2 3.76Å; F295-F317 HydrophobicContact CZ-CE2 3.76Å; F295-F317 AromaticContact CZ-CZ 3.88Å; F295-F317 HydrophobicContact CZ-CZ 3.88Å; L308-F317 HydrophobicContact CB-CD2 4.45Å; L308-F317 HydrophobicContact CD1-CD2 4.26Å; L308-F317 HydrophobicContact CD1-CE2 4.31Å; L308-F317 HydrophobicContact CD2-CD2 4.12Å; L308-F317 HydrophobicContact CD2-CE2 4.3Å; K309-F317 CarbonylContact O-C 3.49Å; K309-F317 WeakPolarHBondContact O-CA 3.37Å; W310-F317 HydrophobicContact CD2-CB 3.44Å; W310-F317 VanDerWaalsContact CD2-CB 3.44Å; W310-F317 HydrophobicContact CD2-CD1 4.5Å; W310-F317 HydrophobicContact CD2-CG 4.26Å; W310-F317 HydrophobicContact CE3-CB 3.71Å; W310-F317 HydrophobicContact CE3-CD1 4.2Å; W310-F317 HydrophobicContact CE3-CG 4.36Å; W310-F317 HydrophobicContact CG-CB 3.8Å; W310-F317 HydrophobicContact CH2-CB 4.34Å; W310-F317 AromaticContact CH2-CD1 3.61Å; W310-F317 HydrophobicContact CH2-CD1 3.61Å; W310-F317 HydrophobicContact CH2-CE1 4.19Å; W310-F317 HydrophobicContact CH2-CG 4.16Å; W310-F317 HydrophobicContact CZ2-CB 4.08Å; W310-F317 AromaticContact CZ2-CD1 3.9Å; W310-F317 HydrophobicContact CZ2-CD1 3.9Å; W310-F317 AromaticContact CZ2-CG 4Å; W310-F317 HydrophobicContact CZ2-CG 4Å; W310-F317 HydrophobicContact CZ3-CB 4.16Å; W310-F317 AromaticContact CZ3-CD1 3.77Å; W310-F317 HydrophobicContact CZ3-CD1 3.77Å; W310-F317 HydrophobicContact CZ3-CG 4.33Å; F317-F328 HydrophobicContact CD1-CB 3.84Å; F317-F328 HydrophobicContact CD2-CB 4.07Å; F317-F328 HydrophobicContact CD2-CD2 4.15Å; F317-F328 HydrophobicContact CD2-CG 4.36Å; F317-F328 HydrophobicContact CE1-CB 3.35Å; F317-F328 HydrophobicContact CE1-CG 4.16Å; F317-F328 HydrophobicContact CE2-CB 3.62Å; F317-F328 HydrophobicContact CE2-CD1 4.4Å; F317-F328 AromaticContact CE2-CD2 3.61Å; F317-F328 HydrophobicContact CE2-CD2 3.61Å; F317-F328 HydrophobicContact CE2-CE2 4.41Å; F317-F328 AromaticContact CE2-CG 3.63Å; F317-F328 HydrophobicContact CE2-CG 3.63Å; F317-F328 HydrophobicContact CG-CB 4.18Å; F317-F328 HydrophobicContact CZ-CB 3.24Å; F317-F328 HydrophobicContact CZ-CD1 4.04Å; F317-F328 HydrophobicContact CZ-CD2 4.02Å; F317-F328 AromaticContact CZ-CG 3.51Å; F317-F328 HydrophobicContact CZ-CG 3.51Å; F317-F328 PolarHBondContact N-O 3.37Å; F317-F328 VanDerWaalsContact N-O 3.09Å; F317-F328 PolarHBondContact O-N 2.72Å; F317-T330 HydrophobicContact CD1-CG2 4.2Å; F317-T330 HydrophobicContact CE1-CG2 4.3Å; F317-F333 AromaticContact CE1-CD1 3.67Å; F317-F333 HydrophobicContact CE1-CD1 3.67Å; F317-F333 HydrophobicContact CE1-CE1 4.18Å; F317-F333 HydrophobicContact CZ-CD1 4.08Å
318	A	94	Very high	92	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	161.7	-178.8	0	0	0	0	0	112.1	K309 L325 S326 I327 F349 W351	K309-A318 PolarHBondContact N-O 3.01Å; K309-A318 PolarHBondContact O-N 3.23Å; A318-L325 HydrophobicContact CB-CD1 4.1Å; A318-S326 WeakPolarHBondContact CA-O 3.29Å; A318-S326 WeakPolarHBondContact CB-O 3.28Å; A318-I327 HydrophobicContact CB-CB 4.46Å; A318-I327 HydrophobicContact CB-CG1 4.06Å; A318-F349 HydrophobicContact CB-CE2 3.76Å; A318-F349 HydrophobicContact CB-CZ 3.86Å; A318-F349 WeakPolarHBondContact O-CZ 3.48Å; A318-W351 HydrophobicContact CB-CZ2 3.93Å
319	F	92.1	Very high	92.2	Very high	14 Å²	14	36.2 Å²	36.2	6%	0.061	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	160.3	167.4	63.3	-91.4	0	0	0	110.2	F295 M298 V301 L308 R321 S326 F328	F295-F319 HydrophobicContact CE1-CE1 4.11Å; M298-F319 HydrophobicContact CE-CE2 4.38Å; V301-F319 HydrophobicContact CG1-CD2 3.7Å; V301-F319 HydrophobicContact CG1-CE2 4.32Å; V301-F319 HydrophobicContact CG1-CG 4.42Å; L308-F319 HydrophobicContact CD2-CB 4.1Å; L308-F319 HydrophobicContact CD2-CD1 3.5Å; L308-F319 VanDerWaalsContact CD2-CD1 3.5Å; L308-F319 HydrophobicContact CD2-CE1 4.25Å; L308-F319 HydrophobicContact CD2-CG 4.12Å; F319-R321 HydrophobicContact CD2-CB 4.23Å; F319-R321 HydrophobicContact CE2-CB 3.95Å; F319-S326 PolarHBondContact N-O 3.13Å; F319-S326 VanDerWaalsContact N-O 3.15Å; F319-S326 PolarHBondContact O-N 2.83Å; F319-F328 HydrophobicContact CD1-CE2 4.06Å; F319-F328 HydrophobicContact CE1-CD2 4.13Å; F319-F328 AromaticContact CE1-CE2 3.3Å; F319-F328 HydrophobicContact CE1-CE2 3.3Å; F319-F328 AromaticContact CE1-CZ 3.94Å; F319-F328 HydrophobicContact CE1-CZ 3.94Å; F319-F328 AromaticContact CZ-CE2 3.95Å; F319-F328 HydrophobicContact CZ-CE2 3.95Å; F319-F328 HydrophobicContact CZ-CZ 4.31Å
320	I	90.1	Very high	92.2	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.185	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.6	175.1	-64.7	167.2	0	0	0	108.6	V301 T324 L325 I346 F349	V301-I320 WeakPolarHBondContact CG1-O 3.35Å; I320-T324 CarbonylContact C-O 3.56Å; I320-T324 WeakPolarHBondContact CA-O 3.33Å; I320-L325 HydrophobicContact CG1-CD1 4.17Å; I320-I346 HydrophobicContact CD1-CD1 3.92Å; I320-I346 HydrophobicContact CD1-CG1 3.8Å; I320-I346 HydrophobicContact CD1-CG2 4.19Å; I320-I346 HydrophobicContact CG1-CD1 4.14Å; I320-I346 HydrophobicContact CG1-CG1 4.43Å; I320-I346 HydrophobicContact CG1-CG2 4.25Å; I320-I346 HydrophobicContact CG2-CG2 3.76Å; I320-F349 HydrophobicContact CD1-CD1 3.58Å; I320-F349 HydrophobicContact CD1-CE1 4.15Å; I320-F349 HydrophobicContact CG1-CD1 3.72Å; I320-F349 HydrophobicContact CG1-CE1 3.9Å
321	R	86.1	Confident	92	Very high	125 Å²	125	38.3 Å²	38.3	47%	0.472	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	122	169.5	174.3	-179.7	175.5	-178	5	109.2	V301 F319 D323 T324	V301-R321 HydrophobicContact CG2-CB 3.67Å; V301-R321 HydrophobicContact CG2-CG 3.7Å; F319-R321 HydrophobicContact CD2-CB 4.23Å; F319-R321 HydrophobicContact CE2-CB 3.95Å; R321-D323 PolarHBondContact O-N 3.25Å; R321-T324 PolarHBondContact N-O 2.83Å; R321-T324 WeakPolarHBondContact O-CA 3.36Å; R321-T324 WeakPolarHBondContact O-CB 3.47Å; R321-T324 PolarHBondContact O-N 3.36Å; R321-T324 PolarHBondContact O-OG1 3.01Å
322	D	84.9	Confident	91.7	Very high	99 Å²	99	40.9 Å²	40.9	53%	0.529	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	61.2	172.6	-52.8	-42.9	0	0	0	112.5	N300 T324	N300-D322 PolarHBondContact ND2-OD1 3.19Å; N300-D322 PolarHBondContact ND2-OD2 3.34Å; D322-T324 PolarHBondContact O-N 2.84Å; D322-T324 VanDerWaalsContact O-N 3.07Å; D322-T324 PolarHBondContact O-OG1 2.93Å
323	D	89.1	Confident	91.7	Very high	53 Å²	53	37.8 Å²	37.8	28%	0.283	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	19	-176.3	-67.7	-12.2	0	0	0	115.4	R321 I343 G345 R365	R321-D323 PolarHBondContact O-N 3.25Å; D323-I343 CarbonylContact O-C 3.6Å; D323-I343 PolarHBondContact O-N 2.89Å; D323-G345 VanDerWaalsContact CG-N 3.28Å; D323-G345 PolarHBondContact OD2-N 2.93Å; D323-R365 IonicContact OD2-NH1 2.9Å; D323-R365 PolarHBondContact OD2-NH1 2.88Å
324	T	92.2	Very high	91.8	Very high	40 Å²	40	38.3 Å²	38.3	25%	0.245	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125	-178.9	-49	0	0	0	0	110.4	I320 R321 D322 S340 M341	I320-T324 CarbonylContact C-O 3.56Å; I320-T324 WeakPolarHBondContact CA-O 3.33Å; R321-T324 PolarHBondContact N-O 2.83Å; R321-T324 WeakPolarHBondContact O-CA 3.36Å; R321-T324 WeakPolarHBondContact O-CB 3.47Å; R321-T324 PolarHBondContact O-N 3.36Å; R321-T324 PolarHBondContact O-OG1 3.01Å; D322-T324 PolarHBondContact O-N 2.84Å; D322-T324 VanDerWaalsContact O-N 3.07Å; D322-T324 PolarHBondContact O-OG1 2.93Å; T324-S340 VanDerWaalsContact CG2-CB 3.41Å; T324-M341 CarbonylContact C-O 3.57Å; T324-M341 WeakPolarHBondContact CA-O 3.19Å; T324-M341 VanDerWaalsContact CG2-O 3.25Å; T324-M341 WeakPolarHBondContact CG2-O 3.45Å
325	L	94.2	Very high	91.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113.4	172.6	-176.4	65.3	0	0	0	109.6	A318 I320 I327 M341 I343 I346 F349 I358	A318-L325 HydrophobicContact CB-CD1 4.1Å; I320-L325 HydrophobicContact CG1-CD1 4.17Å; L325-I327 HydrophobicContact CD2-CD1 4.26Å; L325-I327 HydrophobicContact CD2-CG1 4.39Å; L325-I327 HydrophobicContact CG-CG1 4.15Å; L325-M341 PolarHBondContact N-O 3.37Å; L325-M341 PolarHBondContact O-N 2.88Å; L325-I343 HydrophobicContact CB-CD1 3.91Å; L325-I343 HydrophobicContact CD2-CD1 3.95Å; L325-I346 HydrophobicContact CB-CD1 4.44Å; L325-F349 HydrophobicContact CD1-CD1 4.13Å; L325-F349 HydrophobicContact CD1-CD2 4.28Å; L325-F349 HydrophobicContact CD1-CE1 4.17Å; L325-F349 HydrophobicContact CD1-CE2 4.33Å; L325-F349 HydrophobicContact CD1-CG 4.17Å; L325-F349 HydrophobicContact CD1-CZ 4.26Å; L325-I358 HydrophobicContact CD2-CD1 4.06Å
326	S	93.9	Very high	91.8	Very high	9 Å²	9	37 Å²	37	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.4	178	-63.7	0	0	0	0	109.7	A318 F319 S340	A318-S326 WeakPolarHBondContact CA-O 3.29Å; A318-S326 WeakPolarHBondContact CB-O 3.28Å; F319-S326 PolarHBondContact N-O 3.13Å; F319-S326 VanDerWaalsContact N-O 3.15Å; F319-S326 PolarHBondContact O-N 2.83Å; S326-S340 WeakPolarHBondContact OG-CB 3.11Å; S326-S340 PolarHBondContact OG-OG 3.22Å
327	I	95.5	Very high	91.5	Very high	2 Å²	2	42 Å²	42	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.5	-179.1	-50.5	173.7	0	0	0	108.6	A318 L325 L335 V336 W351 I358 V377	A318-I327 HydrophobicContact CB-CB 4.46Å; A318-I327 HydrophobicContact CB-CG1 4.06Å; L325-I327 HydrophobicContact CD2-CD1 4.26Å; L325-I327 HydrophobicContact CD2-CG1 4.39Å; L325-I327 HydrophobicContact CG-CG1 4.15Å; I327-L335 WeakPolarHBondContact O-CA 3.41Å; I327-V336 HydrophobicContact CB-CG2 4.22Å; I327-V336 HydrophobicContact CG2-CG2 3.78Å; I327-V336 PolarHBondContact O-N 3.15Å; I327-W351 HydrophobicContact CG2-CH2 4.16Å; I327-W351 HydrophobicContact CG2-CZ2 4.38Å; I327-I358 HydrophobicContact CD1-CD1 3.87Å; I327-I358 HydrophobicContact CG1-CD1 4.37Å; I327-V377 HydrophobicContact CD1-CG2 4.02Å; I327-V377 HydrophobicContact CG2-CG1 4.22Å
328	F	94.4	Very high	91.2	Very high	15 Å²	15	50.9 Å²	50.9	7%	0.066	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149.9	179.5	-66.4	-100.7	0	0	0	110.4	F295 Y316 F317 F319 T334 L335	F295-F328 HydrophobicContact CE1-CE1 4.1Å; F295-F328 HydrophobicContact CE1-CE2 4.41Å; F295-F328 AromaticContact CE1-CZ 3.87Å; F295-F328 HydrophobicContact CE1-CZ 3.87Å; F295-F328 HydrophobicContact CZ-CD1 4.39Å; F295-F328 HydrophobicContact CZ-CE1 4.09Å; F295-F328 HydrophobicContact CZ-CE2 4.48Å; F295-F328 HydrophobicContact CZ-CZ 4.15Å; Y316-F328 VanDerWaalsContact CA-O 3.24Å; Y316-F328 WeakPolarHBondContact CA-O 3.24Å; F317-F328 HydrophobicContact CD1-CB 3.84Å; F317-F328 HydrophobicContact CD2-CB 4.07Å; F317-F328 HydrophobicContact CD2-CD2 4.15Å; F317-F328 HydrophobicContact CD2-CG 4.36Å; F317-F328 HydrophobicContact CE1-CB 3.35Å; F317-F328 HydrophobicContact CE1-CG 4.16Å; F317-F328 HydrophobicContact CE2-CB 3.62Å; F317-F328 HydrophobicContact CE2-CD1 4.4Å; F317-F328 AromaticContact CE2-CD2 3.61Å; F317-F328 HydrophobicContact CE2-CD2 3.61Å; F317-F328 HydrophobicContact CE2-CE2 4.41Å; F317-F328 AromaticContact CE2-CG 3.63Å; F317-F328 HydrophobicContact CE2-CG 3.63Å; F317-F328 HydrophobicContact CG-CB 4.18Å; F317-F328 HydrophobicContact CZ-CB 3.24Å; F317-F328 HydrophobicContact CZ-CD1 4.04Å; F317-F328 HydrophobicContact CZ-CD2 4.02Å; F317-F328 AromaticContact CZ-CG 3.51Å; F317-F328 HydrophobicContact CZ-CG 3.51Å; F317-F328 PolarHBondContact N-O 3.37Å; F317-F328 VanDerWaalsContact N-O 3.09Å; F317-F328 PolarHBondContact O-N 2.72Å; F319-F328 HydrophobicContact CD1-CE2 4.06Å; F319-F328 HydrophobicContact CE1-CD2 4.13Å; F319-F328 AromaticContact CE1-CE2 3.3Å; F319-F328 HydrophobicContact CE1-CE2 3.3Å; F319-F328 AromaticContact CE1-CZ 3.94Å; F319-F328 HydrophobicContact CE1-CZ 3.94Å; F319-F328 AromaticContact CZ-CE2 3.95Å; F319-F328 HydrophobicContact CZ-CE2 3.95Å; F319-F328 HydrophobicContact CZ-CZ 4.31Å; F328-T334 CarbonylContact C-O 3.6Å; F328-T334 VanDerWaalsContact CA-O 3.3Å; F328-T334 WeakPolarHBondContact CA-O 3.49Å; F328-L335 HydrophobicContact CD1-CD2 4.38Å; F328-L335 HydrophobicContact CD1-CG 4.25Å; F328-L335 HydrophobicContact CD2-CD2 4.2Å; F328-L335 HydrophobicContact CE1-CD2 3.98Å; F328-L335 HydrophobicContact CE1-CG 3.77Å; F328-L335 HydrophobicContact CE2-CD2 3.75Å; F328-L335 HydrophobicContact CE2-CG 4.45Å; F328-L335 HydrophobicContact CG-CD2 4.48Å; F328-L335 HydrophobicContact CZ-CD2 3.64Å; F328-L335 HydrophobicContact CZ-CG 3.87Å
329	E	94	Very high	91	Very high	65 Å²	65	58.3 Å²	58.3	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	140.1	176.6	-178.9	171.7	-149	0	0	110.9	K315 Y316 S332 F333 T334 V336	K315-E329 WeakPolarHBondContact CE-OE1 2.96Å; K315-E329 IonicContact NZ-OE1 3.09Å; K315-E329 CarbonylContact O-C 3.52Å; K315-E329 WeakPolarHBondContact O-CA 3.33Å; Y316-E329 HydrophobicContact CD1-CB 4.03Å; Y316-E329 HydrophobicContact CD1-CG 4.23Å; Y316-E329 HydrophobicContact CE1-CB 4.03Å; Y316-E329 HydrophobicContact CE1-CG 3.89Å; E329-S332 PolarHBondContact O-OG 2.86Å; E329-F333 VanDerWaalsContact O-CA 3.25Å; E329-F333 WeakPolarHBondContact O-CA 2.79Å; E329-F333 PolarHBondContact O-N 2.89Å; E329-T334 PolarHBondContact N-O 3.01Å; E329-V336 HydrophobicContact CB-CG2 4.13Å
330	T	91.9	Very high	91	Very high	12 Å²	12	60 Å²	60	7%	0.074	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	148.8	168.4	66.7	0	0	0	0	110.2	Y263 W310 G314 K315 F317 F333	Y263-T330 HydrophobicContact CE2-CG2 3.94Å; W310-T330 HydrophobicContact CH2-CG2 3.99Å; W310-T330 HydrophobicContact CZ3-CG2 3.58Å; G314-T330 PolarHBondContact O-OG1 2.67Å; K315-T330 WeakPolarHBondContact CA-OG1 3.14Å; K315-T330 PolarHBondContact O-N 2.82Å; K315-T330 PolarHBondContact O-OG1 2.89Å; F317-T330 HydrophobicContact CD1-CG2 4.2Å; F317-T330 HydrophobicContact CE1-CG2 4.3Å; T330-F333 HydrophobicContact CG2-CD1 4.35Å; T330-F333 HydrophobicContact CG2-CE1 3.9Å; T330-F333 HydrophobicContact CG2-CZ 4.07Å
331	P	89.9	Confident	91.1	Very high	108 Å²	108	60 Å²	60	70%	0.701	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.6	3.7	8.1	36.1	-36.8	0	0	0	115.1	F333	P331-F333 WeakPolarHBondContact O-CD2 3.47Å; P331-F333 VanDerWaalsContact O-CE2 3.28Å; P331-F333 WeakPolarHBondContact O-CE2 3.49Å
332	S	89.2	Confident	91.4	Very high	62 Å²	62	57.7 Å²	57.7	43%	0.434	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.1	-175.9	59	0	0	0	0	114.1	E329 T334	E329-S332 PolarHBondContact O-OG 2.86Å; S332-T334 PolarHBondContact O-N 2.87Å; S332-T334 PolarHBondContact OG-OG1 3.38Å
333	F	91.3	Very high	91.8	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.026	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	32.8	-173.9	-60.5	-90.3	0	0	0	113.1	Y263 I283 K292 R293 W310 F317 E329 T330 P331	Y263-F333 AromaticContact CD1-CZ 3.96Å; Y263-F333 HydrophobicContact CD1-CZ 3.96Å; Y263-F333 HydrophobicContact CE1-CE2 4.3Å; Y263-F333 AromaticContact CE1-CZ 3.6Å; Y263-F333 HydrophobicContact CE1-CZ 3.6Å; Y263-F333 AromaticContact CZ-CZ 3.99Å; I283-F333 HydrophobicContact CB-CE1 4.4Å; I283-F333 HydrophobicContact CD1-CD1 4.19Å; I283-F333 HydrophobicContact CD1-CE1 4.17Å; I283-F333 HydrophobicContact CG2-CE1 3.78Å; I283-F333 HydrophobicContact CG2-CZ 4.28Å; K292-F333 HydrophobicContact CB-CD2 3.93Å; K292-F333 HydrophobicContact CB-CE1 4.28Å; K292-F333 HydrophobicContact CB-CE2 3.43Å; K292-F333 VanDerWaalsContact CB-CE2 3.43Å; K292-F333 HydrophobicContact CB-CZ 3.62Å; K292-F333 HydrophobicContact CD-CE2 4.21Å; K292-F333 HydrophobicContact CG-CE2 3.78Å; K292-F333 HydrophobicContact CG-CZ 3.98Å; R293-F333 HydrophobicContact CB-CB 4.11Å; R293-F333 HydrophobicContact CB-CD1 3.96Å; R293-F333 HydrophobicContact CB-CG 4.05Å; R293-F333 HydrophobicContact CG-CB 4.09Å; W310-F333 HydrophobicContact CH2-CE1 4.17Å; F317-F333 AromaticContact CE1-CD1 3.67Å; F317-F333 HydrophobicContact CE1-CD1 3.67Å; F317-F333 HydrophobicContact CE1-CE1 4.18Å; F317-F333 HydrophobicContact CZ-CD1 4.08Å; E329-F333 VanDerWaalsContact O-CA 3.25Å; E329-F333 WeakPolarHBondContact O-CA 2.79Å; E329-F333 PolarHBondContact O-N 2.89Å; T330-F333 HydrophobicContact CG2-CD1 4.35Å; T330-F333 HydrophobicContact CG2-CE1 3.9Å; T330-F333 HydrophobicContact CG2-CZ 4.07Å; P331-F333 WeakPolarHBondContact O-CD2 3.47Å; P331-F333 VanDerWaalsContact O-CE2 3.28Å; P331-F333 WeakPolarHBondContact O-CE2 3.49Å
334	T	91.2	Very high	91.9	Very high	70 Å²	70	58 Å²	58	43%	0.429	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	152.9	178.2	54.8	0	0	0	0	111.2	F328 E329 S332 V336	F328-T334 CarbonylContact C-O 3.6Å; F328-T334 VanDerWaalsContact CA-O 3.3Å; F328-T334 WeakPolarHBondContact CA-O 3.49Å; E329-T334 PolarHBondContact N-O 3.01Å; S332-T334 PolarHBondContact O-N 2.87Å; S332-T334 PolarHBondContact OG-OG1 3.38Å; T334-V336 PolarHBondContact O-N 3.01Å
335	L	91.9	Very high	91.8	Very high	50 Å²	50	56.4 Å²	56.4	26%	0.262	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	133.2	172.7	-78.8	163.9	0	0	0	111.1	I327 F328 D337 K338 S340	I327-L335 WeakPolarHBondContact O-CA 3.41Å; F328-L335 HydrophobicContact CD1-CD2 4.38Å; F328-L335 HydrophobicContact CD1-CG 4.25Å; F328-L335 HydrophobicContact CD2-CD2 4.2Å; F328-L335 HydrophobicContact CE1-CD2 3.98Å; F328-L335 HydrophobicContact CE1-CG 3.77Å; F328-L335 HydrophobicContact CE2-CD2 3.75Å; F328-L335 HydrophobicContact CE2-CG 4.45Å; F328-L335 HydrophobicContact CG-CD2 4.48Å; F328-L335 HydrophobicContact CZ-CD2 3.64Å; F328-L335 HydrophobicContact CZ-CG 3.87Å; L335-D337 PolarHBondContact O-N 3.13Å; L335-K338 WeakPolarHBondContact O-CA 3.4Å; L335-K338 PolarHBondContact O-N 3.29Å; L335-S340 WeakPolarHBondContact CD2-OG 3.48Å
336	V	92	Very high	91.8	Very high	6 Å²	6	56.7 Å²	56.7	4%	0.036	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-59	127.9	171.7	178.6	0	0	0	0	108.4	Y316 I327 E329 T334 K338 K339 P378 K380	Y316-V336 HydrophobicContact CD1-CG2 4.02Å; Y316-V336 HydrophobicContact CE1-CG2 4.14Å; I327-V336 HydrophobicContact CB-CG2 4.22Å; I327-V336 HydrophobicContact CG2-CG2 3.78Å; I327-V336 PolarHBondContact O-N 3.15Å; E329-V336 HydrophobicContact CB-CG2 4.13Å; T334-V336 PolarHBondContact O-N 3.01Å; V336-K338 PolarHBondContact O-N 2.85Å; V336-K338 VanDerWaalsContact O-N 3.08Å; V336-K339 PolarHBondContact O-N 2.6Å; V336-P378 HydrophobicContact CG1-CB 4.04Å; V336-K380 PolarHBondContact O-NZ 3.09Å
337	D	89.3	Confident	91.7	Very high	110 Å²	110	63.9 Å²	63.9	59%	0.588	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	55	17.9	-172	-44	-50.5	0	0	0	115.2	L335 K339 K380	L335-D337 PolarHBondContact O-N 3.13Å; D337-K339 PolarHBondContact O-N 3.23Å; D337-K339 VanDerWaalsContact O-N 3.1Å; D337-K380 WeakPolarHBondContact OD2-CE 3.47Å; D337-K380 IonicContact OD2-NZ 3.97Å; D337-K380 PolarHBondContact OD2-NZ 2.67Å
338	K	88.5	Confident	91.6	Very high	187 Å²	187	66 Å²	66	81%	0.813	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	57.1	19.6	-175.2	-52.2	179.3	-179.5	-179.2	0	114	L335 V336	L335-K338 WeakPolarHBondContact O-CA 3.4Å; L335-K338 PolarHBondContact O-N 3.29Å; V336-K338 PolarHBondContact O-N 2.85Å; V336-K338 VanDerWaalsContact O-N 3.08Å
339	K	89.3	Confident	91.6	Very high	155 Å²	155	65.6 Å²	65.6	67%	0.674	34%	0.344	S	S	*	.			trans	-139.3	131.8	-176.1	-68.7	-177.6	-178.1	-179.8	0	111.3	V336 D337 K380	V336-K339 PolarHBondContact O-N 2.6Å; D337-K339 PolarHBondContact O-N 3.23Å; D337-K339 VanDerWaalsContact O-N 3.1Å; K339-K380 PolarHBondContact O-NZ 3.22Å
340	S	91.2	Very high	91.7	Very high	49 Å²	49	65.4 Å²	65.4	34%	0.343	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-76.2	153.7	165.2	-53.4	0	0	0	0	110.5	T324 S326 L335	T324-S340 VanDerWaalsContact CG2-CB 3.41Å; S326-S340 WeakPolarHBondContact OG-CB 3.11Å; S326-S340 PolarHBondContact OG-OG 3.22Å; L335-S340 WeakPolarHBondContact CD2-OG 3.48Å
341	M	92.1	Very high	91.9	Very high	38 Å²	38	65.7 Å²	65.7	19%	0.187	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.4	-179.7	-177.6	-170.2	-80.1	0	0	110.1	T324 L325 I343 M375 K380	T324-M341 CarbonylContact C-O 3.57Å; T324-M341 WeakPolarHBondContact CA-O 3.19Å; T324-M341 VanDerWaalsContact CG2-O 3.25Å; T324-M341 WeakPolarHBondContact CG2-O 3.45Å; L325-M341 PolarHBondContact N-O 3.37Å; L325-M341 PolarHBondContact O-N 2.88Å; M341-I343 HydrophobicContact CG-CD1 4.32Å; M341-I343 HydrophobicContact CG-CG1 3.86Å; M341-I343 PolarHBondContact O-N 3.14Å; M341-I343 HydrophobicContact SD-CD1 3.62Å; M341-I343 HydrophobicContact SD-CG1 3.71Å; M341-M375 HydrophobicContact CE-CE 3.68Å; M341-M375 HydrophobicContact CE-SD 3.78Å; M341-M375 HydrophobicContact SD-CE 3.34Å; M341-M375 WeakPolarHBondContact SD-CE 3.45Å; M341-M375 HydrophobicContact SD-SD 3.97Å; M341-K380 HydrophobicContact CE-CB 3.26Å; M341-K380 HydrophobicContact CE-CD 3.95Å; M341-K380 HydrophobicContact CE-CG 3.52Å; M341-K380 WeakPolarHBondContact CE-O 3.26Å
342	A	93.3	Very high	92.3	Very high	76 Å²	76	60.6 Å²	60.6	63%	0.628	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	119.8	171.2	0	0	0	0	0	109.6
343	I	93.2	Very high	92.5	Very high	11 Å²	11	60 Å²	60	6%	0.056	31%	0.305	C	S	.	.			trans	-129.5	86.5	174	-53.8	176.2	0	0	0	106.6	D323 L325 M341 G345 I346 Y360 V362 M375	D323-I343 CarbonylContact O-C 3.6Å; D323-I343 PolarHBondContact O-N 2.89Å; L325-I343 HydrophobicContact CB-CD1 3.91Å; L325-I343 HydrophobicContact CD2-CD1 3.95Å; M341-I343 HydrophobicContact CG-CD1 4.32Å; M341-I343 HydrophobicContact CG-CG1 3.86Å; M341-I343 PolarHBondContact O-N 3.14Å; M341-I343 HydrophobicContact SD-CD1 3.62Å; M341-I343 HydrophobicContact SD-CG1 3.71Å; I343-G345 PolarHBondContact O-N 2.9Å; I343-I346 HydrophobicContact CB-CB 4.1Å; I343-I346 HydrophobicContact CB-CD1 4.42Å; I343-I346 HydrophobicContact CB-CG2 4.34Å; I343-I346 HydrophobicContact CD1-CD1 4.02Å; I343-I346 HydrophobicContact CG2-CB 3.94Å; I343-I346 HydrophobicContact CG2-CD1 4.42Å; I343-I346 WeakPolarHBondContact O-CB 3.39Å; I343-I346 VanDerWaalsContact O-CG2 3.29Å; I343-I346 WeakPolarHBondContact O-CG2 3.45Å; I343-I346 PolarHBondContact O-N 3.26Å; I343-I346 VanDerWaalsContact O-N 3.07Å; I343-Y360 HydrophobicContact CD1-CD2 4.38Å; I343-Y360 HydrophobicContact CD1-CE2 4.08Å; I343-Y360 HydrophobicContact CG2-CD2 4.24Å; I343-Y360 HydrophobicContact CG2-CE2 3.81Å; I343-V362 HydrophobicContact CG2-CG2 3.65Å; I343-M375 HydrophobicContact CD1-CE 4.15Å
344	E	91.4	Very high	92.6	Very high	147 Å²	147	62 Å²	62	69%	0.687	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	126.6	-176	-66.7	-177.8	-174.1	0	0	111.9	I346 V362	E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 3.36Å; E344-V362 WeakPolarHBondContact O-CG1 3.41Å
345	G	90.4	Very high	92.7	Very high	7 Å²	7	61.1 Å²	61.1	7%	0.072	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	14.1	179.4	0	0	0	0	0	116	D323 I343 R347 V362 A363	D323-G345 VanDerWaalsContact CG-N 3.28Å; D323-G345 PolarHBondContact OD2-N 2.93Å; I343-G345 PolarHBondContact O-N 2.9Å; G345-R347 PolarHBondContact O-N 3.19Å; G345-V362 WeakPolarHBondContact O-CA 3.11Å; G345-A363 PolarHBondContact O-N 2.8Å
346	I	93.5	Very high	92.9	Very high	6 Å²	6	60.6 Å²	60.6	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	130.2	172.3	-170.2	170.6	0	0	0	110.7	I320 L325 I343 E344 Y360	I320-I346 HydrophobicContact CD1-CD1 3.92Å; I320-I346 HydrophobicContact CD1-CG1 3.8Å; I320-I346 HydrophobicContact CD1-CG2 4.19Å; I320-I346 HydrophobicContact CG1-CD1 4.14Å; I320-I346 HydrophobicContact CG1-CG1 4.43Å; I320-I346 HydrophobicContact CG1-CG2 4.25Å; I320-I346 HydrophobicContact CG2-CG2 3.76Å; L325-I346 HydrophobicContact CB-CD1 4.44Å; I343-I346 HydrophobicContact CB-CB 4.1Å; I343-I346 HydrophobicContact CB-CD1 4.42Å; I343-I346 HydrophobicContact CB-CG2 4.34Å; I343-I346 HydrophobicContact CD1-CD1 4.02Å; I343-I346 HydrophobicContact CG2-CB 3.94Å; I343-I346 HydrophobicContact CG2-CD1 4.42Å; I343-I346 WeakPolarHBondContact O-CB 3.39Å; I343-I346 VanDerWaalsContact O-CG2 3.29Å; I343-I346 WeakPolarHBondContact O-CG2 3.45Å; I343-I346 PolarHBondContact O-N 3.26Å; I343-I346 VanDerWaalsContact O-N 3.07Å; E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 3.36Å; I346-Y360 HydrophobicContact CD1-CD2 4.03Å; I346-Y360 HydrophobicContact CD1-CG 4.27Å; I346-Y360 HydrophobicContact CG1-CD2 4.35Å
347	R	91.6	Very high	93.1	Very high	160 Å²	160	62.2 Å²	62.2	60%	0.604	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	-44.8	-177.6	-67.2	-58.7	-171.6	168.8	-0.4	112.8	G345 W361 A363	G345-R347 PolarHBondContact O-N 3.19Å; R347-W361 HydrophobicContact CB-CD2 3.88Å; R347-W361 VanDerWaalsContact CB-CE2 3.44Å; R347-W361 HydrophobicContact CB-CE3 4.12Å; R347-W361 HydrophobicContact CB-CH2 3.67Å; R347-W361 HydrophobicContact CB-CZ2 3.33Å; R347-W361 HydrophobicContact CB-CZ3 4.04Å; R347-W361 HydrophobicContact CG-CD2 4.42Å; R347-W361 HydrophobicContact CG-CE3 4.15Å; R347-W361 HydrophobicContact CG-CH2 3.55Å; R347-W361 HydrophobicContact CG-CZ2 3.8Å; R347-W361 HydrophobicContact CG-CZ3 3.73Å; R347-W361 PolarHBondContact N-O 3.08Å; R347-A363 HydrophobicContact CG-CB 3.73Å
348	D	93.2	Very high	93.5	Very high	47 Å²	47	57 Å²	57	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	159.7	177.3	-165.1	23.5	0	0	0	111.7	K309 Y360 W361	K309-D348 IonicContact NZ-OD1 2.84Å; K309-D348 PolarHBondContact NZ-OD1 3.37Å; K309-D348 IonicContact NZ-OD2 3.03Å; D348-Y360 VanDerWaalsContact O-CA 3.31Å; D348-Y360 WeakPolarHBondContact O-CA 3.49Å; D348-Y360 WeakPolarHBondContact O-CB 3.31Å; D348-W361 PolarHBondContact O-N 3.4Å; D348-W361 VanDerWaalsContact O-N 3.09Å
349	F	95.5	Very high	94	Very high	5 Å²	5	48 Å²	48	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	154.4	173.5	78.5	-74.4	0	0	0	111.6	K309 A318 I320 L325 W351 I358 A359	K309-F349 HydrophobicContact CB-CE2 3.74Å; K309-F349 HydrophobicContact CB-CZ 3.64Å; K309-F349 HydrophobicContact CD-CD1 4.3Å; K309-F349 HydrophobicContact CD-CD2 4.43Å; K309-F349 HydrophobicContact CD-CE1 3.89Å; K309-F349 HydrophobicContact CD-CE2 4.02Å; K309-F349 HydrophobicContact CD-CZ 3.73Å; K309-F349 WeakPolarHBondContact CD-O 3.3Å; K309-F349 HydrophobicContact CG-CE1 4.36Å; K309-F349 HydrophobicContact CG-CE2 4.32Å; K309-F349 HydrophobicContact CG-CZ 3.88Å; K309-F349 PolarHBondContact NZ-O 2.88Å; A318-F349 HydrophobicContact CB-CE2 3.76Å; A318-F349 HydrophobicContact CB-CZ 3.86Å; A318-F349 WeakPolarHBondContact O-CZ 3.48Å; I320-F349 HydrophobicContact CD1-CD1 3.58Å; I320-F349 HydrophobicContact CD1-CE1 4.15Å; I320-F349 HydrophobicContact CG1-CD1 3.72Å; I320-F349 HydrophobicContact CG1-CE1 3.9Å; L325-F349 HydrophobicContact CD1-CD1 4.13Å; L325-F349 HydrophobicContact CD1-CD2 4.28Å; L325-F349 HydrophobicContact CD1-CE1 4.17Å; L325-F349 HydrophobicContact CD1-CE2 4.33Å; L325-F349 HydrophobicContact CD1-CG 4.17Å; L325-F349 HydrophobicContact CD1-CZ 4.26Å; F349-W351 AromaticContact CE2-NE1 3.76Å; F349-I358 HydrophobicContact CB-CG2 3.85Å; F349-I358 HydrophobicContact CD2-CG2 3.85Å; F349-I358 HydrophobicContact CG-CG2 4.29Å; F349-A359 CarbonylContact C-O 3.54Å; F349-A359 WeakPolarHBondContact CA-O 3.46Å; F349-A359 WeakPolarHBondContact CB-O 3.02Å
350	Q	96.2	Very high	94.4	Very high	61 Å²	61	40.7 Å²	40.7	29%	0.285	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	142.6	170.6	-71.6	-176.9	10.4	0	0	110.3	A359 I396	Q350-A359 PolarHBondContact N-O 2.84Å; Q350-A359 PolarHBondContact O-N 2.85Å; Q350-I396 HydrophobicContact CB-CD1 4.48Å; Q350-I396 HydrophobicContact CB-CG2 4.15Å; Q350-I396 HydrophobicContact CG-CB 4.22Å; Q350-I396 HydrophobicContact CG-CD1 4.44Å; Q350-I396 HydrophobicContact CG-CG2 4.39Å; Q350-I396 PolarHBondContact NE2-O 2.95Å; Q350-I396 VanDerWaalsContact NE2-O 3.13Å; Q350-I396 PolarHBondContact OE1-O 3.01Å
351	W	96.3	Very high	94.6	Very high	18 Å²	18	39.3 Å²	39.3	7%	0.068	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.1	171.4	-68.8	98	0	0	0	111.4	K309 N311 Y316 A318 I327 F349 Y357 I358 V377 W398	K309-W351 PolarHBondContact O-NE1 3.19Å; N311-W351 HydrophobicContact CB-CD2 3.61Å; N311-W351 HydrophobicContact CB-CE3 3.43Å; N311-W351 VanDerWaalsContact CB-CE3 3.43Å; N311-W351 HydrophobicContact CB-CG 4.12Å; N311-W351 HydrophobicContact CB-CH2 4.22Å; N311-W351 HydrophobicContact CB-CZ2 4.38Å; N311-W351 HydrophobicContact CB-CZ3 3.76Å; Y316-W351 HydrophobicContact CD2-CH2 4.49Å; Y316-W351 HydrophobicContact CG-CH2 4.34Å; A318-W351 HydrophobicContact CB-CZ2 3.93Å; I327-W351 HydrophobicContact CG2-CH2 4.16Å; I327-W351 HydrophobicContact CG2-CZ2 4.38Å; F349-W351 AromaticContact CE2-NE1 3.76Å; W351-Y357 CarbonylContact C-O 3.57Å; W351-Y357 WeakPolarHBondContact CA-O 3.42Å; W351-I358 HydrophobicContact CD2-CD1 4.34Å; W351-I358 HydrophobicContact CD2-CG1 3.77Å; W351-I358 HydrophobicContact CE3-CD1 4.2Å; W351-I358 HydrophobicContact CE3-CG1 3.48Å; W351-I358 VanDerWaalsContact CE3-CG1 3.48Å; W351-I358 HydrophobicContact CH2-CD1 3.59Å; W351-I358 HydrophobicContact CH2-CG1 3.81Å; W351-I358 HydrophobicContact CZ2-CD1 3.72Å; W351-I358 HydrophobicContact CZ2-CG1 4.07Å; W351-I358 HydrophobicContact CZ3-CD1 3.84Å; W351-I358 HydrophobicContact CZ3-CG1 3.5Å; W351-I358 VanDerWaalsContact CZ3-CG1 3.5Å; W351-V377 HydrophobicContact CH2-CB 4.33Å; W351-V377 HydrophobicContact CH2-CG1 4.11Å; W351-V377 HydrophobicContact CH2-CG2 4.03Å; W351-V377 HydrophobicContact CZ3-CB 4.08Å; W351-V377 HydrophobicContact CZ3-CG1 4.3Å; W351-V377 HydrophobicContact CZ3-CG2 3.88Å; W351-W398 PolarHBondContact O-NE1 3.47Å
352	S	96.8	Very high	94.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.007	20%	0.196	C	C	.	.			trans	-62	139	164.8	167.4	0	0	0	0	109.6	T354 E355 Y357	S352-T354 PolarHBondContact O-N 3.05Å; S352-T354 PolarHBondContact OG-N 3.35Å; S352-E355 WeakPolarHBondContact CB-O 3.45Å; S352-E355 PolarHBondContact OG-N 2.8Å; S352-Y357 PolarHBondContact N-O 3.05Å
353	P	94.2	Very high	94.7	Very high	51 Å²	51	35.3 Å²	35.3	33%	0.331	17%	0.172	S	C	.	.	S	Bend	trans	-74.3	-11	-179.8	28.5	-33.2	0	0	0	113.5	H312 W398 Q399 K400	H312-P353 WeakPolarHBondContact CB-O 3.32Å; P353-W398 HydrophobicContact CG-CB 4.3Å; P353-Q399 WeakPolarHBondContact CG-O 3.47Å; P353-K400 WeakPolarHBondContact CG-O 3.36Å
354	T	92.9	Very high	94.6	Very high	47 Å²	47	37.2 Å²	37.2	29%	0.288	18%	0.18	S	C	.	.	S	Bend	trans	-131.2	-11.7	-175.9	57.3	0	0	0	0	115.1	H312 S352 S401 G402 R438	H312-T354 VanDerWaalsContact CD2-CA 3.47Å; H312-T354 WeakPolarHBondContact CD2-CA 3.23Å; H312-T354 PolarHBondContact CD2-O 2.84Å; H312-T354 PolarHBondContact NE2-O 2.63Å; H312-T354 VanDerWaalsContact NE2-O 3.09Å; S352-T354 PolarHBondContact O-N 3.05Å; S352-T354 PolarHBondContact OG-N 3.35Å; T354-S401 WeakPolarHBondContact CG2-O 3.25Å; T354-S401 PolarHBondContact OG1-O 3.13Å; T354-G402 WeakPolarHBondContact OG1-CA 3.44Å; T354-R438 PolarHBondContact OG1-NH2 2.85Å
355	E	94	Very high	94.3	Very high	52 Å²	52	36 Å²	36	24%	0.243	17%	0.169	C	C	.	.	S	Bend	trans	-139.2	167.1	-179.8	-64.5	-163	151	0	0	111.5	S352 Y357 R438	S352-E355 WeakPolarHBondContact CB-O 3.45Å; S352-E355 PolarHBondContact OG-N 2.8Å; E355-Y357 HydrophobicContact CB-CD2 4.07Å; E355-Y357 HydrophobicContact CB-CE1 4.46Å; E355-Y357 HydrophobicContact CB-CE2 4.02Å; E355-Y357 HydrophobicContact CB-CG 4.32Å; E355-Y357 PolarHBondContact O-N 2.88Å; E355-Y357 WeakPolarHBondContact OE2-CE2 3.45Å; E355-Y357 PolarHBondContact OE2-OH 2.74Å; E355-R438 IonicContact OE1-CZ 3.9Å; E355-R438 IonicContact OE1-NH1 3.54Å; E355-R438 PolarHBondContact OE1-NH1 2.86Å; E355-R438 IonicContact OE1-NH2 3.87Å; E355-R438 IonicContact OE2-NH1 3.79Å; E355-R438 PolarHBondContact OE2-NH1 2.98Å
356	N	95.5	Very high	94.1	Very high	39 Å²	39	43 Å²	43	21%	0.209	21%	0.205	C	C	.	.	S	Bend	trans	-81.4	54.9	178.5	-66.9	-32.8	0	0	0	111.9	N311 H312 Y316 V377	N311-N356 PolarHBondContact ND2-OD1 3.28Å; H312-N356 PolarHBondContact CE1-OD1 3.29Å; H312-N356 PolarHBondContact ND1-OD1 2.82Å; Y316-N356 HydrophobicContact CE2-CB 4.38Å; N356-V377 WeakPolarHBondContact CB-O 3.34Å; N356-V377 PolarHBondContact O-N 2.82Å
357	Y	96.9	Very high	93.6	Very high	39 Å²	39	51.7 Å²	51.7	15%	0.153	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150	174.4	-54.4	-26.2	0	0	0	111.6	W351 S352 E355 L374 M375 K376 L383 V437	W351-Y357 CarbonylContact C-O 3.57Å; W351-Y357 WeakPolarHBondContact CA-O 3.42Å; S352-Y357 PolarHBondContact N-O 3.05Å; E355-Y357 HydrophobicContact CB-CD2 4.07Å; E355-Y357 HydrophobicContact CB-CE1 4.46Å; E355-Y357 HydrophobicContact CB-CE2 4.02Å; E355-Y357 HydrophobicContact CB-CG 4.32Å; E355-Y357 PolarHBondContact O-N 2.88Å; E355-Y357 WeakPolarHBondContact OE2-CE2 3.45Å; E355-Y357 PolarHBondContact OE2-OH 2.74Å; Y357-L374 HydrophobicContact CD2-CD1 4.38Å; Y357-L374 HydrophobicContact CD2-CD2 4.4Å; Y357-L374 HydrophobicContact CG-CD1 4.39Å; Y357-M375 CarbonylContact C-O 3.57Å; Y357-M375 WeakPolarHBondContact CA-O 3.16Å; Y357-M375 WeakPolarHBondContact CB-O 3.27Å; Y357-K376 HydrophobicContact CD1-CB 4.14Å; Y357-K376 HydrophobicContact CD1-CG 3.95Å; Y357-K376 HydrophobicContact CE1-CB 4.25Å; Y357-K376 HydrophobicContact CE1-CD 4.22Å; Y357-K376 HydrophobicContact CE1-CG 3.75Å; Y357-L383 HydrophobicContact CD1-CD1 3.96Å; Y357-L383 HydrophobicContact CD2-CD1 4.35Å; Y357-L383 HydrophobicContact CE1-CD1 3.72Å; Y357-L383 HydrophobicContact CE2-CD1 4.09Å; Y357-L383 HydrophobicContact CG-CD1 4.3Å; Y357-V437 HydrophobicContact CD2-CG1 3.99Å; Y357-V437 HydrophobicContact CE2-CG1 3.71Å
358	I	97.7	Very high	93.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120	171.7	-65.2	178.5	0	0	0	108.2	L325 I327 F349 W351 Y360 M375 V377	L325-I358 HydrophobicContact CD2-CD1 4.06Å; I327-I358 HydrophobicContact CD1-CD1 3.87Å; I327-I358 HydrophobicContact CG1-CD1 4.37Å; F349-I358 HydrophobicContact CB-CG2 3.85Å; F349-I358 HydrophobicContact CD2-CG2 3.85Å; F349-I358 HydrophobicContact CG-CG2 4.29Å; W351-I358 HydrophobicContact CD2-CD1 4.34Å; W351-I358 HydrophobicContact CD2-CG1 3.77Å; W351-I358 HydrophobicContact CE3-CD1 4.2Å; W351-I358 HydrophobicContact CE3-CG1 3.48Å; W351-I358 VanDerWaalsContact CE3-CG1 3.48Å; W351-I358 HydrophobicContact CH2-CD1 3.59Å; W351-I358 HydrophobicContact CH2-CG1 3.81Å; W351-I358 HydrophobicContact CZ2-CD1 3.72Å; W351-I358 HydrophobicContact CZ2-CG1 4.07Å; W351-I358 HydrophobicContact CZ3-CD1 3.84Å; W351-I358 HydrophobicContact CZ3-CG1 3.5Å; W351-I358 VanDerWaalsContact CZ3-CG1 3.5Å; I358-Y360 HydrophobicContact CG2-CD1 4.22Å; I358-M375 PolarHBondContact N-O 3.14Å; I358-M375 PolarHBondContact O-N 2.85Å; I358-V377 HydrophobicContact CD1-CG2 3.73Å; I358-V377 HydrophobicContact CG1-CG2 3.94Å
359	A	98.1	Very high	93.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	134.3	161.1	0	0	0	0	0	108.6	F349 Q350 A373 L374 I396 W398 L405 F407	F349-A359 CarbonylContact C-O 3.54Å; F349-A359 WeakPolarHBondContact CA-O 3.46Å; F349-A359 WeakPolarHBondContact CB-O 3.02Å; Q350-A359 PolarHBondContact N-O 2.84Å; Q350-A359 PolarHBondContact O-N 2.85Å; A359-A373 WeakPolarHBondContact CA-O 3.24Å; A359-L374 HydrophobicContact CB-CD1 4.46Å; A359-I396 HydrophobicContact CB-CD1 4.38Å; A359-I396 HydrophobicContact CB-CG2 3.77Å; A359-W398 HydrophobicContact CB-CZ2 3.6Å; A359-L405 HydrophobicContact CB-CD1 3.94Å; A359-L405 HydrophobicContact CB-CD2 3.61Å; A359-L405 HydrophobicContact CB-CG 4.44Å; A359-F407 HydrophobicContact CB-CZ 3.92Å
360	Y	97.5	Very high	93.6	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	163.6	176.3	66.5	-79.2	0	0	0	110.8	I343 I346 D348 I358 V362 R371 A373 M375 D382	I343-Y360 HydrophobicContact CD1-CD2 4.38Å; I343-Y360 HydrophobicContact CD1-CE2 4.08Å; I343-Y360 HydrophobicContact CG2-CD2 4.24Å; I343-Y360 HydrophobicContact CG2-CE2 3.81Å; I346-Y360 HydrophobicContact CD1-CD2 4.03Å; I346-Y360 HydrophobicContact CD1-CG 4.27Å; I346-Y360 HydrophobicContact CG1-CD2 4.35Å; D348-Y360 VanDerWaalsContact O-CA 3.31Å; D348-Y360 WeakPolarHBondContact O-CA 3.49Å; D348-Y360 WeakPolarHBondContact O-CB 3.31Å; I358-Y360 HydrophobicContact CG2-CD1 4.22Å; Y360-V362 HydrophobicContact CD2-CG2 4.11Å; Y360-V362 HydrophobicContact CE2-CG2 4.04Å; Y360-R371 PolarHBondContact OH-NH2 2.88Å; Y360-A373 HydrophobicContact CD1-CB 4.23Å; Y360-A373 HydrophobicContact CE1-CB 3.55Å; Y360-A373 HydrophobicContact CE2-CB 4Å; Y360-A373 VanDerWaalsContact CZ-CB 3.44Å; Y360-A373 PolarHBondContact N-O 2.78Å; Y360-A373 PolarHBondContact O-N 2.9Å; Y360-M375 HydrophobicContact CD1-CB 4.42Å; Y360-M375 HydrophobicContact CE1-CB 3.81Å; Y360-M375 HydrophobicContact CE1-CE 3.74Å; Y360-D382 PolarHBondContact OH-OD1 3.48Å; Y360-D382 PolarHBondContact OH-OD2 3.09Å
361	W	96.6	Very high	93.6	Very high	19 Å²	19	46.8 Å²	46.8	7%	0.072	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149.7	174.6	77	-87.1	0	0	0	112.5	R347 D348 A363 R371 V372 M391 A394 F407	R347-W361 HydrophobicContact CB-CD2 3.88Å; R347-W361 VanDerWaalsContact CB-CE2 3.44Å; R347-W361 HydrophobicContact CB-CE3 4.12Å; R347-W361 HydrophobicContact CB-CH2 3.67Å; R347-W361 HydrophobicContact CB-CZ2 3.33Å; R347-W361 HydrophobicContact CB-CZ3 4.04Å; R347-W361 HydrophobicContact CG-CD2 4.42Å; R347-W361 HydrophobicContact CG-CE3 4.15Å; R347-W361 HydrophobicContact CG-CH2 3.55Å; R347-W361 HydrophobicContact CG-CZ2 3.8Å; R347-W361 HydrophobicContact CG-CZ3 3.73Å; R347-W361 PolarHBondContact N-O 3.08Å; D348-W361 PolarHBondContact O-N 3.4Å; D348-W361 VanDerWaalsContact O-N 3.09Å; W361-A363 HydrophobicContact CH2-CB 4.5Å; W361-A363 HydrophobicContact CZ3-CB 3.82Å; W361-R371 CarbonylContact C-O 3.57Å; W361-R371 VanDerWaalsContact CA-O 3.23Å; W361-R371 WeakPolarHBondContact CA-O 3.29Å; W361-V372 HydrophobicContact CB-CG1 4.03Å; W361-M391 HydrophobicContact CD2-CE 4.49Å; W361-M391 HydrophobicContact CE3-CE 3.4Å; W361-M391 VanDerWaalsContact CE3-CE 3.4Å; W361-M391 HydrophobicContact CE3-SD 4.27Å; W361-M391 HydrophobicContact CZ3-CE 3.75Å; W361-A394 HydrophobicContact CB-CB 4.21Å; W361-A394 HydrophobicContact CD2-CB 3.77Å; W361-A394 HydrophobicContact CE3-CB 4.21Å; W361-A394 HydrophobicContact CG-CB 3.8Å; W361-A394 PolarHBondContact NE1-O 2.75Å; W361-F407 HydrophobicContact CB-CE1 4.42Å
362	V	95.5	Very high	93.6	Very high	16 Å²	16	45.9 Å²	45.9	10%	0.097	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.8	-176	175.6	0	0	0	0	108.3	I343 E344 G345 Y360 G370 R371 M391	I343-V362 HydrophobicContact CG2-CG2 3.65Å; E344-V362 WeakPolarHBondContact O-CG1 3.41Å; G345-V362 WeakPolarHBondContact O-CA 3.11Å; Y360-V362 HydrophobicContact CD2-CG2 4.11Å; Y360-V362 HydrophobicContact CE2-CG2 4.04Å; V362-G370 VanDerWaalsContact O-CA 3.3Å; V362-G370 WeakPolarHBondContact O-CA 3.39Å; V362-R371 HydrophobicContact CB-CB 4.23Å; V362-R371 PolarHBondContact N-O 3.47Å; V362-R371 PolarHBondContact O-N 3.13Å; V362-M391 WeakPolarHBondContact O-CE 3.23Å
363	A	92.8	Very high	93.6	Very high	15 Å²	15	45.9 Å²	45.9	12%	0.124	24%	0.235	C	C	.	.			trans	-72.4	156.5	176.3	0	0	0	0	0	111.6	G345 R347 W361 R365	G345-A363 PolarHBondContact O-N 2.8Å; R347-A363 HydrophobicContact CG-CB 3.73Å; W361-A363 HydrophobicContact CH2-CB 4.5Å; W361-A363 HydrophobicContact CZ3-CB 3.82Å; A363-R365 PolarHBondContact O-N 2.9Å
364	E	89.7	Confident	93.8	Very high	51 Å²	51	43.4 Å²	43.4	24%	0.238	22%	0.219	C	C	.	.			trans	-60.1	134.5	171.4	-76.2	168.7	-174.4	0	0	111.4	F389 N390 M391 Y412	E364-F389 VanDerWaalsContact OE1-CA 3.26Å; E364-F389 WeakPolarHBondContact OE1-CA 2.93Å; E364-N390 VanDerWaalsContact OE1-CA 3.27Å; E364-N390 WeakPolarHBondContact OE1-CA 3.29Å; E364-N390 PolarHBondContact OE1-N 3.37Å; E364-M391 PolarHBondContact OE1-N 2.77Å; E364-Y412 PolarHBondContact OE2-OH 3.4Å
365	R	85.8	Confident	94	Very high	121 Å²	121	41.3 Å²	41.3	46%	0.457	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-142.5	127.6	177.1	-170.9	176.7	-177.7	164.3	1.9	109.6	D323 A363 Q367 A368	D323-R365 IonicContact OD2-NH1 2.9Å; D323-R365 PolarHBondContact OD2-NH1 2.88Å; A363-R365 PolarHBondContact O-N 2.9Å; R365-Q367 PolarHBondContact O-N 2.81Å; R365-A368 PolarHBondContact N-O 2.89Å; R365-A368 WeakPolarHBondContact O-CB 3.41Å; R365-A368 PolarHBondContact O-N 3.47Å
366	D	85.3	Confident	94.1	Very high	155 Å²	155	42.1 Å²	42.1	83%	0.829	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	-108.4	-179.2	-54.4	-43.6	0	0	0	112.6
367	Q	84.5	Confident	94.1	Very high	188 Å²	188	40.4 Å²	40.4	88%	0.879	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-5.3	177.6	-61.3	-64.2	-38	0	0	112.9	R365	R365-Q367 PolarHBondContact O-N 2.81Å
368	A	90.4	Very high	94	Very high	59 Å²	59	41 Å²	41	49%	0.488	21%	0.208	S	C	.	.	B	Isolated β-bridge	trans	-82	126.2	-179.4	0	0	0	0	0	110.4	R365	R365-A368 PolarHBondContact N-O 2.89Å; R365-A368 WeakPolarHBondContact O-CB 3.41Å; R365-A368 PolarHBondContact O-N 3.47Å
369	P	93.6	Very high	93.8	Very high	38 Å²	38	45.6 Å²	45.6	25%	0.247	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-65.8	158.9	174.4	29	-34.2	0	0	0	110.7	N387 F389	P369-N387 HydrophobicContact CB-CB 4.42Å; P369-N387 HydrophobicContact CG-CB 4.08Å; P369-F389 HydrophobicContact CB-CD1 3.91Å; P369-F389 HydrophobicContact CB-CE1 3.67Å; P369-F389 HydrophobicContact CB-CG 4.49Å; P369-F389 HydrophobicContact CB-CZ 4.04Å; P369-F389 HydrophobicContact CG-CE1 4.32Å; P369-F389 HydrophobicContact CG-CZ 4.41Å
370	G	94.6	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	154.6	169.5	0	0	0	0	0	110.8	V362 N387 M388	V362-G370 VanDerWaalsContact O-CA 3.3Å; V362-G370 WeakPolarHBondContact O-CA 3.39Å; G370-N387 CarbonylContact O-C 3.51Å; G370-N387 WeakPolarHBondContact O-CA 3.01Å; G370-M388 WeakPolarHBondContact CA-O 3.1Å; G370-M388 PolarHBondContact N-O 2.64Å; G370-M388 PolarHBondContact O-N 3.25Å
371	R	95.9	Very high	93.4	Very high	72 Å²	72	50.8 Å²	50.8	27%	0.272	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135	-177.7	-172.6	174.9	82.8	177.8	4.4	111	Y360 W361 V362 A373 D382	Y360-R371 PolarHBondContact OH-NH2 2.88Å; W361-R371 CarbonylContact C-O 3.57Å; W361-R371 VanDerWaalsContact CA-O 3.23Å; W361-R371 WeakPolarHBondContact CA-O 3.29Å; V362-R371 HydrophobicContact CB-CB 4.23Å; V362-R371 PolarHBondContact N-O 3.47Å; V362-R371 PolarHBondContact O-N 3.13Å; R371-A373 HydrophobicContact CG-CB 4.44Å; R371-D382 IonicContact CZ-OD2 3.69Å; R371-D382 IonicContact NH1-OD2 2.81Å; R371-D382 IonicContact NH2-OD2 2.91Å; R371-D382 PolarHBondContact NH2-OD2 2.84Å
372	V	97.3	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.8	162.5	-65	0	0	0	0	108.5	W361 S385 K386 M391 F407 V409 F435	W361-V372 HydrophobicContact CB-CG1 4.03Å; V372-S385 CarbonylContact O-C 3.16Å; V372-S385 WeakPolarHBondContact O-CA 3.47Å; V372-K386 HydrophobicContact CG2-CB 3.94Å; V372-K386 PolarHBondContact N-O 2.86Å; V372-K386 PolarHBondContact O-N 2.91Å; V372-M391 HydrophobicContact CG1-SD 4.49Å; V372-F407 HydrophobicContact CB-CD1 3.95Å; V372-F407 HydrophobicContact CB-CD2 3.91Å; V372-F407 HydrophobicContact CB-CE1 3.97Å; V372-F407 HydrophobicContact CB-CE2 3.93Å; V372-F407 HydrophobicContact CB-CG 3.91Å; V372-F407 HydrophobicContact CB-CZ 3.96Å; V372-F407 HydrophobicContact CG1-CB 4.15Å; V372-F407 HydrophobicContact CG1-CD1 3.66Å; V372-F407 HydrophobicContact CG1-CD2 4.32Å; V372-F407 HydrophobicContact CG1-CE1 4.06Å; V372-F407 HydrophobicContact CG1-CG 3.8Å; V372-F407 HydrophobicContact CG2-CD2 4.23Å; V372-F407 HydrophobicContact CG2-CE2 4.47Å; V372-F407 HydrophobicContact CG2-CG 4.47Å; V372-V409 HydrophobicContact CG1-CG2 4.3Å; V372-F435 HydrophobicContact CG2-CE2 4.12Å; V372-F435 HydrophobicContact CG2-CZ 4.03Å
373	A	97.4	Very high	93.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.6	-172.5	0	0	0	0	0	112.7	A359 Y360 R371 R384	A359-A373 WeakPolarHBondContact CA-O 3.24Å; Y360-A373 HydrophobicContact CD1-CB 4.23Å; Y360-A373 HydrophobicContact CE1-CB 3.55Å; Y360-A373 HydrophobicContact CE2-CB 4Å; Y360-A373 VanDerWaalsContact CZ-CB 3.44Å; Y360-A373 PolarHBondContact N-O 2.78Å; Y360-A373 PolarHBondContact O-N 2.9Å; R371-A373 HydrophobicContact CG-CB 4.44Å; A373-R384 WeakPolarHBondContact CA-O 3.29Å
374	L	97.9	Very high	93.5	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.8	172.7	-179.8	67	0	0	0	108.4	Y357 A359 D382 L383 R384 W398 L405 V437 I442	Y357-L374 HydrophobicContact CD2-CD1 4.38Å; Y357-L374 HydrophobicContact CD2-CD2 4.4Å; Y357-L374 HydrophobicContact CG-CD1 4.39Å; A359-L374 HydrophobicContact CB-CD1 4.46Å; L374-D382 CarbonylContact O-C 3.59Å; L374-L383 PolarHBondContact O-N 3.19Å; L374-R384 PolarHBondContact N-O 2.97Å; L374-R384 PolarHBondContact O-N 2.94Å; L374-W398 HydrophobicContact CD1-CH2 3.57Å; L374-W398 HydrophobicContact CD1-CZ2 3.7Å; L374-L405 HydrophobicContact CD1-CD2 4.11Å; L374-V437 HydrophobicContact CD2-CG1 4.21Å; L374-V437 HydrophobicContact CD2-CG2 4.06Å; L374-I442 HydrophobicContact CD2-CD1 3.95Å
375	M	97.2	Very high	93.8	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.015	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145.2	-177.5	175.2	-174.5	-64.2	0	0	111.7	M341 I343 Y357 I358 Y360 T381 D382	M341-M375 HydrophobicContact CE-CE 3.68Å; M341-M375 HydrophobicContact CE-SD 3.78Å; M341-M375 HydrophobicContact SD-CE 3.34Å; M341-M375 WeakPolarHBondContact SD-CE 3.45Å; M341-M375 HydrophobicContact SD-SD 3.97Å; I343-M375 HydrophobicContact CD1-CE 4.15Å; Y357-M375 CarbonylContact C-O 3.57Å; Y357-M375 WeakPolarHBondContact CA-O 3.16Å; Y357-M375 WeakPolarHBondContact CB-O 3.27Å; I358-M375 PolarHBondContact N-O 3.14Å; I358-M375 PolarHBondContact O-N 2.85Å; Y360-M375 HydrophobicContact CD1-CB 4.42Å; Y360-M375 HydrophobicContact CE1-CB 3.81Å; Y360-M375 HydrophobicContact CE1-CE 3.74Å; M375-T381 WeakPolarHBondContact CA-O 3.49Å; M375-D382 WeakPolarHBondContact CE-OD1 3.48Å
376	K	96.4	Very high	94.3	Very high	69 Å²	69	56.6 Å²	56.6	30%	0.3	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	137.4	172.2	-169.4	177.9	-176.8	-154.7	0	112	Y357 E379 K380 T381 L383	Y357-K376 HydrophobicContact CD1-CB 4.14Å; Y357-K376 HydrophobicContact CD1-CG 3.95Å; Y357-K376 HydrophobicContact CE1-CB 4.25Å; Y357-K376 HydrophobicContact CE1-CD 4.22Å; Y357-K376 HydrophobicContact CE1-CG 3.75Å; K376-E379 WeakPolarHBondContact CD-OE2 3.09Å; K376-E379 VanDerWaalsContact CE-OE1 3.3Å; K376-E379 WeakPolarHBondContact CE-OE1 3.46Å; K376-E379 WeakPolarHBondContact CE-OE2 3.16Å; K376-E379 WeakPolarHBondContact CG-OE2 3.25Å; K376-E379 IonicContact NZ-OE1 3.55Å; K376-E379 PolarHBondContact NZ-OE1 3.42Å; K376-E379 IonicContact NZ-OE2 3.83Å; K376-K380 WeakPolarHBondContact O-CA 3.47Å; K376-K380 PolarHBondContact O-N 2.68Å; K376-T381 PolarHBondContact N-O 3.28Å; K376-L383 HydrophobicContact CB-CD1 4.04Å; K376-L383 HydrophobicContact CB-CD2 3.99Å; K376-L383 HydrophobicContact CB-CG 3.9Å; K376-L383 HydrophobicContact CD-CD2 4.26Å
377	V	95.9	Very high	94.8	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.018	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	134.6	175.3	-179.8	0	0	0	0	108.8	Y316 I327 W351 N356 I358	Y316-V377 HydrophobicContact CD1-CG1 4.42Å; Y316-V377 HydrophobicContact CD2-CG1 3.94Å; Y316-V377 HydrophobicContact CE2-CG1 4.04Å; Y316-V377 HydrophobicContact CG-CG1 4.15Å; I327-V377 HydrophobicContact CD1-CG2 4.02Å; I327-V377 HydrophobicContact CG2-CG1 4.22Å; W351-V377 HydrophobicContact CH2-CB 4.33Å; W351-V377 HydrophobicContact CH2-CG1 4.11Å; W351-V377 HydrophobicContact CH2-CG2 4.03Å; W351-V377 HydrophobicContact CZ3-CB 4.08Å; W351-V377 HydrophobicContact CZ3-CG1 4.3Å; W351-V377 HydrophobicContact CZ3-CG2 3.88Å; N356-V377 WeakPolarHBondContact CB-O 3.34Å; N356-V377 PolarHBondContact O-N 2.82Å; I358-V377 HydrophobicContact CD1-CG2 3.73Å; I358-V377 HydrophobicContact CG1-CG2 3.94Å
378	P	93.7	Very high	95.2	Very high	51 Å²	51	45.2 Å²	45.2	33%	0.331	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.6	-6.4	13.3	35.5	-36.5	0	0	0	116	V336 K380	V336-P378 HydrophobicContact CG1-CB 4.04Å; P378-K380 PolarHBondContact O-N 2.81Å
379	E	92.8	Very high	95.3	Very high	96 Å²	96	48.4 Å²	48.4	45%	0.449	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-17.2	-172.2	-62	92.8	148.6	0	0	114	K376 T381	K376-E379 WeakPolarHBondContact CD-OE2 3.09Å; K376-E379 VanDerWaalsContact CE-OE1 3.3Å; K376-E379 WeakPolarHBondContact CE-OE1 3.46Å; K376-E379 WeakPolarHBondContact CE-OE2 3.16Å; K376-E379 WeakPolarHBondContact CG-OE2 3.25Å; K376-E379 IonicContact NZ-OE1 3.55Å; K376-E379 PolarHBondContact NZ-OE1 3.42Å; K376-E379 IonicContact NZ-OE2 3.83Å; E379-T381 HydrophobicContact CB-CG2 4.28Å; E379-T381 PolarHBondContact O-N 2.91Å
380	K	93.5	Very high	95.2	Very high	39 Å²	39	49.8 Å²	49.8	17%	0.17	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	29.4	175.6	-80.6	173	-170.2	166.7	0	112.2	V336 D337 K339 M341 K376 P378	V336-K380 PolarHBondContact O-NZ 3.09Å; D337-K380 WeakPolarHBondContact OD2-CE 3.47Å; D337-K380 IonicContact OD2-NZ 3.97Å; D337-K380 PolarHBondContact OD2-NZ 2.67Å; K339-K380 PolarHBondContact O-NZ 3.22Å; M341-K380 HydrophobicContact CE-CB 3.26Å; M341-K380 HydrophobicContact CE-CD 3.95Å; M341-K380 HydrophobicContact CE-CG 3.52Å; M341-K380 WeakPolarHBondContact CE-O 3.26Å; K376-K380 WeakPolarHBondContact O-CA 3.47Å; K376-K380 PolarHBondContact O-N 2.68Å; P378-K380 PolarHBondContact O-N 2.81Å
381	T	94.2	Very high	95.1	Very high	72 Å²	72	50 Å²	50	44%	0.442	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.9	-179.5	56	0	0	0	0	111.2	M375 K376 E379 L383	M375-T381 WeakPolarHBondContact CA-O 3.49Å; K376-T381 PolarHBondContact N-O 3.28Å; E379-T381 HydrophobicContact CB-CG2 4.28Å; E379-T381 PolarHBondContact O-N 2.91Å; T381-L383 PolarHBondContact O-N 3.18Å
382	D	95.5	Very high	94.9	Very high	58 Å²	58	47.6 Å²	47.6	31%	0.31	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	116.7	170.3	-70.9	-22.6	0	0	0	109.8	Y360 R371 L374 M375	Y360-D382 PolarHBondContact OH-OD1 3.48Å; Y360-D382 PolarHBondContact OH-OD2 3.09Å; R371-D382 IonicContact CZ-OD2 3.69Å; R371-D382 IonicContact NH1-OD2 2.81Å; R371-D382 IonicContact NH2-OD2 2.91Å; R371-D382 PolarHBondContact NH2-OD2 2.84Å; L374-D382 CarbonylContact O-C 3.59Å; M375-D382 WeakPolarHBondContact CE-OD1 3.48Å
383	L	96	Very high	94.7	Very high	67 Å²	67	52.8 Å²	52.8	35%	0.351	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-39.9	173.6	-63.6	176.8	0	0	0	110.9	Y357 L374 K376 T381 I442	Y357-L383 HydrophobicContact CD1-CD1 3.96Å; Y357-L383 HydrophobicContact CD2-CD1 4.35Å; Y357-L383 HydrophobicContact CE1-CD1 3.72Å; Y357-L383 HydrophobicContact CE2-CD1 4.09Å; Y357-L383 HydrophobicContact CG-CD1 4.3Å; L374-L383 PolarHBondContact O-N 3.19Å; K376-L383 HydrophobicContact CB-CD1 4.04Å; K376-L383 HydrophobicContact CB-CD2 3.99Å; K376-L383 HydrophobicContact CB-CG 3.9Å; K376-L383 HydrophobicContact CD-CD2 4.26Å; T381-L383 PolarHBondContact O-N 3.18Å; L383-I442 HydrophobicContact CB-CD1 3.86Å; L383-I442 HydrophobicContact CD1-CD1 4.21Å
384	R	96.1	Very high	94.6	Very high	107 Å²	107	53 Å²	53	40%	0.404	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	138.1	178.9	-169.7	70.3	-172.8	171.8	0.8	109.8	A373 L374 F435 I442 V444	A373-R384 WeakPolarHBondContact CA-O 3.29Å; L374-R384 PolarHBondContact N-O 2.97Å; L374-R384 PolarHBondContact O-N 2.94Å; R384-F435 HydrophobicContact CB-CD1 4.04Å; R384-F435 HydrophobicContact CB-CE1 3.86Å; R384-F435 HydrophobicContact CG-CD1 3.8Å; R384-F435 HydrophobicContact CG-CE1 3.5Å; R384-I442 HydrophobicContact CB-CB 4.14Å; R384-I442 HydrophobicContact CB-CG2 4.14Å; R384-I442 WeakPolarHBondContact CD-O 3.45Å; R384-I442 HydrophobicContact CG-CB 4.34Å; R384-I442 HydrophobicContact CG-CG2 4.3Å; R384-V444 HydrophobicContact CG-CG2 4.14Å
385	S	95.9	Very high	94.5	Very high	53 Å²	53	55.4 Å²	55.4	37%	0.371	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.6	173.4	61.6	0	0	0	0	110.7	V372	V372-S385 CarbonylContact O-C 3.16Å; V372-S385 WeakPolarHBondContact O-CA 3.47Å
386	K	95.9	Very high	94.5	Very high	58 Å²	58	55.4 Å²	55.4	25%	0.252	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	124.9	172.2	-170.4	-178.9	-174.2	-173.2	0	109.2	V372 M388 E433 F435 V444 T446	V372-K386 HydrophobicContact CG2-CB 3.94Å; V372-K386 PolarHBondContact N-O 2.86Å; V372-K386 PolarHBondContact O-N 2.91Å; K386-M388 HydrophobicContact CD-SD 4.34Å; K386-E433 IonicContact NZ-OE1 2.96Å; K386-E433 PolarHBondContact NZ-OE1 2.94Å; K386-E433 IonicContact NZ-OE2 2.85Å; K386-E433 PolarHBondContact NZ-OE2 3.35Å; K386-F435 HydrophobicContact CB-CZ 4.36Å; K386-V444 HydrophobicContact CD-CG1 4.31Å; K386-T446 PolarHBondContact NZ-OG1 3.11Å
387	N	95.7	Very high	94.5	Very high	93 Å²	93	54.3 Å²	54.3	50%	0.497	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	139.7	172.3	-66.2	-14.3	0	0	0	109.5	P369 G370	P369-N387 HydrophobicContact CB-CB 4.42Å; P369-N387 HydrophobicContact CG-CB 4.08Å; G370-N387 CarbonylContact O-C 3.51Å; G370-N387 WeakPolarHBondContact O-CA 3.01Å
388	M	93.6	Very high	94.5	Very high	11 Å²	11	55.6 Å²	55.6	5%	0.054	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.3	-174.4	-71	-74.2	-67.8	0	0	109	G370 K386 M391 V409 R411 E433	G370-M388 WeakPolarHBondContact CA-O 3.1Å; G370-M388 PolarHBondContact N-O 2.64Å; G370-M388 PolarHBondContact O-N 3.25Å; K386-M388 HydrophobicContact CD-SD 4.34Å; M388-M391 HydrophobicContact CB-SD 4.45Å; M388-V409 HydrophobicContact CE-CB 4.08Å; M388-V409 HydrophobicContact CE-CG1 3.75Å; M388-V409 HydrophobicContact CE-CG2 4.36Å; M388-R411 HydrophobicContact CE-CG 4.17Å; M388-E433 HydrophobicContact SD-CG 4.45Å
389	F	92.2	Very high	94.6	Very high	127 Å²	127	53.1 Å²	53.1	56%	0.557	27%	0.267	S	S	*	.	S	Bend	trans	-110.2	149.4	176	-62.2	-87.8	0	0	0	111	E364 P369 R411	E364-F389 VanDerWaalsContact OE1-CA 3.26Å; E364-F389 WeakPolarHBondContact OE1-CA 2.93Å; P369-F389 HydrophobicContact CB-CD1 3.91Å; P369-F389 HydrophobicContact CB-CE1 3.67Å; P369-F389 HydrophobicContact CB-CG 4.49Å; P369-F389 HydrophobicContact CB-CZ 4.04Å; P369-F389 HydrophobicContact CG-CE1 4.32Å; P369-F389 HydrophobicContact CG-CZ 4.41Å; F389-R411 PolarHBondContact O-NE 2.47Å; F389-R411 PolarHBondContact O-NH2 2.95Å
390	N	92.5	Very high	94.6	Very high	66 Å²	66	55.2 Å²	55.2	35%	0.353	27%	0.274	S	S	.	.	S	Bend	trans	55.8	44.5	-172	-48.8	-29.2	0	0	0	113.3	E364 R411 Y412	E364-N390 VanDerWaalsContact OE1-CA 3.27Å; E364-N390 WeakPolarHBondContact OE1-CA 3.29Å; E364-N390 PolarHBondContact OE1-N 3.37Å; N390-R411 CarbonylContact O-C 3.6Å; N390-R411 WeakPolarHBondContact O-CA 3.41Å; N390-Y412 VanDerWaalsContact CA-CZ 3.44Å; N390-Y412 HydrophobicContact CB-CD1 4.11Å; N390-Y412 HydrophobicContact CB-CD2 3.9Å; N390-Y412 HydrophobicContact CB-CE1 3.97Å; N390-Y412 HydrophobicContact CB-CE2 3.74Å; N390-Y412 HydrophobicContact CB-CG 4.08Å; N390-Y412 WeakPolarHBondContact CB-O 3.35Å; N390-Y412 WeakPolarHBondContact O-CD1 3.26Å; N390-Y412 WeakPolarHBondContact O-CE1 3.24Å; N390-Y412 PolarHBondContact O-N 3.22Å
391	M	92	Very high	94.5	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.5	178.4	-174.1	164.8	70.4	0	0	111.6	W361 V362 E364 V372 M388 A394 V409	W361-M391 HydrophobicContact CD2-CE 4.49Å; W361-M391 HydrophobicContact CE3-CE 3.4Å; W361-M391 VanDerWaalsContact CE3-CE 3.4Å; W361-M391 HydrophobicContact CE3-SD 4.27Å; W361-M391 HydrophobicContact CZ3-CE 3.75Å; V362-M391 WeakPolarHBondContact O-CE 3.23Å; E364-M391 PolarHBondContact OE1-N 2.77Å; V372-M391 HydrophobicContact CG1-SD 4.49Å; M388-M391 HydrophobicContact CB-SD 4.45Å; M391-A394 HydrophobicContact SD-CB 4.07Å; M391-V409 HydrophobicContact CB-CG1 4.35Å; M391-V409 HydrophobicContact CG-CG1 3.55Å; M391-V409 HydrophobicContact SD-CG1 3.55Å; M391-V409 VanDerWaalsContact SD-CG1 3.55Å
392	A	91.1	Very high	94.5	Very high	23 Å²	23	50.8 Å²	50.8	19%	0.19	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-50.5	173.5	0	0	0	0	0	111.2	D410 Y412 Y425	A392-D410 PolarHBondContact N-O 2.75Å; A392-Y412 HydrophobicContact CB-CD1 4.02Å; A392-Y425 HydrophobicContact CB-CD1 4.07Å; A392-Y425 HydrophobicContact CB-CD2 3.88Å; A392-Y425 HydrophobicContact CB-CE1 4.22Å; A392-Y425 HydrophobicContact CB-CE2 4.07Å; A392-Y425 HydrophobicContact CB-CG 3.88Å
393	E	92.8	Very high	94.4	Very high	109 Å²	109	50.6 Å²	50.6	51%	0.509	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	152.2	-175.8	-172.3	171.3	-173.8	0	0	110	D410	E393-D410 PolarHBondContact O-N 3.03Å
394	A	95.2	Very high	94.3	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.033	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.9	168.9	0	0	0	0	0	110.9	W361 M391 K408 V409	W361-A394 HydrophobicContact CB-CB 4.21Å; W361-A394 HydrophobicContact CD2-CB 3.77Å; W361-A394 HydrophobicContact CE3-CB 4.21Å; W361-A394 HydrophobicContact CG-CB 3.8Å; W361-A394 PolarHBondContact NE1-O 2.75Å; M391-A394 HydrophobicContact SD-CB 4.07Å; A394-K408 CarbonylContact C-O 3.58Å; A394-K408 VanDerWaalsContact CA-O 3.29Å; A394-K408 WeakPolarHBondContact CA-O 3.29Å; A394-V409 HydrophobicContact CB-CG2 4.18Å
395	V	96	Very high	94.3	Very high	50 Å²	50	42.5 Å²	42.5	30%	0.303	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.9	174.1	-174.1	0	0	0	0	109.1	H397 F407 K408	V395-H397 WeakPolarHBondContact CG1-NE2 3.34Å; V395-F407 WeakPolarHBondContact O-CA 3.42Å; V395-K408 HydrophobicContact CB-CB 4.46Å; V395-K408 HydrophobicContact CG2-CD 4.49Å; V395-K408 PolarHBondContact N-O 2.96Å; V395-K408 PolarHBondContact O-N 2.81Å
396	I	97.3	Very high	94.4	Very high	4 Å²	4	40 Å²	40	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.4	-176.5	-48.1	-176.9	0	0	0	109.1	Q350 A359 L405 F407	Q350-I396 HydrophobicContact CB-CD1 4.48Å; Q350-I396 HydrophobicContact CB-CG2 4.15Å; Q350-I396 HydrophobicContact CG-CB 4.22Å; Q350-I396 HydrophobicContact CG-CD1 4.44Å; Q350-I396 HydrophobicContact CG-CG2 4.39Å; Q350-I396 PolarHBondContact NE2-O 2.95Å; Q350-I396 VanDerWaalsContact NE2-O 3.13Å; Q350-I396 PolarHBondContact OE1-O 3.01Å; A359-I396 HydrophobicContact CB-CD1 4.38Å; A359-I396 HydrophobicContact CB-CG2 3.77Å; I396-L405 HydrophobicContact CG2-CD1 3.55Å; I396-F407 HydrophobicContact CB-CE1 4.49Å; I396-F407 HydrophobicContact CD1-CE1 3.95Å; I396-F407 HydrophobicContact CG1-CD1 3.93Å; I396-F407 HydrophobicContact CG1-CE1 3.71Å; I396-F407 HydrophobicContact CG2-CE1 4.27Å
397	H	96.9	Very high	94.5	Very high	45 Å²	45	37.2 Å²	37.2	21%	0.208	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	99.3	177.9	-67.1	-81.5	0	0	0	110.7	V395 C406 W458	V395-H397 WeakPolarHBondContact CG1-NE2 3.34Å; H397-C406 HydrophobicContact CB-CB 4.22Å; H397-C406 PolarHBondContact N-O 3.36Å; H397-C406 PolarHBondContact O-N 3.19Å; H397-W458 PolarHBondContact O-NE1 2.7Å
398	W	96.4	Very high	94.5	Very high	30 Å²	30	34.1 Å²	34.1	11%	0.114	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.8	170.3	-78.8	105.5	0	0	0	111.9	W351 P353 A359 L374 L405 V437	W351-W398 PolarHBondContact O-NE1 3.47Å; P353-W398 HydrophobicContact CG-CB 4.3Å; A359-W398 HydrophobicContact CB-CZ2 3.6Å; L374-W398 HydrophobicContact CD1-CH2 3.57Å; L374-W398 HydrophobicContact CD1-CZ2 3.7Å; W398-L405 HydrophobicContact CD2-CB 4.25Å; W398-L405 HydrophobicContact CD2-CD1 3.88Å; W398-L405 HydrophobicContact CE3-CB 3.84Å; W398-L405 HydrophobicContact CE3-CD1 4.34Å; W398-L405 HydrophobicContact CG-CD1 4.23Å; W398-L405 HydrophobicContact CH2-CB 3.99Å; W398-L405 HydrophobicContact CH2-CD2 3.95Å; W398-L405 HydrophobicContact CH2-CG 4.4Å; W398-L405 HydrophobicContact CZ2-CB 4.39Å; W398-L405 HydrophobicContact CZ2-CD1 4.16Å; W398-L405 HydrophobicContact CZ2-CD2 3.87Å; W398-L405 HydrophobicContact CZ2-CG 4.37Å; W398-L405 HydrophobicContact CZ3-CB 3.71Å; W398-V437 HydrophobicContact CH2-CG2 4.29Å; W398-V437 HydrophobicContact CZ3-CG2 3.97Å
399	Q	94.9	Very high	94.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.			trans	-71.5	140.2	160.2	-175.3	174.7	28.4	0	0	109.8	P353 S401 G402 N404 W458 E459 G462	P353-Q399 WeakPolarHBondContact CG-O 3.47Å; Q399-S401 VanDerWaalsContact C-N 3.26Å; Q399-S401 PolarHBondContact O-N 3.43Å; Q399-S401 PolarHBondContact OE1-OG 3.43Å; Q399-G402 WeakPolarHBondContact O-CA 3.43Å; Q399-G402 PolarHBondContact O-N 3.02Å; Q399-N404 HydrophobicContact CB-CB 4.26Å; Q399-N404 VanDerWaalsContact CB-O 3.25Å; Q399-N404 WeakPolarHBondContact CB-O 3.27Å; Q399-N404 PolarHBondContact N-O 2.83Å; Q399-N404 PolarHBondContact OE1-ND2 3.44Å; Q399-W458 HydrophobicContact CB-CB 4.24Å; Q399-W458 HydrophobicContact CB-CD2 4.09Å; Q399-W458 HydrophobicContact CB-CE3 4.42Å; Q399-W458 HydrophobicContact CB-CG 4.01Å; Q399-W458 HydrophobicContact CG-CB 4.19Å; Q399-W458 HydrophobicContact CG-CE3 4.5Å; Q399-W458 HydrophobicContact CG-CG 4.41Å; Q399-E459 PolarHBondContact NE2-O 3.13Å; Q399-E459 VanDerWaalsContact NE2-O 3.14Å; Q399-G462 VanDerWaalsContact NE2-C 3.33Å; Q399-G462 PolarHBondContact NE2-O 2.85Å
400	K	92.9	Very high	94.8	Very high	139 Å²	139	28.4 Å²	28.4	60%	0.604	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.7	-177.3	-68.5	-168.6	179.5	178.5	0	114.1	P353 G402 P460	P353-K400 WeakPolarHBondContact CG-O 3.36Å; K400-G402 PolarHBondContact O-N 2.86Å; K400-P460 HydrophobicContact CB-CB 4.34Å; K400-P460 WeakPolarHBondContact CB-O 3.26Å; K400-P460 HydrophobicContact CD-CB 3.93Å; K400-P460 HydrophobicContact CD-CG 4.17Å; K400-P460 HydrophobicContact CG-CB 4.44Å
401	S	91.8	Very high	94.8	Very high	19 Å²	19	28.7 Å²	28.7	13%	0.133	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-14.8	171.9	64.8	0	0	0	0	114	T354 Q399 D403 P460	T354-S401 WeakPolarHBondContact CG2-O 3.25Å; T354-S401 PolarHBondContact OG1-O 3.13Å; Q399-S401 VanDerWaalsContact C-N 3.26Å; Q399-S401 PolarHBondContact O-N 3.43Å; Q399-S401 PolarHBondContact OE1-OG 3.43Å; S401-D403 VanDerWaalsContact CB-OD2 3.24Å; S401-D403 WeakPolarHBondContact CB-OD2 3.39Å; S401-D403 PolarHBondContact O-N 3.36Å; S401-D403 VanDerWaalsContact OG-CG 3.24Å; S401-D403 PolarHBondContact OG-N 3Å; S401-D403 PolarHBondContact OG-OD2 2.85Å; S401-P460 PolarHBondContact N-O 2.82Å
402	G	93.6	Very high	94.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	73.7	9.3	-175.4	0	0	0	0	0	114.2	T354 Q399 K400	T354-G402 WeakPolarHBondContact OG1-CA 3.44Å; Q399-G402 WeakPolarHBondContact O-CA 3.43Å; Q399-G402 PolarHBondContact O-N 3.02Å; K400-G402 PolarHBondContact O-N 2.86Å
403	D	93.1	Very high	94.8	Very high	54 Å²	54	30.8 Å²	30.8	29%	0.289	16%	0.157	S	C	.	.	S	Bend	trans	-76.8	-32.2	-177.3	-57.2	-37.9	0	0	0	112.6	S401 V437 R438	S401-D403 VanDerWaalsContact CB-OD2 3.24Å; S401-D403 WeakPolarHBondContact CB-OD2 3.39Å; S401-D403 PolarHBondContact O-N 3.36Å; S401-D403 VanDerWaalsContact OG-CG 3.24Å; S401-D403 PolarHBondContact OG-N 3Å; S401-D403 PolarHBondContact OG-OD2 2.85Å; D403-V437 PolarHBondContact O-N 2.93Å; D403-R438 HydrophobicContact CB-CG 3.86Å; D403-R438 WeakPolarHBondContact OD1-CG 3.2Å; D403-R438 IonicContact OD1-CZ 3.76Å; D403-R438 IonicContact OD1-NE 3.58Å; D403-R438 PolarHBondContact OD1-NE 3.32Å; D403-R438 IonicContact OD1-NH2 3.31Å
404	N	94.9	Very high	94.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.016	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.2	179.4	-59.7	-68.8	0	0	0	111.1	Q399 F435 W458	Q399-N404 HydrophobicContact CB-CB 4.26Å; Q399-N404 VanDerWaalsContact CB-O 3.25Å; Q399-N404 WeakPolarHBondContact CB-O 3.27Å; Q399-N404 PolarHBondContact N-O 2.83Å; Q399-N404 PolarHBondContact OE1-ND2 3.44Å; N404-F435 WeakPolarHBondContact CA-O 3.4Å; N404-W458 HydrophobicContact CB-CH2 3.52Å; N404-W458 HydrophobicContact CB-CZ2 3.81Å; N404-W458 HydrophobicContact CB-CZ3 3.97Å
405	L	96.3	Very high	94.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.3	173.3	160.9	64.8	0	0	0	108.2	A359 L374 I396 W398 F407 I434 F435 V437	A359-L405 HydrophobicContact CB-CD1 3.94Å; A359-L405 HydrophobicContact CB-CD2 3.61Å; A359-L405 HydrophobicContact CB-CG 4.44Å; L374-L405 HydrophobicContact CD1-CD2 4.11Å; I396-L405 HydrophobicContact CG2-CD1 3.55Å; W398-L405 HydrophobicContact CD2-CB 4.25Å; W398-L405 HydrophobicContact CD2-CD1 3.88Å; W398-L405 HydrophobicContact CE3-CB 3.84Å; W398-L405 HydrophobicContact CE3-CD1 4.34Å; W398-L405 HydrophobicContact CG-CD1 4.23Å; W398-L405 HydrophobicContact CH2-CB 3.99Å; W398-L405 HydrophobicContact CH2-CD2 3.95Å; W398-L405 HydrophobicContact CH2-CG 4.4Å; W398-L405 HydrophobicContact CZ2-CB 4.39Å; W398-L405 HydrophobicContact CZ2-CD1 4.16Å; W398-L405 HydrophobicContact CZ2-CD2 3.87Å; W398-L405 HydrophobicContact CZ2-CG 4.37Å; W398-L405 HydrophobicContact CZ3-CB 3.71Å; L405-F407 HydrophobicContact CD1-CE2 4.22Å; L405-F407 HydrophobicContact CD1-CZ 4.47Å; L405-F407 HydrophobicContact CD2-CD2 4.36Å; L405-F407 HydrophobicContact CD2-CE2 3.51Å; L405-F407 HydrophobicContact CD2-CZ 3.96Å; L405-F407 HydrophobicContact CG-CD2 4.23Å; L405-F407 HydrophobicContact CG-CE2 3.84Å; L405-F407 HydrophobicContact CG-CZ 4.47Å; L405-I434 CarbonylContact O-C 3.5Å; L405-I434 WeakPolarHBondContact O-CA 3.31Å; L405-F435 HydrophobicContact CB-CB 4.13Å; L405-F435 HydrophobicContact CD2-CB 4.4Å; L405-F435 HydrophobicContact CD2-CG 4.46Å; L405-F435 HydrophobicContact CG-CB 4.42Å; L405-F435 PolarHBondContact N-O 2.81Å; L405-F435 PolarHBondContact O-N 3.14Å; L405-V437 HydrophobicContact CB-CG2 4.28Å
406	C	96.9	Very high	93.8	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.007	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.7	173.4	-179.6	0	0	0	0	110	H397 E433 I434 W458	H397-C406 HydrophobicContact CB-CB 4.22Å; H397-C406 PolarHBondContact N-O 3.36Å; H397-C406 PolarHBondContact O-N 3.19Å; C406-E433 WeakPolarHBondContact CA-O 3.43Å; C406-I434 HydrophobicContact CB-CG1 4.08Å; C406-W458 HydrophobicContact CB-CZ2 3.72Å
407	F	97.7	Very high	93.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	119.1	159.6	-65.9	-92.4	0	0	0	108.7	A359 W361 V372 V395 I396 L405 V409 L432 E433 F435	A359-F407 HydrophobicContact CB-CZ 3.92Å; W361-F407 HydrophobicContact CB-CE1 4.42Å; V372-F407 HydrophobicContact CB-CD1 3.95Å; V372-F407 HydrophobicContact CB-CD2 3.91Å; V372-F407 HydrophobicContact CB-CE1 3.97Å; V372-F407 HydrophobicContact CB-CE2 3.93Å; V372-F407 HydrophobicContact CB-CG 3.91Å; V372-F407 HydrophobicContact CB-CZ 3.96Å; V372-F407 HydrophobicContact CG1-CB 4.15Å; V372-F407 HydrophobicContact CG1-CD1 3.66Å; V372-F407 HydrophobicContact CG1-CD2 4.32Å; V372-F407 HydrophobicContact CG1-CE1 4.06Å; V372-F407 HydrophobicContact CG1-CG 3.8Å; V372-F407 HydrophobicContact CG2-CD2 4.23Å; V372-F407 HydrophobicContact CG2-CE2 4.47Å; V372-F407 HydrophobicContact CG2-CG 4.47Å; V395-F407 WeakPolarHBondContact O-CA 3.42Å; I396-F407 HydrophobicContact CB-CE1 4.49Å; I396-F407 HydrophobicContact CD1-CE1 3.95Å; I396-F407 HydrophobicContact CG1-CD1 3.93Å; I396-F407 HydrophobicContact CG1-CE1 3.71Å; I396-F407 HydrophobicContact CG2-CE1 4.27Å; L405-F407 HydrophobicContact CD1-CE2 4.22Å; L405-F407 HydrophobicContact CD1-CZ 4.47Å; L405-F407 HydrophobicContact CD2-CD2 4.36Å; L405-F407 HydrophobicContact CD2-CE2 3.51Å; L405-F407 HydrophobicContact CD2-CZ 3.96Å; L405-F407 HydrophobicContact CG-CD2 4.23Å; L405-F407 HydrophobicContact CG-CE2 3.84Å; L405-F407 HydrophobicContact CG-CZ 4.47Å; F407-V409 HydrophobicContact CB-CG2 3.9Å; F407-V409 PolarHBondContact O-N 3.25Å; F407-L432 WeakPolarHBondContact O-CA 3.29Å; F407-E433 HydrophobicContact CB-CB 4.3Å; F407-E433 PolarHBondContact N-O 2.99Å; F407-E433 PolarHBondContact O-N 3.01Å; F407-F435 AromaticContact CD2-CD2 3.98Å; F407-F435 HydrophobicContact CD2-CD2 3.98Å; F407-F435 AromaticContact CD2-CE2 3.72Å; F407-F435 HydrophobicContact CD2-CE2 3.72Å; F407-F435 HydrophobicContact CD2-CZ 4.48Å; F407-F435 HydrophobicContact CE2-CD2 4.11Å; F407-F435 AromaticContact CE2-CE2 3.85Å; F407-F435 HydrophobicContact CE2-CE2 3.85Å; F407-F435 HydrophobicContact CE2-CZ 4.23Å
408	K	96.8	Very high	92.5	Very high	28 Å²	28	49.4 Å²	49.4	12%	0.122	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	106.1	164.7	-179.5	-120	-174.7	-163.1	0	107.7	A394 V395 D410 L432 I456	A394-K408 CarbonylContact C-O 3.58Å; A394-K408 VanDerWaalsContact CA-O 3.29Å; A394-K408 WeakPolarHBondContact CA-O 3.29Å; V395-K408 HydrophobicContact CB-CB 4.46Å; V395-K408 HydrophobicContact CG2-CD 4.49Å; V395-K408 PolarHBondContact N-O 2.96Å; V395-K408 PolarHBondContact O-N 2.81Å; K408-D410 WeakPolarHBondContact CE-OD1 3.37Å; K408-D410 VanDerWaalsContact NZ-CG 3.27Å; K408-D410 IonicContact NZ-OD1 2.93Å; K408-D410 PolarHBondContact NZ-OD1 3.01Å; K408-D410 IonicContact NZ-OD2 3.22Å; K408-D410 PolarHBondContact NZ-OD2 3.31Å; K408-L432 HydrophobicContact CB-CD2 3.81Å; K408-L432 HydrophobicContact CG-CD2 3.77Å; K408-I456 HydrophobicContact CB-CD1 3.83Å; K408-I456 HydrophobicContact CG-CD1 3.78Å
409	V	96.5	Very high	91.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.1	-176.3	-173.5	0	0	0	0	109.8	V372 M388 M391 A394 F407 R411 H431 E433	V372-V409 HydrophobicContact CG1-CG2 4.3Å; M388-V409 HydrophobicContact CE-CB 4.08Å; M388-V409 HydrophobicContact CE-CG1 3.75Å; M388-V409 HydrophobicContact CE-CG2 4.36Å; M391-V409 HydrophobicContact CB-CG1 4.35Å; M391-V409 HydrophobicContact CG-CG1 3.55Å; M391-V409 HydrophobicContact SD-CG1 3.55Å; M391-V409 VanDerWaalsContact SD-CG1 3.55Å; A394-V409 HydrophobicContact CB-CG2 4.18Å; F407-V409 HydrophobicContact CB-CG2 3.9Å; F407-V409 PolarHBondContact O-N 3.25Å; V409-R411 HydrophobicContact CG1-CG 4.23Å; V409-H431 PolarHBondContact N-O 3.45Å; V409-H431 PolarHBondContact O-N 3.4Å; V409-E433 HydrophobicContact CG2-CG 4.31Å
410	D	94.9	Very high	90.4	Very high	18 Å²	18	65.2 Å²	65.2	10%	0.096	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115	175.5	-69.1	0.5	0	0	0	108.3	A392 E393 K408 I428 H430	A392-D410 PolarHBondContact N-O 2.75Å; E393-D410 PolarHBondContact O-N 3.03Å; K408-D410 WeakPolarHBondContact CE-OD1 3.37Å; K408-D410 VanDerWaalsContact NZ-CG 3.27Å; K408-D410 IonicContact NZ-OD1 2.93Å; K408-D410 PolarHBondContact NZ-OD1 3.01Å; K408-D410 IonicContact NZ-OD2 3.22Å; K408-D410 PolarHBondContact NZ-OD2 3.31Å; D410-I428 HydrophobicContact CB-CG2 3.95Å; D410-H430 IonicContact OD1-CE1 2.96Å; D410-H430 PolarHBondContact OD1-CE1 3.39Å; D410-H430 IonicContact OD1-CG 3.27Å; D410-H430 IonicContact OD1-ND1 3.97Å; D410-H430 PolarHBondContact OD1-ND1 3.22Å; D410-H430 IonicContact OD2-CE1 3.98Å; D410-H430 IonicContact OD2-ND1 2.66Å
411	R	93.2	Very high	89.4	Confident	71 Å²	71	60.6 Å²	60.6	27%	0.268	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.8	-179.1	-65.1	-176.3	75	-158.7	-1	110.7	M388 F389 N390 V409 I428 S429 H431	M388-R411 HydrophobicContact CE-CG 4.17Å; F389-R411 PolarHBondContact O-NE 2.47Å; F389-R411 PolarHBondContact O-NH2 2.95Å; N390-R411 CarbonylContact O-C 3.6Å; N390-R411 WeakPolarHBondContact O-CA 3.41Å; V409-R411 HydrophobicContact CG1-CG 4.23Å; R411-I428 CarbonylContact O-C 3.49Å; R411-I428 VanDerWaalsContact O-CA 3.24Å; R411-I428 WeakPolarHBondContact O-CA 3.38Å; R411-S429 PolarHBondContact N-O 2.75Å; R411-S429 PolarHBondContact O-N 2.95Å; R411-H431 WeakPolarHBondContact CD-CD2 3.24Å
412	Y	91.8	Very high	88.5	Confident	25 Å²	25	66.5 Å²	66.5	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140.6	178.3	61.9	-95.2	0	0	0	111.6	E364 N390 A392 K415 Y425	E364-Y412 PolarHBondContact OE2-OH 3.4Å; N390-Y412 VanDerWaalsContact CA-CZ 3.44Å; N390-Y412 HydrophobicContact CB-CD1 4.11Å; N390-Y412 HydrophobicContact CB-CD2 3.9Å; N390-Y412 HydrophobicContact CB-CE1 3.97Å; N390-Y412 HydrophobicContact CB-CE2 3.74Å; N390-Y412 HydrophobicContact CB-CG 4.08Å; N390-Y412 WeakPolarHBondContact CB-O 3.35Å; N390-Y412 WeakPolarHBondContact O-CD1 3.26Å; N390-Y412 WeakPolarHBondContact O-CE1 3.24Å; N390-Y412 PolarHBondContact O-N 3.22Å; A392-Y412 HydrophobicContact CB-CD1 4.02Å; Y412-K415 HydrophobicContact CD2-CB 3.97Å; Y412-K415 HydrophobicContact CE2-CB 3.66Å; Y412-Y425 AromaticContact CD1-CD1 3.42Å; Y412-Y425 HydrophobicContact CD1-CD1 3.42Å; Y412-Y425 VanDerWaalsContact CD1-CD1 3.42Å; Y412-Y425 AromaticContact CD1-CE1 3.59Å; Y412-Y425 HydrophobicContact CD1-CE1 3.59Å; Y412-Y425 HydrophobicContact CD1-CG 4.42Å; Y412-Y425 HydrophobicContact CD2-CD1 4.21Å; Y412-Y425 HydrophobicContact CE1-CD1 4.04Å; Y412-Y425 AromaticContact CE1-CE1 3.74Å; Y412-Y425 HydrophobicContact CE1-CE1 3.74Å; Y412-Y425 AromaticContact CG-CD1 3.52Å; Y412-Y425 HydrophobicContact CG-CD1 3.52Å; Y412-Y425 HydrophobicContact CG-CE1 4.11Å; Y412-Y425 HydrophobicContact CG-CG 4.45Å
413	G	90.7	Very high	87.9	Confident	46 Å²	46	70.6 Å²	70.6	47%	0.474	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-36.1	168.7	0	0	0	0	0	112.1	T426 N427	G413-T426 PolarHBondContact N-O 3.5Å; G413-N427 PolarHBondContact N-O 3.14Å
414	K	88.9	Confident	87.5	Confident	141 Å²	141	73.3 Å²	73.3	61%	0.613	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	141.4	177.4	-65	179.2	-178.8	176.5	0	110.9	T426	K414-T426 PolarHBondContact N-O 3.36Å; K414-T426 PolarHBondContact O-N 3.22Å
415	K	87.5	Confident	87.1	Confident	99 Å²	99	76.8 Å²	76.8	43%	0.43	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.9	173.2	-179	177.9	178.2	-178.8	0	108.6	Y412 F423 Y425	Y412-K415 HydrophobicContact CD2-CB 3.97Å; Y412-K415 HydrophobicContact CE2-CB 3.66Å; K415-F423 HydrophobicContact CD-CD1 4.12Å; K415-F423 HydrophobicContact CD-CG 4.49Å; K415-F423 HydrophobicContact CG-CB 4.4Å; K415-F423 HydrophobicContact CG-CD1 3.91Å; K415-F423 HydrophobicContact CG-CG 4.39Å; K415-Y425 HydrophobicContact CB-CD1 4.42Å; K415-Y425 HydrophobicContact CB-CE1 4.48Å; K415-Y425 HydrophobicContact CD-CE1 4.17Å; K415-Y425 HydrophobicContact CG-CD1 4.34Å; K415-Y425 HydrophobicContact CG-CE1 4.03Å
416	K	86.7	Confident	86.7	Confident	143 Å²	143	79.4 Å²	79.4	62%	0.622	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.3	174.8	-172.6	-179.7	178.3	-174.3	0	108.9	E418 K424	K416-E418 PolarHBondContact O-N 3.32Å; K416-K424 PolarHBondContact N-O 3.28Å; K416-K424 PolarHBondContact O-N 2.88Å
417	E	83	Confident	86.3	Confident	133 Å²	133	85.1 Å²	85.1	62%	0.621	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.6	171.2	-163.8	173.7	170.8	0	0	109.1	F423	E417-F423 HydrophobicContact CB-CD1 3.99Å; E417-F423 HydrophobicContact CB-CE1 3.79Å; E417-F423 HydrophobicContact CG-CD1 4.12Å; E417-F423 HydrophobicContact CG-CE1 3.68Å; E417-F423 HydrophobicContact CG-CZ 4.34Å
418	E	83.2	Confident	86	Confident	88 Å²	88	89 Å²	89	41%	0.411	42%	0.423	S	S	.	.			trans	-92.7	-177.6	170.2	-69.7	-157	160.1	0	0	110.4	K416 E422 K424	K416-E418 PolarHBondContact O-N 3.32Å; E418-E422 PolarHBondContact N-O 3.37Å; E418-K424 HydrophobicContact CG-CB 3.91Å; E418-K424 WeakPolarHBondContact OE1-CD 3.39Å; E418-K424 IonicContact OE1-NZ 3.84Å
419	K	76.3	Confident	85.7	Confident	134 Å²	134	89.1 Å²	89.1	58%	0.583	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-66.6	144.7	177.1	-67.5	-179.5	-175.1	172	0	109	S3	S3-K419 PolarHBondContact OG-NZ 3.3Å
420	Y	72.3	Confident	85.7	Confident	228 Å²	228	89.7 Å²	89.7	89%	0.894	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	74	19.6	178.2	-46.9	-75.9	0	0	0	116.3	E422	Y420-E422 PolarHBondContact O-N 2.85Å
421	G	70.5	Confident	85.7	Confident	42 Å²	42	89.4 Å²	89.4	43%	0.433	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	78.2	7	172.8	0	0	0	0	0	114.4
422	E	74.3	Confident	85.8	Confident	142 Å²	142	86 Å²	86	66%	0.664	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-75.5	137.3	166.8	-71.5	-171.3	164.2	0	0	110.2	E418 Y420	E418-E422 PolarHBondContact N-O 3.37Å; Y420-E422 PolarHBondContact O-N 2.85Å
423	F	79.8	Confident	86	Confident	86 Å²	86	85 Å²	85	38%	0.377	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.3	177.5	-66.6	-74.6	0	0	0	110.1	K415 E417 Y425	K415-F423 HydrophobicContact CD-CD1 4.12Å; K415-F423 HydrophobicContact CD-CG 4.49Å; K415-F423 HydrophobicContact CG-CB 4.4Å; K415-F423 HydrophobicContact CG-CD1 3.91Å; K415-F423 HydrophobicContact CG-CG 4.39Å; E417-F423 HydrophobicContact CB-CD1 3.99Å; E417-F423 HydrophobicContact CB-CE1 3.79Å; E417-F423 HydrophobicContact CG-CD1 4.12Å; E417-F423 HydrophobicContact CG-CE1 3.68Å; E417-F423 HydrophobicContact CG-CZ 4.34Å; F423-Y425 HydrophobicContact CB-CE2 4.29Å
424	K	85.8	Confident	86.3	Confident	111 Å²	111	82.8 Å²	82.8	48%	0.483	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.3	168.6	-172.3	166.2	-176.5	169.4	0	110.1	K416 E418	K416-K424 PolarHBondContact N-O 3.28Å; K416-K424 PolarHBondContact O-N 2.88Å; E418-K424 HydrophobicContact CG-CB 3.91Å; E418-K424 WeakPolarHBondContact OE1-CD 3.39Å; E418-K424 IonicContact OE1-NZ 3.84Å
425	Y	86.8	Confident	86.6	Confident	77 Å²	77	76 Å²	76	30%	0.302	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	138.7	175.4	-57.5	-74.3	0	0	0	110.1	A392 Y412 K415 F423	A392-Y425 HydrophobicContact CB-CD1 4.07Å; A392-Y425 HydrophobicContact CB-CD2 3.88Å; A392-Y425 HydrophobicContact CB-CE1 4.22Å; A392-Y425 HydrophobicContact CB-CE2 4.07Å; A392-Y425 HydrophobicContact CB-CG 3.88Å; Y412-Y425 AromaticContact CD1-CD1 3.42Å; Y412-Y425 HydrophobicContact CD1-CD1 3.42Å; Y412-Y425 VanDerWaalsContact CD1-CD1 3.42Å; Y412-Y425 AromaticContact CD1-CE1 3.59Å; Y412-Y425 HydrophobicContact CD1-CE1 3.59Å; Y412-Y425 HydrophobicContact CD1-CG 4.42Å; Y412-Y425 HydrophobicContact CD2-CD1 4.21Å; Y412-Y425 HydrophobicContact CE1-CD1 4.04Å; Y412-Y425 AromaticContact CE1-CE1 3.74Å; Y412-Y425 HydrophobicContact CE1-CE1 3.74Å; Y412-Y425 AromaticContact CG-CD1 3.52Å; Y412-Y425 HydrophobicContact CG-CD1 3.52Å; Y412-Y425 HydrophobicContact CG-CE1 4.11Å; Y412-Y425 HydrophobicContact CG-CG 4.45Å; K415-Y425 HydrophobicContact CB-CD1 4.42Å; K415-Y425 HydrophobicContact CB-CE1 4.48Å; K415-Y425 HydrophobicContact CD-CE1 4.17Å; K415-Y425 HydrophobicContact CG-CD1 4.34Å; K415-Y425 HydrophobicContact CG-CE1 4.03Å; F423-Y425 HydrophobicContact CB-CE2 4.29Å
426	T	88.1	Confident	87	Confident	54 Å²	54	71.3 Å²	71.3	33%	0.331	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.4	175.4	63	0	0	0	0	111.5	G413 K414	G413-T426 PolarHBondContact N-O 3.5Å; K414-T426 PolarHBondContact N-O 3.36Å; K414-T426 PolarHBondContact O-N 3.22Å
427	N	88.2	Confident	87.3	Confident	122 Å²	122	65.1 Å²	65.1	65%	0.652	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.5	60.9	-172.1	-62.8	-7.5	0	0	0	111.5	G413	G413-N427 PolarHBondContact N-O 3.14Å
428	I	89.8	Confident	87.7	Confident	80 Å²	80	64.1 Å²	64.1	41%	0.41	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	128.2	-179.1	-61.3	172.3	0	0	0	108.9	D410 R411	D410-I428 HydrophobicContact CB-CG2 3.95Å; R411-I428 CarbonylContact O-C 3.49Å; R411-I428 VanDerWaalsContact O-CA 3.24Å; R411-I428 WeakPolarHBondContact O-CA 3.38Å
429	S	92.4	Very high	88	Confident	31 Å²	31	61 Å²	61	22%	0.217	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.3	166.9	65.7	0	0	0	0	110	R411 H431	R411-S429 PolarHBondContact N-O 2.75Å; R411-S429 PolarHBondContact O-N 2.95Å; S429-H431 PolarHBondContact OG-NE2 3.22Å; S429-H431 VanDerWaalsContact OG-NE2 3.14Å
430	H	95.1	Very high	88.7	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.056	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.6	-177.7	-59	-69	0	0	0	110	D410 I449 D451 V453	D410-H430 IonicContact OD1-CE1 2.96Å; D410-H430 PolarHBondContact OD1-CE1 3.39Å; D410-H430 IonicContact OD1-CG 3.27Å; D410-H430 IonicContact OD1-ND1 3.97Å; D410-H430 PolarHBondContact OD1-ND1 3.22Å; D410-H430 IonicContact OD2-CE1 3.98Å; D410-H430 IonicContact OD2-ND1 2.66Å; H430-I449 HydrophobicContact CB-CB 4.36Å; H430-I449 PolarHBondContact N-O 3.08Å; H430-I449 PolarHBondContact O-N 3.21Å; H430-I449 VanDerWaalsContact O-O 3.12Å; H430-D451 PolarHBondContact CD2-O 3Å; H430-D451 VanDerWaalsContact CD2-O 3.28Å; H430-V453 HydrophobicContact CB-CG2 3.89Å
431	H	95.4	Very high	89.6	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.056	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.1	176.5	-69.4	-102.1	0	0	0	109.5	V409 R411 S429 E448	V409-H431 PolarHBondContact N-O 3.45Å; V409-H431 PolarHBondContact O-N 3.4Å; R411-H431 WeakPolarHBondContact CD-CD2 3.24Å; S429-H431 PolarHBondContact OG-NE2 3.22Å; S429-H431 VanDerWaalsContact OG-NE2 3.14Å; H431-E448 IonicContact CE1-OE2 3.69Å
432	L	96	Very high	90.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	116.9	171.4	-53.4	-169	0	0	0	108.8	F407 K408 T446 L447 I449 I456 F465 T467	F407-L432 WeakPolarHBondContact O-CA 3.29Å; K408-L432 HydrophobicContact CB-CD2 3.81Å; K408-L432 HydrophobicContact CG-CD2 3.77Å; L432-T446 WeakPolarHBondContact O-CA 3.28Å; L432-L447 HydrophobicContact CB-CB 4.27Å; L432-L447 HydrophobicContact CD1-CD2 4.26Å; L432-L447 PolarHBondContact N-O 3.31Å; L432-L447 PolarHBondContact O-N 3.28Å; L432-I449 HydrophobicContact CD1-CD1 3.58Å; L432-I449 HydrophobicContact CD2-CD1 4.48Å; L432-I449 HydrophobicContact CG-CD1 3.82Å; L432-I456 HydrophobicContact CD1-CD1 4.05Å; L432-I456 HydrophobicContact CD2-CD1 3.39Å; L432-I456 HydrophobicContact CG-CD1 4.4Å; L432-F465 HydrophobicContact CD1-CE2 3.83Å; L432-F465 HydrophobicContact CD1-CZ 4.19Å; L432-T467 HydrophobicContact CD1-CG2 4.4Å
433	E	95.8	Very high	91.6	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	102.6	177.2	-60.4	-66.4	-179.9	0	0	109	K386 M388 C406 F407 V409 F435 V444 T446	K386-E433 IonicContact NZ-OE1 2.96Å; K386-E433 PolarHBondContact NZ-OE1 2.94Å; K386-E433 IonicContact NZ-OE2 2.85Å; K386-E433 PolarHBondContact NZ-OE2 3.35Å; M388-E433 HydrophobicContact SD-CG 4.45Å; C406-E433 WeakPolarHBondContact CA-O 3.43Å; F407-E433 HydrophobicContact CB-CB 4.3Å; F407-E433 PolarHBondContact N-O 2.99Å; F407-E433 PolarHBondContact O-N 3.01Å; V409-E433 HydrophobicContact CG2-CG 4.31Å; E433-F435 HydrophobicContact CB-CE2 4.34Å; E433-V444 HydrophobicContact CB-CG1 4.34Å; E433-T446 WeakPolarHBondContact OE1-CG2 3.45Å; E433-T446 PolarHBondContact OE1-OG1 3.47Å; E433-T446 PolarHBondContact OE2-OG1 2.89Å
434	I	96.1	Very high	92.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	111.3	-172.2	-60.7	168.1	0	0	0	109.7	L405 C406 H436 V444 S445 W458 F465 V481 V488	L405-I434 CarbonylContact O-C 3.5Å; L405-I434 WeakPolarHBondContact O-CA 3.31Å; C406-I434 HydrophobicContact CB-CG1 4.08Å; I434-H436 PolarHBondContact O-CD2 2.84Å; I434-V444 CarbonylContact O-C 3.56Å; I434-V444 VanDerWaalsContact O-CA 3.3Å; I434-V444 WeakPolarHBondContact O-CA 3.42Å; I434-S445 PolarHBondContact N-O 3.45Å; I434-S445 PolarHBondContact O-N 3.24Å; I434-W458 HydrophobicContact CG2-CH2 3.96Å; I434-W458 HydrophobicContact CG2-CZ2 4.23Å; I434-F465 HydrophobicContact CD1-CE1 3.72Å; I434-F465 HydrophobicContact CD1-CZ 3.87Å; I434-V481 HydrophobicContact CD1-CG2 4.21Å; I434-V481 HydrophobicContact CG2-CG1 4.08Å; I434-V488 HydrophobicContact CD1-CG1 4.36Å; I434-V488 HydrophobicContact CD1-CG2 3.75Å
435	F	95.8	Very high	92.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123.5	175.7	-73	-122.8	0	0	0	109.1	V372 R384 K386 N404 L405 F407 E433 V437 I442 V444	V372-F435 HydrophobicContact CG2-CE2 4.12Å; V372-F435 HydrophobicContact CG2-CZ 4.03Å; R384-F435 HydrophobicContact CB-CD1 4.04Å; R384-F435 HydrophobicContact CB-CE1 3.86Å; R384-F435 HydrophobicContact CG-CD1 3.8Å; R384-F435 HydrophobicContact CG-CE1 3.5Å; K386-F435 HydrophobicContact CB-CZ 4.36Å; N404-F435 WeakPolarHBondContact CA-O 3.4Å; L405-F435 HydrophobicContact CB-CB 4.13Å; L405-F435 HydrophobicContact CD2-CB 4.4Å; L405-F435 HydrophobicContact CD2-CG 4.46Å; L405-F435 HydrophobicContact CG-CB 4.42Å; L405-F435 PolarHBondContact N-O 2.81Å; L405-F435 PolarHBondContact O-N 3.14Å; F407-F435 AromaticContact CD2-CD2 3.98Å; F407-F435 HydrophobicContact CD2-CD2 3.98Å; F407-F435 AromaticContact CD2-CE2 3.72Å; F407-F435 HydrophobicContact CD2-CE2 3.72Å; F407-F435 HydrophobicContact CD2-CZ 4.48Å; F407-F435 HydrophobicContact CE2-CD2 4.11Å; F407-F435 AromaticContact CE2-CE2 3.85Å; F407-F435 HydrophobicContact CE2-CE2 3.85Å; F407-F435 HydrophobicContact CE2-CZ 4.23Å; E433-F435 HydrophobicContact CB-CE2 4.34Å; F435-V437 PolarHBondContact O-N 2.8Å; F435-I442 HydrophobicContact CB-CG2 4.12Å; F435-I442 HydrophobicContact CD1-CG2 4.06Å; F435-V444 HydrophobicContact CD1-CG2 3.85Å; F435-V444 HydrophobicContact CD2-CG1 4.01Å; F435-V444 HydrophobicContact CD2-CG2 4Å; F435-V444 HydrophobicContact CE1-CG2 3.86Å; F435-V444 HydrophobicContact CE2-CG1 3.91Å; F435-V444 HydrophobicContact CE2-CG2 3.97Å; F435-V444 HydrophobicContact CG-CG2 3.92Å; F435-V444 HydrophobicContact CZ-CG2 3.9Å
436	H	94.7	Very high	93	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	86.7	178.2	-62.7	-111.9	0	0	0	109.2	I434 R438 A439 P443 S445 V481 R482 S483 T486	I434-H436 PolarHBondContact O-CD2 2.84Å; H436-R438 VanDerWaalsContact C-N 3.28Å; H436-R438 PolarHBondContact O-N 3.02Å; H436-A439 HydrophobicContact CB-CB 4.01Å; H436-A439 PolarHBondContact O-N 2.88Å; H436-A439 VanDerWaalsContact O-N 3.14Å; H436-P443 HydrophobicContact CB-CG 4.08Å; H436-P443 PolarHBondContact CD2-O 2.99Å; H436-P443 PolarHBondContact N-O 2.64Å; H436-S445 PolarHBondContact NE2-OG 2.96Å; H436-V481 WeakPolarHBondContact CE1-CG1 3.23Å; H436-R482 PolarHBondContact CE1-O 3.05Å; H436-R482 VanDerWaalsContact CE1-O 3.22Å; H436-S483 PolarHBondContact ND1-OG 3.29Å; H436-T486 WeakPolarHBondContact CD2-CG2 3.31Å; H436-T486 VanDerWaalsContact CE1-CG2 3.47Å; H436-T486 WeakPolarHBondContact CE1-CG2 3.47Å; H436-T486 WeakPolarHBondContact NE2-CG2 3.4Å
437	V	93.7	Very high	93.3	Very high	12 Å²	12	45.4 Å²	45.4	7%	0.073	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-31.9	-166.7	-176.2	0	0	0	0	112.7	Y357 L374 W398 D403 L405 F435	Y357-V437 HydrophobicContact CD2-CG1 3.99Å; Y357-V437 HydrophobicContact CE2-CG1 3.71Å; L374-V437 HydrophobicContact CD2-CG1 4.21Å; L374-V437 HydrophobicContact CD2-CG2 4.06Å; W398-V437 HydrophobicContact CH2-CG2 4.29Å; W398-V437 HydrophobicContact CZ3-CG2 3.97Å; D403-V437 PolarHBondContact O-N 2.93Å; L405-V437 HydrophobicContact CB-CG2 4.28Å; F435-V437 PolarHBondContact O-N 2.8Å
438	R	91.1	Very high	93.6	Very high	113 Å²	113	44.9 Å²	44.9	43%	0.426	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-17.8	179.2	-58.1	-58.4	-179.6	-165.6	-2.9	114.4	T354 E355 D403 H436	T354-R438 PolarHBondContact OG1-NH2 2.85Å; E355-R438 IonicContact OE1-CZ 3.9Å; E355-R438 IonicContact OE1-NH1 3.54Å; E355-R438 PolarHBondContact OE1-NH1 2.86Å; E355-R438 IonicContact OE1-NH2 3.87Å; E355-R438 IonicContact OE2-NH1 3.79Å; E355-R438 PolarHBondContact OE2-NH1 2.98Å; D403-R438 HydrophobicContact CB-CG 3.86Å; D403-R438 WeakPolarHBondContact OD1-CG 3.2Å; D403-R438 IonicContact OD1-CZ 3.76Å; D403-R438 IonicContact OD1-NE 3.58Å; D403-R438 PolarHBondContact OD1-NE 3.32Å; D403-R438 IonicContact OD1-NH2 3.31Å; H436-R438 VanDerWaalsContact C-N 3.28Å; H436-R438 PolarHBondContact O-N 3.02Å
439	A	90.7	Very high	93.7	Very high	21 Å²	21	41.3 Å²	41.3	17%	0.174	21%	0.207	C	C	.	.	S	Bend	trans	-80	149.5	-179.4	0	0	0	0	0	110.8	H436 E441 I442 P443	H436-A439 HydrophobicContact CB-CB 4.01Å; H436-A439 PolarHBondContact O-N 2.88Å; H436-A439 VanDerWaalsContact O-N 3.14Å; A439-E441 PolarHBondContact O-N 3.02Å; A439-I442 PolarHBondContact O-N 2.95Å; A439-I442 VanDerWaalsContact O-N 3.08Å; A439-P443 HydrophobicContact CB-CG 3.92Å
440	K	90	Very high	93.5	Very high	184 Å²	184	48 Å²	48	80%	0.8	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	133.4	178.1	-169.9	-175.8	173.2	-174.6	0	109.7	I442	K440-I442 PolarHBondContact O-N 2.9Å
441	E	90.7	Very high	93.2	Very high	153 Å²	153	51.6 Å²	51.6	72%	0.715	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	6.3	-177.2	-62.9	174.4	-167.9	0	0	116.2	A439	A439-E441 PolarHBondContact O-N 3.02Å
442	I	93.7	Very high	93	Very high	17 Å²	17	53.6 Å²	53.6	9%	0.087	26%	0.264	C	S	.	.			trans	50.6	67.2	176.6	-48.5	179.3	0	0	0	111	L374 L383 R384 F435 A439 K440	L374-I442 HydrophobicContact CD2-CD1 3.95Å; L383-I442 HydrophobicContact CB-CD1 3.86Å; L383-I442 HydrophobicContact CD1-CD1 4.21Å; R384-I442 HydrophobicContact CB-CB 4.14Å; R384-I442 HydrophobicContact CB-CG2 4.14Å; R384-I442 WeakPolarHBondContact CD-O 3.45Å; R384-I442 HydrophobicContact CG-CB 4.34Å; R384-I442 HydrophobicContact CG-CG2 4.3Å; F435-I442 HydrophobicContact CB-CG2 4.12Å; F435-I442 HydrophobicContact CD1-CG2 4.06Å; A439-I442 PolarHBondContact O-N 2.95Å; A439-I442 VanDerWaalsContact O-N 3.08Å; K440-I442 PolarHBondContact O-N 2.9Å
443	P	94.1	Very high	92.9	Very high	35 Å²	35	54 Å²	54	23%	0.227	27%	0.267	C	S	.	.			trans	-62.8	152.7	178.2	30.2	-35.6	0	0	0	110.4	H436 A439 T486	H436-P443 HydrophobicContact CB-CG 4.08Å; H436-P443 PolarHBondContact CD2-O 2.99Å; H436-P443 PolarHBondContact N-O 2.64Å; A439-P443 HydrophobicContact CB-CG 3.92Å; P443-T486 HydrophobicContact CB-CG2 3.89Å; P443-T486 HydrophobicContact CG-CG2 3.66Å
444	V	94.2	Very high	92.8	Very high	35 Å²	35	57.4 Å²	57.4	21%	0.212	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.5	-177.8	-176	0	0	0	0	109.3	R384 K386 E433 I434 F435	R384-V444 HydrophobicContact CG-CG2 4.14Å; K386-V444 HydrophobicContact CD-CG1 4.31Å; E433-V444 HydrophobicContact CB-CG1 4.34Å; I434-V444 CarbonylContact O-C 3.56Å; I434-V444 VanDerWaalsContact O-CA 3.3Å; I434-V444 WeakPolarHBondContact O-CA 3.42Å; F435-V444 HydrophobicContact CD1-CG2 3.85Å; F435-V444 HydrophobicContact CD2-CG1 4.01Å; F435-V444 HydrophobicContact CD2-CG2 4Å; F435-V444 HydrophobicContact CE1-CG2 3.86Å; F435-V444 HydrophobicContact CE2-CG1 3.91Å; F435-V444 HydrophobicContact CE2-CG2 3.97Å; F435-V444 HydrophobicContact CG-CG2 3.92Å; F435-V444 HydrophobicContact CZ-CG2 3.9Å
445	S	94.2	Very high	92.7	Very high	13 Å²	13	58.4 Å²	58.4	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.6	171.9	-58.9	0	0	0	0	110.1	I434 H436 T486	I434-S445 PolarHBondContact N-O 3.45Å; I434-S445 PolarHBondContact O-N 3.24Å; H436-S445 PolarHBondContact NE2-OG 2.96Å; S445-T486 WeakPolarHBondContact OG-CG2 3.24Å
446	T	93.6	Very high	92.7	Very high	73 Å²	73	59.1 Å²	59.1	45%	0.448	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.7	176.1	-55	0	0	0	0	110	K386 L432 E433	K386-T446 PolarHBondContact NZ-OG1 3.11Å; L432-T446 WeakPolarHBondContact O-CA 3.28Å; E433-T446 WeakPolarHBondContact OE1-CG2 3.45Å; E433-T446 PolarHBondContact OE1-OG1 3.47Å; E433-T446 PolarHBondContact OE2-OG1 2.89Å
447	L	94.2	Very high	92.8	Very high	37 Å²	37	60.8 Å²	60.8	19%	0.194	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.2	172	172.9	65.8	0	0	0	109.1	L432 I449 F465 Y479 V488	L432-L447 HydrophobicContact CB-CB 4.27Å; L432-L447 HydrophobicContact CD1-CD2 4.26Å; L432-L447 PolarHBondContact N-O 3.31Å; L432-L447 PolarHBondContact O-N 3.28Å; L447-I449 HydrophobicContact CD2-CD1 4.4Å; L447-I449 HydrophobicContact CD2-CG1 4.42Å; L447-I449 HydrophobicContact CG-CG1 4.22Å; L447-F465 HydrophobicContact CD2-CZ 4.38Å; L447-Y479 HydrophobicContact CD1-CE1 4.48Å; L447-Y479 HydrophobicContact CD2-CD1 3.85Å; L447-Y479 HydrophobicContact CD2-CE1 3.55Å; L447-Y479 HydrophobicContact CD2-CE2 4.35Å; L447-Y479 HydrophobicContact CD2-CG 4.38Å; L447-V488 HydrophobicContact CD2-CG1 4.11Å
448	E	93.6	Very high	93	Very high	112 Å²	112	60.9 Å²	60.9	52%	0.523	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.3	174.4	-176	179.9	153.4	0	0	110	H431	H431-E448 IonicContact CE1-OE2 3.69Å
449	I	93.2	Very high	93.2	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.1	175.9	-57.2	172.4	0	0	0	107.6	H430 L432 L447 V453 Q469	H430-I449 HydrophobicContact CB-CB 4.36Å; H430-I449 PolarHBondContact N-O 3.08Å; H430-I449 PolarHBondContact O-N 3.21Å; H430-I449 VanDerWaalsContact O-O 3.12Å; L432-I449 HydrophobicContact CD1-CD1 3.58Å; L432-I449 HydrophobicContact CD2-CD1 4.48Å; L432-I449 HydrophobicContact CG-CD1 3.82Å; L447-I449 HydrophobicContact CD2-CD1 4.4Å; L447-I449 HydrophobicContact CD2-CG1 4.42Å; L447-I449 HydrophobicContact CG-CG1 4.22Å; I449-V453 HydrophobicContact CB-CG2 4.16Å; I449-V453 HydrophobicContact CD1-CG2 4.02Å; I449-V453 HydrophobicContact CG2-CG2 3.76Å; I449-Q469 HydrophobicContact CG2-CG 4.31Å
450	K	86.5	Confident	93.2	Very high	172 Å²	172	54.8 Å²	54.8	75%	0.748	28%	0.279	S	S	*	.			trans	-82.7	-32.5	-176.9	-67.8	-175.4	178.3	-180	0	113.1
451	D	90.2	Very high	93	Very high	87 Å²	87	52.1 Å²	52.1	47%	0.465	27%	0.272	S	S	.	.	S	Bend	trans	-82.8	155	180	-63.4	-45.9	0	0	0	111.3	H430 V453 Q469	H430-D451 PolarHBondContact CD2-O 3Å; H430-D451 VanDerWaalsContact CD2-O 3.28Å; D451-V453 PolarHBondContact O-N 3.03Å; D451-Q469 HydrophobicContact CB-CB 4.43Å
452	T	91.7	Very high	92.9	Very high	54 Å²	54	45.6 Å²	45.6	33%	0.331	25%	0.246	S	C	.	.			trans	-56.3	128	177	-50.3	0	0	0	0	110.5	Q469 G470 D471	T452-Q469 CarbonylContact O-C 3.43Å; T452-Q469 VanDerWaalsContact O-CA 3.26Å; T452-Q469 WeakPolarHBondContact O-CA 3.38Å; T452-G470 PolarHBondContact O-N 2.96Å; T452-D471 VanDerWaalsContact CB-OD1 3.25Å; T452-D471 WeakPolarHBondContact CB-OD1 3.42Å; T452-D471 WeakPolarHBondContact CG2-OD1 3.46Å; T452-D471 PolarHBondContact OG1-OD1 3.12Å; T452-D471 PolarHBondContact OG1-OD2 2.81Å
453	V	94	Very high	92.7	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.055	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	111	176.7	-176.7	0	0	0	0	109.6	H430 I449 D451 I456 Q469	H430-V453 HydrophobicContact CB-CG2 3.89Å; I449-V453 HydrophobicContact CB-CG2 4.16Å; I449-V453 HydrophobicContact CD1-CG2 4.02Å; I449-V453 HydrophobicContact CG2-CG2 3.76Å; D451-V453 PolarHBondContact O-N 3.03Å; V453-I456 HydrophobicContact CG1-CD1 3.88Å; V453-I456 HydrophobicContact CG1-CG1 3.55Å; V453-Q469 HydrophobicContact CG2-CG 4.48Å
454	Q	92.4	Very high	92.7	Very high	73 Å²	73	47.6 Å²	47.6	34%	0.341	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-41	179.6	-60.1	-170.3	18.5	0	0	112.4	I468 G470 V500	Q454-I468 HydrophobicContact CB-CB 4.29Å; Q454-I468 HydrophobicContact CB-CG2 3.98Å; Q454-I468 HydrophobicContact CG-CG2 4.28Å; Q454-I468 PolarHBondContact N-O 2.94Å; Q454-G470 PolarHBondContact NE2-O 2.99Å; Q454-V500 PolarHBondContact OE1-O 2.75Å
455	A	94.3	Very high	92.8	Very high	21 Å²	21	46 Å²	46	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	149.2	-177.5	0	0	0	0	0	111.8	T467 I468 I503	A455-T467 CarbonylContact O-C 3.59Å; A455-T467 WeakPolarHBondContact O-CA 3.17Å; A455-I468 HydrophobicContact CB-CB 4.35Å; A455-I468 HydrophobicContact CB-CD1 4.15Å; A455-I468 HydrophobicContact CB-CG1 4.48Å; A455-I468 PolarHBondContact O-N 3.3Å; A455-I503 HydrophobicContact CB-CD1 4Å; A455-I503 HydrophobicContact CB-CG1 4.08Å
456	I	96.5	Very high	92.9	Very high	16 Å²	16	45.4 Å²	45.4	8%	0.082	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.7	174.2	-56.4	-178	0	0	0	107.9	K408 L432 V453 F465 A466 T467	K408-I456 HydrophobicContact CB-CD1 3.83Å; K408-I456 HydrophobicContact CG-CD1 3.78Å; L432-I456 HydrophobicContact CD1-CD1 4.05Å; L432-I456 HydrophobicContact CD2-CD1 3.39Å; L432-I456 HydrophobicContact CG-CD1 4.4Å; V453-I456 HydrophobicContact CG1-CD1 3.88Å; V453-I456 HydrophobicContact CG1-CG1 3.55Å; I456-F465 HydrophobicContact CG2-CD2 4.28Å; I456-A466 WeakPolarHBondContact CA-O 3.22Å; I456-T467 HydrophobicContact CB-CG2 4.43Å; I456-T467 HydrophobicContact CD1-CG2 4.47Å; I456-T467 HydrophobicContact CG1-CG2 3.91Å; I456-T467 HydrophobicContact CG2-CG2 4.23Å
457	S	96.9	Very high	93.1	Very high	34 Å²	34	41.9 Å²	41.9	24%	0.238	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	132	175.5	-164.1	0	0	0	0	112.1	F465 A466 W505	S457-F465 WeakPolarHBondContact O-CA 3.34Å; S457-F465 WeakPolarHBondContact O-CB 3.3Å; S457-A466 PolarHBondContact N-O 2.91Å; S457-A466 PolarHBondContact O-N 2.75Å; S457-W505 PolarHBondContact O-NE1 3.07Å
458	W	96	Very high	93.2	Very high	14 Å²	14	40.1 Å²	40.1	5%	0.053	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.2	177.7	-73.2	103.9	0	0	0	112	H397 Q399 N404 C406 I434 P460 F465 V481 W505	H397-W458 PolarHBondContact O-NE1 2.7Å; Q399-W458 HydrophobicContact CB-CB 4.24Å; Q399-W458 HydrophobicContact CB-CD2 4.09Å; Q399-W458 HydrophobicContact CB-CE3 4.42Å; Q399-W458 HydrophobicContact CB-CG 4.01Å; Q399-W458 HydrophobicContact CG-CB 4.19Å; Q399-W458 HydrophobicContact CG-CE3 4.5Å; Q399-W458 HydrophobicContact CG-CG 4.41Å; N404-W458 HydrophobicContact CB-CH2 3.52Å; N404-W458 HydrophobicContact CB-CZ2 3.81Å; N404-W458 HydrophobicContact CB-CZ3 3.97Å; C406-W458 HydrophobicContact CB-CZ2 3.72Å; I434-W458 HydrophobicContact CG2-CH2 3.96Å; I434-W458 HydrophobicContact CG2-CZ2 4.23Å; W458-P460 WeakPolarHBondContact O-CD 3.32Å; W458-F465 HydrophobicContact CD2-CB 3.87Å; W458-F465 HydrophobicContact CD2-CG 4.49Å; W458-F465 HydrophobicContact CE3-CB 3.64Å; W458-F465 HydrophobicContact CE3-CD1 4.01Å; W458-F465 HydrophobicContact CE3-CG 4.22Å; W458-F465 HydrophobicContact CG-CB 4.31Å; W458-F465 AromaticContact CH2-CD1 3.86Å; W458-F465 HydrophobicContact CH2-CD1 3.86Å; W458-F465 HydrophobicContact CH2-CE1 4.33Å; W458-F465 HydrophobicContact CZ2-CD1 4.47Å; W458-F465 HydrophobicContact CZ3-CB 4.14Å; W458-F465 AromaticContact CZ3-CD1 3.59Å; W458-F465 HydrophobicContact CZ3-CD1 3.59Å; W458-F465 HydrophobicContact CZ3-CE1 4.43Å; W458-F465 HydrophobicContact CZ3-CG 4.25Å; W458-V481 HydrophobicContact CH2-CB 4.4Å; W458-V481 HydrophobicContact CH2-CG2 3.72Å; W458-V481 HydrophobicContact CZ3-CB 4.29Å; W458-V481 HydrophobicContact CZ3-CG2 3.75Å; W458-W505 VanDerWaalsContact O-CD1 3.26Å
459	E	95.4	Very high	93.2	Very high	3 Å²	3	35.1 Å²	35.1	1%	0.014	19%	0.188	C	C	.	.			trans	-62.9	123.2	162.1	-175.4	177.4	-147.8	0	0	109.1	Q399 L461 G462 K464 W505 H510	Q399-E459 PolarHBondContact NE2-O 3.13Å; Q399-E459 VanDerWaalsContact NE2-O 3.14Å; E459-L461 PolarHBondContact O-N 2.94Å; E459-G462 WeakPolarHBondContact OE2-CA 3.45Å; E459-K464 HydrophobicContact CB-CB 4.32Å; E459-K464 WeakPolarHBondContact CB-O 3.29Å; E459-K464 PolarHBondContact N-O 2.94Å; E459-K464 IonicContact OE1-NZ 3.68Å; E459-K464 PolarHBondContact OE1-NZ 2.88Å; E459-K464 WeakPolarHBondContact OE2-CB 3.45Å; E459-K464 WeakPolarHBondContact OE2-CE 3.49Å; E459-K464 IonicContact OE2-NZ 3.91Å; E459-K464 PolarHBondContact OE2-NZ 2.95Å; E459-W505 HydrophobicContact CB-CD2 4.25Å; E459-W505 HydrophobicContact CB-CE3 4.02Å; E459-W505 HydrophobicContact CB-CH2 4.09Å; E459-W505 HydrophobicContact CB-CZ2 4.29Å; E459-W505 HydrophobicContact CB-CZ3 3.94Å; E459-W505 HydrophobicContact CG-CE3 3.96Å; E459-W505 HydrophobicContact CG-CH2 4.49Å; E459-W505 HydrophobicContact CG-CZ3 3.9Å; E459-H510 PolarHBondContact OE1-N 2.72Å; E459-H510 IonicContact OE1-ND1 2.74Å
460	P	92	Very high	93.1	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.026	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-49.2	-173.2	-38.3	41.2	0	0	0	116.1	K400 S401 W458 W505	K400-P460 HydrophobicContact CB-CB 4.34Å; K400-P460 WeakPolarHBondContact CB-O 3.26Å; K400-P460 HydrophobicContact CD-CB 3.93Å; K400-P460 HydrophobicContact CD-CG 4.17Å; K400-P460 HydrophobicContact CG-CB 4.44Å; S401-P460 PolarHBondContact N-O 2.82Å; W458-P460 WeakPolarHBondContact O-CD 3.32Å; P460-W505 HydrophobicContact CG-CB 4.04Å
461	L	85.4	Confident	92.9	Very high	127 Å²	127	31.9 Å²	31.9	67%	0.665	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.3	16.9	-170.9	-61.9	175.8	0	0	0	112.7	E459	E459-L461 PolarHBondContact O-N 2.94Å
462	G	87.9	Confident	92.6	Very high	17 Å²	17	35.9 Å²	35.9	18%	0.175	20%	0.201	C	C	.	.	S	Bend	trans	-115.3	-145.9	-172.6	0	0	0	0	0	113.6	Q399 E459	Q399-G462 VanDerWaalsContact NE2-C 3.33Å; Q399-G462 PolarHBondContact NE2-O 2.85Å; E459-G462 WeakPolarHBondContact OE2-CA 3.45Å
463	T	90	Very high	92.4	Very high	64 Å²	64	39.2 Å²	39.2	39%	0.393	21%	0.211	S	C	.	.	S	Bend	trans	-134.8	8.6	172.5	65.6	0	0	0	0	111.9	V481	T463-V481 VanDerWaalsContact CB-O 3.24Å; T463-V481 WeakPolarHBondContact CB-O 3.4Å; T463-V481 PolarHBondContact O-N 3.45Å
464	K	93.9	Very high	92.4	Very high	30 Å²	30	38.8 Å²	38.8	13%	0.13	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	154.3	-177.2	-56.8	-174.2	-62.2	-63.1	0	110.1	E459 Y479 I491 T530	E459-K464 HydrophobicContact CB-CB 4.32Å; E459-K464 WeakPolarHBondContact CB-O 3.29Å; E459-K464 PolarHBondContact N-O 2.94Å; E459-K464 IonicContact OE1-NZ 3.68Å; E459-K464 PolarHBondContact OE1-NZ 2.88Å; E459-K464 WeakPolarHBondContact OE2-CB 3.45Å; E459-K464 WeakPolarHBondContact OE2-CE 3.49Å; E459-K464 IonicContact OE2-NZ 3.91Å; E459-K464 PolarHBondContact OE2-NZ 2.95Å; K464-Y479 CarbonylContact C-O 3.58Å; K464-Y479 WeakPolarHBondContact CA-O 3.48Å; K464-Y479 WeakPolarHBondContact CB-O 3.42Å; K464-I491 HydrophobicContact CD-CD1 3.65Å; K464-I491 HydrophobicContact CG-CD1 3.99Å; K464-T530 VanDerWaalsContact CE-CB 3.44Å; K464-T530 VanDerWaalsContact CE-O 3.25Å; K464-T530 WeakPolarHBondContact CE-O 3.32Å; K464-T530 WeakPolarHBondContact CE-OG1 3.47Å; K464-T530 PolarHBondContact NZ-O 2.91Å
465	F	95.9	Very high	92.5	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.8	165	67.2	-86.7	0	0	0	109.7	L432 I434 L447 I456 S457 W458 T467 Y479 V481 V488	L432-F465 HydrophobicContact CD1-CE2 3.83Å; L432-F465 HydrophobicContact CD1-CZ 4.19Å; I434-F465 HydrophobicContact CD1-CE1 3.72Å; I434-F465 HydrophobicContact CD1-CZ 3.87Å; L447-F465 HydrophobicContact CD2-CZ 4.38Å; I456-F465 HydrophobicContact CG2-CD2 4.28Å; S457-F465 WeakPolarHBondContact O-CA 3.34Å; S457-F465 WeakPolarHBondContact O-CB 3.3Å; W458-F465 HydrophobicContact CD2-CB 3.87Å; W458-F465 HydrophobicContact CD2-CG 4.49Å; W458-F465 HydrophobicContact CE3-CB 3.64Å; W458-F465 HydrophobicContact CE3-CD1 4.01Å; W458-F465 HydrophobicContact CE3-CG 4.22Å; W458-F465 HydrophobicContact CG-CB 4.31Å; W458-F465 AromaticContact CH2-CD1 3.86Å; W458-F465 HydrophobicContact CH2-CD1 3.86Å; W458-F465 HydrophobicContact CH2-CE1 4.33Å; W458-F465 HydrophobicContact CZ2-CD1 4.47Å; W458-F465 HydrophobicContact CZ3-CB 4.14Å; W458-F465 AromaticContact CZ3-CD1 3.59Å; W458-F465 HydrophobicContact CZ3-CD1 3.59Å; W458-F465 HydrophobicContact CZ3-CE1 4.43Å; W458-F465 HydrophobicContact CZ3-CG 4.25Å; F465-T467 HydrophobicContact CD2-CG2 3.82Å; F465-T467 HydrophobicContact CE2-CG2 3.72Å; F465-Y479 AromaticContact CD2-CD2 3.99Å; F465-Y479 HydrophobicContact CD2-CD2 3.99Å; F465-Y479 HydrophobicContact CE1-CD2 4.48Å; F465-Y479 HydrophobicContact CE1-CG 4.14Å; F465-Y479 AromaticContact CE2-CD2 3.34Å; F465-Y479 HydrophobicContact CE2-CD2 3.34Å; F465-Y479 HydrophobicContact CE2-CE2 4.11Å; F465-Y479 AromaticContact CE2-CG 3.81Å; F465-Y479 HydrophobicContact CE2-CG 3.81Å; F465-Y479 HydrophobicContact CZ-CD1 4.44Å; F465-Y479 AromaticContact CZ-CD2 3.64Å; F465-Y479 HydrophobicContact CZ-CD2 3.64Å; F465-Y479 AromaticContact CZ-CG 3.57Å; F465-Y479 HydrophobicContact CZ-CG 3.57Å; F465-Y479 PolarHBondContact N-O 2.91Å; F465-Y479 PolarHBondContact O-N 3.07Å; F465-V481 HydrophobicContact CD1-CG2 3.76Å; F465-V481 HydrophobicContact CE1-CG2 3.51Å; F465-V488 HydrophobicContact CE1-CG1 4.18Å; F465-V488 HydrophobicContact CZ-CG1 4.24Å
466	A	97.1	Very high	92.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.1	176.3	0	0	0	0	0	110.2	I456 S457 H477 F478 I503 W505 F514	I456-A466 WeakPolarHBondContact CA-O 3.22Å; S457-A466 PolarHBondContact N-O 2.91Å; S457-A466 PolarHBondContact O-N 2.75Å; A466-H477 CarbonylContact C-O 3.57Å; A466-H477 VanDerWaalsContact CA-O 3.29Å; A466-H477 WeakPolarHBondContact CA-O 3.39Å; A466-F478 HydrophobicContact CB-CD1 4.09Å; A466-F478 HydrophobicContact CB-CE1 4Å; A466-I503 HydrophobicContact CB-CD1 4.24Å; A466-I503 HydrophobicContact CB-CG2 4.37Å; A466-I503 WeakPolarHBondContact O-CD1 3.23Å; A466-W505 HydrophobicContact CB-CZ2 3.92Å; A466-F514 HydrophobicContact CB-CE1 3.97Å; A466-F514 HydrophobicContact CB-CZ 3.82Å
467	T	97.1	Very high	92.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.5	172.1	68.3	0	0	0	0	110.6	L432 A455 I456 F465 Q469 H477 Y479	L432-T467 HydrophobicContact CD1-CG2 4.4Å; A455-T467 CarbonylContact O-C 3.59Å; A455-T467 WeakPolarHBondContact O-CA 3.17Å; I456-T467 HydrophobicContact CB-CG2 4.43Å; I456-T467 HydrophobicContact CD1-CG2 4.47Å; I456-T467 HydrophobicContact CG1-CG2 3.91Å; I456-T467 HydrophobicContact CG2-CG2 4.23Å; F465-T467 HydrophobicContact CD2-CG2 3.82Å; F465-T467 HydrophobicContact CE2-CG2 3.72Å; T467-Q469 PolarHBondContact OG1-NE2 2.8Å; T467-H477 PolarHBondContact N-O 2.86Å; T467-H477 PolarHBondContact O-N 3.29Å; T467-Y479 HydrophobicContact CG2-CD2 4.26Å; T467-Y479 HydrophobicContact CG2-CE2 4.03Å
468	I	96.2	Very high	92.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.5	168.4	-64	171.7	0	0	0	107.7	Q454 A455 V500 I503 F514	Q454-I468 HydrophobicContact CB-CB 4.29Å; Q454-I468 HydrophobicContact CB-CG2 3.98Å; Q454-I468 HydrophobicContact CG-CG2 4.28Å; Q454-I468 PolarHBondContact N-O 2.94Å; A455-I468 HydrophobicContact CB-CB 4.35Å; A455-I468 HydrophobicContact CB-CD1 4.15Å; A455-I468 HydrophobicContact CB-CG1 4.48Å; A455-I468 PolarHBondContact O-N 3.3Å; I468-V500 HydrophobicContact CD1-CB 4.49Å; I468-V500 HydrophobicContact CD1-CG2 4.08Å; I468-V500 HydrophobicContact CG1-CG2 4.45Å; I468-V500 WeakPolarHBondContact CG2-O 3.21Å; I468-I503 HydrophobicContact CD1-CD1 4.21Å; I468-I503 HydrophobicContact CD1-CG1 3.58Å; I468-I503 HydrophobicContact CG1-CD1 3.94Å; I468-I503 HydrophobicContact CG1-CG1 3.85Å; I468-F514 HydrophobicContact CD1-CD1 4.14Å; I468-F514 HydrophobicContact CG1-CD1 4.14Å; I468-F514 HydrophobicContact CG1-CE1 4.46Å
469	Q	94.7	Very high	92.5	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149	-175.4	-58.2	-178.4	16.4	0	0	111.6	I449 D451 T452 V453 T467 F475 H477 Y479	I449-Q469 HydrophobicContact CG2-CG 4.31Å; D451-Q469 HydrophobicContact CB-CB 4.43Å; T452-Q469 CarbonylContact O-C 3.43Å; T452-Q469 VanDerWaalsContact O-CA 3.26Å; T452-Q469 WeakPolarHBondContact O-CA 3.38Å; V453-Q469 HydrophobicContact CG2-CG 4.48Å; T467-Q469 PolarHBondContact OG1-NE2 2.8Å; Q469-F475 PolarHBondContact N-O 3.21Å; Q469-F475 PolarHBondContact O-N 3.12Å; Q469-H477 PolarHBondContact OE1-CD2 2.99Å; Q469-H477 PolarHBondContact OE1-NE2 3.3Å; Q469-Y479 PolarHBondContact NE2-OH 3.12Å; Q469-Y479 VanDerWaalsContact NE2-OH 3.07Å
470	G	90.2	Very high	92.4	Very high	8 Å²	8	36.1 Å²	36.1	8%	0.082	19%	0.19	C	C	.	.			trans	94.9	157.3	175.1	0	0	0	0	0	114.1	T452 Q454 K473	T452-G470 PolarHBondContact O-N 2.96Å; Q454-G470 PolarHBondContact NE2-O 2.99Å; G470-K473 CarbonylContact C-O 3.51Å; G470-K473 WeakPolarHBondContact CA-O 3.27Å
471	D	83.5	Confident	92.4	Very high	102 Å²	102	36 Å²	36	55%	0.545	19%	0.189	S	C	.	.	S	Bend	trans	-99.6	-62.5	-179.3	-62.4	-40.8	0	0	0	111.4	T452 Q499	T452-D471 VanDerWaalsContact CB-OD1 3.25Å; T452-D471 WeakPolarHBondContact CB-OD1 3.42Å; T452-D471 WeakPolarHBondContact CG2-OD1 3.46Å; T452-D471 PolarHBondContact OG1-OD1 3.12Å; T452-D471 PolarHBondContact OG1-OD2 2.81Å; D471-Q499 PolarHBondContact O-NE2 2.71Å
472	L	83.1	Confident	92.2	Very high	170 Å²	170	37.8 Å²	37.8	89%	0.89	19%	0.187	S	C	*	.	S	Bend	trans	-79.5	-42	-178.5	-67.9	174	0	0	0	112.8	Q499	L472-Q499 VanDerWaalsContact C-NE2 3.32Å; L472-Q499 PolarHBondContact O-NE2 2.83Å
473	K	88.8	Confident	91.3	Very high	124 Å²	124	39.3 Å²	39.3	54%	0.539	20%	0.195	S	C	.	.	S	Bend	trans	-106.3	134.6	173.1	-72	-170.6	167.4	-150.2	0	108.5	G470 F475 E495	G470-K473 CarbonylContact C-O 3.51Å; G470-K473 WeakPolarHBondContact CA-O 3.27Å; K473-F475 HydrophobicContact CB-CD2 4.32Å; K473-F475 HydrophobicContact CB-CE2 3.61Å; K473-F475 HydrophobicContact CB-CZ 4.12Å; K473-F475 HydrophobicContact CD-CE2 4.24Å; K473-F475 HydrophobicContact CD-CZ 4.03Å; K473-E495 IonicContact NZ-OE1 3.1Å; K473-E495 PolarHBondContact NZ-OE1 2.96Å
474	C	92.4	Very high	90.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118	-179.4	-178.6	0	0	0	0	109.9	Q496 V500	C474-Q496 HydrophobicContact CB-CB 4.38Å; C474-Q496 PolarHBondContact O-N 2.75Å; C474-V500 WeakPolarHBondContact SG-CG2 3.45Å
475	F	95.7	Very high	89.3	Confident	51 Å²	51	46.3 Å²	46.3	22%	0.224	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.3	174.2	-63	-84	0	0	0	110.3	Q469 K473 H477 V493 L494 E495	Q469-F475 PolarHBondContact N-O 3.21Å; Q469-F475 PolarHBondContact O-N 3.12Å; K473-F475 HydrophobicContact CB-CD2 4.32Å; K473-F475 HydrophobicContact CB-CE2 3.61Å; K473-F475 HydrophobicContact CB-CZ 4.12Å; K473-F475 HydrophobicContact CD-CE2 4.24Å; K473-F475 HydrophobicContact CD-CZ 4.03Å; F475-H477 WeakPolarHBondContact CB-NE2 3.18Å; F475-V493 HydrophobicContact CB-CG1 4.23Å; F475-V493 HydrophobicContact CD1-CG1 4.02Å; F475-L494 WeakPolarHBondContact CA-O 3.27Å; F475-E495 HydrophobicContact CD1-CB 3.94Å; F475-E495 HydrophobicContact CD1-CG 4.14Å; F475-E495 HydrophobicContact CE1-CB 3.75Å; F475-E495 HydrophobicContact CE1-CG 3.62Å; F475-E495 HydrophobicContact CZ-CG 4.24Å
476	I	96.5	Very high	88.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	116.4	171.9	-59.3	169.2	0	0	0	107.6	F478 V493 L494 Q496 V500 F514	I476-F478 HydrophobicContact CG2-CD2 4.1Å; I476-F478 HydrophobicContact CG2-CE2 3.47Å; I476-F478 VanDerWaalsContact CG2-CE2 3.47Å; I476-F478 HydrophobicContact CG2-CZ 3.93Å; I476-V493 CarbonylContact O-C 3.56Å; I476-V493 WeakPolarHBondContact O-CA 3.34Å; I476-L494 HydrophobicContact CB-CB 4.28Å; I476-L494 PolarHBondContact N-O 2.92Å; I476-L494 PolarHBondContact O-N 3.29Å; I476-Q496 HydrophobicContact CD1-CG 3.47Å; I476-Q496 VanDerWaalsContact CD1-CG 3.47Å; I476-Q496 HydrophobicContact CG1-CG 3.97Å; I476-V500 HydrophobicContact CD1-CG2 4.14Å; I476-V500 HydrophobicContact CG1-CG2 4.28Å; I476-F514 HydrophobicContact CB-CE1 4.44Å; I476-F514 HydrophobicContact CD1-CB 4.01Å; I476-F514 HydrophobicContact CD1-CD1 3.73Å; I476-F514 HydrophobicContact CD1-CD2 3.8Å; I476-F514 HydrophobicContact CD1-CE1 4.15Å; I476-F514 HydrophobicContact CD1-CE2 4.2Å; I476-F514 HydrophobicContact CD1-CG 3.55Å; I476-F514 HydrophobicContact CD1-CZ 4.39Å; I476-F514 HydrophobicContact CG1-CD1 4.06Å; I476-F514 HydrophobicContact CG1-CE1 4.24Å; I476-F514 HydrophobicContact CG1-CG 4.39Å; I476-F514 HydrophobicContact CG2-CD1 4.07Å; I476-F514 HydrophobicContact CG2-CE1 3.39Å; I476-F514 HydrophobicContact CG2-CE2 3.97Å; I476-F514 HydrophobicContact CG2-CZ 3.34Å
477	H	96.2	Very high	87.9	Confident	21 Å²	21	51.8 Å²	51.8	10%	0.097	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.3	176.7	-63.5	-115.3	0	0	0	109.9	A466 T467 Q469 F475 Y479 V493	A466-H477 CarbonylContact C-O 3.57Å; A466-H477 VanDerWaalsContact CA-O 3.29Å; A466-H477 WeakPolarHBondContact CA-O 3.39Å; T467-H477 PolarHBondContact N-O 2.86Å; T467-H477 PolarHBondContact O-N 3.29Å; Q469-H477 PolarHBondContact OE1-CD2 2.99Å; Q469-H477 PolarHBondContact OE1-NE2 3.3Å; F475-H477 WeakPolarHBondContact CB-NE2 3.18Å; H477-Y479 HydrophobicContact CB-CD2 4.26Å; H477-Y479 HydrophobicContact CB-CE2 3.46Å; H477-Y479 VanDerWaalsContact CB-CE2 3.46Å; H477-V493 WeakPolarHBondContact ND1-CG2 3.23Å
478	F	96.3	Very high	87.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.2	171.6	-70.1	-91.1	0	0	0	109.6	A466 I476 I491 K492 L494 W505 V512 F514 V528 T530 V535	A466-F478 HydrophobicContact CB-CD1 4.09Å; A466-F478 HydrophobicContact CB-CE1 4Å; I476-F478 HydrophobicContact CG2-CD2 4.1Å; I476-F478 HydrophobicContact CG2-CE2 3.47Å; I476-F478 VanDerWaalsContact CG2-CE2 3.47Å; I476-F478 HydrophobicContact CG2-CZ 3.93Å; F478-I491 HydrophobicContact CB-CB 4.22Å; F478-I491 HydrophobicContact CB-CD1 4.47Å; F478-I491 PolarHBondContact O-N 3.36Å; F478-K492 HydrophobicContact CB-CB 4.49Å; F478-K492 HydrophobicContact CD2-CB 4.41Å; F478-K492 PolarHBondContact N-O 3.02Å; F478-L494 HydrophobicContact CE2-CD1 3.8Å; F478-L494 HydrophobicContact CE2-CG 4.32Å; F478-W505 HydrophobicContact CE1-CH2 4.25Å; F478-W505 HydrophobicContact CE1-CZ2 4.47Å; F478-V512 HydrophobicContact CE1-CG1 4.01Å; F478-V512 HydrophobicContact CZ-CG1 4.21Å; F478-F514 HydrophobicContact CE1-CE2 4.34Å; F478-F514 AromaticContact CE1-CZ 3.98Å; F478-F514 HydrophobicContact CE1-CZ 3.98Å; F478-F514 HydrophobicContact CE2-CE2 4.41Å; F478-F514 HydrophobicContact CE2-CZ 4.24Å; F478-F514 AromaticContact CZ-CE2 3.6Å; F478-F514 HydrophobicContact CZ-CE2 3.6Å; F478-F514 AromaticContact CZ-CZ 3.49Å; F478-F514 HydrophobicContact CZ-CZ 3.49Å; F478-F514 VanDerWaalsContact CZ-CZ 3.49Å; F478-V528 HydrophobicContact CE1-CG1 4.44Å; F478-V528 HydrophobicContact CE2-CG1 4.35Å; F478-V528 HydrophobicContact CZ-CB 4.43Å; F478-V528 HydrophobicContact CZ-CG1 3.73Å; F478-T530 HydrophobicContact CD1-CG2 4.07Å; F478-T530 HydrophobicContact CE1-CG2 3.66Å; F478-T530 HydrophobicContact CZ-CG2 4.38Å; F478-V535 HydrophobicContact CB-CG2 4.2Å; F478-V535 HydrophobicContact CD1-CG2 4.31Å; F478-V535 HydrophobicContact CD2-CB 4.46Å; F478-V535 HydrophobicContact CD2-CG1 3.9Å; F478-V535 HydrophobicContact CD2-CG2 4.17Å; F478-V535 HydrophobicContact CE1-CG1 4.29Å; F478-V535 HydrophobicContact CE2-CG1 3.61Å; F478-V535 HydrophobicContact CG-CG1 4.35Å; F478-V535 HydrophobicContact CG-CG2 3.97Å; F478-V535 HydrophobicContact CZ-CG1 3.8Å
479	Y	95.1	Very high	87.4	Confident	14 Å²	14	56.3 Å²	56.3	6%	0.055	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.6	176.3	-60.9	-85.7	0	0	0	110	L447 K464 F465 T467 Q469 H477 V488 T489 M490	L447-Y479 HydrophobicContact CD1-CE1 4.48Å; L447-Y479 HydrophobicContact CD2-CD1 3.85Å; L447-Y479 HydrophobicContact CD2-CE1 3.55Å; L447-Y479 HydrophobicContact CD2-CE2 4.35Å; L447-Y479 HydrophobicContact CD2-CG 4.38Å; K464-Y479 CarbonylContact C-O 3.58Å; K464-Y479 WeakPolarHBondContact CA-O 3.48Å; K464-Y479 WeakPolarHBondContact CB-O 3.42Å; F465-Y479 AromaticContact CD2-CD2 3.99Å; F465-Y479 HydrophobicContact CD2-CD2 3.99Å; F465-Y479 HydrophobicContact CE1-CD2 4.48Å; F465-Y479 HydrophobicContact CE1-CG 4.14Å; F465-Y479 AromaticContact CE2-CD2 3.34Å; F465-Y479 HydrophobicContact CE2-CD2 3.34Å; F465-Y479 HydrophobicContact CE2-CE2 4.11Å; F465-Y479 AromaticContact CE2-CG 3.81Å; F465-Y479 HydrophobicContact CE2-CG 3.81Å; F465-Y479 HydrophobicContact CZ-CD1 4.44Å; F465-Y479 AromaticContact CZ-CD2 3.64Å; F465-Y479 HydrophobicContact CZ-CD2 3.64Å; F465-Y479 AromaticContact CZ-CG 3.57Å; F465-Y479 HydrophobicContact CZ-CG 3.57Å; F465-Y479 PolarHBondContact N-O 2.91Å; F465-Y479 PolarHBondContact O-N 3.07Å; T467-Y479 HydrophobicContact CG2-CD2 4.26Å; T467-Y479 HydrophobicContact CG2-CE2 4.03Å; Q469-Y479 PolarHBondContact NE2-OH 3.12Å; Q469-Y479 VanDerWaalsContact NE2-OH 3.07Å; H477-Y479 HydrophobicContact CB-CD2 4.26Å; H477-Y479 HydrophobicContact CB-CE2 3.46Å; H477-Y479 VanDerWaalsContact CB-CE2 3.46Å; Y479-V488 HydrophobicContact CD1-CG1 4.18Å; Y479-T489 CarbonylContact C-O 3.51Å; Y479-T489 VanDerWaalsContact CA-O 3.28Å; Y479-T489 WeakPolarHBondContact CA-O 3.3Å; Y479-M490 HydrophobicContact CD1-CB 3.98Å; Y479-M490 HydrophobicContact CD1-CG 4.3Å; Y479-M490 HydrophobicContact CE1-CB 3.89Å; Y479-M490 HydrophobicContact CE1-CG 3.99Å
480	S	93	Very high	87.4	Confident	19 Å²	19	61.3 Å²	61.3	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.9	168.4	-169.9	0	0	0	0	108.9	V488 T489	S480-V488 WeakPolarHBondContact O-CA 3.47Å; S480-T489 PolarHBondContact N-O 2.87Å; S480-T489 PolarHBondContact O-N 2.93Å
481	V	91	Very high	87.5	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.8	176.7	-177.4	0	0	0	0	108.1	I434 H436 W458 T463 F465 V488	I434-V481 HydrophobicContact CD1-CG2 4.21Å; I434-V481 HydrophobicContact CG2-CG1 4.08Å; H436-V481 WeakPolarHBondContact CE1-CG1 3.23Å; W458-V481 HydrophobicContact CH2-CB 4.4Å; W458-V481 HydrophobicContact CH2-CG2 3.72Å; W458-V481 HydrophobicContact CZ3-CB 4.29Å; W458-V481 HydrophobicContact CZ3-CG2 3.75Å; T463-V481 VanDerWaalsContact CB-O 3.24Å; T463-V481 WeakPolarHBondContact CB-O 3.4Å; T463-V481 PolarHBondContact O-N 3.45Å; F465-V481 HydrophobicContact CD1-CG2 3.76Å; F465-V481 HydrophobicContact CE1-CG2 3.51Å; V481-V488 HydrophobicContact CG2-CG2 4.38Å
482	R	81.3	Confident	88	Confident	165 Å²	165	61.8 Å²	61.8	62%	0.623	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.1	171.3	-73.6	-176.3	145.7	174.7	-6	108.9	H436 P485 T486 V487	H436-R482 PolarHBondContact CE1-O 3.05Å; H436-R482 VanDerWaalsContact CE1-O 3.22Å; R482-P485 CarbonylContact C-O 3.57Å; R482-P485 VanDerWaalsContact O-O 3.06Å; R482-T486 CarbonylContact O-C 3.53Å; R482-T486 VanDerWaalsContact O-CA 3.29Å; R482-T486 WeakPolarHBondContact O-CA 3.43Å; R482-V487 PolarHBondContact N-O 2.86Å; R482-V487 PolarHBondContact O-N 2.75Å
483	S	69.9	Low	88.6	Confident	48 Å²	48	56.3 Å²	56.3	34%	0.336	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-17.4	-178.9	-44.9	0	0	0	0	112.6	H436 T486	H436-S483 PolarHBondContact ND1-OG 3.29Å; S483-T486 PolarHBondContact O-OG1 2.83Å
484	D	71.5	Confident	88.9	Confident	154 Å²	154	51.5 Å²	51.5	82%	0.824	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.6	102.9	179	-169.1	7.4	0	0	0	111.2
485	P	70.9	Confident	88.9	Confident	87 Å²	87	56.9 Å²	56.9	57%	0.565	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	cis	-68	153.9	-8	30.5	-34.9	0	0	0	111.3	R482 V487	R482-P485 CarbonylContact C-O 3.57Å; R482-P485 VanDerWaalsContact O-O 3.06Å; P485-V487 VanDerWaalsContact C-N 3.33Å; P485-V487 HydrophobicContact CB-CG2 4.11Å; P485-V487 HydrophobicContact CG-CG2 4.01Å; P485-V487 PolarHBondContact O-N 3.39Å
486	T	78.8	Confident	88.7	Confident	54 Å²	54	55.3 Å²	55.3	33%	0.331	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	83.2	-178.9	-29.7	0	0	0	0	111.6	H436 P443 S445 R482 S483	H436-T486 WeakPolarHBondContact CD2-CG2 3.31Å; H436-T486 VanDerWaalsContact CE1-CG2 3.47Å; H436-T486 WeakPolarHBondContact CE1-CG2 3.47Å; H436-T486 WeakPolarHBondContact NE2-CG2 3.4Å; P443-T486 HydrophobicContact CB-CG2 3.89Å; P443-T486 HydrophobicContact CG-CG2 3.66Å; S445-T486 WeakPolarHBondContact OG-CG2 3.24Å; R482-T486 CarbonylContact O-C 3.53Å; R482-T486 VanDerWaalsContact O-CA 3.29Å; R482-T486 WeakPolarHBondContact O-CA 3.43Å; S483-T486 PolarHBondContact O-OG1 2.83Å
487	V	83.9	Confident	88.2	Confident	63 Å²	63	65.5 Å²	65.5	38%	0.382	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.8	-173.2	-176.4	0	0	0	0	110.2	R482 P485 T489	R482-V487 PolarHBondContact N-O 2.86Å; R482-V487 PolarHBondContact O-N 2.75Å; P485-V487 VanDerWaalsContact C-N 3.33Å; P485-V487 HydrophobicContact CB-CG2 4.11Å; P485-V487 HydrophobicContact CG-CG2 4.01Å; P485-V487 PolarHBondContact O-N 3.39Å; V487-T489 HydrophobicContact CG1-CG2 3.69Å
488	V	91.6	Very high	87.9	Confident	31 Å²	31	68.4 Å²	68.4	19%	0.188	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	116.4	168.9	-177	0	0	0	0	107	I434 L447 F465 Y479 S480 V481	I434-V488 HydrophobicContact CD1-CG1 4.36Å; I434-V488 HydrophobicContact CD1-CG2 3.75Å; L447-V488 HydrophobicContact CD2-CG1 4.11Å; F465-V488 HydrophobicContact CE1-CG1 4.18Å; F465-V488 HydrophobicContact CZ-CG1 4.24Å; Y479-V488 HydrophobicContact CD1-CG1 4.18Å; S480-V488 WeakPolarHBondContact O-CA 3.47Å; V481-V488 HydrophobicContact CG2-CG2 4.38Å
489	T	92.1	Very high	87.5	Confident	63 Å²	63	70.8 Å²	70.8	39%	0.387	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134	179.5	58.5	0	0	0	0	110.3	Y479 S480 V487	Y479-T489 CarbonylContact C-O 3.51Å; Y479-T489 VanDerWaalsContact CA-O 3.28Å; Y479-T489 WeakPolarHBondContact CA-O 3.3Å; S480-T489 PolarHBondContact N-O 2.87Å; S480-T489 PolarHBondContact O-N 2.93Å; V487-T489 HydrophobicContact CG1-CG2 3.69Å
490	M	92.9	Very high	87.4	Confident	111 Å²	111	70.1 Å²	70.1	55%	0.547	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	123.3	169.5	-172.1	-178.7	71.3	0	0	108.8	Y479 V493	Y479-M490 HydrophobicContact CD1-CB 3.98Å; Y479-M490 HydrophobicContact CD1-CG 4.3Å; Y479-M490 HydrophobicContact CE1-CB 3.89Å; Y479-M490 HydrophobicContact CE1-CG 3.99Å; M490-V493 HydrophobicContact CE-CG2 3.86Å; M490-V493 HydrophobicContact CG-CG2 4.32Å; M490-V493 HydrophobicContact SD-CG2 3.42Å; M490-V493 WeakPolarHBondContact SD-CG2 3.37Å
491	I	92.9	Very high	87.4	Confident	55 Å²	55	71.4 Å²	71.4	28%	0.282	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-51.1	-178.7	-50	174	0	0	0	109.9	K464 F478 V535	K464-I491 HydrophobicContact CD-CD1 3.65Å; K464-I491 HydrophobicContact CG-CD1 3.99Å; F478-I491 HydrophobicContact CB-CB 4.22Å; F478-I491 HydrophobicContact CB-CD1 4.47Å; F478-I491 PolarHBondContact O-N 3.36Å; I491-V535 HydrophobicContact CG2-CG2 4.19Å
492	K	94.2	Very high	87.6	Confident	66 Å²	66	72.6 Å²	72.6	29%	0.287	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	150.2	-171.7	-164.7	69.1	161.8	-141.9	0	110.8	F478 L494 D534 V535	F478-K492 HydrophobicContact CB-CB 4.49Å; F478-K492 HydrophobicContact CD2-CB 4.41Å; F478-K492 PolarHBondContact N-O 3.02Å; K492-L494 HydrophobicContact CG-CD2 3.87Å; K492-L494 HydrophobicContact CG-CG 4.36Å; K492-D534 VanDerWaalsContact NZ-CG 3.33Å; K492-D534 IonicContact NZ-OD1 2.8Å; K492-D534 PolarHBondContact NZ-OD1 2.85Å; K492-D534 IonicContact NZ-OD2 3.53Å; K492-D534 PolarHBondContact NZ-OD2 2.78Å; K492-V535 HydrophobicContact CB-CB 4.06Å; K492-V535 HydrophobicContact CB-CG2 4.02Å; K492-V535 HydrophobicContact CG-CB 4.17Å
493	V	95.4	Very high	88.4	Confident	54 Å²	54	65.7 Å²	65.7	33%	0.327	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.1	165.7	-173.9	0	0	0	0	107.8	F475 I476 H477 M490	F475-V493 HydrophobicContact CB-CG1 4.23Å; F475-V493 HydrophobicContact CD1-CG1 4.02Å; I476-V493 CarbonylContact O-C 3.56Å; I476-V493 WeakPolarHBondContact O-CA 3.34Å; H477-V493 WeakPolarHBondContact ND1-CG2 3.23Å; M490-V493 HydrophobicContact CE-CG2 3.86Å; M490-V493 HydrophobicContact CG-CG2 4.32Å; M490-V493 HydrophobicContact SD-CG2 3.42Å; M490-V493 WeakPolarHBondContact SD-CG2 3.37Å
494	L	94.7	Very high	89.7	Confident	23 Å²	23	65.9 Å²	65.9	12%	0.12	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.2	173.4	-54.3	176.8	0	0	0	108.7	F475 I476 F478 K492 V528 V535 V537	F475-L494 WeakPolarHBondContact CA-O 3.27Å; I476-L494 HydrophobicContact CB-CB 4.28Å; I476-L494 PolarHBondContact N-O 2.92Å; I476-L494 PolarHBondContact O-N 3.29Å; F478-L494 HydrophobicContact CE2-CD1 3.8Å; F478-L494 HydrophobicContact CE2-CG 4.32Å; K492-L494 HydrophobicContact CG-CD2 3.87Å; K492-L494 HydrophobicContact CG-CG 4.36Å; L494-V528 HydrophobicContact CD1-CG2 4.44Å; L494-V535 HydrophobicContact CD1-CG1 4.32Å; L494-V537 HydrophobicContact CD1-CG2 3.88Å
495	E	94.2	Very high	90.9	Very high	114 Å²	114	59.4 Å²	59.4	53%	0.533	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.4	169.4	-174.4	172.5	-169.5	0	0	108.7	K473 F475	K473-E495 IonicContact NZ-OE1 3.1Å; K473-E495 PolarHBondContact NZ-OE1 2.96Å; F475-E495 HydrophobicContact CD1-CB 3.94Å; F475-E495 HydrophobicContact CD1-CG 4.14Å; F475-E495 HydrophobicContact CE1-CB 3.75Å; F475-E495 HydrophobicContact CE1-CG 3.62Å; F475-E495 HydrophobicContact CZ-CG 4.24Å
496	Q	90.7	Very high	92.1	Very high	18 Å²	18	55.3 Å²	55.3	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.8	176.4	-65	-55.3	-37.1	0	0	110.5	C474 I476 Q498 Q540	C474-Q496 HydrophobicContact CB-CB 4.38Å; C474-Q496 PolarHBondContact O-N 2.75Å; I476-Q496 HydrophobicContact CD1-CG 3.47Å; I476-Q496 VanDerWaalsContact CD1-CG 3.47Å; I476-Q496 HydrophobicContact CG1-CG 3.97Å; Q496-Q498 WeakPolarHBondContact CB-O 3.42Å; Q496-Q540 VanDerWaalsContact OE1-NE2 3.1Å
497	K	86.8	Confident	92.8	Very high	215 Å²	215	54.6 Å²	54.6	94%	0.935	28%	0.275	S	S	*	.	S	Bend	trans	-68.2	-38.4	177.1	-67.3	-178.5	180	176.9	0	111.9
498	Q	88.2	Confident	93.1	Very high	81 Å²	81	54.8 Å²	54.8	38%	0.379	28%	0.276	S	S	.	.	S	Bend	trans	-101.4	147.9	177.5	-69.3	173.7	-23.1	0	0	109.5	Q496 T524	Q496-Q498 WeakPolarHBondContact CB-O 3.42Å; Q498-T524 HydrophobicContact CB-CG2 4.03Å; Q498-T524 WeakPolarHBondContact CB-OG1 3.25Å; Q498-T524 VanDerWaalsContact CD-OG1 3.25Å; Q498-T524 PolarHBondContact OE1-OG1 2.86Å
499	Q	89.3	Confident	93	Very high	50 Å²	50	53.3 Å²	53.3	23%	0.234	27%	0.268	C	S	.	.			trans	-72.2	131.6	-178.6	-76.3	-77	-18.1	0	0	110.7	D471 L472 L521	D471-Q499 PolarHBondContact O-NE2 2.71Å; L472-Q499 VanDerWaalsContact C-NE2 3.32Å; L472-Q499 PolarHBondContact O-NE2 2.83Å; Q499-L521 HydrophobicContact CB-CD2 3.39Å; Q499-L521 HydrophobicContact CG-CD2 4.39Å
500	V	93.5	Very high	93	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.			trans	-125.4	145.9	170.7	-66.7	0	0	0	0	108.3	Q454 I468 C474 I476 F514 V526	Q454-V500 PolarHBondContact OE1-O 2.75Å; I468-V500 HydrophobicContact CD1-CB 4.49Å; I468-V500 HydrophobicContact CD1-CG2 4.08Å; I468-V500 HydrophobicContact CG1-CG2 4.45Å; I468-V500 WeakPolarHBondContact CG2-O 3.21Å; C474-V500 WeakPolarHBondContact SG-CG2 3.45Å; I476-V500 HydrophobicContact CD1-CG2 4.14Å; I476-V500 HydrophobicContact CG1-CG2 4.28Å; V500-F514 HydrophobicContact CB-CB 4.28Å; V500-F514 HydrophobicContact CG1-CB 4.31Å; V500-F514 HydrophobicContact CG2-CB 4.16Å; V500-V526 HydrophobicContact CG1-CG2 4.49Å
501	N	92.8	Very high	93.2	Very high	47 Å²	47	50.6 Å²	50.6	25%	0.251	25%	0.249	S	C	.	.			trans	-132	-6.8	-176.2	64.2	2.7	0	0	0	113.7	A515 L517 L521	N501-A515 PolarHBondContact N-O 3.3Å; N501-A515 PolarHBondContact OD1-O 3.16Å; N501-A515 VanDerWaalsContact OD1-O 3.12Å; N501-L517 PolarHBondContact ND2-O 3.17Å; N501-L517 PolarHBondContact OD1-N 3.14Å; N501-L521 HydrophobicContact CB-CD1 4.21Å; N501-L521 VanDerWaalsContact ND2-CD1 3.27Å; N501-L521 WeakPolarHBondContact ND2-CD1 3.35Å
502	S	95.2	Very high	93.4	Very high	26 Å²	26	48 Å²	48	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	143.1	-173.2	-56.8	0	0	0	0	111.3	F504 F514 A515	S502-F504 VanDerWaalsContact CB-CE2 3.44Å; S502-F514 WeakPolarHBondContact O-CA 3.26Å; S502-A515 PolarHBondContact N-O 2.91Å; S502-A515 PolarHBondContact O-N 3.07Å
503	I	97.1	Very high	93.5	Very high	19 Å²	19	44.9 Å²	44.9	10%	0.097	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	121.1	-177.3	-47.9	175.1	0	0	0	109.5	A455 A466 I468 V512 F514	A455-I503 HydrophobicContact CB-CD1 4Å; A455-I503 HydrophobicContact CB-CG1 4.08Å; A466-I503 HydrophobicContact CB-CD1 4.24Å; A466-I503 HydrophobicContact CB-CG2 4.37Å; A466-I503 WeakPolarHBondContact O-CD1 3.23Å; I468-I503 HydrophobicContact CD1-CD1 4.21Å; I468-I503 HydrophobicContact CD1-CG1 3.58Å; I468-I503 HydrophobicContact CG1-CD1 3.94Å; I468-I503 HydrophobicContact CG1-CG1 3.85Å; I503-V512 HydrophobicContact CG2-CG2 3.54Å; I503-F514 HydrophobicContact CB-CD1 4.41Å; I503-F514 HydrophobicContact CB-CE1 4.32Å; I503-F514 HydrophobicContact CD1-CE1 4.11Å; I503-F514 HydrophobicContact CG1-CD1 3.88Å; I503-F514 HydrophobicContact CG1-CE1 3.82Å; I503-F514 HydrophobicContact CG2-CD1 4.2Å; I503-F514 HydrophobicContact CG2-CE1 3.76Å; I503-F514 HydrophobicContact CG2-CZ 4.28Å
504	F	97	Very high	93.6	Very high	53 Å²	53	42.3 Å²	42.3	23%	0.232	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	100.5	-178.9	-62.2	-85.8	0	0	0	110.8	S502 L513 A515 L517 I549 W551	S502-F504 VanDerWaalsContact CB-CE2 3.44Å; F504-L513 HydrophobicContact CB-CB 4.33Å; F504-L513 PolarHBondContact N-O 2.98Å; F504-L513 PolarHBondContact O-N 2.98Å; F504-A515 HydrophobicContact CD2-CB 4.42Å; F504-A515 HydrophobicContact CE2-CB 4.21Å; F504-L517 HydrophobicContact CE2-CD1 3.84Å; F504-L517 HydrophobicContact CZ-CD1 3.73Å; F504-I549 HydrophobicContact CB-CG2 4.43Å; F504-I549 HydrophobicContact CD1-CB 4.41Å; F504-I549 HydrophobicContact CD1-CG2 4.29Å; F504-I549 HydrophobicContact CD2-CB 4.2Å; F504-I549 HydrophobicContact CD2-CD1 4.25Å; F504-I549 HydrophobicContact CD2-CG2 4.01Å; F504-I549 HydrophobicContact CE1-CB 4.23Å; F504-I549 HydrophobicContact CE2-CB 3.99Å; F504-I549 HydrophobicContact CE2-CD1 4.01Å; F504-I549 HydrophobicContact CE2-CG1 4.39Å; F504-I549 HydrophobicContact CE2-CG2 4.33Å; F504-I549 HydrophobicContact CG-CB 4.4Å; F504-I549 HydrophobicContact CG-CG2 3.99Å; F504-I549 HydrophobicContact CZ-CB 4.02Å; F504-W551 PolarHBondContact O-NE1 3.47Å
505	W	96.8	Very high	93.7	Very high	18 Å²	18	41.2 Å²	41.2	7%	0.068	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	139.8	173.7	-71.8	92.9	0	0	0	111.7	S457 W458 E459 P460 A466 F478 V512 T530	S457-W505 PolarHBondContact O-NE1 3.07Å; W458-W505 VanDerWaalsContact O-CD1 3.26Å; E459-W505 HydrophobicContact CB-CD2 4.25Å; E459-W505 HydrophobicContact CB-CE3 4.02Å; E459-W505 HydrophobicContact CB-CH2 4.09Å; E459-W505 HydrophobicContact CB-CZ2 4.29Å; E459-W505 HydrophobicContact CB-CZ3 3.94Å; E459-W505 HydrophobicContact CG-CE3 3.96Å; E459-W505 HydrophobicContact CG-CH2 4.49Å; E459-W505 HydrophobicContact CG-CZ3 3.9Å; P460-W505 HydrophobicContact CG-CB 4.04Å; A466-W505 HydrophobicContact CB-CZ2 3.92Å; F478-W505 HydrophobicContact CE1-CH2 4.25Å; F478-W505 HydrophobicContact CE1-CZ2 4.47Å; W505-V512 HydrophobicContact CD2-CB 3.73Å; W505-V512 HydrophobicContact CD2-CG2 3.77Å; W505-V512 HydrophobicContact CE3-CB 3.65Å; W505-V512 HydrophobicContact CE3-CG1 4.36Å; W505-V512 HydrophobicContact CE3-CG2 4.23Å; W505-V512 HydrophobicContact CG-CB 4.28Å; W505-V512 HydrophobicContact CG-CG2 3.97Å; W505-V512 HydrophobicContact CH2-CB 4.28Å; W505-V512 HydrophobicContact CH2-CG1 4.19Å; W505-V512 HydrophobicContact CZ2-CB 4.37Å; W505-V512 HydrophobicContact CZ2-CG1 4.47Å; W505-V512 HydrophobicContact CZ2-CG2 4.36Å; W505-V512 HydrophobicContact CZ3-CB 3.93Å; W505-V512 HydrophobicContact CZ3-CG1 4.13Å; W505-T530 HydrophobicContact CH2-CG2 4.08Å; W505-T530 HydrophobicContact CZ3-CG2 4.22Å
506	A	95.9	Very high	93.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.			trans	-60.9	142	167.5	0	0	0	0	0	110	T508 G509 H511 W551	A506-T508 PolarHBondContact O-N 3.43Å; A506-T508 VanDerWaalsContact O-N 3.14Å; A506-G509 PolarHBondContact O-N 3.32Å; A506-H511 HydrophobicContact CB-CB 4.02Å; A506-H511 WeakPolarHBondContact CB-O 3.47Å; A506-H511 PolarHBondContact N-O 2.95Å; A506-W551 HydrophobicContact CB-CD2 4Å; A506-W551 HydrophobicContact CB-CE3 3.94Å; A506-W551 HydrophobicContact CB-CH2 4.21Å; A506-W551 HydrophobicContact CB-CZ2 4.26Å; A506-W551 HydrophobicContact CB-CZ3 4.05Å
507	P	93.4	Very high	93.5	Very high	39 Å²	39	35.7 Å²	35.7	25%	0.253	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.5	-179.6	-28.9	36.4	0	0	0	114.4	G509 W551 D552	P507-G509 PolarHBondContact O-N 3.46Å; P507-W551 HydrophobicContact CG-CB 4.24Å; P507-D552 WeakPolarHBondContact CG-O 3.43Å
508	T	89.8	Confident	93	Very high	67 Å²	67	35 Å²	35	41%	0.411	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.4	175.8	50.4	0	0	0	0	113.9	A506 S554	A506-T508 PolarHBondContact O-N 3.43Å; A506-T508 VanDerWaalsContact O-N 3.14Å; T508-S554 WeakPolarHBondContact CG2-O 3.48Å
509	G	91.5	Very high	91.9	Very high	1 Å²	1	35 Å²	35	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	76.6	-163.9	-165.1	0	0	0	0	0	111.8	A506 P507 H511	A506-G509 PolarHBondContact O-N 3.32Å; P507-G509 PolarHBondContact O-N 3.46Å; G509-H511 PolarHBondContact O-N 2.71Å
510	H	91.8	Very high	91.1	Very high	87 Å²	87	38.8 Å²	38.8	40%	0.403	20%	0.201	S	C	.	.	S	Bend	trans	65.7	-52.8	-179.5	-53.5	-57.4	0	0	0	115.8	E459 T530	E459-H510 PolarHBondContact OE1-N 2.72Å; E459-H510 IonicContact OE1-ND1 2.74Å; H510-T530 WeakPolarHBondContact O-CA 3.21Å; H510-T530 WeakPolarHBondContact O-CB 3.36Å; H510-T530 PolarHBondContact O-N 2.81Å; H510-T530 PolarHBondContact O-OG1 2.99Å
511	H	95.9	Very high	90.3	Very high	30 Å²	30	41 Å²	41	14%	0.139	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	140.9	179.3	-56.3	-60.9	0	0	0	111.2	A506 G509 V528 D529 W551 F580	A506-H511 HydrophobicContact CB-CB 4.02Å; A506-H511 WeakPolarHBondContact CB-O 3.47Å; A506-H511 PolarHBondContact N-O 2.95Å; G509-H511 PolarHBondContact O-N 2.71Å; H511-V528 WeakPolarHBondContact CA-O 3.41Å; H511-D529 IonicContact CE1-OD1 3.68Å; H511-D529 IonicContact CE1-OD2 2.67Å; H511-D529 IonicContact ND1-OD1 2.72Å; H511-W551 HydrophobicContact CB-CH2 4.23Å; H511-F580 AromaticContact CD2-CD2 3.59Å; H511-F580 AromaticContact CE1-CD2 3.67Å; H511-F580 AromaticContact CE1-CE2 3.91Å; H511-F580 AromaticContact CG-CD2 3.99Å; H511-F580 AromaticContact NE2-CD2 3.38Å; H511-F580 WeakPolarHBondContact NE2-CD2 3.21Å; H511-F580 AromaticContact NE2-CE2 3.64Å
512	V	97	Very high	89.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	140	176.6	60.2	0	0	0	0	110.1	F478 I503 W505 F514 V528 T530	F478-V512 HydrophobicContact CE1-CG1 4.01Å; F478-V512 HydrophobicContact CZ-CG1 4.21Å; I503-V512 HydrophobicContact CG2-CG2 3.54Å; W505-V512 HydrophobicContact CD2-CB 3.73Å; W505-V512 HydrophobicContact CD2-CG2 3.77Å; W505-V512 HydrophobicContact CE3-CB 3.65Å; W505-V512 HydrophobicContact CE3-CG1 4.36Å; W505-V512 HydrophobicContact CE3-CG2 4.23Å; W505-V512 HydrophobicContact CG-CB 4.28Å; W505-V512 HydrophobicContact CG-CG2 3.97Å; W505-V512 HydrophobicContact CH2-CB 4.28Å; W505-V512 HydrophobicContact CH2-CG1 4.19Å; W505-V512 HydrophobicContact CZ2-CB 4.37Å; W505-V512 HydrophobicContact CZ2-CG1 4.47Å; W505-V512 HydrophobicContact CZ2-CG2 4.36Å; W505-V512 HydrophobicContact CZ3-CB 3.93Å; W505-V512 HydrophobicContact CZ3-CG1 4.13Å; V512-F514 HydrophobicContact CB-CE2 4.4Å; V512-F514 HydrophobicContact CG1-CD2 4.47Å; V512-F514 HydrophobicContact CG1-CE2 3.56Å; V512-F514 HydrophobicContact CG1-CZ 3.98Å; V512-F514 HydrophobicContact CG2-CE2 3.99Å; V512-F514 HydrophobicContact CG2-CZ 3.98Å; V512-V528 HydrophobicContact CG1-CB 3.87Å; V512-V528 HydrophobicContact CG1-CG1 4.31Å; V512-V528 PolarHBondContact N-O 2.87Å; V512-V528 PolarHBondContact O-N 3.07Å; V512-T530 HydrophobicContact CG1-CG2 4.3Å
513	L	97.6	Very high	89.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.9	175.2	170.7	60.2	0	0	0	109.1	F504 L525 V526 F527 I549 W551 V558	F504-L513 HydrophobicContact CB-CB 4.33Å; F504-L513 PolarHBondContact N-O 2.98Å; F504-L513 PolarHBondContact O-N 2.98Å; L513-L525 HydrophobicContact CD1-CB 3.88Å; L513-L525 HydrophobicContact CD1-CD2 4.23Å; L513-L525 HydrophobicContact CD2-CD2 4.48Å; L513-V526 WeakPolarHBondContact CA-O 3.39Å; L513-F527 HydrophobicContact CD1-CD1 4.3Å; L513-F527 HydrophobicContact CD1-CD2 4.05Å; L513-F527 HydrophobicContact CD1-CE1 4.16Å; L513-F527 HydrophobicContact CD1-CE2 3.88Å; L513-F527 HydrophobicContact CD1-CG 4.26Å; L513-F527 HydrophobicContact CD1-CZ 3.93Å; L513-F527 HydrophobicContact CD2-CE1 4.38Å; L513-F527 HydrophobicContact CD2-CZ 4.3Å; L513-I549 HydrophobicContact CD2-CD1 4.13Å; L513-I549 HydrophobicContact CD2-CG2 3.65Å; L513-W551 HydrophobicContact CB-CZ2 4Å; L513-V558 HydrophobicContact CD2-CG1 4.34Å; L513-V558 HydrophobicContact CD2-CG2 3.82Å
514	F	97	Very high	89.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.4	167.5	-58.3	-93.3	0	0	0	109.2	A466 I468 I476 F478 V500 S502 I503 V512 L525 V526 V528	A466-F514 HydrophobicContact CB-CE1 3.97Å; A466-F514 HydrophobicContact CB-CZ 3.82Å; I468-F514 HydrophobicContact CD1-CD1 4.14Å; I468-F514 HydrophobicContact CG1-CD1 4.14Å; I468-F514 HydrophobicContact CG1-CE1 4.46Å; I476-F514 HydrophobicContact CB-CE1 4.44Å; I476-F514 HydrophobicContact CD1-CB 4.01Å; I476-F514 HydrophobicContact CD1-CD1 3.73Å; I476-F514 HydrophobicContact CD1-CD2 3.8Å; I476-F514 HydrophobicContact CD1-CE1 4.15Å; I476-F514 HydrophobicContact CD1-CE2 4.2Å; I476-F514 HydrophobicContact CD1-CG 3.55Å; I476-F514 HydrophobicContact CD1-CZ 4.39Å; I476-F514 HydrophobicContact CG1-CD1 4.06Å; I476-F514 HydrophobicContact CG1-CE1 4.24Å; I476-F514 HydrophobicContact CG1-CG 4.39Å; I476-F514 HydrophobicContact CG2-CD1 4.07Å; I476-F514 HydrophobicContact CG2-CE1 3.39Å; I476-F514 HydrophobicContact CG2-CE2 3.97Å; I476-F514 HydrophobicContact CG2-CZ 3.34Å; F478-F514 HydrophobicContact CE1-CE2 4.34Å; F478-F514 AromaticContact CE1-CZ 3.98Å; F478-F514 HydrophobicContact CE1-CZ 3.98Å; F478-F514 HydrophobicContact CE2-CE2 4.41Å; F478-F514 HydrophobicContact CE2-CZ 4.24Å; F478-F514 AromaticContact CZ-CE2 3.6Å; F478-F514 HydrophobicContact CZ-CE2 3.6Å; F478-F514 AromaticContact CZ-CZ 3.49Å; F478-F514 HydrophobicContact CZ-CZ 3.49Å; F478-F514 VanDerWaalsContact CZ-CZ 3.49Å; V500-F514 HydrophobicContact CB-CB 4.28Å; V500-F514 HydrophobicContact CG1-CB 4.31Å; V500-F514 HydrophobicContact CG2-CB 4.16Å; S502-F514 WeakPolarHBondContact O-CA 3.26Å; I503-F514 HydrophobicContact CB-CD1 4.41Å; I503-F514 HydrophobicContact CB-CE1 4.32Å; I503-F514 HydrophobicContact CD1-CE1 4.11Å; I503-F514 HydrophobicContact CG1-CD1 3.88Å; I503-F514 HydrophobicContact CG1-CE1 3.82Å; I503-F514 HydrophobicContact CG2-CD1 4.2Å; I503-F514 HydrophobicContact CG2-CE1 3.76Å; I503-F514 HydrophobicContact CG2-CZ 4.28Å; V512-F514 HydrophobicContact CB-CE2 4.4Å; V512-F514 HydrophobicContact CG1-CD2 4.47Å; V512-F514 HydrophobicContact CG1-CE2 3.56Å; V512-F514 HydrophobicContact CG1-CZ 3.98Å; V512-F514 HydrophobicContact CG2-CE2 3.99Å; V512-F514 HydrophobicContact CG2-CZ 3.98Å; F514-L525 WeakPolarHBondContact O-CA 3.49Å; F514-V526 HydrophobicContact CB-CB 4.27Å; F514-V526 PolarHBondContact N-O 3.42Å; F514-V526 PolarHBondContact O-N 2.87Å; F514-V528 HydrophobicContact CD2-CG2 3.94Å; F514-V528 HydrophobicContact CE2-CB 4.16Å; F514-V528 HydrophobicContact CE2-CG2 3.85Å
515	A	95.4	Very high	89	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.2	-175.8	0	0	0	0	0	112.2	N501 S502 F504 L517 T524 L525 I549	N501-A515 PolarHBondContact N-O 3.3Å; N501-A515 PolarHBondContact OD1-O 3.16Å; N501-A515 VanDerWaalsContact OD1-O 3.12Å; S502-A515 PolarHBondContact N-O 2.91Å; S502-A515 PolarHBondContact O-N 3.07Å; F504-A515 HydrophobicContact CD2-CB 4.42Å; F504-A515 HydrophobicContact CE2-CB 4.21Å; A515-L517 HydrophobicContact CB-CD2 3.96Å; A515-L517 HydrophobicContact CB-CG 4.07Å; A515-T524 VanDerWaalsContact CA-O 3.29Å; A515-T524 WeakPolarHBondContact CA-O 3.19Å; A515-L525 HydrophobicContact CB-CD2 3.94Å; A515-I549 HydrophobicContact CB-CD1 3.28Å
516	G	92.9	Very high	89	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.01	19%	0.188	C	C	.	.			trans	-91.2	87.6	165.9	0	0	0	0	0	110.2	G523 T524	G516-G523 WeakPolarHBondContact O-CA 3.43Å; G516-G523 PolarHBondContact O-N 2.9Å; G516-T524 PolarHBondContact N-O 3.47Å
517	L	88.7	Confident	89.1	Confident	14 Å²	14	35.3 Å²	35.3	7%	0.073	19%	0.188	C	C	.	.			trans	-89.1	147.5	-178.4	-61.9	-173	0	0	0	112.1	N501 F504 A515 L521 V546 I549	N501-L517 PolarHBondContact ND2-O 3.17Å; N501-L517 PolarHBondContact OD1-N 3.14Å; F504-L517 HydrophobicContact CE2-CD1 3.84Å; F504-L517 HydrophobicContact CZ-CD1 3.73Å; A515-L517 HydrophobicContact CB-CD2 3.96Å; A515-L517 HydrophobicContact CB-CG 4.07Å; L517-L521 WeakPolarHBondContact O-CD1 3.26Å; L517-V546 HydrophobicContact CD2-CB 4.32Å; L517-V546 HydrophobicContact CD2-CG1 3.61Å; L517-V546 HydrophobicContact CD2-CG2 3.9Å; L517-I549 HydrophobicContact CD2-CD1 3.69Å; L517-I549 HydrophobicContact CD2-CG1 4.01Å
518	R	75.3	Confident	89.3	Confident	202 Å²	202	33.5 Å²	33.5	76%	0.762	18%	0.176	S	C	*	.	S	Bend	trans	70.5	144.8	176.5	-49.4	177.2	-178.5	-165.7	-1.5	114.2	L521	R518-L521 VanDerWaalsContact O-CB 3.3Å; R518-L521 WeakPolarHBondContact O-CB 3.46Å; R518-L521 PolarHBondContact O-N 2.97Å
519	T	65.9	Low	89.6	Confident	81 Å²	81	32 Å²	32	50%	0.497	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	134.7	178.2	-54.9	0	0	0	0	110	T568	T519-T568 HydrophobicContact CG2-CG2 4.15Å; T519-T568 VanDerWaalsContact OG1-CG2 3.23Å; T519-T568 WeakPolarHBondContact OG1-CG2 3.36Å; T519-T568 PolarHBondContact OG1-OG1 2.87Å
520	P	72.9	Confident	89.7	Confident	128 Å²	128	32.2 Å²	32.2	83%	0.831	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	cis	-94.4	14.8	19.1	37.6	-36.6	0	0	0	116.6
521	L	76	Confident	89.6	Confident	46 Å²	46	31.3 Å²	31.3	24%	0.241	17%	0.17	C	C	.	.	S	Bend	trans	-70.9	146.4	-178.6	-59	179.4	0	0	0	112.1	Q499 N501 L517 R518 G523	Q499-L521 HydrophobicContact CB-CD2 3.39Å; Q499-L521 HydrophobicContact CG-CD2 4.39Å; N501-L521 HydrophobicContact CB-CD1 4.21Å; N501-L521 VanDerWaalsContact ND2-CD1 3.27Å; N501-L521 WeakPolarHBondContact ND2-CD1 3.35Å; L517-L521 WeakPolarHBondContact O-CD1 3.26Å; R518-L521 VanDerWaalsContact O-CB 3.3Å; R518-L521 WeakPolarHBondContact O-CB 3.46Å; R518-L521 PolarHBondContact O-N 2.97Å; L521-G523 PolarHBondContact O-N 2.69Å
522	S	77.9	Confident	89.1	Confident	39 Å²	39	32.3 Å²	32.3	27%	0.273	19%	0.188	S	C	.	.			trans	-68.3	-14.1	-175.9	42.6	0	0	0	0	114.5	T524 T544	S522-T524 PolarHBondContact OG-OG1 2.83Å; S522-T544 WeakPolarHBondContact O-CA 3.47Å
523	G	87.7	Confident	88.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.01	23%	0.231	C	C	.	.			trans	81.4	30.3	-171	0	0	0	0	0	113.2	G516 L521 H543	G516-G523 WeakPolarHBondContact O-CA 3.43Å; G516-G523 PolarHBondContact O-N 2.9Å; L521-G523 PolarHBondContact O-N 2.69Å; G523-H543 WeakPolarHBondContact CA-O 3.3Å; G523-H543 PolarHBondContact O-N 2.85Å
524	T	94	Very high	87.7	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	135.8	175.1	-53.6	0	0	0	0	111.1	Q498 A515 G516 S522 V526	Q498-T524 HydrophobicContact CB-CG2 4.03Å; Q498-T524 WeakPolarHBondContact CB-OG1 3.25Å; Q498-T524 VanDerWaalsContact CD-OG1 3.25Å; Q498-T524 PolarHBondContact OE1-OG1 2.86Å; A515-T524 VanDerWaalsContact CA-O 3.29Å; A515-T524 WeakPolarHBondContact CA-O 3.19Å; G516-T524 PolarHBondContact N-O 3.47Å; S522-T524 PolarHBondContact OG-OG1 2.83Å; T524-V526 HydrophobicContact CG2-CG2 3.97Å
525	L	96.3	Very high	87.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117	177.6	-58.5	179.3	0	0	0	109	L513 F514 A515 F527 Q540 Q541 H543 I549 T560 W578	L513-L525 HydrophobicContact CD1-CB 3.88Å; L513-L525 HydrophobicContact CD1-CD2 4.23Å; L513-L525 HydrophobicContact CD2-CD2 4.48Å; F514-L525 WeakPolarHBondContact O-CA 3.49Å; A515-L525 HydrophobicContact CB-CD2 3.94Å; L525-F527 HydrophobicContact CB-CE2 3.89Å; L525-Q540 WeakPolarHBondContact O-CA 3.49Å; L525-Q541 HydrophobicContact CB-CB 4.25Å; L525-Q541 PolarHBondContact N-O 2.9Å; L525-Q541 PolarHBondContact O-N 3.02Å; L525-H543 HydrophobicContact CD1-CB 3.93Å; L525-I549 HydrophobicContact CD2-CD1 3.79Å; L525-T560 HydrophobicContact CD1-CG2 3.88Å; L525-T560 HydrophobicContact CD2-CG2 4.26Å; L525-W578 HydrophobicContact CD1-CZ2 4.08Å
526	V	96.9	Very high	87.4	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	111.1	178.7	-174.5	0	0	0	0	109.3	V500 L513 F514 T524 V528 V537 Q540	V500-V526 HydrophobicContact CG1-CG2 4.49Å; L513-V526 WeakPolarHBondContact CA-O 3.39Å; F514-V526 HydrophobicContact CB-CB 4.27Å; F514-V526 PolarHBondContact N-O 3.42Å; F514-V526 PolarHBondContact O-N 2.87Å; T524-V526 HydrophobicContact CG2-CG2 3.97Å; V526-V528 HydrophobicContact CG1-CG2 3.9Å; V526-V537 HydrophobicContact CG1-CG1 3.91Å; V526-Q540 HydrophobicContact CG1-CG 4.1Å; V526-Q540 HydrophobicContact CG2-CG 4.22Å
527	F	97.5	Very high	87.5	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.2	179.5	-68.3	-98.6	0	0	0	109.8	L513 L525 V537 C538 N539 Q541 V558 W578 G582	L513-F527 HydrophobicContact CD1-CD1 4.3Å; L513-F527 HydrophobicContact CD1-CD2 4.05Å; L513-F527 HydrophobicContact CD1-CE1 4.16Å; L513-F527 HydrophobicContact CD1-CE2 3.88Å; L513-F527 HydrophobicContact CD1-CG 4.26Å; L513-F527 HydrophobicContact CD1-CZ 3.93Å; L513-F527 HydrophobicContact CD2-CE1 4.38Å; L513-F527 HydrophobicContact CD2-CZ 4.3Å; L525-F527 HydrophobicContact CB-CE2 3.89Å; F527-V537 CarbonylContact O-C 3.54Å; F527-C538 HydrophobicContact CB-CB 4.36Å; F527-C538 PolarHBondContact O-N 2.89Å; F527-N539 HydrophobicContact CB-CB 4.43Å; F527-N539 PolarHBondContact N-O 2.9Å; F527-N539 PolarHBondContact O-N 2.93Å; F527-Q541 HydrophobicContact CE2-CB 4.49Å; F527-Q541 HydrophobicContact CE2-CG 4.46Å; F527-V558 HydrophobicContact CE1-CG1 3.54Å; F527-V558 HydrophobicContact CZ-CG1 3.85Å; F527-W578 HydrophobicContact CZ-CB 4.17Å; F527-W578 HydrophobicContact CZ-CG 4.22Å; F527-G582 VanDerWaalsContact CD2-CA 3.47Å; F527-G582 VanDerWaalsContact CG-CA 3.47Å
528	V	97	Very high	87.8	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.2	-173.9	-179.2	0	0	0	0	110.4	F478 L494 H511 V512 F514 V526 T530 V535 V536 V537	F478-V528 HydrophobicContact CE1-CG1 4.44Å; F478-V528 HydrophobicContact CE2-CG1 4.35Å; F478-V528 HydrophobicContact CZ-CB 4.43Å; F478-V528 HydrophobicContact CZ-CG1 3.73Å; L494-V528 HydrophobicContact CD1-CG2 4.44Å; H511-V528 WeakPolarHBondContact CA-O 3.41Å; V512-V528 HydrophobicContact CG1-CB 3.87Å; V512-V528 HydrophobicContact CG1-CG1 4.31Å; V512-V528 PolarHBondContact N-O 2.87Å; V512-V528 PolarHBondContact O-N 3.07Å; F514-V528 HydrophobicContact CD2-CG2 3.94Å; F514-V528 HydrophobicContact CE2-CB 4.16Å; F514-V528 HydrophobicContact CE2-CG2 3.85Å; V526-V528 HydrophobicContact CG1-CG2 3.9Å; V528-T530 HydrophobicContact CG1-CG2 4.23Å; V528-V535 HydrophobicContact CG1-CG1 3.22Å; V528-V536 CarbonylContact C-O 3.53Å; V528-V536 WeakPolarHBondContact CA-O 3.18Å; V528-V537 HydrophobicContact CG2-CG2 4.27Å
529	D	95.7	Very high	88.8	Confident	35 Å²	35	43.1 Å²	43.1	19%	0.187	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.7	171.2	-176.2	11.2	0	0	0	110.7	H511 S531 V536 C538	H511-D529 IonicContact CE1-OD1 3.68Å; H511-D529 IonicContact CE1-OD2 2.67Å; H511-D529 IonicContact ND1-OD1 2.72Å; D529-S531 VanDerWaalsContact CG-OG 3.24Å; D529-S531 WeakPolarHBondContact OD1-CB 3.46Å; D529-S531 PolarHBondContact OD1-N 2.84Å; D529-S531 PolarHBondContact OD1-OG 3.04Å; D529-S531 PolarHBondContact OD2-OG 2.89Å; D529-V536 PolarHBondContact N-O 2.89Å; D529-V536 PolarHBondContact O-N 3.38Å; D529-C538 WeakPolarHBondContact CB-SG 3.41Å
530	T	94.1	Very high	90.2	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.031	28%	0.279	C	S	.	.			trans	-125.7	13.9	-178.3	72.6	0	0	0	0	112.2	K464 F478 W505 H510 V512 V528 V535	K464-T530 VanDerWaalsContact CE-CB 3.44Å; K464-T530 VanDerWaalsContact CE-O 3.25Å; K464-T530 WeakPolarHBondContact CE-O 3.32Å; K464-T530 WeakPolarHBondContact CE-OG1 3.47Å; K464-T530 PolarHBondContact NZ-O 2.91Å; F478-T530 HydrophobicContact CD1-CG2 4.07Å; F478-T530 HydrophobicContact CE1-CG2 3.66Å; F478-T530 HydrophobicContact CZ-CG2 4.38Å; W505-T530 HydrophobicContact CH2-CG2 4.08Å; W505-T530 HydrophobicContact CZ3-CG2 4.22Å; H510-T530 WeakPolarHBondContact O-CA 3.21Å; H510-T530 WeakPolarHBondContact O-CB 3.36Å; H510-T530 PolarHBondContact O-N 2.81Å; H510-T530 PolarHBondContact O-OG1 2.99Å; V512-T530 HydrophobicContact CG1-CG2 4.3Å; V528-T530 HydrophobicContact CG1-CG2 4.23Å; T530-V535 HydrophobicContact CG2-CG1 4.25Å; T530-V535 HydrophobicContact CG2-CG2 4.31Å
531	S	89.6	Confident	91.2	Very high	69 Å²	69	41.3 Å²	41.3	48%	0.483	25%	0.254	S	S	.	.	S	Bend	trans	-68.3	-34.4	176.9	64.4	0	0	0	0	113.3	D529	D529-S531 VanDerWaalsContact CG-OG 3.24Å; D529-S531 WeakPolarHBondContact OD1-CB 3.46Å; D529-S531 PolarHBondContact OD1-N 2.84Å; D529-S531 PolarHBondContact OD1-OG 3.04Å; D529-S531 PolarHBondContact OD2-OG 2.89Å
532	G	84.9	Confident	92	Very high	50 Å²	50	43.8 Å²	43.8	52%	0.515	27%	0.265	S	S	.	.	S	Bend	trans	-79.8	-174.1	-179.4	0	0	0	0	0	114.4	D534	G532-D534 VanDerWaalsContact C-N 3.34Å
533	S	79.8	Confident	92.6	Very high	128 Å²	128	42.4 Å²	42.4	90%	0.895	25%	0.254	S	S	*	.	S	Bend	trans	-73.3	-25.8	174	55.4	0	0	0	0	113.5
534	D	85.7	Confident	92.6	Very high	72 Å²	72	47 Å²	47	39%	0.385	28%	0.282	S	S	.	.	S	Bend	trans	-117	158.5	173.2	-163.3	8.7	0	0	0	109.5	K492 G532	K492-D534 VanDerWaalsContact NZ-CG 3.33Å; K492-D534 IonicContact NZ-OD1 2.8Å; K492-D534 PolarHBondContact NZ-OD1 2.85Å; K492-D534 IonicContact NZ-OD2 3.53Å; K492-D534 PolarHBondContact NZ-OD2 2.78Å; G532-D534 VanDerWaalsContact C-N 3.34Å
535	V	92.6	Very high	92.3	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	29%	0.288	C	S	.	.			trans	-88.9	123.6	177	176.7	0	0	0	0	108.8	F478 I491 K492 L494 V528 T530	F478-V535 HydrophobicContact CB-CG2 4.2Å; F478-V535 HydrophobicContact CD1-CG2 4.31Å; F478-V535 HydrophobicContact CD2-CB 4.46Å; F478-V535 HydrophobicContact CD2-CG1 3.9Å; F478-V535 HydrophobicContact CD2-CG2 4.17Å; F478-V535 HydrophobicContact CE1-CG1 4.29Å; F478-V535 HydrophobicContact CE2-CG1 3.61Å; F478-V535 HydrophobicContact CG-CG1 4.35Å; F478-V535 HydrophobicContact CG-CG2 3.97Å; F478-V535 HydrophobicContact CZ-CG1 3.8Å; I491-V535 HydrophobicContact CG2-CG2 4.19Å; K492-V535 HydrophobicContact CB-CB 4.06Å; K492-V535 HydrophobicContact CB-CG2 4.02Å; K492-V535 HydrophobicContact CG-CB 4.17Å; L494-V535 HydrophobicContact CD1-CG1 4.32Å; V528-V535 HydrophobicContact CG1-CG1 3.22Å; T530-V535 HydrophobicContact CG2-CG1 4.25Å; T530-V535 HydrophobicContact CG2-CG2 4.31Å
536	V	94.5	Very high	92	Very high	82 Å²	82	47.7 Å²	47.7	50%	0.497	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.7	-175.1	-178.2	0	0	0	0	110	V528 D529 C538	V528-V536 CarbonylContact C-O 3.53Å; V528-V536 WeakPolarHBondContact CA-O 3.18Å; D529-V536 PolarHBondContact N-O 2.89Å; D529-V536 PolarHBondContact O-N 3.38Å; V536-C538 PolarHBondContact O-N 3.11Å
537	V	95.2	Very high	91.7	Very high	54 Å²	54	49 Å²	49	33%	0.327	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	111.5	168.8	-179	0	0	0	0	107.7	L494 V526 F527 V528 Q540	L494-V537 HydrophobicContact CD1-CG2 3.88Å; V526-V537 HydrophobicContact CG1-CG1 3.91Å; F527-V537 CarbonylContact O-C 3.54Å; V528-V537 HydrophobicContact CG2-CG2 4.27Å; V537-Q540 HydrophobicContact CG1-CG 3.9Å
538	C	94.6	Very high	91.5	Very high	52 Å²	52	52 Å²	52	35%	0.351	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-44.6	-179.4	-58.7	0	0	0	0	111.6	F527 D529 V536	F527-C538 HydrophobicContact CB-CB 4.36Å; F527-C538 PolarHBondContact O-N 2.89Å; D529-C538 WeakPolarHBondContact CB-SG 3.41Å; V536-C538 PolarHBondContact O-N 3.11Å
539	N	95.9	Very high	91.4	Very high	50 Å²	50	52.7 Å²	52.7	27%	0.267	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	155.5	-175.4	-154.9	-18	0	0	0	110.6	F527 Q541 Q581 G582	F527-N539 HydrophobicContact CB-CB 4.43Å; F527-N539 PolarHBondContact N-O 2.9Å; F527-N539 PolarHBondContact O-N 2.93Å; N539-Q541 PolarHBondContact ND2-NE2 3.46Å; N539-Q541 PolarHBondContact OD1-NE2 2.82Å; N539-Q581 WeakPolarHBondContact CB-O 3.32Å; N539-G582 PolarHBondContact ND2-O 2.95Å; N539-G582 VanDerWaalsContact ND2-O 3.08Å
540	Q	95.4	Very high	91.5	Very high	101 Å²	101	54.1 Å²	54.1	47%	0.472	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.1	170.6	-68.3	-168.3	-18	0	0	108.6	Q496 L525 V526 V537	Q496-Q540 VanDerWaalsContact OE1-NE2 3.1Å; L525-Q540 WeakPolarHBondContact O-CA 3.49Å; V526-Q540 HydrophobicContact CG1-CG 4.1Å; V526-Q540 HydrophobicContact CG2-CG 4.22Å; V537-Q540 HydrophobicContact CG1-CG 3.9Å
541	Q	95.1	Very high	91.6	Very high	69 Å²	69	54.9 Å²	54.9	32%	0.322	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	169.1	-176.9	-64.4	-65.3	-40.1	0	0	109.4	L525 F527 N539 W578 G582	L525-Q541 HydrophobicContact CB-CB 4.25Å; L525-Q541 PolarHBondContact N-O 2.9Å; L525-Q541 PolarHBondContact O-N 3.02Å; F527-Q541 HydrophobicContact CE2-CB 4.49Å; F527-Q541 HydrophobicContact CE2-CG 4.46Å; N539-Q541 PolarHBondContact ND2-NE2 3.46Å; N539-Q541 PolarHBondContact OD1-NE2 2.82Å; Q541-W578 HydrophobicContact CB-CH2 4.02Å; Q541-W578 HydrophobicContact CB-CZ3 3.83Å; Q541-W578 HydrophobicContact CG-CE3 4.17Å; Q541-W578 HydrophobicContact CG-CH2 4.3Å; Q541-W578 HydrophobicContact CG-CZ3 3.61Å; Q541-G582 WeakPolarHBondContact CG-O 3.14Å
542	E	91.9	Very high	91.9	Very high	99 Å²	99	51.6 Å²	51.6	46%	0.463	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.1	175.9	-170.2	174	162.4	0	0	109.4
543	H	90.9	Very high	92.2	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.046	29%	0.288	C	S	.	.			trans	-130.3	90.5	170.6	-174	-175.3	0	0	0	108.9	G523 L525 G545 V546 T560 V562 M576	G523-H543 WeakPolarHBondContact CA-O 3.3Å; G523-H543 PolarHBondContact O-N 2.85Å; L525-H543 HydrophobicContact CD1-CB 3.93Å; H543-G545 PolarHBondContact O-N 2.93Å; H543-V546 HydrophobicContact CB-CB 4.38Å; H543-V546 WeakPolarHBondContact O-CB 3.28Å; H543-V546 VanDerWaalsContact O-CG1 3.32Å; H543-V546 WeakPolarHBondContact O-CG1 3.48Å; H543-V546 PolarHBondContact O-N 2.84Å; H543-T560 PolarHBondContact CE1-O 3.28Å; H543-T560 WeakPolarHBondContact ND1-CB 3.47Å; H543-T560 PolarHBondContact ND1-OG1 2.94Å; H543-V562 VanDerWaalsContact NE2-CG2 3.35Å; H543-V562 WeakPolarHBondContact NE2-CG2 3.36Å; H543-M576 HydrophobicContact CB-SD 4.48Å; H543-M576 VanDerWaalsContact CD2-CE 3.4Å; H543-M576 WeakPolarHBondContact CD2-CE 3.44Å; H543-M576 VanDerWaalsContact NE2-CE 3.29Å; H543-M576 WeakPolarHBondContact NE2-CE 3.41Å
544	T	87.9	Confident	92.7	Very high	97 Å²	97	46.4 Å²	46.4	60%	0.595	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	131.3	-176.1	-46.3	0	0	0	0	111.8	S522 V546	S522-T544 WeakPolarHBondContact O-CA 3.47Å; T544-V546 VanDerWaalsContact C-N 3.3Å; T544-V546 PolarHBondContact O-N 3.49Å
545	G	87	Confident	93	Very high	15 Å²	15	43.2 Å²	43.2	16%	0.155	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	8.5	177.8	0	0	0	0	0	115	H543 T547	H543-G545 PolarHBondContact O-N 2.93Å; G545-T547 PolarHBondContact O-N 3.43Å
546	V	90.7	Very high	93	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.018	26%	0.255	C	S	.	.			trans	-50.3	127.7	176.2	60.6	0	0	0	0	111.7	L517 H543 T544 I549	L517-V546 HydrophobicContact CD2-CB 4.32Å; L517-V546 HydrophobicContact CD2-CG1 3.61Å; L517-V546 HydrophobicContact CD2-CG2 3.9Å; H543-V546 HydrophobicContact CB-CB 4.38Å; H543-V546 WeakPolarHBondContact O-CB 3.28Å; H543-V546 VanDerWaalsContact O-CG1 3.32Å; H543-V546 WeakPolarHBondContact O-CG1 3.48Å; H543-V546 PolarHBondContact O-N 2.84Å; T544-V546 VanDerWaalsContact C-N 3.3Å; T544-V546 PolarHBondContact O-N 3.49Å; V546-I549 HydrophobicContact CG2-CD1 4.21Å; V546-I549 HydrophobicContact CG2-CG1 3.84Å
547	T	90.4	Very high	93.1	Very high	27 Å²	27	45.4 Å²	45.4	17%	0.166	24%	0.239	C	C	.	.			trans	-104	-43.8	177.8	56.1	0	0	0	0	111.7	G545 S561 S563 S566	G545-T547 PolarHBondContact O-N 3.43Å; T547-S561 PolarHBondContact N-O 3.35Å; T547-S561 PolarHBondContact OG1-O 2.95Å; T547-S561 VanDerWaalsContact OG1-O 3.12Å; T547-S563 PolarHBondContact OG1-N 3.01Å; T547-S563 VanDerWaalsContact OG1-N 3.12Å; T547-S566 WeakPolarHBondContact CG2-OG 3.43Å
548	D	92.7	Very high	93.2	Very high	65 Å²	65	42.8 Å²	42.8	35%	0.348	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	145.3	-170.5	-56.5	-84.9	0	0	0	110.7	T560 S561	D548-T560 WeakPolarHBondContact O-CA 3.41Å; D548-S561 PolarHBondContact N-O 2.92Å; D548-S561 PolarHBondContact O-N 3.25Å
549	I	95.9	Very high	93.3	Very high	16 Å²	16	40.4 Å²	40.4	8%	0.082	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.1	179.5	-61.3	-173.4	0	0	0	107.8	F504 L513 A515 L517 L525 V546 V558 V559 T560	F504-I549 HydrophobicContact CB-CG2 4.43Å; F504-I549 HydrophobicContact CD1-CB 4.41Å; F504-I549 HydrophobicContact CD1-CG2 4.29Å; F504-I549 HydrophobicContact CD2-CB 4.2Å; F504-I549 HydrophobicContact CD2-CD1 4.25Å; F504-I549 HydrophobicContact CD2-CG2 4.01Å; F504-I549 HydrophobicContact CE1-CB 4.23Å; F504-I549 HydrophobicContact CE2-CB 3.99Å; F504-I549 HydrophobicContact CE2-CD1 4.01Å; F504-I549 HydrophobicContact CE2-CG1 4.39Å; F504-I549 HydrophobicContact CE2-CG2 4.33Å; F504-I549 HydrophobicContact CG-CB 4.4Å; F504-I549 HydrophobicContact CG-CG2 3.99Å; F504-I549 HydrophobicContact CZ-CB 4.02Å; L513-I549 HydrophobicContact CD2-CD1 4.13Å; L513-I549 HydrophobicContact CD2-CG2 3.65Å; A515-I549 HydrophobicContact CB-CD1 3.28Å; L517-I549 HydrophobicContact CD2-CD1 3.69Å; L517-I549 HydrophobicContact CD2-CG1 4.01Å; L525-I549 HydrophobicContact CD2-CD1 3.79Å; V546-I549 HydrophobicContact CG2-CD1 4.21Å; V546-I549 HydrophobicContact CG2-CG1 3.84Å; I549-V558 HydrophobicContact CG2-CG2 3.73Å; I549-V559 WeakPolarHBondContact CA-O 3.41Å; I549-T560 HydrophobicContact CD1-CG2 4.08Å; I549-T560 HydrophobicContact CG1-CG2 3.87Å; I549-T560 HydrophobicContact CG2-CG2 4.32Å
550	E	96.2	Very high	93.3	Very high	65 Å²	65	38 Å²	38	30%	0.304	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.6	177.8	-162.8	-178	-170.8	0	0	110.6	V558 V559 S597 W598	E550-V558 WeakPolarHBondContact O-CG2 3.37Å; E550-V559 HydrophobicContact CB-CG1 3.8Å; E550-V559 PolarHBondContact N-O 3.23Å; E550-V559 WeakPolarHBondContact O-CG1 3.32Å; E550-V559 PolarHBondContact O-N 3.4Å; E550-S597 WeakPolarHBondContact OE2-CA 3.29Å; E550-W598 PolarHBondContact OE2-N 2.58Å
551	W	96.8	Very high	93.2	Very high	20 Å²	20	33.4 Å²	33.4	8%	0.076	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.3	168.3	-76.8	94.2	0	0	0	109.6	F504 A506 P507 H511 L513 Y557 V558 F580	F504-W551 PolarHBondContact O-NE1 3.47Å; A506-W551 HydrophobicContact CB-CD2 4Å; A506-W551 HydrophobicContact CB-CE3 3.94Å; A506-W551 HydrophobicContact CB-CH2 4.21Å; A506-W551 HydrophobicContact CB-CZ2 4.26Å; A506-W551 HydrophobicContact CB-CZ3 4.05Å; P507-W551 HydrophobicContact CG-CB 4.24Å; H511-W551 HydrophobicContact CB-CH2 4.23Å; L513-W551 HydrophobicContact CB-CZ2 4Å; W551-Y557 VanDerWaalsContact CE3-O 3.3Å; W551-V558 HydrophobicContact CD2-CB 3.93Å; W551-V558 HydrophobicContact CD2-CG2 4.07Å; W551-V558 HydrophobicContact CE3-CB 3.9Å; W551-V558 HydrophobicContact CG-CG2 4.26Å; W551-V558 HydrophobicContact CH2-CB 4.34Å; W551-V558 HydrophobicContact CZ2-CB 4.37Å; W551-V558 HydrophobicContact CZ3-CB 4.11Å; W551-F580 HydrophobicContact CH2-CB 4.03Å; W551-F580 HydrophobicContact CZ3-CB 3.72Å
552	D	95.3	Very high	93.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.			trans	-63.5	153.4	166.7	91.8	-65.7	0	0	0	109.5	P507 S554 G555 R556 Y557 W598	P507-D552 WeakPolarHBondContact CG-O 3.43Å; D552-S554 PolarHBondContact O-N 3.25Å; D552-S554 WeakPolarHBondContact OD2-CA 3.35Å; D552-S554 WeakPolarHBondContact OD2-CB 3.49Å; D552-S554 PolarHBondContact OD2-N 3.2Å; D552-S554 PolarHBondContact OD2-OG 3.44Å; D552-G555 PolarHBondContact O-N 2.88Å; D552-G555 WeakPolarHBondContact OD1-CA 3.5Å; D552-G555 PolarHBondContact OD1-N 3.03Å; D552-R556 PolarHBondContact OD1-N 3Å; D552-Y557 PolarHBondContact N-O 3.38Å; D552-Y557 PolarHBondContact OD1-N 2.86Å; D552-Y557 VanDerWaalsContact OD1-O 3.04Å; D552-W598 HydrophobicContact CB-CD2 3.89Å; D552-W598 HydrophobicContact CB-CE3 4.29Å; D552-W598 HydrophobicContact CB-CG 4.22Å; D552-W598 HydrophobicContact CB-CZ2 4.3Å
553	P	92.3	Very high	93	Very high	36 Å²	36	25.8 Å²	25.8	23%	0.234	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.9	-178	-27.4	35.6	0	0	0	114.8	R599 R601	P553-R599 WeakPolarHBondContact CG-O 3.43Å; P553-R601 HydrophobicContact CB-CB 4.12Å; P553-R601 HydrophobicContact CB-CG 3.63Å; P553-R601 HydrophobicContact CG-CG 4.03Å
554	S	90.1	Very high	92.9	Very high	34 Å²	34	28 Å²	28	24%	0.238	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.8	178.7	80.1	0	0	0	0	113.5	T508 D552 R556	T508-S554 WeakPolarHBondContact CG2-O 3.48Å; D552-S554 PolarHBondContact O-N 3.25Å; D552-S554 WeakPolarHBondContact OD2-CA 3.35Å; D552-S554 WeakPolarHBondContact OD2-CB 3.49Å; D552-S554 PolarHBondContact OD2-N 3.2Å; D552-S554 PolarHBondContact OD2-OG 3.44Å; S554-R556 VanDerWaalsContact C-N 3.26Å; S554-R556 PolarHBondContact O-N 3.26Å; S554-R556 WeakPolarHBondContact OG-CB 3.39Å; S554-R556 WeakPolarHBondContact OG-CG 3.44Å; S554-R556 PolarHBondContact OG-N 2.89Å; S554-R556 PolarHBondContact OG-NE 3.5Å
555	G	92.8	Very high	92.7	Very high	4 Å²	4	29.4 Å²	29.4	4%	0.041	15%	0.145	C	C	.	.	S	Bend	trans	73.4	12.9	-176.2	0	0	0	0	0	114.6	D552 F580	D552-G555 PolarHBondContact O-N 2.88Å; D552-G555 WeakPolarHBondContact OD1-CA 3.5Å; D552-G555 PolarHBondContact OD1-N 3.03Å; G555-F580 WeakPolarHBondContact O-CB 3.47Å
556	R	92.3	Very high	92.3	Very high	96 Å²	96	29.7 Å²	29.7	36%	0.362	14%	0.144	S	C	.	.	S	Bend	trans	-85.3	-30.6	177.7	-69.4	-177	-65.8	172.3	1	112.5	C177 D179 D552 S554 N579 F580	C177-R556 PolarHBondContact O-NH2 2.85Å; D179-R556 IonicContact OD2-NH2 3.77Å; D179-R556 PolarHBondContact OD2-NH2 3.36Å; D179-R556 VanDerWaalsContact OD2-NH2 3.08Å; D552-R556 PolarHBondContact OD1-N 3Å; S554-R556 VanDerWaalsContact C-N 3.26Å; S554-R556 PolarHBondContact O-N 3.26Å; S554-R556 WeakPolarHBondContact OG-CB 3.39Å; S554-R556 WeakPolarHBondContact OG-CG 3.44Å; S554-R556 PolarHBondContact OG-N 2.89Å; S554-R556 PolarHBondContact OG-NE 3.5Å; R556-N579 CarbonylContact O-C 3.58Å; R556-N579 WeakPolarHBondContact O-CA 3.42Å; R556-F580 WeakPolarHBondContact O-CD1 3.41Å; R556-F580 PolarHBondContact O-N 2.94Å
557	Y	95.6	Very high	91.2	Very high	40 Å²	40	35.3 Å²	35.3	16%	0.157	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.1	-174.2	-54	-74.1	0	0	0	110.5	W551 D552 I577 W578 L585	W551-Y557 VanDerWaalsContact CE3-O 3.3Å; D552-Y557 PolarHBondContact N-O 3.38Å; D552-Y557 PolarHBondContact OD1-N 2.86Å; D552-Y557 VanDerWaalsContact OD1-O 3.04Å; Y557-I577 HydrophobicContact CD1-CG2 4.19Å; Y557-I577 HydrophobicContact CG-CG2 4.46Å; Y557-W578 CarbonylContact C-O 3.47Å; Y557-W578 VanDerWaalsContact CA-O 3.25Å; Y557-W578 WeakPolarHBondContact CA-O 3.35Å; Y557-L585 HydrophobicContact CD1-CD1 3.51Å; Y557-L585 HydrophobicContact CE1-CD1 3.36Å
558	V	97.1	Very high	89.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.8	166.6	67.2	0	0	0	0	108.4	L513 F527 I549 E550 W551 W578	L513-V558 HydrophobicContact CD2-CG1 4.34Å; L513-V558 HydrophobicContact CD2-CG2 3.82Å; F527-V558 HydrophobicContact CE1-CG1 3.54Å; F527-V558 HydrophobicContact CZ-CG1 3.85Å; I549-V558 HydrophobicContact CG2-CG2 3.73Å; E550-V558 WeakPolarHBondContact O-CG2 3.37Å; W551-V558 HydrophobicContact CD2-CB 3.93Å; W551-V558 HydrophobicContact CD2-CG2 4.07Å; W551-V558 HydrophobicContact CE3-CB 3.9Å; W551-V558 HydrophobicContact CG-CG2 4.26Å; W551-V558 HydrophobicContact CH2-CB 4.34Å; W551-V558 HydrophobicContact CZ2-CB 4.37Å; W551-V558 HydrophobicContact CZ3-CB 4.11Å; V558-W578 HydrophobicContact CG1-CB 3.73Å; V558-W578 HydrophobicContact CG1-CG 4.16Å; V558-W578 PolarHBondContact N-O 2.77Å; V558-W578 PolarHBondContact O-N 2.89Å
559	V	97	Very high	88.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.4	171.1	76.4	0	0	0	0	108.7	I549 E550 Y575 M576 I577 F596	I549-V559 WeakPolarHBondContact CA-O 3.41Å; E550-V559 HydrophobicContact CB-CG1 3.8Å; E550-V559 PolarHBondContact N-O 3.23Å; E550-V559 WeakPolarHBondContact O-CG1 3.32Å; E550-V559 PolarHBondContact O-N 3.4Å; V559-Y575 HydrophobicContact CG2-CD2 4.06Å; V559-Y575 HydrophobicContact CG2-CG 4.45Å; V559-M576 CarbonylContact C-O 3.59Å; V559-M576 VanDerWaalsContact CA-O 3.3Å; V559-M576 WeakPolarHBondContact CA-O 3.37Å; V559-M576 WeakPolarHBondContact CG2-O 3.29Å; V559-I577 HydrophobicContact CG2-CG1 4.23Å; V559-F596 HydrophobicContact CB-CD1 4.21Å; V559-F596 HydrophobicContact CB-CE1 4.03Å; V559-F596 HydrophobicContact CB-CZ 4.28Å; V559-F596 HydrophobicContact CG1-CD1 3.55Å; V559-F596 HydrophobicContact CG1-CE1 3.7Å; V559-F596 HydrophobicContact CG1-CG 4.22Å; V559-F596 HydrophobicContact CG1-CZ 4.42Å; V559-F596 HydrophobicContact CG2-CD1 4.06Å; V559-F596 HydrophobicContact CG2-CD2 3.99Å; V559-F596 HydrophobicContact CG2-CE1 4.09Å; V559-F596 HydrophobicContact CG2-CE2 3.98Å; V559-F596 HydrophobicContact CG2-CG 4.03Å; V559-F596 HydrophobicContact CG2-CZ 4.03Å
560	T	95.7	Very high	86.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.6	166.3	61	0	0	0	0	108	L525 H543 D548 I549 Y575 M576 W578	L525-T560 HydrophobicContact CD1-CG2 3.88Å; L525-T560 HydrophobicContact CD2-CG2 4.26Å; H543-T560 PolarHBondContact CE1-O 3.28Å; H543-T560 WeakPolarHBondContact ND1-CB 3.47Å; H543-T560 PolarHBondContact ND1-OG1 2.94Å; D548-T560 WeakPolarHBondContact O-CA 3.41Å; I549-T560 HydrophobicContact CD1-CG2 4.08Å; I549-T560 HydrophobicContact CG1-CG2 3.87Å; I549-T560 HydrophobicContact CG2-CG2 4.32Å; T560-Y575 CarbonylContact O-C 3.53Å; T560-Y575 WeakPolarHBondContact O-CA 3.46Å; T560-M576 PolarHBondContact N-O 2.85Å; T560-M576 PolarHBondContact O-N 3.5Å; T560-W578 PolarHBondContact OG1-NE1 2.77Å
561	S	93.9	Very high	84.9	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.6	-173.4	61.1	0	0	0	0	113.2	T547 D548 G574	T547-S561 PolarHBondContact N-O 3.35Å; T547-S561 PolarHBondContact OG1-O 2.95Å; T547-S561 VanDerWaalsContact OG1-O 3.12Å; D548-S561 PolarHBondContact N-O 2.92Å; D548-S561 PolarHBondContact O-N 3.25Å; S561-G574 WeakPolarHBondContact CA-O 3.35Å
562	V	92.1	Very high	84	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	103.7	178.6	-178	0	0	0	0	108.4	H543 G574 F593	H543-V562 VanDerWaalsContact NE2-CG2 3.35Å; H543-V562 WeakPolarHBondContact NE2-CG2 3.36Å; V562-G574 PolarHBondContact N-O 3.44Å; V562-G574 PolarHBondContact O-N 2.84Å; V562-F593 WeakPolarHBondContact O-CD1 3.08Å
563	S	90.3	Very high	83.8	Confident	7 Å²	7	52 Å²	52	5%	0.049	28%	0.279	C	S	.	.			trans	-76.9	142.4	178.4	-173.7	0	0	0	0	112.6	T547 W565 S566 C594	T547-S563 PolarHBondContact OG1-N 3.01Å; T547-S563 VanDerWaalsContact OG1-N 3.12Å; S563-W565 PolarHBondContact O-N 3.3Å; S563-W565 PolarHBondContact OG-N 3.09Å; S563-S566 WeakPolarHBondContact O-CB 3.42Å; S563-S566 PolarHBondContact O-N 3.08Å; S563-S566 VanDerWaalsContact O-N 3.08Å; S563-C594 WeakPolarHBondContact CB-O 3.25Å; S563-C594 PolarHBondContact OG-O 2.87Å
564	I	88.2	Confident	83.8	Confident	56 Å²	56	50.5 Å²	50.5	29%	0.287	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.8	169.1	-168.4	164.5	0	0	0	112.6	S566 E592 F593	I564-S566 PolarHBondContact O-N 3.01Å; I564-E592 HydrophobicContact CD1-CB 3.98Å; I564-E592 HydrophobicContact CD1-CG 3.81Å; I564-F593 WeakPolarHBondContact CB-O 3.41Å; I564-F593 VanDerWaalsContact CG2-O 3.27Å; I564-F593 WeakPolarHBondContact CG2-O 3.48Å; I564-F593 PolarHBondContact N-O 2.81Å
565	W	84.3	Confident	84	Confident	127 Å²	127	49 Å²	49	48%	0.481	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.1	176.1	-58.7	-34.9	0	0	0	113.2	F190 S563 S567 C594	F190-W565 AromaticContact CE1-CZ2 3.81Å; F190-W565 HydrophobicContact CE1-CZ2 3.81Å; F190-W565 AromaticContact CZ-CZ2 3.8Å; F190-W565 HydrophobicContact CZ-CZ2 3.8Å; S563-W565 PolarHBondContact O-N 3.3Å; S563-W565 PolarHBondContact OG-N 3.09Å; W565-S567 PolarHBondContact O-N 3.35Å; W565-C594 HydrophobicContact CD2-CB 4.42Å; W565-C594 HydrophobicContact CE3-CB 4.38Å; W565-C594 HydrophobicContact CH2-CB 3.66Å; W565-C594 HydrophobicContact CZ2-CB 3.66Å; W565-C594 HydrophobicContact CZ3-CB 4.02Å
566	S	78.2	Confident	84.2	Confident	21 Å²	21	49.5 Å²	49.5	15%	0.147	26%	0.261	C	S	.	.	S	Bend	trans	-58.4	138.7	170.5	-165.7	0	0	0	0	110.6	T547 S563 I564 T568	T547-S566 WeakPolarHBondContact CG2-OG 3.43Å; S563-S566 WeakPolarHBondContact O-CB 3.42Å; S563-S566 PolarHBondContact O-N 3.08Å; S563-S566 VanDerWaalsContact O-N 3.08Å; I564-S566 PolarHBondContact O-N 3.01Å; S566-T568 PolarHBondContact O-N 3.27Å; S566-T568 VanDerWaalsContact O-N 3.14Å; S566-T568 PolarHBondContact OG-N 2.72Å; S566-T568 PolarHBondContact OG-OG1 3.12Å
567	S	67.1	Low	84.3	Confident	121 Å²	121	45 Å²	45	85%	0.846	24%	0.244	S	C	*	.	S	Bend	trans	-57.4	-26.7	169.4	50.6	0	0	0	0	112.2	W565 R569	W565-S567 PolarHBondContact O-N 3.35Å; S567-R569 PolarHBondContact O-N 2.86Å
568	T	62	Low	84.4	Confident	49 Å²	49	43.3 Å²	43.3	30%	0.301	24%	0.238	S	C	.	.	S	Bend	trans	-92.7	89.3	176.3	-8.1	0	0	0	0	107.3	T519 S566 S570	T519-T568 HydrophobicContact CG2-CG2 4.15Å; T519-T568 VanDerWaalsContact OG1-CG2 3.23Å; T519-T568 WeakPolarHBondContact OG1-CG2 3.36Å; T519-T568 PolarHBondContact OG1-OG1 2.87Å; S566-T568 PolarHBondContact O-N 3.27Å; S566-T568 VanDerWaalsContact O-N 3.14Å; S566-T568 PolarHBondContact OG-N 2.72Å; S566-T568 PolarHBondContact OG-OG1 3.12Å; T568-S570 PolarHBondContact O-N 3.08Å
569	R	59.3	Low	84.3	Confident	231 Å²	231	44.5 Å²	44.5	87%	0.872	24%	0.244	S	C	*	.			trans	-62.6	83.6	171.2	-71	-175.7	-178.3	171.2	0.3	109.2	S567	S567-R569 PolarHBondContact O-N 2.86Å
570	S	59.6	Low	84.1	Confident	37 Å²	37	47.4 Å²	47.4	26%	0.259	26%	0.256	S	S	.	.			trans	-74.7	142.4	170.8	106.3	0	0	0	0	108.2	T568 D572	T568-S570 PolarHBondContact O-N 3.08Å; S570-D572 PolarHBondContact O-N 2.49Å; S570-D572 PolarHBondContact OG-N 3.49Å
571	A	63.2	Low	84.1	Confident	106 Å²	106	52.2 Å²	52.2	88%	0.876	28%	0.279	S	S	*	.	S	Bend	trans	-65.9	-15.9	175.4	0	0	0	0	0	112.4
572	D	78.6	Confident	84.2	Confident	98 Å²	98	52 Å²	52	52%	0.524	28%	0.278	S	S	.	.			trans	-109.4	62.6	-172.6	-73.2	0.8	0	0	0	111.1	S570 R587	S570-D572 PolarHBondContact O-N 2.49Å; S570-D572 PolarHBondContact OG-N 3.49Å; D572-R587 IonicContact OD2-NH2 3.98Å; D572-R587 PolarHBondContact OD2-NH2 3.48Å
573	C	89.7	Confident	84.3	Confident	23 Å²	23	59.6 Å²	59.6	16%	0.155	31%	0.306	C	S	.	.			trans	-69.3	141.1	171.1	-69.5	0	0	0	0	110.9	V590 F593	C573-V590 CarbonylContact C-O 3.48Å; C573-V590 PolarHBondContact O-N 2.78Å; C573-F593 HydrophobicContact CB-CB 4.13Å
574	G	93.4	Very high	84.6	Confident	4 Å²	4	62.9 Å²	62.9	4%	0.041	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.7	-161.1	-179	0	0	0	0	0	113.4	S561 V562 K588	S561-G574 WeakPolarHBondContact CA-O 3.35Å; V562-G574 PolarHBondContact N-O 3.44Å; V562-G574 PolarHBondContact O-N 2.84Å; G574-K588 WeakPolarHBondContact CA-O 3.44Å
575	Y	94.7	Very high	84.7	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153	-179.3	69.6	-84.9	0	0	0	112.3	I183 V559 T560 I577 K588 V590 F593 F596	I183-Y575 HydrophobicContact CD1-CD1 4.02Å; I183-Y575 HydrophobicContact CD1-CE1 3.25Å; I183-Y575 HydrophobicContact CG1-CE1 4.24Å; V559-Y575 HydrophobicContact CG2-CD2 4.06Å; V559-Y575 HydrophobicContact CG2-CG 4.45Å; T560-Y575 CarbonylContact O-C 3.53Å; T560-Y575 WeakPolarHBondContact O-CA 3.46Å; Y575-I577 HydrophobicContact CD2-CD1 4.36Å; Y575-I577 HydrophobicContact CD2-CG1 4Å; Y575-I577 HydrophobicContact CE2-CD1 3.92Å; Y575-I577 HydrophobicContact CE2-CG1 4.03Å; Y575-K588 HydrophobicContact CD1-CB 4.26Å; Y575-K588 HydrophobicContact CE1-CB 3.71Å; Y575-K588 HydrophobicContact CE1-CD 3.82Å; Y575-K588 HydrophobicContact CE1-CG 4.14Å; Y575-K588 HydrophobicContact CE2-CB 4.19Å; Y575-K588 PolarHBondContact N-O 2.93Å; Y575-K588 VanDerWaalsContact N-O 3.11Å; Y575-K588 PolarHBondContact O-N 2.91Å; Y575-K588 WeakPolarHBondContact OH-CD 3.49Å; Y575-V590 HydrophobicContact CD1-CG2 4.22Å; Y575-V590 HydrophobicContact CE1-CG2 4.03Å; Y575-F593 HydrophobicContact CD1-CD2 4.44Å; Y575-F593 HydrophobicContact CD1-CE2 4.02Å; Y575-F596 HydrophobicContact CD1-CD2 4.35Å; Y575-F596 AromaticContact CD2-CD2 3.99Å; Y575-F596 HydrophobicContact CD2-CD2 3.99Å; Y575-F596 AromaticContact CD2-CE2 3.93Å; Y575-F596 HydrophobicContact CD2-CE2 3.93Å; Y575-F596 HydrophobicContact CE2-CD2 4.4Å; Y575-F596 HydrophobicContact CE2-CE2 4.04Å; Y575-F596 AromaticContact CG-CD2 3.96Å; Y575-F596 HydrophobicContact CG-CD2 3.96Å; Y575-F596 HydrophobicContact CG-CE2 4.37Å
576	M	95.3	Very high	85	Confident	15 Å²	15	58.6 Å²	58.6	7%	0.074	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.3	175.6	-62.4	-177	-169.3	0	0	109.3	H543 V559 T560 W578 L584 Q586 R587	H543-M576 HydrophobicContact CB-SD 4.48Å; H543-M576 VanDerWaalsContact CD2-CE 3.4Å; H543-M576 WeakPolarHBondContact CD2-CE 3.44Å; H543-M576 VanDerWaalsContact NE2-CE 3.29Å; H543-M576 WeakPolarHBondContact NE2-CE 3.41Å; V559-M576 CarbonylContact C-O 3.59Å; V559-M576 VanDerWaalsContact CA-O 3.3Å; V559-M576 WeakPolarHBondContact CA-O 3.37Å; V559-M576 WeakPolarHBondContact CG2-O 3.29Å; T560-M576 PolarHBondContact N-O 2.85Å; T560-M576 PolarHBondContact O-N 3.5Å; M576-W578 HydrophobicContact CB-CZ2 4.06Å; M576-W578 HydrophobicContact SD-CH2 4.31Å; M576-W578 HydrophobicContact SD-CZ2 3.63Å; M576-L584 HydrophobicContact CB-CD1 3.94Å; M576-L584 HydrophobicContact CG-CD1 4.38Å; M576-L584 HydrophobicContact SD-CD1 4.42Å; M576-Q586 CarbonylContact C-O 3.1Å; M576-Q586 VanDerWaalsContact CA-O 3.25Å; M576-Q586 WeakPolarHBondContact CA-O 3.43Å; M576-R587 HydrophobicContact CE-CG 4.03Å; M576-R587 HydrophobicContact CG-CB 4.27Å; M576-R587 HydrophobicContact CG-CG 4.06Å
577	I	95.8	Very high	85.7	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.9	174.9	-58.7	179.4	0	0	0	108.4	Y557 V559 Y575 L585 Q586 W598	Y557-I577 HydrophobicContact CD1-CG2 4.19Å; Y557-I577 HydrophobicContact CG-CG2 4.46Å; V559-I577 HydrophobicContact CG2-CG1 4.23Å; Y575-I577 HydrophobicContact CD2-CD1 4.36Å; Y575-I577 HydrophobicContact CD2-CG1 4Å; Y575-I577 HydrophobicContact CE2-CD1 3.92Å; Y575-I577 HydrophobicContact CE2-CG1 4.03Å; I577-L585 HydrophobicContact CG2-CD1 4.49Å; I577-L585 WeakPolarHBondContact O-CB 3.37Å; I577-L585 PolarHBondContact O-N 2.84Å; I577-Q586 HydrophobicContact CB-CB 4.36Å; I577-Q586 PolarHBondContact N-O 3.05Å; I577-Q586 PolarHBondContact O-N 2.96Å; I577-Q586 VanDerWaalsContact O-N 3.16Å; I577-W598 HydrophobicContact CD1-CH2 4.29Å; I577-W598 HydrophobicContact CD1-CZ2 4.4Å
578	W	96.3	Very high	86.9	Confident	5 Å²	5	61.7 Å²	61.7	2%	0.019	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	153.6	177.5	-43.1	76.4	0	0	0	109	L525 F527 Q541 Y557 V558 T560 M576 R583 L584	L525-W578 HydrophobicContact CD1-CZ2 4.08Å; F527-W578 HydrophobicContact CZ-CB 4.17Å; F527-W578 HydrophobicContact CZ-CG 4.22Å; Q541-W578 HydrophobicContact CB-CH2 4.02Å; Q541-W578 HydrophobicContact CB-CZ3 3.83Å; Q541-W578 HydrophobicContact CG-CE3 4.17Å; Q541-W578 HydrophobicContact CG-CH2 4.3Å; Q541-W578 HydrophobicContact CG-CZ3 3.61Å; Y557-W578 CarbonylContact C-O 3.47Å; Y557-W578 VanDerWaalsContact CA-O 3.25Å; Y557-W578 WeakPolarHBondContact CA-O 3.35Å; V558-W578 HydrophobicContact CG1-CB 3.73Å; V558-W578 HydrophobicContact CG1-CG 4.16Å; V558-W578 PolarHBondContact N-O 2.77Å; V558-W578 PolarHBondContact O-N 2.89Å; T560-W578 PolarHBondContact OG1-NE1 2.77Å; M576-W578 HydrophobicContact CB-CZ2 4.06Å; M576-W578 HydrophobicContact SD-CH2 4.31Å; M576-W578 HydrophobicContact SD-CZ2 3.63Å; W578-R583 CarbonylContact C-O 3.54Å; W578-R583 VanDerWaalsContact CA-O 3.26Å; W578-R583 WeakPolarHBondContact CA-O 3.25Å; W578-L584 HydrophobicContact CD2-CB 4.5Å; W578-L584 HydrophobicContact CD2-CD1 3.97Å; W578-L584 HydrophobicContact CE3-CB 3.72Å; W578-L584 HydrophobicContact CE3-CD1 3.98Å; W578-L584 HydrophobicContact CE3-CG 4.46Å; W578-L584 HydrophobicContact CH2-CB 4.28Å; W578-L584 HydrophobicContact CH2-CD1 3.94Å; W578-L584 HydrophobicContact CZ2-CD1 3.92Å; W578-L584 HydrophobicContact CZ3-CB 3.59Å; W578-L584 HydrophobicContact CZ3-CD1 3.97Å; W578-L584 HydrophobicContact CZ3-CG 4.27Å
579	N	95	Very high	88.4	Confident	24 Å²	24	64.2 Å²	64.2	13%	0.128	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	168.2	163.2	78.3	-1.6	0	0	0	110.5	R556 Q581 G582 R583 L585	R556-N579 CarbonylContact O-C 3.58Å; R556-N579 WeakPolarHBondContact O-CA 3.42Å; N579-Q581 PolarHBondContact O-N 2.87Å; N579-Q581 WeakPolarHBondContact OD1-CA 3.48Å; N579-Q581 WeakPolarHBondContact OD1-CB 3.42Å; N579-Q581 PolarHBondContact OD1-N 2.78Å; N579-Q581 VanDerWaalsContact OD1-N 3.09Å; N579-G582 PolarHBondContact O-N 2.69Å; N579-G582 PolarHBondContact OD1-N 2.82Å; N579-R583 PolarHBondContact N-O 2.9Å; N579-R583 WeakPolarHBondContact OD1-CB 3.34Å; N579-R583 PolarHBondContact OD1-N 2.85Å; N579-L585 HydrophobicContact CB-CD1 4.12Å; N579-L585 HydrophobicContact CB-CG 4.4Å
580	F	94.2	Very high	89.9	Confident	64 Å²	64	54.7 Å²	54.7	28%	0.281	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.9	179.7	65.4	-90.8	0	0	0	115	H511 W551 G555 R556	H511-F580 AromaticContact CD2-CD2 3.59Å; H511-F580 AromaticContact CE1-CD2 3.67Å; H511-F580 AromaticContact CE1-CE2 3.91Å; H511-F580 AromaticContact CG-CD2 3.99Å; H511-F580 AromaticContact NE2-CD2 3.38Å; H511-F580 WeakPolarHBondContact NE2-CD2 3.21Å; H511-F580 AromaticContact NE2-CE2 3.64Å; W551-F580 HydrophobicContact CH2-CB 4.03Å; W551-F580 HydrophobicContact CZ3-CB 3.72Å; G555-F580 WeakPolarHBondContact O-CB 3.47Å; R556-F580 WeakPolarHBondContact O-CD1 3.41Å; R556-F580 PolarHBondContact O-N 2.94Å
581	Q	94.8	Very high	91.3	Very high	100 Å²	100	59 Å²	59	47%	0.467	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.3	176	-58.5	177	-38	0	0	112.9	N539 N579	N539-Q581 WeakPolarHBondContact CB-O 3.32Å; N579-Q581 PolarHBondContact O-N 2.87Å; N579-Q581 WeakPolarHBondContact OD1-CA 3.48Å; N579-Q581 WeakPolarHBondContact OD1-CB 3.42Å; N579-Q581 PolarHBondContact OD1-N 2.78Å; N579-Q581 VanDerWaalsContact OD1-N 3.09Å
582	G	95.4	Very high	92.6	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	89.6	16.5	-178.4	0	0	0	0	0	115.5	F527 N539 Q541 N579	F527-G582 VanDerWaalsContact CD2-CA 3.47Å; F527-G582 VanDerWaalsContact CG-CA 3.47Å; N539-G582 PolarHBondContact ND2-O 2.95Å; N539-G582 VanDerWaalsContact ND2-O 3.08Å; Q541-G582 WeakPolarHBondContact CG-O 3.14Å; N579-G582 PolarHBondContact O-N 2.69Å; N579-G582 PolarHBondContact OD1-N 2.82Å
583	R	95.7	Very high	93.2	Very high	160 Å²	160	53.3 Å²	53.3	60%	0.604	26%	0.262	S	S	*	.			trans	-80.1	127.8	169.1	-176	-179.1	175.4	176.1	0.2	109.5	W578 N579 L585	W578-R583 CarbonylContact C-O 3.54Å; W578-R583 VanDerWaalsContact CA-O 3.26Å; W578-R583 WeakPolarHBondContact CA-O 3.25Å; N579-R583 PolarHBondContact N-O 2.9Å; N579-R583 WeakPolarHBondContact OD1-CB 3.34Å; N579-R583 PolarHBondContact OD1-N 2.85Å; R583-L585 PolarHBondContact O-N 2.93Å
584	L	94.9	Very high	93.3	Very high	76 Å²	76	52.3 Å²	52.3	40%	0.398	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.8	173.4	-175.1	63.2	0	0	0	110	M576 W578 Q586	M576-L584 HydrophobicContact CB-CD1 3.94Å; M576-L584 HydrophobicContact CG-CD1 4.38Å; M576-L584 HydrophobicContact SD-CD1 4.42Å; W578-L584 HydrophobicContact CD2-CB 4.5Å; W578-L584 HydrophobicContact CD2-CD1 3.97Å; W578-L584 HydrophobicContact CE3-CB 3.72Å; W578-L584 HydrophobicContact CE3-CD1 3.98Å; W578-L584 HydrophobicContact CE3-CG 4.46Å; W578-L584 HydrophobicContact CH2-CB 4.28Å; W578-L584 HydrophobicContact CH2-CD1 3.94Å; W578-L584 HydrophobicContact CZ2-CD1 3.92Å; W578-L584 HydrophobicContact CZ3-CB 3.59Å; W578-L584 HydrophobicContact CZ3-CD1 3.97Å; W578-L584 HydrophobicContact CZ3-CG 4.27Å; L584-Q586 WeakPolarHBondContact CD1-O 3.42Å
585	L	92.2	Very high	93.3	Very high	68 Å²	68	57 Å²	57	36%	0.356	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-42.8	175.8	-60.3	178.3	0	0	0	111.3	Y557 I577 N579 R583	Y557-L585 HydrophobicContact CD1-CD1 3.51Å; Y557-L585 HydrophobicContact CE1-CD1 3.36Å; I577-L585 HydrophobicContact CG2-CD1 4.49Å; I577-L585 WeakPolarHBondContact O-CB 3.37Å; I577-L585 PolarHBondContact O-N 2.84Å; N579-L585 HydrophobicContact CB-CD1 4.12Å; N579-L585 HydrophobicContact CB-CG 4.4Å; R583-L585 PolarHBondContact O-N 2.93Å
586	Q	90.6	Very high	93.3	Very high	25 Å²	25	57.4 Å²	57.4	12%	0.117	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.4	-178.6	-169.7	178.2	19.6	0	0	111	P202 M576 I577 L584	P202-Q586 VanDerWaalsContact CD-OE1 3.29Å; P202-Q586 VanDerWaalsContact CG-OE1 3.22Å; M576-Q586 CarbonylContact C-O 3.1Å; M576-Q586 VanDerWaalsContact CA-O 3.25Å; M576-Q586 WeakPolarHBondContact CA-O 3.43Å; I577-Q586 HydrophobicContact CB-CB 4.36Å; I577-Q586 PolarHBondContact N-O 3.05Å; I577-Q586 PolarHBondContact O-N 2.96Å; I577-Q586 VanDerWaalsContact O-N 3.16Å; L584-Q586 WeakPolarHBondContact CD1-O 3.42Å
587	R	92.5	Very high	93.3	Very high	145 Å²	145	57.5 Å²	57.5	55%	0.547	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120	164.6	177.8	177	-176.2	175.6	1.8	107.8	D572 M576	D572-R587 IonicContact OD2-NH2 3.98Å; D572-R587 PolarHBondContact OD2-NH2 3.48Å; M576-R587 HydrophobicContact CE-CG 4.03Å; M576-R587 HydrophobicContact CG-CB 4.27Å; M576-R587 HydrophobicContact CG-CG 4.06Å
588	K	92.1	Very high	93.4	Very high	62 Å²	62	57.5 Å²	57.5	27%	0.27	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	104	179.1	-158.9	173.6	-168.5	172.4	0	110.2	G574 Y575 V590	G574-K588 WeakPolarHBondContact CA-O 3.44Å; Y575-K588 HydrophobicContact CD1-CB 4.26Å; Y575-K588 HydrophobicContact CE1-CB 3.71Å; Y575-K588 HydrophobicContact CE1-CD 3.82Å; Y575-K588 HydrophobicContact CE1-CG 4.14Å; Y575-K588 HydrophobicContact CE2-CB 4.19Å; Y575-K588 PolarHBondContact N-O 2.93Å; Y575-K588 VanDerWaalsContact N-O 3.11Å; Y575-K588 PolarHBondContact O-N 2.91Å; Y575-K588 WeakPolarHBondContact OH-CD 3.49Å; K588-V590 HydrophobicContact CG-CG2 4.34Å
589	P	92.6	Very high	93.4	Very high	102 Å²	102	57.4 Å²	57.4	66%	0.662	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	136	169.5	29.1	-32.1	0	0	0	108.9
590	V	91.6	Very high	93.4	Very high	30 Å²	30	57.9 Å²	57.9	18%	0.182	28%	0.279	C	S	.	.			trans	-135.1	120.4	179.4	175.4	0	0	0	0	108.1	A185 C573 Y575 K588 E592 F593	A185-V590 HydrophobicContact CB-CG1 3.75Å; C573-V590 CarbonylContact C-O 3.48Å; C573-V590 PolarHBondContact O-N 2.78Å; Y575-V590 HydrophobicContact CD1-CG2 4.22Å; Y575-V590 HydrophobicContact CE1-CG2 4.03Å; K588-V590 HydrophobicContact CG-CG2 4.34Å; V590-E592 PolarHBondContact O-N 2.86Å; V590-F593 HydrophobicContact CB-CB 3.92Å; V590-F593 HydrophobicContact CB-CD2 4.07Å; V590-F593 HydrophobicContact CB-CG 4.43Å; V590-F593 HydrophobicContact CG1-CB 4.01Å; V590-F593 HydrophobicContact CG1-CD2 4.19Å; V590-F593 WeakPolarHBondContact O-CB 3.41Å; V590-F593 PolarHBondContact O-N 2.92Å
591	V	89	Confident	93.2	Very high	128 Å²	128	58.7 Å²	58.7	78%	0.776	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	130.9	177.6	179.3	0	0	0	0	109	F593	V591-F593 PolarHBondContact O-N 2.86Å
592	E	89.5	Confident	92.9	Very high	85 Å²	85	55.5 Å²	55.5	40%	0.397	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	36.5	-178.1	-60	-176.4	161.9	0	0	113.8	A185 G186 C187 I564 V590 C594	A185-E592 CarbonylContact C-O 3.57Å; A185-E592 VanDerWaalsContact CA-O 3.32Å; A185-E592 WeakPolarHBondContact CA-O 3.49Å; G186-E592 VanDerWaalsContact CA-OE2 3.23Å; G186-E592 WeakPolarHBondContact CA-OE2 3.45Å; G186-E592 PolarHBondContact N-O 2.85Å; C187-E592 PolarHBondContact N-OE2 2.83Å; I564-E592 HydrophobicContact CD1-CB 3.98Å; I564-E592 HydrophobicContact CD1-CG 3.81Å; V590-E592 PolarHBondContact O-N 2.86Å; E592-C594 PolarHBondContact O-N 2.79Å; E592-C594 PolarHBondContact O-SG 2.9Å; E592-C594 VanDerWaalsContact O-SG 3.36Å
593	F	92.5	Very high	92.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	126.5	176.5	177	-90.8	0	0	0	111.5	I183 V562 I564 C573 Y575 V590 V591 R595 F596	I183-F593 HydrophobicContact CG2-CD2 3.88Å; I183-F593 HydrophobicContact CG2-CE2 3.84Å; V562-F593 WeakPolarHBondContact O-CD1 3.08Å; I564-F593 WeakPolarHBondContact CB-O 3.41Å; I564-F593 VanDerWaalsContact CG2-O 3.27Å; I564-F593 WeakPolarHBondContact CG2-O 3.48Å; I564-F593 PolarHBondContact N-O 2.81Å; C573-F593 HydrophobicContact CB-CB 4.13Å; Y575-F593 HydrophobicContact CD1-CD2 4.44Å; Y575-F593 HydrophobicContact CD1-CE2 4.02Å; V590-F593 HydrophobicContact CB-CB 3.92Å; V590-F593 HydrophobicContact CB-CD2 4.07Å; V590-F593 HydrophobicContact CB-CG 4.43Å; V590-F593 HydrophobicContact CG1-CB 4.01Å; V590-F593 HydrophobicContact CG1-CD2 4.19Å; V590-F593 WeakPolarHBondContact O-CB 3.41Å; V590-F593 PolarHBondContact O-N 2.92Å; V591-F593 PolarHBondContact O-N 2.86Å; F593-R595 VanDerWaalsContact CZ-C 3.44Å; F593-F596 HydrophobicContact CE2-CB 4.12Å; F593-F596 HydrophobicContact CZ-CB 3.7Å
594	C	91.8	Very high	92	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-52.4	-179.4	-64.6	0	0	0	0	111.9	Q184 G186 S563 W565 E592	Q184-C594 HydrophobicContact CB-CB 4.45Å; Q184-C594 HydrophobicContact CG-CB 4.19Å; Q184-C594 WeakPolarHBondContact O-CA 3.39Å; Q184-C594 WeakPolarHBondContact O-CB 3.44Å; Q184-C594 PolarHBondContact O-N 3.36Å; G186-C594 PolarHBondContact O-SG 2.92Å; G186-C594 VanDerWaalsContact O-SG 3.4Å; S563-C594 WeakPolarHBondContact CB-O 3.25Å; S563-C594 PolarHBondContact OG-O 2.87Å; W565-C594 HydrophobicContact CD2-CB 4.42Å; W565-C594 HydrophobicContact CE3-CB 4.38Å; W565-C594 HydrophobicContact CH2-CB 3.66Å; W565-C594 HydrophobicContact CZ2-CB 3.66Å; W565-C594 HydrophobicContact CZ3-CB 4.02Å; E592-C594 PolarHBondContact O-N 2.79Å; E592-C594 PolarHBondContact O-SG 2.9Å; E592-C594 VanDerWaalsContact O-SG 3.36Å
595	R	92.1	Very high	91.7	Very high	104 Å²	104	67 Å²	67	39%	0.392	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	145.2	-172.2	-167.5	173.5	-174.1	89.3	2.5	112.1	I183 Q184 F593	I183-R595 WeakPolarHBondContact CA-O 3.32Å; Q184-R595 HydrophobicContact CB-CB 4.4Å; Q184-R595 PolarHBondContact N-O 2.89Å; Q184-R595 PolarHBondContact O-N 2.91Å; Q184-R595 VanDerWaalsContact O-N 3.13Å; F593-R595 VanDerWaalsContact CZ-C 3.44Å
596	F	95.7	Very high	91.5	Very high	10 Å²	10	67.6 Å²	67.6	4%	0.044	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144	164.9	-177.7	-73.2	0	0	0	108.4	F181 V182 I183 V559 Y575 F593 W598	F181-F596 HydrophobicContact CB-CE1 3.74Å; F181-F596 HydrophobicContact CB-CE2 4.02Å; F181-F596 HydrophobicContact CB-CZ 3.38Å; F181-F596 HydrophobicContact CD1-CE2 4.2Å; F181-F596 AromaticContact CD1-CZ 3.88Å; F181-F596 HydrophobicContact CD1-CZ 3.88Å; F181-F596 AromaticContact CD2-CD2 3.94Å; F181-F596 HydrophobicContact CD2-CD2 3.94Å; F181-F596 HydrophobicContact CD2-CE1 4.46Å; F181-F596 AromaticContact CD2-CE2 3.21Å; F181-F596 HydrophobicContact CD2-CE2 3.21Å; F181-F596 AromaticContact CD2-CZ 3.53Å; F181-F596 HydrophobicContact CD2-CZ 3.53Å; F181-F596 HydrophobicContact CE1-CE2 4.48Å; F181-F596 HydrophobicContact CE2-CD2 4.36Å; F181-F596 AromaticContact CE2-CE2 3.6Å; F181-F596 HydrophobicContact CE2-CE2 3.6Å; F181-F596 HydrophobicContact CE2-CZ 4.24Å; F181-F596 HydrophobicContact CG-CE1 4.17Å; F181-F596 AromaticContact CG-CE2 3.55Å; F181-F596 HydrophobicContact CG-CE2 3.55Å; F181-F596 AromaticContact CG-CZ 3.31Å; F181-F596 HydrophobicContact CG-CZ 3.31Å; F181-F596 HydrophobicContact CZ-CE2 4.2Å; V182-F596 WeakPolarHBondContact O-CA 3.33Å; I183-F596 HydrophobicContact CG1-CD2 4Å; V559-F596 HydrophobicContact CB-CD1 4.21Å; V559-F596 HydrophobicContact CB-CE1 4.03Å; V559-F596 HydrophobicContact CB-CZ 4.28Å; V559-F596 HydrophobicContact CG1-CD1 3.55Å; V559-F596 HydrophobicContact CG1-CE1 3.7Å; V559-F596 HydrophobicContact CG1-CG 4.22Å; V559-F596 HydrophobicContact CG1-CZ 4.42Å; V559-F596 HydrophobicContact CG2-CD1 4.06Å; V559-F596 HydrophobicContact CG2-CD2 3.99Å; V559-F596 HydrophobicContact CG2-CE1 4.09Å; V559-F596 HydrophobicContact CG2-CE2 3.98Å; V559-F596 HydrophobicContact CG2-CG 4.03Å; V559-F596 HydrophobicContact CG2-CZ 4.03Å; Y575-F596 HydrophobicContact CD1-CD2 4.35Å; Y575-F596 AromaticContact CD2-CD2 3.99Å; Y575-F596 HydrophobicContact CD2-CD2 3.99Å; Y575-F596 AromaticContact CD2-CE2 3.93Å; Y575-F596 HydrophobicContact CD2-CE2 3.93Å; Y575-F596 HydrophobicContact CE2-CD2 4.4Å; Y575-F596 HydrophobicContact CE2-CE2 4.04Å; Y575-F596 AromaticContact CG-CD2 3.96Å; Y575-F596 HydrophobicContact CG-CD2 3.96Å; Y575-F596 HydrophobicContact CG-CE2 4.37Å; F593-F596 HydrophobicContact CE2-CB 4.12Å; F593-F596 HydrophobicContact CZ-CB 3.7Å; F596-W598 AromaticContact CE1-CD1 3.7Å; F596-W598 AromaticContact CE1-CD2 3.68Å; F596-W598 HydrophobicContact CE1-CD2 3.68Å; F596-W598 AromaticContact CE1-CE2 3.47Å; F596-W598 VanDerWaalsContact CE1-CE2 3.47Å; F596-W598 HydrophobicContact CE1-CE3 4.39Å; F596-W598 AromaticContact CE1-CG 3.79Å; F596-W598 HydrophobicContact CE1-CG 3.79Å; F596-W598 AromaticContact CE1-CZ2 3.97Å; F596-W598 HydrophobicContact CE1-CZ2 3.97Å; F596-W598 AromaticContact CE1-NE1 3.51Å; F596-W598 AromaticContact CZ-CD2 3.97Å; F596-W598 HydrophobicContact CZ-CD2 3.97Å; F596-W598 AromaticContact CZ-CE2 3.62Å; F596-W598 HydrophobicContact CZ-CE3 4.33Å; F596-W598 AromaticContact CZ-CH2 3.97Å; F596-W598 HydrophobicContact CZ-CH2 3.97Å; F596-W598 AromaticContact CZ-CZ2 3.62Å; F596-W598 HydrophobicContact CZ-CZ2 3.62Å; F596-W598 HydrophobicContact CZ-CZ3 4.34Å
597	S	96.1	Very high	91.6	Very high	17 Å²	17	69 Å²	69	12%	0.119	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	124.3	169	-169.2	0	0	0	0	112.4	F181 V182 W218 E550	F181-S597 VanDerWaalsContact CA-O 3.31Å; F181-S597 WeakPolarHBondContact CA-O 3.4Å; F181-S597 WeakPolarHBondContact CB-O 3.37Å; V182-S597 PolarHBondContact N-O 3.07Å; V182-S597 PolarHBondContact O-N 2.81Å; W218-S597 PolarHBondContact NE1-O 2.87Å; E550-S597 WeakPolarHBondContact OE2-CA 3.29Å
598	W	96.6	Very high	91.4	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.008	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	138.9	170.4	-73.1	111.4	0	0	0	110.7	D179 F181 N197 E550 D552 I577 F596 P600	D179-W598 HydrophobicContact CB-CE3 4.13Å; D179-W598 HydrophobicContact CB-CZ3 4Å; F181-W598 HydrophobicContact CB-CD2 4.23Å; F181-W598 HydrophobicContact CB-CE3 3.71Å; F181-W598 HydrophobicContact CB-CZ3 3.95Å; F181-W598 HydrophobicContact CD1-CE3 4.16Å; F181-W598 AromaticContact CD1-CH2 3.83Å; F181-W598 HydrophobicContact CD1-CH2 3.83Å; F181-W598 AromaticContact CD1-CZ3 3.49Å; F181-W598 HydrophobicContact CD1-CZ3 3.49Å; F181-W598 VanDerWaalsContact CD1-CZ3 3.49Å; F181-W598 HydrophobicContact CE1-CH2 4.42Å; F181-W598 HydrophobicContact CE1-CZ3 4.4Å; F181-W598 HydrophobicContact CG-CE3 4.37Å; F181-W598 HydrophobicContact CG-CZ3 4.12Å; N197-W598 HydrophobicContact CB-CH2 3.84Å; N197-W598 HydrophobicContact CB-CZ3 3.8Å; E550-W598 PolarHBondContact OE2-N 2.58Å; D552-W598 HydrophobicContact CB-CD2 3.89Å; D552-W598 HydrophobicContact CB-CE3 4.29Å; D552-W598 HydrophobicContact CB-CG 4.22Å; D552-W598 HydrophobicContact CB-CZ2 4.3Å; I577-W598 HydrophobicContact CD1-CH2 4.29Å; I577-W598 HydrophobicContact CD1-CZ2 4.4Å; F596-W598 AromaticContact CE1-CD1 3.7Å; F596-W598 AromaticContact CE1-CD2 3.68Å; F596-W598 HydrophobicContact CE1-CD2 3.68Å; F596-W598 AromaticContact CE1-CE2 3.47Å; F596-W598 VanDerWaalsContact CE1-CE2 3.47Å; F596-W598 HydrophobicContact CE1-CE3 4.39Å; F596-W598 AromaticContact CE1-CG 3.79Å; F596-W598 HydrophobicContact CE1-CG 3.79Å; F596-W598 AromaticContact CE1-CZ2 3.97Å; F596-W598 HydrophobicContact CE1-CZ2 3.97Å; F596-W598 AromaticContact CE1-NE1 3.51Å; F596-W598 AromaticContact CZ-CD2 3.97Å; F596-W598 HydrophobicContact CZ-CD2 3.97Å; F596-W598 AromaticContact CZ-CE2 3.62Å; F596-W598 HydrophobicContact CZ-CE3 4.33Å; F596-W598 AromaticContact CZ-CH2 3.97Å; F596-W598 HydrophobicContact CZ-CH2 3.97Å; F596-W598 AromaticContact CZ-CZ2 3.62Å; F596-W598 HydrophobicContact CZ-CZ2 3.62Å; F596-W598 HydrophobicContact CZ-CZ3 4.34Å; W598-P600 VanDerWaalsContact O-CD 3.24Å; W598-P600 WeakPolarHBondContact O-CD 3.37Å
599	R	96.2	Very high	91.5	Very high	3 Å²	3	67.8 Å²	67.8	1%	0.011	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-70.2	117.8	171.5	-172.4	173.7	-172	166.2	2.9	108.3	W171 Q180 W218 G222 P553	W171-R599 VanDerWaalsContact CD1-NH1 3.34Å; Q180-R599 HydrophobicContact CB-CB 3.82Å; Q180-R599 HydrophobicContact CB-CG 4.49Å; Q180-R599 VanDerWaalsContact O-CB 3.26Å; Q180-R599 WeakPolarHBondContact O-CB 3.41Å; Q180-R599 PolarHBondContact O-N 2.81Å; Q180-R599 VanDerWaalsContact OE1-CD 3.23Å; W218-R599 HydrophobicContact CD2-CB 4.35Å; W218-R599 HydrophobicContact CD2-CG 4.11Å; W218-R599 HydrophobicContact CE3-CG 4.04Å; W218-R599 HydrophobicContact CH2-CB 4.16Å; W218-R599 HydrophobicContact CH2-CG 3.73Å; W218-R599 HydrophobicContact CZ2-CB 3.71Å; W218-R599 HydrophobicContact CZ2-CG 3.8Å; W218-R599 HydrophobicContact CZ3-CG 3.87Å; G222-R599 PolarHBondContact O-NE 2.8Å; G222-R599 PolarHBondContact O-NH2 2.83Å; P553-R599 WeakPolarHBondContact CG-O 3.43Å
600	P	94.6	Very high	91.6	Very high	33 Å²	33	67.2 Å²	67.2	21%	0.214	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-60.8	151.2	179.5	-24.7	35.8	0	0	0	112	W171 W218 P220 W598	W171-P600 WeakPolarHBondContact CH2-O 3.34Å; W171-P600 VanDerWaalsContact CZ2-O 3.29Å; W171-P600 WeakPolarHBondContact CZ2-O 3.05Å; W218-P600 VanDerWaalsContact CB-CD 3.43Å; W218-P600 HydrophobicContact CB-CG 3.91Å; P220-P600 WeakPolarHBondContact O-CB 3.38Å; W598-P600 VanDerWaalsContact O-CD 3.24Å; W598-P600 WeakPolarHBondContact O-CD 3.37Å
601	R	90.7	Very high	91.5	Very high	81 Å²	81	69.3 Å²	69.3	31%	0.306	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-102.7	138.1	169.4	-54	-140.3	178.7	-172.5	-2.7	111.7	W171 C177 D179 P553	W171-R601 HydrophobicContact CH2-CB 3.82Å; W171-R601 HydrophobicContact CH2-CG 3.44Å; W171-R601 VanDerWaalsContact CH2-CG 3.44Å; W171-R601 HydrophobicContact CZ3-CG 3.82Å; C177-R601 PolarHBondContact O-NH2 3.3Å; C177-R601 VanDerWaalsContact O-NH2 3.08Å; D179-R601 IonicContact OD1-CZ 3.8Å; D179-R601 IonicContact OD1-NE 2.72Å; D179-R601 PolarHBondContact OD1-NE 3.49Å; D179-R601 IonicContact OD1-NH2 3.72Å; D179-R601 PolarHBondContact OD1-NH2 3.33Å; D179-R601 IonicContact OD2-NH2 2.62Å; D179-R601 PolarHBondContact OD2-NH2 2.98Å; P553-R601 HydrophobicContact CB-CB 4.12Å; P553-R601 HydrophobicContact CB-CG 3.63Å; P553-R601 HydrophobicContact CG-CG 4.03Å
602	P	89.6	Confident	91.6	Very high	33 Å²	33	69.6 Å²	69.6	21%	0.214	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-64	162.2	167.2	26.9	-30.6	0	0	0	110.5	L172 Q221 S604	L172-P602 HydrophobicContact CD1-CG 3.64Å; Q221-P602 HydrophobicContact CB-CB 4.15Å; Q221-P602 WeakPolarHBondContact O-CD 3.48Å; P602-S604 PolarHBondContact O-N 3.37Å
603	R	85	Confident	91.8	Very high	233 Å²	233	72 Å²	72	88%	0.879	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-58	139	174.4	-172.7	175.6	178.2	-179.4	0	110	L605	R603-L605 PolarHBondContact O-N 3.08Å
604	S	86	Confident	91.7	Very high	67 Å²	67	74.8 Å²	74.8	47%	0.469	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-55.9	137	176.2	-176.1	0	0	0	0	111.2	P602 L606	P602-S604 PolarHBondContact O-N 3.37Å; S604-L606 WeakPolarHBondContact OG-CB 3.33Å; S604-L606 WeakPolarHBondContact OG-CG 3.23Å; S604-L606 PolarHBondContact OG-N 3.42Å
605	L	88	Confident	91.5	Very high	178 Å²	178	82.7 Å²	82.7	93%	0.932	41%	0.41	S	S	*	.			trans	-78.4	-9.2	172.5	-62.4	175.7	0	0	0	112.4	R603	R603-L605 PolarHBondContact O-N 3.08Å
606	L	89.5	Confident	91.6	Very high	80 Å²	80	87.7 Å²	87.7	42%	0.419	43%	0.429	S	S	.	.			trans	-66.7	134.1	179.1	-64.4	174.8	0	0	0	110.8	S604 E610 M611	S604-L606 WeakPolarHBondContact OG-CB 3.33Å; S604-L606 WeakPolarHBondContact OG-CG 3.23Å; S604-L606 PolarHBondContact OG-N 3.42Å; L606-E610 HydrophobicContact CB-CB 4.29Å; L606-E610 HydrophobicContact CD2-CB 4.13Å; L606-M611 HydrophobicContact CB-CG 3.93Å; L606-M611 HydrophobicContact CD1-CG 4.45Å
607	S	92	Very high	91.4	Very high	54 Å²	54	90.5 Å²	90.5	38%	0.378	44%	0.444	S	S	.	.			trans	-67.1	159.6	170	64.8	0	0	0	0	111.6	A609 E610 M611	S607-A609 PolarHBondContact O-N 2.82Å; S607-A609 VanDerWaalsContact O-N 3.16Å; S607-E610 WeakPolarHBondContact CB-OE2 3.41Å; S607-E610 PolarHBondContact N-OE2 3.44Å; S607-E610 PolarHBondContact O-N 3.08Å; S607-E610 VanDerWaalsContact O-N 3.07Å; S607-E610 VanDerWaalsContact OG-CD 3.31Å; S607-E610 VanDerWaalsContact OG-CG 3.31Å; S607-E610 WeakPolarHBondContact OG-CG 3.46Å; S607-E610 PolarHBondContact OG-N 2.7Å; S607-E610 PolarHBondContact OG-OE2 2.84Å; S607-M611 PolarHBondContact O-N 2.76Å
608	D	89	Confident	91.1	Very high	110 Å²	110	94.4 Å²	94.4	59%	0.588	46%	0.463	S	S	*	.	H	α-helix	trans	-58.2	-30.9	175.3	-68.6	-21.5	0	0	0	112.7	M611 K612	D608-M611 VanDerWaalsContact OD1-CE 3.24Å; D608-M611 WeakPolarHBondContact OD1-CE 3.45Å; D608-K612 WeakPolarHBondContact O-CB 3.18Å; D608-K612 VanDerWaalsContact O-CG 3.23Å; D608-K612 WeakPolarHBondContact O-CG 3.38Å; D608-K612 PolarHBondContact O-N 2.96Å
609	A	93.7	Very high	90.8	Very high	72 Å²	72	102.7 Å²	102.7	60%	0.595	50%	0.499	S	S	*	.	H	α-helix	trans	-68.3	-42.8	176.5	0	0	0	0	0	111.7	S607 K612 K613	S607-A609 PolarHBondContact O-N 2.82Å; S607-A609 VanDerWaalsContact O-N 3.16Å; A609-K612 PolarHBondContact O-N 2.81Å; A609-K613 PolarHBondContact O-N 3.09Å
610	E	94.2	Very high	90.6	Very high	91 Å²	91	109.1 Å²	109.1	43%	0.425	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-43.3	176.4	-70	163.3	137.2	0	0	111.3	L606 S607 K612 K613 V614	L606-E610 HydrophobicContact CB-CB 4.29Å; L606-E610 HydrophobicContact CD2-CB 4.13Å; S607-E610 WeakPolarHBondContact CB-OE2 3.41Å; S607-E610 PolarHBondContact N-OE2 3.44Å; S607-E610 PolarHBondContact O-N 3.08Å; S607-E610 VanDerWaalsContact O-N 3.07Å; S607-E610 VanDerWaalsContact OG-CD 3.31Å; S607-E610 VanDerWaalsContact OG-CG 3.31Å; S607-E610 WeakPolarHBondContact OG-CG 3.46Å; S607-E610 PolarHBondContact OG-N 2.7Å; S607-E610 PolarHBondContact OG-OE2 2.84Å; E610-K612 VanDerWaalsContact C-N 3.29Å; E610-K612 PolarHBondContact O-N 3.04Å; E610-K613 CarbonylContact O-C 3.59Å; E610-K613 WeakPolarHBondContact O-CA 3.48Å; E610-K613 WeakPolarHBondContact O-CB 3.26Å; E610-K613 PolarHBondContact O-N 3.07Å; E610-V614 WeakPolarHBondContact O-CG2 3.49Å; E610-V614 PolarHBondContact O-N 3.16Å
611	M	89.5	Confident	90.3	Very high	74 Å²	74	111.5 Å²	111.5	37%	0.365	53%	0.533	S	S	.	.	H	α-helix	trans	-58.6	-41.7	173.6	-73.4	-164.9	-79.1	0	0	111.7	L606 S607 D608 K613 V614 K615	L606-M611 HydrophobicContact CB-CG 3.93Å; L606-M611 HydrophobicContact CD1-CG 4.45Å; S607-M611 PolarHBondContact O-N 2.76Å; D608-M611 VanDerWaalsContact OD1-CE 3.24Å; D608-M611 WeakPolarHBondContact OD1-CE 3.45Å; M611-K613 VanDerWaalsContact C-N 3.34Å; M611-K613 PolarHBondContact O-N 3.32Å; M611-V614 PolarHBondContact O-N 2.84Å; M611-K615 WeakPolarHBondContact O-CG 3.08Å; M611-K615 PolarHBondContact O-N 2.91Å
612	K	91.4	Very high	90.3	Very high	134 Å²	134	110.2 Å²	110.2	58%	0.583	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-39.2	173.1	-77.6	172.3	-175.5	174.1	0	112	D608 A609 E610 K615 R616	D608-K612 WeakPolarHBondContact O-CB 3.18Å; D608-K612 VanDerWaalsContact O-CG 3.23Å; D608-K612 WeakPolarHBondContact O-CG 3.38Å; D608-K612 PolarHBondContact O-N 2.96Å; A609-K612 PolarHBondContact O-N 2.81Å; E610-K612 VanDerWaalsContact C-N 3.29Å; E610-K612 PolarHBondContact O-N 3.04Å; K612-K615 PolarHBondContact O-N 2.94Å; K612-R616 WeakPolarHBondContact O-CG 3.42Å; K612-R616 PolarHBondContact O-N 3.08Å
613	K	93.6	Very high	90.4	Very high	135 Å²	135	115.1 Å²	115.1	59%	0.587	55%	0.554	S	S	*	*	H	α-helix	trans	-64.2	-42.3	176.2	-174.3	-178.7	177.9	-176.3	0	111.6	A609 E610 M611 R616 N617	A609-K613 PolarHBondContact O-N 3.09Å; E610-K613 CarbonylContact O-C 3.59Å; E610-K613 WeakPolarHBondContact O-CA 3.48Å; E610-K613 WeakPolarHBondContact O-CB 3.26Å; E610-K613 PolarHBondContact O-N 3.07Å; M611-K613 VanDerWaalsContact C-N 3.34Å; M611-K613 PolarHBondContact O-N 3.32Å; K613-R616 PolarHBondContact O-N 3.47Å; K613-N617 PolarHBondContact O-N 2.81Å; K613-N617 VanDerWaalsContact O-N 3.08Å; K613-N617 PolarHBondContact O-ND2 2.93Å
614	V	90.9	Very high	90.6	Very high	59 Å²	59	109.7 Å²	109.7	36%	0.358	54%	0.54	S	S	.	.	H	α-helix	trans	-60.3	-48.8	174.9	173.8	0	0	0	0	110.4	E610 M611 R616 N617 L618 Y621	E610-V614 WeakPolarHBondContact O-CG2 3.49Å; E610-V614 PolarHBondContact O-N 3.16Å; M611-V614 PolarHBondContact O-N 2.84Å; V614-R616 VanDerWaalsContact C-N 3.31Å; V614-R616 PolarHBondContact O-N 3.13Å; V614-N617 CarbonylContact O-C 3.57Å; V614-N617 PolarHBondContact O-N 2.66Å; V614-N617 VanDerWaalsContact O-N 3.13Å; V614-L618 PolarHBondContact O-N 2.96Å; V614-L618 VanDerWaalsContact O-N 3.08Å; V614-Y621 HydrophobicContact CG1-CD2 4.47Å; V614-Y621 HydrophobicContact CG1-CE2 4.41Å
615	K	88.1	Confident	90.7	Very high	166 Å²	166	111.6 Å²	111.6	72%	0.722	54%	0.54	S	S	*	.	H	α-helix	trans	-59.5	-38.3	177	-71.7	-177.5	179.6	-172.6	0	113	M611 K612 N617 L618	M611-K615 WeakPolarHBondContact O-CG 3.08Å; M611-K615 PolarHBondContact O-N 2.91Å; K612-K615 PolarHBondContact O-N 2.94Å; K615-N617 VanDerWaalsContact C-N 3.35Å; K615-L618 WeakPolarHBondContact O-CB 3.5Å
616	R	92.8	Very high	90.7	Very high	210 Å²	210	108.9 Å²	108.9	79%	0.792	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-36.2	176.5	-75.3	176.1	-174	177.6	1.8	112.8	K612 K613 V614	K612-R616 WeakPolarHBondContact O-CG 3.42Å; K612-R616 PolarHBondContact O-N 3.08Å; K613-R616 PolarHBondContact O-N 3.47Å; V614-R616 VanDerWaalsContact C-N 3.31Å; V614-R616 PolarHBondContact O-N 3.13Å
617	N	92.6	Very high	90.6	Very high	68 Å²	68	108.9 Å²	108.9	36%	0.364	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	16.2	-177.2	-65.9	-26.7	0	0	0	112.9	K613 V614 K615 K619 K620 Y621	K613-N617 PolarHBondContact O-N 2.81Å; K613-N617 VanDerWaalsContact O-N 3.08Å; K613-N617 PolarHBondContact O-ND2 2.93Å; V614-N617 CarbonylContact O-C 3.57Å; V614-N617 PolarHBondContact O-N 2.66Å; V614-N617 VanDerWaalsContact O-N 3.13Å; K615-N617 VanDerWaalsContact C-N 3.35Å; N617-K619 VanDerWaalsContact C-N 3.3Å; N617-K619 PolarHBondContact O-N 2.91Å; N617-K620 PolarHBondContact O-N 3.17Å; N617-K620 VanDerWaalsContact O-N 3.1Å; N617-Y621 HydrophobicContact CB-CD2 4.13Å; N617-Y621 HydrophobicContact CB-CE2 3.65Å; N617-Y621 VanDerWaalsContact O-CD2 3.23Å; N617-Y621 WeakPolarHBondContact O-CD2 3.48Å; N617-Y621 PolarHBondContact O-N 2.81Å
618	L	89	Confident	90.3	Very high	99 Å²	99	111 Å²	111	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-55.1	-44.1	-171.6	-170.9	65.6	0	0	0	112.2	V614 K615 K620 Y621 T622	V614-L618 PolarHBondContact O-N 2.96Å; V614-L618 VanDerWaalsContact O-N 3.08Å; K615-L618 WeakPolarHBondContact O-CB 3.5Å; L618-K620 VanDerWaalsContact C-N 3.31Å; L618-K620 PolarHBondContact O-N 3.21Å; L618-Y621 CarbonylContact O-C 3.59Å; L618-Y621 PolarHBondContact O-N 3.34Å; L618-T622 PolarHBondContact O-N 3.36Å; L618-T622 PolarHBondContact O-OG1 2.96Å
619	K	91.2	Very high	90.1	Very high	177 Å²	177	110.2 Å²	110.2	77%	0.77	52%	0.516	S	S	*	.	H	α-helix	trans	-55.2	-42.9	179.1	-66.5	-171.8	177.7	-172	0	113.4	N617 Y621 T622 E623	N617-K619 VanDerWaalsContact C-N 3.3Å; N617-K619 PolarHBondContact O-N 2.91Å; K619-Y621 VanDerWaalsContact C-N 3.34Å; K619-Y621 PolarHBondContact O-N 3.04Å; K619-T622 WeakPolarHBondContact O-CB 3.37Å; K619-T622 PolarHBondContact O-N 3.28Å; K619-E623 PolarHBondContact O-N 3.1Å; K619-E623 VanDerWaalsContact O-N 3.14Å
620	K	91	Very high	89.7	Confident	138 Å²	138	113.5 Å²	113.5	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-40.9	177.8	-179	179.9	177.8	178.8	0	111.4	N617 L618 M624	N617-K620 PolarHBondContact O-N 3.17Å; N617-K620 VanDerWaalsContact O-N 3.1Å; L618-K620 VanDerWaalsContact C-N 3.31Å; L618-K620 PolarHBondContact O-N 3.21Å; K620-M624 WeakPolarHBondContact O-CG 3.05Å; K620-M624 PolarHBondContact O-N 3.48Å
621	Y	89.3	Confident	89.3	Confident	82 Å²	82	113.2 Å²	113.2	32%	0.322	51%	0.514	S	S	.	.	H	α-helix	trans	-70.4	-38	177.5	-64.2	-58.1	0	0	0	111.6	V614 N617 L618 K619 E623 M624 F625	V614-Y621 HydrophobicContact CG1-CD2 4.47Å; V614-Y621 HydrophobicContact CG1-CE2 4.41Å; N617-Y621 HydrophobicContact CB-CD2 4.13Å; N617-Y621 HydrophobicContact CB-CE2 3.65Å; N617-Y621 VanDerWaalsContact O-CD2 3.23Å; N617-Y621 WeakPolarHBondContact O-CD2 3.48Å; N617-Y621 PolarHBondContact O-N 2.81Å; L618-Y621 CarbonylContact O-C 3.59Å; L618-Y621 PolarHBondContact O-N 3.34Å; K619-Y621 VanDerWaalsContact C-N 3.34Å; K619-Y621 PolarHBondContact O-N 3.04Å; Y621-E623 PolarHBondContact O-N 3.49Å; Y621-M624 PolarHBondContact O-N 3.31Å; Y621-F625 WeakPolarHBondContact O-CD2 3.48Å; Y621-F625 PolarHBondContact O-N 3.41Å
622	T	90.1	Very high	88.8	Confident	54 Å²	54	111.4 Å²	111.4	33%	0.331	51%	0.506	S	S	.	.	H	α-helix	trans	-55.1	-51.8	175.1	-60.4	0	0	0	0	111	L618 K619 M624 F625 E626	L618-T622 PolarHBondContact O-N 3.36Å; L618-T622 PolarHBondContact O-OG1 2.96Å; K619-T622 WeakPolarHBondContact O-CB 3.37Å; K619-T622 PolarHBondContact O-N 3.28Å; T622-M624 VanDerWaalsContact C-N 3.3Å; T622-M624 PolarHBondContact O-N 3.23Å; T622-F625 PolarHBondContact O-N 3.49Å; T622-F625 VanDerWaalsContact O-N 3.17Å; T622-E626 HydrophobicContact CG2-CG 4.18Å; T622-E626 WeakPolarHBondContact CG2-OE1 3.4Å; T622-E626 WeakPolarHBondContact O-CB 3.49Å; T622-E626 WeakPolarHBondContact O-CG 3.45Å; T622-E626 PolarHBondContact O-N 3.18Å
623	E	90.7	Very high	88.3	Confident	137 Å²	137	110.5 Å²	110.5	64%	0.64	51%	0.507	S	S	*	.	H	α-helix	trans	-58.3	-41.2	177.9	-70.8	170.8	-169.3	0	0	112.4	K619 Y621 E627	K619-E623 PolarHBondContact O-N 3.1Å; K619-E623 VanDerWaalsContact O-N 3.14Å; Y621-E623 PolarHBondContact O-N 3.49Å; E623-E627 PolarHBondContact O-N 3.02Å; E623-E627 VanDerWaalsContact O-N 3.16Å
624	M	89.7	Confident	87.8	Confident	119 Å²	119	108.8 Å²	108.8	59%	0.586	50%	0.503	S	S	*	.	H	α-helix	trans	-65.4	-41.2	177.3	-73.1	-177.2	58.1	0	0	113	K620 Y621 T622 R628	K620-M624 WeakPolarHBondContact O-CG 3.05Å; K620-M624 PolarHBondContact O-N 3.48Å; Y621-M624 PolarHBondContact O-N 3.31Å; T622-M624 VanDerWaalsContact C-N 3.3Å; T622-M624 PolarHBondContact O-N 3.23Å; M624-R628 PolarHBondContact O-N 2.86Å
625	F	87.5	Confident	87.3	Confident	106 Å²	106	112.7 Å²	112.7	47%	0.465	52%	0.516	S	S	.	.	H	α-helix	trans	-75.3	-38.9	-179.4	-73.6	-60.2	0	0	0	111.9	Y621 T622 E627 R628 D629	Y621-F625 WeakPolarHBondContact O-CD2 3.48Å; Y621-F625 PolarHBondContact O-N 3.41Å; T622-F625 PolarHBondContact O-N 3.49Å; T622-F625 VanDerWaalsContact O-N 3.17Å; F625-E627 VanDerWaalsContact C-N 3.32Å; F625-E627 PolarHBondContact O-N 2.81Å; F625-R628 PolarHBondContact O-N 3.42Å; F625-D629 WeakPolarHBondContact O-CB 3.4Å; F625-D629 PolarHBondContact O-N 3.03Å
626	E	88.3	Confident	86.6	Confident	121 Å²	121	105.8 Å²	105.8	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-60	-41.7	174.6	-75.6	177.7	171.3	0	0	111.7	T622 D629 R630	T622-E626 HydrophobicContact CG2-CG 4.18Å; T622-E626 WeakPolarHBondContact CG2-OE1 3.4Å; T622-E626 WeakPolarHBondContact O-CB 3.49Å; T622-E626 WeakPolarHBondContact O-CG 3.45Å; T622-E626 PolarHBondContact O-N 3.18Å; E626-D629 PolarHBondContact O-N 3.46Å; E626-R630 WeakPolarHBondContact O-CB 3.34Å; E626-R630 PolarHBondContact O-N 2.96Å
627	E	88.9	Confident	85.9	Confident	80 Å²	80	98.5 Å²	98.5	37%	0.374	47%	0.471	S	S	.	.	H	α-helix	trans	-63.3	-42.8	175.3	-176.6	58.4	-152.2	0	0	111.7	E623 F625 R630 L631	E623-E627 PolarHBondContact O-N 3.02Å; E623-E627 VanDerWaalsContact O-N 3.16Å; F625-E627 VanDerWaalsContact C-N 3.32Å; F625-E627 PolarHBondContact O-N 2.81Å; E627-R630 PolarHBondContact O-N 3.41Å; E627-R630 IonicContact OE1-CZ 3.65Å; E627-R630 IonicContact OE1-NE 3.83Å; E627-R630 IonicContact OE1-NH2 2.91Å; E627-R630 PolarHBondContact OE1-NH2 2.9Å; E627-R630 IonicContact OE2-CZ 2.81Å; E627-R630 IonicContact OE2-NE 2.68Å; E627-R630 IonicContact OE2-NH1 3.42Å; E627-R630 IonicContact OE2-NH2 3.7Å; E627-R630 PolarHBondContact OE2-NH2 3.42Å; E627-L631 HydrophobicContact CG-CD1 4.41Å; E627-L631 WeakPolarHBondContact O-CG 3.42Å; E627-L631 PolarHBondContact O-N 2.94Å
628	R	85.8	Confident	85.3	Confident	100 Å²	100	102.1 Å²	102.1	38%	0.377	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-43.6	178.8	-167	173.9	-175.6	129.2	-2.1	111.7	E176 M624 F625 R630 L631 N632	E176-R628 VanDerWaalsContact CD-NE 3.29Å; E176-R628 IonicContact OE1-CZ 3.23Å; E176-R628 IonicContact OE1-NE 3.72Å; E176-R628 PolarHBondContact OE1-NE 3.16Å; E176-R628 IonicContact OE1-NH2 3.83Å; E176-R628 PolarHBondContact OE1-NH2 3.25Å; E176-R628 IonicContact OE2-CZ 3.78Å; E176-R628 IonicContact OE2-NE 3.91Å; E176-R628 PolarHBondContact OE2-NE 3.14Å; E176-R628 IonicContact OE2-NH2 2.67Å; M624-R628 PolarHBondContact O-N 2.86Å; F625-R628 PolarHBondContact O-N 3.42Å; R628-R630 VanDerWaalsContact C-N 3.32Å; R628-R630 PolarHBondContact O-N 3.25Å; R628-L631 PolarHBondContact O-N 2.85Å; R628-N632 WeakPolarHBondContact O-CB 3.36Å; R628-N632 VanDerWaalsContact O-CG 3.27Å; R628-N632 PolarHBondContact O-N 3.31Å; R628-N632 PolarHBondContact O-ND2 3.02Å
629	D	83.8	Confident	84.8	Confident	93 Å²	93	103.2 Å²	103.2	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-41.2	176.4	-76.1	-14.4	0	0	0	111.1	F625 E626 N632 L633	F625-D629 WeakPolarHBondContact O-CB 3.4Å; F625-D629 PolarHBondContact O-N 3.03Å; E626-D629 PolarHBondContact O-N 3.46Å; D629-N632 PolarHBondContact O-N 3.44Å; D629-L633 WeakPolarHBondContact O-CB 3.37Å; D629-L633 PolarHBondContact O-N 3.29Å
630	R	85.4	Confident	84.1	Confident	141 Å²	141	97.6 Å²	97.6	53%	0.532	47%	0.468	S	S	.	.	H	α-helix	trans	-60.7	-47	174.3	-171.7	-178.2	72.9	179.3	3.9	111.7	E626 E627 R628 N632 L633 L634	E626-R630 WeakPolarHBondContact O-CB 3.34Å; E626-R630 PolarHBondContact O-N 2.96Å; E627-R630 PolarHBondContact O-N 3.41Å; E627-R630 IonicContact OE1-CZ 3.65Å; E627-R630 IonicContact OE1-NE 3.83Å; E627-R630 IonicContact OE1-NH2 2.91Å; E627-R630 PolarHBondContact OE1-NH2 2.9Å; E627-R630 IonicContact OE2-CZ 2.81Å; E627-R630 IonicContact OE2-NE 2.68Å; E627-R630 IonicContact OE2-NH1 3.42Å; E627-R630 IonicContact OE2-NH2 3.7Å; E627-R630 PolarHBondContact OE2-NH2 3.42Å; R628-R630 VanDerWaalsContact C-N 3.32Å; R628-R630 PolarHBondContact O-N 3.25Å; R630-N632 VanDerWaalsContact C-N 3.34Å; R630-N632 PolarHBondContact O-N 3.44Å; R630-L633 PolarHBondContact O-N 3.46Å; R630-L634 HydrophobicContact CG-CD1 4.31Å; R630-L634 VanDerWaalsContact O-CG 3.3Å; R630-L634 WeakPolarHBondContact O-CG 3.35Å; R630-L634 PolarHBondContact O-N 3.2Å
631	L	86.1	Confident	83.6	Confident	84 Å²	84	94.8 Å²	94.8	44%	0.44	46%	0.462	S	S	.	.	H	α-helix	trans	-63.5	-39.4	177.9	-70.7	171.8	0	0	0	112.2	E627 R628 L634 K635	E627-L631 HydrophobicContact CG-CD1 4.41Å; E627-L631 WeakPolarHBondContact O-CG 3.42Å; E627-L631 PolarHBondContact O-N 2.94Å; R628-L631 PolarHBondContact O-N 2.85Å; L631-L634 PolarHBondContact O-N 2.68Å; L631-K635 WeakPolarHBondContact O-CG 3.3Å; L631-K635 PolarHBondContact O-N 3Å
632	N	79.5	Confident	83.4	Confident	37 Å²	37	97.4 Å²	97.4	20%	0.198	47%	0.472	C	S	.	.	H	α-helix	trans	-66.7	-43.1	177	-73.6	-20	0	0	0	111.6	E176 R628 D629 R630 L634 K635 A636	E176-N632 PolarHBondContact OE2-ND2 2.93Å; R628-N632 WeakPolarHBondContact O-CB 3.36Å; R628-N632 VanDerWaalsContact O-CG 3.27Å; R628-N632 PolarHBondContact O-N 3.31Å; R628-N632 PolarHBondContact O-ND2 3.02Å; D629-N632 PolarHBondContact O-N 3.44Å; R630-N632 VanDerWaalsContact C-N 3.34Å; R630-N632 PolarHBondContact O-N 3.44Å; N632-L634 VanDerWaalsContact C-N 3.33Å; N632-L634 PolarHBondContact O-N 3.37Å; N632-K635 PolarHBondContact O-N 3.39Å; N632-A636 WeakPolarHBondContact O-CB 3.4Å; N632-A636 PolarHBondContact O-N 3.27Å
633	L	79.3	Confident	83.1	Confident	115 Å²	115	103 Å²	103	60%	0.602	49%	0.487	S	S	*	.	H	α-helix	trans	-62.5	-41.6	176.4	-168.9	72.6	0	0	0	111.4	D629 R630 A636 S637	D629-L633 WeakPolarHBondContact O-CB 3.37Å; D629-L633 PolarHBondContact O-N 3.29Å; R630-L633 PolarHBondContact O-N 3.46Å; L633-A636 PolarHBondContact O-N 3.38Å; L633-S637 WeakPolarHBondContact O-CB 3.42Å; L633-S637 PolarHBondContact O-N 2.81Å; L633-S637 PolarHBondContact O-OG 2.95Å
634	L	84.2	Confident	82.7	Confident	99 Å²	99	104.6 Å²	104.6	52%	0.518	49%	0.487	S	S	.	.	H	α-helix	trans	-61.8	-49.1	176	-73.5	169.3	0	0	0	111.6	R630 L631 N632 A636 S637 E638	R630-L634 HydrophobicContact CG-CD1 4.31Å; R630-L634 VanDerWaalsContact O-CG 3.3Å; R630-L634 WeakPolarHBondContact O-CG 3.35Å; R630-L634 PolarHBondContact O-N 3.2Å; L631-L634 PolarHBondContact O-N 2.68Å; N632-L634 VanDerWaalsContact C-N 3.33Å; N632-L634 PolarHBondContact O-N 3.37Å; L634-A636 PolarHBondContact O-N 2.93Å; L634-S637 PolarHBondContact O-N 3.04Å; L634-S637 PolarHBondContact O-OG 3.47Å; L634-E638 PolarHBondContact O-N 3.47Å
635	K	79.9	Confident	82.6	Confident	141 Å²	141	106.3 Å²	106.3	61%	0.613	49%	0.487	S	S	*	.	H	α-helix	trans	-59.1	-45	176.4	-77.3	179.4	179.6	176.6	0	112.5	L631 N632 S637 E638 E639	L631-K635 WeakPolarHBondContact O-CG 3.3Å; L631-K635 PolarHBondContact O-N 3Å; N632-K635 PolarHBondContact O-N 3.39Å; K635-S637 VanDerWaalsContact C-N 3.31Å; K635-S637 PolarHBondContact O-N 2.88Å; K635-E638 PolarHBondContact O-N 3.48Å; K635-E639 PolarHBondContact O-N 3.34Å
636	A	73.9	Confident	82.8	Confident	20 Å²	20	105.1 Å²	105.1	17%	0.165	48%	0.483	C	S	.	.	H	α-helix	trans	-64.3	-39	178.3	0	0	0	0	0	111.6	P200 N632 L633 L634 E639 V640	P200-A636 VanDerWaalsContact CD-CB 3.44Å; P200-A636 HydrophobicContact CG-CB 4.19Å; N632-A636 WeakPolarHBondContact O-CB 3.4Å; N632-A636 PolarHBondContact O-N 3.27Å; L633-A636 PolarHBondContact O-N 3.38Å; L634-A636 PolarHBondContact O-N 2.93Å; A636-E639 PolarHBondContact O-N 3.47Å; A636-V640 WeakPolarHBondContact O-CB 3.5Å; A636-V640 VanDerWaalsContact O-CG2 3.25Å; A636-V640 WeakPolarHBondContact O-CG2 3.36Å; A636-V640 PolarHBondContact O-N 3.46Å
637	S	77.6	Confident	82.9	Confident	58 Å²	58	104.3 Å²	104.3	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-63.9	-41.4	175.9	76.7	0	0	0	0	111.7	L633 L634 K635 V640 V641	L633-S637 WeakPolarHBondContact O-CB 3.42Å; L633-S637 PolarHBondContact O-N 2.81Å; L633-S637 PolarHBondContact O-OG 2.95Å; L634-S637 PolarHBondContact O-N 3.04Å; L634-S637 PolarHBondContact O-OG 3.47Å; K635-S637 VanDerWaalsContact C-N 3.31Å; K635-S637 PolarHBondContact O-N 2.88Å; S637-V640 PolarHBondContact O-N 3Å; S637-V641 VanDerWaalsContact O-CB 3.27Å; S637-V641 WeakPolarHBondContact O-CB 3.11Å; S637-V641 WeakPolarHBondContact O-CG2 3.27Å; S637-V641 PolarHBondContact O-N 3.35Å
638	E	80.8	Confident	83	Confident	144 Å²	144	106.4 Å²	106.4	67%	0.673	49%	0.488	S	S	*	.	H	α-helix	trans	-64.1	-44.5	177.6	-171	-179.4	177.9	0	0	111.6	L634 K635 V641 R642	L634-E638 PolarHBondContact O-N 3.47Å; K635-E638 PolarHBondContact O-N 3.48Å; E638-V641 PolarHBondContact O-N 3.49Å; E638-R642 WeakPolarHBondContact O-CB 3.35Å; E638-R642 PolarHBondContact O-N 3Å
639	E	78.1	Confident	83.4	Confident	121 Å²	121	106.3 Å²	106.3	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-67.5	-41	179.4	-174.4	160.2	-157.7	0	0	112.4	K635 A636 R642 R643	K635-E639 PolarHBondContact O-N 3.34Å; A636-E639 PolarHBondContact O-N 3.47Å; E639-R642 PolarHBondContact O-N 2.88Å; E639-R642 IonicContact OE1-NH2 2.72Å; E639-R643 WeakPolarHBondContact O-CB 3.25Å; E639-R643 PolarHBondContact O-N 2.89Å
640	V	77.2	Confident	83.8	Confident	59 Å²	59	108.2 Å²	108.2	36%	0.358	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-43.4	173.8	170.9	0	0	0	0	110.8	A636 S637 R643 R644	A636-V640 WeakPolarHBondContact O-CB 3.5Å; A636-V640 VanDerWaalsContact O-CG2 3.25Å; A636-V640 WeakPolarHBondContact O-CG2 3.36Å; A636-V640 PolarHBondContact O-N 3.46Å; S637-V640 PolarHBondContact O-N 3Å; V640-R643 PolarHBondContact O-N 2.91Å; V640-R644 HydrophobicContact CG1-CG 4.43Å; V640-R644 WeakPolarHBondContact O-CB 3.39Å; V640-R644 VanDerWaalsContact O-CG 3.29Å; V640-R644 WeakPolarHBondContact O-CG 3.44Å; V640-R644 PolarHBondContact O-N 3.43Å
641	V	80.3	Confident	84.2	Confident	79 Å²	79	107.2 Å²	107.2	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-42.2	177.3	168.2	0	0	0	0	110.7	S637 E638 R644 R645	S637-V641 VanDerWaalsContact O-CB 3.27Å; S637-V641 WeakPolarHBondContact O-CB 3.11Å; S637-V641 WeakPolarHBondContact O-CG2 3.27Å; S637-V641 PolarHBondContact O-N 3.35Å; E638-V641 PolarHBondContact O-N 3.49Å; V641-R644 PolarHBondContact O-N 3.33Å; V641-R645 WeakPolarHBondContact O-CB 3.37Å; V641-R645 PolarHBondContact O-N 3.34Å
642	R	85	Confident	84.6	Confident	137 Å²	137	105.7 Å²	105.7	52%	0.517	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-49.3	176.2	-167.8	-173.7	74.7	-152.3	-10.3	111	E638 E639 R644 R645 E646	E638-R642 WeakPolarHBondContact O-CB 3.35Å; E638-R642 PolarHBondContact O-N 3Å; E639-R642 PolarHBondContact O-N 2.88Å; E639-R642 IonicContact OE1-NH2 2.72Å; R642-R644 VanDerWaalsContact C-N 3.34Å; R642-R644 PolarHBondContact O-N 2.87Å; R642-R645 WeakPolarHBondContact O-CB 3.41Å; R642-R645 PolarHBondContact O-N 3.12Å; R642-R645 VanDerWaalsContact O-N 3.12Å; R642-E646 WeakPolarHBondContact CG-OE1 3.37Å; R642-E646 IonicContact NE-OE1 3.7Å; R642-E646 PolarHBondContact NE-OE1 3.03Å; R642-E646 WeakPolarHBondContact O-CG 3.44Å; R642-E646 PolarHBondContact O-N 3.41Å
643	R	82.3	Confident	85.3	Confident	172 Å²	172	110.2 Å²	110.2	65%	0.649	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-38.3	179.6	-160.6	178.2	-168.5	159.8	3.4	112.5	E639 V640 R645 M647	E639-R643 WeakPolarHBondContact O-CB 3.25Å; E639-R643 PolarHBondContact O-N 2.89Å; V640-R643 PolarHBondContact O-N 2.91Å; R643-R645 VanDerWaalsContact C-N 3.35Å; R643-M647 WeakPolarHBondContact O-CG 3.38Å; R643-M647 PolarHBondContact O-N 3.42Å
644	R	83	Confident	85.9	Confident	171 Å²	171	109.1 Å²	109.1	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-65.6	-38.7	173.5	-76.4	178.9	179.7	-176	1.2	111.9	V640 V641 R642 M647 F648	V640-R644 HydrophobicContact CG1-CG 4.43Å; V640-R644 WeakPolarHBondContact O-CB 3.39Å; V640-R644 VanDerWaalsContact O-CG 3.29Å; V640-R644 WeakPolarHBondContact O-CG 3.44Å; V640-R644 PolarHBondContact O-N 3.43Å; V641-R644 PolarHBondContact O-N 3.33Å; R642-R644 VanDerWaalsContact C-N 3.34Å; R642-R644 PolarHBondContact O-N 2.87Å; R644-M647 HydrophobicContact CG-CE 4.24Å; R644-F648 VanDerWaalsContact O-CB 3.27Å; R644-F648 WeakPolarHBondContact O-CB 3.35Å; R644-F648 PolarHBondContact O-N 2.74Å
645	R	87.4	Confident	86.3	Confident	154 Å²	154	111.5 Å²	111.5	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-46.5	175.3	-173.1	-175.8	-65.1	-119	-0.1	111.2	V641 R642 R643 M647 F648 E649	V641-R645 WeakPolarHBondContact O-CB 3.37Å; V641-R645 PolarHBondContact O-N 3.34Å; R642-R645 WeakPolarHBondContact O-CB 3.41Å; R642-R645 PolarHBondContact O-N 3.12Å; R642-R645 VanDerWaalsContact O-N 3.12Å; R643-R645 VanDerWaalsContact C-N 3.35Å; R645-M647 PolarHBondContact O-N 2.96Å; R645-F648 PolarHBondContact O-N 3.5Å; R645-F648 VanDerWaalsContact O-N 3.17Å; R645-E649 WeakPolarHBondContact CG-OE1 3.47Å; R645-E649 WeakPolarHBondContact O-CB 3.29Å; R645-E649 WeakPolarHBondContact O-CG 3.36Å; R645-E649 PolarHBondContact O-N 2.96Å
646	E	92.3	Very high	87	Confident	82 Å²	82	110.3 Å²	110.3	38%	0.383	50%	0.501	S	S	.	.	H	α-helix	trans	-57	-50	174.8	-71.6	165	-172.3	0	0	111.3	R642 F648 E649 E650	R642-E646 WeakPolarHBondContact CG-OE1 3.37Å; R642-E646 IonicContact NE-OE1 3.7Å; R642-E646 PolarHBondContact NE-OE1 3.03Å; R642-E646 WeakPolarHBondContact O-CG 3.44Å; R642-E646 PolarHBondContact O-N 3.41Å; E646-F648 VanDerWaalsContact C-N 3.29Å; E646-F648 PolarHBondContact O-N 3.25Å; E646-E649 PolarHBondContact O-N 3.35Å; E646-E650 WeakPolarHBondContact O-CG 3.44Å; E646-E650 PolarHBondContact O-N 2.89Å
647	M	90.6	Very high	88	Confident	104 Å²	104	113.5 Å²	113.5	51%	0.512	51%	0.513	S	S	.	.	H	α-helix	trans	-62.8	-35.4	176.7	-71.7	-173.3	-60.4	0	0	113	R643 R644 R645 F651	R643-M647 WeakPolarHBondContact O-CG 3.38Å; R643-M647 PolarHBondContact O-N 3.42Å; R644-M647 HydrophobicContact CG-CE 4.24Å; R645-M647 PolarHBondContact O-N 2.96Å; M647-F651 VanDerWaalsContact O-CB 3.3Å; M647-F651 WeakPolarHBondContact O-CB 3.3Å; M647-F651 PolarHBondContact O-N 2.89Å
648	F	90	Very high	88.6	Confident	123 Å²	123	117.9 Å²	117.9	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-69.3	-41.3	176.9	-177.8	-100.8	0	0	0	111.4	R644 R645 E646 F651 Q652	R644-F648 VanDerWaalsContact O-CB 3.27Å; R644-F648 WeakPolarHBondContact O-CB 3.35Å; R644-F648 PolarHBondContact O-N 2.74Å; R645-F648 PolarHBondContact O-N 3.5Å; R645-F648 VanDerWaalsContact O-N 3.17Å; E646-F648 VanDerWaalsContact C-N 3.29Å; E646-F648 PolarHBondContact O-N 3.25Å; F648-F651 PolarHBondContact O-N 3.06Å; F648-Q652 HydrophobicContact CD1-CG 4.17Å; F648-Q652 HydrophobicContact CE1-CG 3.84Å; F648-Q652 HydrophobicContact CE2-CG 4.48Å; F648-Q652 HydrophobicContact CZ-CG 4.03Å; F648-Q652 VanDerWaalsContact O-CG 3.31Å; F648-Q652 WeakPolarHBondContact O-CG 3.37Å; F648-Q652 PolarHBondContact O-N 2.8Å
649	E	94	Very high	89	Confident	99 Å²	99	115.6 Å²	115.6	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-62.8	-47.9	174.4	-73.6	170.6	-173	0	0	110.8	R645 E646 F651 Q652 E653	R645-E649 WeakPolarHBondContact CG-OE1 3.47Å; R645-E649 WeakPolarHBondContact O-CB 3.29Å; R645-E649 WeakPolarHBondContact O-CG 3.36Å; R645-E649 PolarHBondContact O-N 2.96Å; E646-E649 PolarHBondContact O-N 3.35Å; E649-F651 VanDerWaalsContact C-N 3.3Å; E649-F651 PolarHBondContact O-N 2.85Å; E649-Q652 PolarHBondContact O-N 2.72Å; E649-Q652 VanDerWaalsContact O-N 3.14Å; E649-E653 WeakPolarHBondContact O-CG 3.34Å; E649-E653 PolarHBondContact O-N 2.83Å
650	E	93.4	Very high	89.7	Confident	133 Å²	133	117.6 Å²	117.6	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-57	-42.1	173.7	-74.1	179.7	179.9	0	0	112.2	E646 E653 L654	E646-E650 WeakPolarHBondContact O-CG 3.44Å; E646-E650 PolarHBondContact O-N 2.89Å; E650-E653 PolarHBondContact O-N 3.17Å; E650-L654 WeakPolarHBondContact O-CB 3.34Å; E650-L654 PolarHBondContact O-N 3.49Å
651	F	94.3	Very high	90.2	Very high	120 Å²	120	117.9 Å²	117.9	53%	0.526	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-41.6	176.7	176.5	-100	0	0	0	112.2	M647 F648 E649 L654 R655	M647-F651 VanDerWaalsContact O-CB 3.3Å; M647-F651 WeakPolarHBondContact O-CB 3.3Å; M647-F651 PolarHBondContact O-N 2.89Å; F648-F651 PolarHBondContact O-N 3.06Å; E649-F651 VanDerWaalsContact C-N 3.3Å; E649-F651 PolarHBondContact O-N 2.85Å; F651-L654 PolarHBondContact O-N 2.88Å; F651-R655 VanDerWaalsContact O-CB 3.28Å; F651-R655 WeakPolarHBondContact O-CB 3.31Å; F651-R655 PolarHBondContact O-N 3.06Å
652	Q	93	Very high	90.4	Very high	51 Å²	51	119 Å²	119	24%	0.238	51%	0.505	C	S	.	.	H	α-helix	trans	-65.7	-43.3	176.4	-70.8	-63.2	-5.9	0	0	111.2	F648 E649 L654 R655 E656	F648-Q652 HydrophobicContact CD1-CG 4.17Å; F648-Q652 HydrophobicContact CE1-CG 3.84Å; F648-Q652 HydrophobicContact CE2-CG 4.48Å; F648-Q652 HydrophobicContact CZ-CG 4.03Å; F648-Q652 VanDerWaalsContact O-CG 3.31Å; F648-Q652 WeakPolarHBondContact O-CG 3.37Å; F648-Q652 PolarHBondContact O-N 2.8Å; E649-Q652 PolarHBondContact O-N 2.72Å; E649-Q652 VanDerWaalsContact O-N 3.14Å; Q652-L654 PolarHBondContact O-N 2.93Å; Q652-R655 PolarHBondContact O-N 3.32Å; Q652-E656 WeakPolarHBondContact O-CB 3.27Å; Q652-E656 WeakPolarHBondContact O-CG 3.37Å; Q652-E656 PolarHBondContact O-N 2.86Å
653	E	94.4	Very high	90.5	Very high	133 Å²	133	116.6 Å²	116.6	62%	0.621	50%	0.502	S	S	*	.	H	α-helix	trans	-59.4	-45.8	175.1	-74.4	-175	176.3	0	0	111.7	E649 E650 R655 E656 Q657	E649-E653 WeakPolarHBondContact O-CG 3.34Å; E649-E653 PolarHBondContact O-N 2.83Å; E650-E653 PolarHBondContact O-N 3.17Å; E653-R655 VanDerWaalsContact C-N 3.34Å; E653-R655 PolarHBondContact O-N 3.14Å; E653-E656 PolarHBondContact O-N 3.4Å; E653-Q657 WeakPolarHBondContact O-CB 3.28Å; E653-Q657 PolarHBondContact O-N 2.8Å
654	L	93.3	Very high	90.7	Very high	91 Å²	91	112.3 Å²	112.3	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-60.1	-45.2	174.9	-172.7	83.8	0	0	0	111	E650 F651 Q652 Q657 R658	E650-L654 WeakPolarHBondContact O-CB 3.34Å; E650-L654 PolarHBondContact O-N 3.49Å; F651-L654 PolarHBondContact O-N 2.88Å; Q652-L654 PolarHBondContact O-N 2.93Å; L654-Q657 PolarHBondContact O-N 2.9Å; L654-R658 WeakPolarHBondContact O-CG 3.36Å; L654-R658 PolarHBondContact O-N 2.74Å
655	R	92.7	Very high	90.8	Very high	149 Å²	149	109.6 Å²	109.6	56%	0.562	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-45	179.4	-176.1	178.7	175.3	-118.6	-0.1	111.2	F651 Q652 E653 R658 H659	F651-R655 VanDerWaalsContact O-CB 3.28Å; F651-R655 WeakPolarHBondContact O-CB 3.31Å; F651-R655 PolarHBondContact O-N 3.06Å; Q652-R655 PolarHBondContact O-N 3.32Å; E653-R655 VanDerWaalsContact C-N 3.34Å; E653-R655 PolarHBondContact O-N 3.14Å; R655-R658 PolarHBondContact O-N 3.18Å; R655-H659 VanDerWaalsContact O-CB 3.28Å; R655-H659 WeakPolarHBondContact O-CB 3.43Å; R655-H659 PolarHBondContact O-N 2.92Å
656	E	94.2	Very high	90.5	Very high	116 Å²	116	107 Å²	107	54%	0.542	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-38	175.9	-74.5	-177.6	-177	0	0	112.1	Q652 E653 H659 R660	Q652-E656 WeakPolarHBondContact O-CB 3.27Å; Q652-E656 WeakPolarHBondContact O-CG 3.37Å; Q652-E656 PolarHBondContact O-N 2.86Å; E653-E656 PolarHBondContact O-N 3.4Å; E656-H659 PolarHBondContact O-N 3.42Å; E656-R660 WeakPolarHBondContact O-CB 3.49Å; E656-R660 WeakPolarHBondContact O-CG 3.36Å; E656-R660 PolarHBondContact O-N 2.82Å; E656-R660 PolarHBondContact O-NE 3.37Å
657	Q	93.7	Very high	89.9	Confident	88 Å²	88	108.3 Å²	108.3	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-50.7	173	-178.2	-177.3	-11.2	0	0	111	E653 L654 H659 R660 E661	E653-Q657 WeakPolarHBondContact O-CB 3.28Å; E653-Q657 PolarHBondContact O-N 2.8Å; L654-Q657 PolarHBondContact O-N 2.9Å; Q657-H659 VanDerWaalsContact C-N 3.3Å; Q657-H659 PolarHBondContact O-N 3.45Å; Q657-R660 WeakPolarHBondContact O-CB 3.47Å; Q657-R660 PolarHBondContact O-N 3.45Å; Q657-R660 VanDerWaalsContact O-N 3.12Å; Q657-E661 PolarHBondContact NE2-OE1 3.48Å; Q657-E661 WeakPolarHBondContact O-CG 3.42Å; Q657-E661 PolarHBondContact O-N 3.46Å
658	R	91	Very high	89.5	Confident	149 Å²	149	107.2 Å²	107.2	56%	0.562	50%	0.497	S	S	*	.	H	α-helix	trans	-62.8	-37.4	178	-67.7	-56	-174.7	-174.1	1.4	112.1	L654 R655 R660 E661 W662	L654-R658 WeakPolarHBondContact O-CG 3.36Å; L654-R658 PolarHBondContact O-N 2.74Å; R655-R658 PolarHBondContact O-N 3.18Å; R658-R660 VanDerWaalsContact C-N 3.34Å; R658-E661 WeakPolarHBondContact CD-OE2 3.41Å; R658-E661 IonicContact CZ-OE2 3.73Å; R658-E661 IonicContact NE-OE2 3.66Å; R658-E661 IonicContact NH1-OE1 2.83Å; R658-E661 IonicContact NH1-OE2 3.52Å; R658-E661 PolarHBondContact NH1-OE2 3.44Å; R658-E661 PolarHBondContact O-N 3.48Å; R658-W662 VanDerWaalsContact O-CB 3.29Å; R658-W662 WeakPolarHBondContact O-CB 3.47Å; R658-W662 PolarHBondContact O-N 2.87Å
659	H	89.4	Confident	89.1	Confident	97 Å²	97	102.7 Å²	102.7	45%	0.449	48%	0.476	S	S	.	.	H	α-helix	trans	-64.1	-40.1	174.1	-168.9	-37.3	0	0	0	111.4	R655 E656 Q657 W662 L663	R655-H659 VanDerWaalsContact O-CB 3.28Å; R655-H659 WeakPolarHBondContact O-CB 3.43Å; R655-H659 PolarHBondContact O-N 2.92Å; E656-H659 PolarHBondContact O-N 3.42Å; Q657-H659 VanDerWaalsContact C-N 3.3Å; Q657-H659 PolarHBondContact O-N 3.45Å; H659-W662 PolarHBondContact O-N 3.12Å; H659-L663 WeakPolarHBondContact ND1-CD1 3.28Å; H659-L663 WeakPolarHBondContact O-CG 3.29Å; H659-L663 PolarHBondContact O-N 3.41Å
660	R	91.7	Very high	88.3	Confident	162 Å²	162	99.4 Å²	99.4	61%	0.611	46%	0.461	S	S	*	.	H	α-helix	trans	-65.8	-43.8	175.1	-78.3	-179.3	-72.8	153.8	-7.2	112.2	E656 Q657 R658 W662 L663 A664	E656-R660 WeakPolarHBondContact O-CB 3.49Å; E656-R660 WeakPolarHBondContact O-CG 3.36Å; E656-R660 PolarHBondContact O-N 2.82Å; E656-R660 PolarHBondContact O-NE 3.37Å; Q657-R660 WeakPolarHBondContact O-CB 3.47Å; Q657-R660 PolarHBondContact O-N 3.45Å; Q657-R660 VanDerWaalsContact O-N 3.12Å; R658-R660 VanDerWaalsContact C-N 3.34Å; R660-W662 VanDerWaalsContact C-N 3.34Å; R660-L663 PolarHBondContact O-N 3.49Å; R660-A664 WeakPolarHBondContact O-CB 3.47Å; R660-A664 PolarHBondContact O-N 2.85Å
661	E	88.6	Confident	87.7	Confident	65 Å²	65	102.9 Å²	102.9	30%	0.304	47%	0.469	S	S	.	.	H	α-helix	trans	-59.5	-45.9	173.8	-71.3	170.3	-171.9	0	0	110.8	Q657 R658 L663 A664 E665	Q657-E661 PolarHBondContact NE2-OE1 3.48Å; Q657-E661 WeakPolarHBondContact O-CG 3.42Å; Q657-E661 PolarHBondContact O-N 3.46Å; R658-E661 WeakPolarHBondContact CD-OE2 3.41Å; R658-E661 IonicContact CZ-OE2 3.73Å; R658-E661 IonicContact NE-OE2 3.66Å; R658-E661 IonicContact NH1-OE1 2.83Å; R658-E661 IonicContact NH1-OE2 3.52Å; R658-E661 PolarHBondContact NH1-OE2 3.44Å; R658-E661 PolarHBondContact O-N 3.48Å; E661-L663 PolarHBondContact O-N 3Å; E661-A664 PolarHBondContact O-N 3.18Å; E661-E665 WeakPolarHBondContact O-CG 3.44Å; E661-E665 PolarHBondContact O-N 3.42Å
662	W	84.5	Confident	86.9	Confident	102 Å²	102	104.1 Å²	104.1	39%	0.386	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-42.1	175.5	-175.2	88.3	0	0	0	111.9	R658 H659 R660 A664 E665 R666 R669	R658-W662 VanDerWaalsContact O-CB 3.29Å; R658-W662 WeakPolarHBondContact O-CB 3.47Å; R658-W662 PolarHBondContact O-N 2.87Å; H659-W662 PolarHBondContact O-N 3.12Å; R660-W662 VanDerWaalsContact C-N 3.34Å; W662-A664 PolarHBondContact O-N 3.01Å; W662-E665 PolarHBondContact O-N 2.93Å; W662-R666 PolarHBondContact O-N 3.06Å; W662-R669 VanDerWaalsContact CE2-NH2 3.32Å; W662-R669 PolarHBondContact O-NH1 3.28Å; W662-R669 PolarHBondContact O-NH2 2.93Å
663	L	86.5	Confident	85.8	Confident	88 Å²	88	109.4 Å²	109.4	46%	0.461	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-38.7	174.8	-74.8	172.2	0	0	0	112.4	H659 R660 E661 E665 R666	H659-L663 WeakPolarHBondContact ND1-CD1 3.28Å; H659-L663 WeakPolarHBondContact O-CG 3.29Å; H659-L663 PolarHBondContact O-N 3.41Å; R660-L663 PolarHBondContact O-N 3.49Å; E661-L663 PolarHBondContact O-N 3Å; L663-E665 VanDerWaalsContact C-N 3.33Å; L663-E665 PolarHBondContact O-N 3.32Å; L663-R666 WeakPolarHBondContact O-CB 3.33Å; L663-R666 PolarHBondContact O-N 3.22Å
664	A	87.9	Confident	84.4	Confident	81 Å²	81	106.3 Å²	106.3	67%	0.669	50%	0.501	S	S	*	.	H	α-helix	trans	-66.6	-33.9	179.6	0	0	0	0	0	112.8	R660 E661 W662 R666	R660-A664 WeakPolarHBondContact O-CB 3.47Å; R660-A664 PolarHBondContact O-N 2.85Å; E661-A664 PolarHBondContact O-N 3.18Å; W662-A664 PolarHBondContact O-N 3.01Å; A664-R666 VanDerWaalsContact C-N 3.25Å; A664-R666 PolarHBondContact O-N 3.43Å
665	E	84.8	Confident	82.8	Confident	115 Å²	115	109.5 Å²	109.5	54%	0.537	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	0.1	177.8	-69.9	-177.3	175.4	0	0	114.1	E661 W662 L663 D667 V668 R669	E661-E665 WeakPolarHBondContact O-CG 3.44Å; E661-E665 PolarHBondContact O-N 3.42Å; W662-E665 PolarHBondContact O-N 2.93Å; L663-E665 VanDerWaalsContact C-N 3.33Å; L663-E665 PolarHBondContact O-N 3.32Å; E665-D667 VanDerWaalsContact C-N 3.33Å; E665-D667 PolarHBondContact O-N 3.39Å; E665-V668 WeakPolarHBondContact O-CB 3.41Å; E665-V668 PolarHBondContact O-N 3.13Å; E665-R669 PolarHBondContact O-N 3Å
666	R	80.5	Confident	81.2	Confident	100 Å²	100	108.7 Å²	108.7	38%	0.377	52%	0.518	S	S	.	.	H	α-helix	trans	-50.8	-48.9	-177.8	177.7	172.7	-175	-75.1	-3.2	112.9	W662 L663 A664 V668 R669 I670 D678	W662-R666 PolarHBondContact O-N 3.06Å; L663-R666 WeakPolarHBondContact O-CB 3.33Å; L663-R666 PolarHBondContact O-N 3.22Å; A664-R666 VanDerWaalsContact C-N 3.25Å; A664-R666 PolarHBondContact O-N 3.43Å; R666-V668 VanDerWaalsContact C-N 3.27Å; R666-V668 PolarHBondContact O-N 3.43Å; R666-R669 WeakPolarHBondContact O-CB 3.44Å; R666-R669 PolarHBondContact O-N 2.75Å; R666-R669 VanDerWaalsContact O-N 3.17Å; R666-I670 HydrophobicContact CG-CD1 3.79Å; R666-I670 HydrophobicContact CG-CG1 4.49Å; R666-I670 VanDerWaalsContact CZ-CD1 3.5Å; R666-I670 VanDerWaalsContact NH1-CD1 3.31Å; R666-I670 WeakPolarHBondContact O-CG1 3.4Å; R666-I670 PolarHBondContact O-N 2.95Å; R666-D678 WeakPolarHBondContact CG-OD2 3.4Å; R666-D678 IonicContact NE-OD2 3.48Å
667	D	80.1	Confident	79.4	Confident	108 Å²	108	107.3 Å²	107.3	58%	0.578	52%	0.518	S	S	*	.	H	α-helix	trans	-65.8	-32.1	-177.6	-65.2	-19	0	0	0	112.5	E665 R671	E665-D667 VanDerWaalsContact C-N 3.33Å; E665-D667 PolarHBondContact O-N 3.39Å; D667-R671 WeakPolarHBondContact O-CB 3.49Å; D667-R671 PolarHBondContact O-N 2.83Å; D667-R671 VanDerWaalsContact O-N 3.15Å
668	V	82.5	Confident	77.6	Confident	82 Å²	82	104.1 Å²	104.1	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-71.1	-43.2	175.1	-177.8	0	0	0	0	110	E665 R666 R671 L672	E665-V668 WeakPolarHBondContact O-CB 3.41Å; E665-V668 PolarHBondContact O-N 3.13Å; R666-V668 VanDerWaalsContact C-N 3.27Å; R666-V668 PolarHBondContact O-N 3.43Å; V668-R671 PolarHBondContact O-N 2.93Å; V668-L672 HydrophobicContact CG1-CD1 3.97Å; V668-L672 HydrophobicContact CG1-CG 4.49Å; V668-L672 WeakPolarHBondContact O-CG 3.44Å; V668-L672 PolarHBondContact O-N 2.92Å
669	R	81.2	Confident	75.7	Confident	27 Å²	27	103 Å²	103	10%	0.102	51%	0.508	C	S	.	.	H	α-helix	trans	-60.4	-46.9	176	-72.1	-161.9	-60.1	-78.2	0.5	112.3	W662 E665 R666 R671 L672 R673 D678	W662-R669 VanDerWaalsContact CE2-NH2 3.32Å; W662-R669 PolarHBondContact O-NH1 3.28Å; W662-R669 PolarHBondContact O-NH2 2.93Å; E665-R669 PolarHBondContact O-N 3Å; R666-R669 WeakPolarHBondContact O-CB 3.44Å; R666-R669 PolarHBondContact O-N 2.75Å; R666-R669 VanDerWaalsContact O-N 3.17Å; R669-R671 VanDerWaalsContact C-N 3.3Å; R669-R671 PolarHBondContact O-N 3.32Å; R669-L672 PolarHBondContact O-N 3.28Å; R669-R673 WeakPolarHBondContact O-CB 3.13Å; R669-R673 WeakPolarHBondContact O-CG 3.37Å; R669-R673 PolarHBondContact O-N 2.84Å; R669-D678 IonicContact CZ-OD2 3.66Å; R669-D678 IonicContact NE-OD1 3.12Å; R669-D678 PolarHBondContact NE-OD1 2.89Å; R669-D678 IonicContact NE-OD2 3.95Å; R669-D678 IonicContact NH2-OD1 2.82Å; R669-D678 IonicContact NH2-OD2 3.95Å; R669-D678 PolarHBondContact NH2-OD2 3.41Å
670	I	76.6	Confident	74	Confident	30 Å²	30	102.8 Å²	102.8	15%	0.154	51%	0.511	C	S	.	.	H	α-helix	trans	-59.7	-44	178.2	-69	168.1	0	0	0	110.2	R666 L672 R673 G674	R666-I670 HydrophobicContact CG-CD1 3.79Å; R666-I670 HydrophobicContact CG-CG1 4.49Å; R666-I670 VanDerWaalsContact CZ-CD1 3.5Å; R666-I670 VanDerWaalsContact NH1-CD1 3.31Å; R666-I670 WeakPolarHBondContact O-CG1 3.4Å; R666-I670 PolarHBondContact O-N 2.95Å; I670-L672 PolarHBondContact O-N 2.92Å; I670-R673 PolarHBondContact O-N 2.88Å; I670-G674 PolarHBondContact O-N 3.44Å; I670-G674 VanDerWaalsContact O-N 3.09Å
671	R	80.5	Confident	71.9	Confident	207 Å²	207	99.3 Å²	99.3	78%	0.781	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-41.1	177.5	-167.8	-174.3	-57	-164.2	2	112.7	D667 V668 R669	D667-R671 WeakPolarHBondContact O-CB 3.49Å; D667-R671 PolarHBondContact O-N 2.83Å; D667-R671 VanDerWaalsContact O-N 3.15Å; V668-R671 PolarHBondContact O-N 2.93Å; R669-R671 VanDerWaalsContact C-N 3.3Å; R669-R671 PolarHBondContact O-N 3.32Å
672	L	78.9	Confident	69.9	Low	145 Å²	145	102.8 Å²	102.8	76%	0.759	54%	0.536	S	S	*	.	H	α-helix	trans	-75.9	-30.4	-179.4	-70	171.8	0	0	0	113.1	V668 R669 I670	V668-L672 HydrophobicContact CG1-CD1 3.97Å; V668-L672 HydrophobicContact CG1-CG 4.49Å; V668-L672 WeakPolarHBondContact O-CG 3.44Å; V668-L672 PolarHBondContact O-N 2.92Å; R669-L672 PolarHBondContact O-N 3.28Å; I670-L672 PolarHBondContact O-N 2.92Å
673	R	68.8	Low	68	Low	163 Å²	163	105.6 Å²	105.6	62%	0.615	56%	0.559	S	S	*	*	H	α-helix	trans	-91.6	-10.4	-177	-67.6	-178.3	-177	-176.7	0.9	114.4	R669 I670 K675	R669-R673 WeakPolarHBondContact O-CB 3.13Å; R669-R673 WeakPolarHBondContact O-CG 3.37Å; R669-R673 PolarHBondContact O-N 2.84Å; I670-R673 PolarHBondContact O-N 2.88Å; R673-K675 PolarHBondContact O-N 2.83Å; R673-K675 VanDerWaalsContact O-N 3.17Å
674	G	65.4	Low	65.8	Low	67 Å²	67	106.3 Å²	106.3	69%	0.691	57%	0.571	S	S	*	*	S	Bend	trans	69.6	10.2	169.8	0	0	0	0	0	116	I670	I670-G674 PolarHBondContact O-N 3.44Å; I670-G674 VanDerWaalsContact O-N 3.09Å
675	K	60	Low	63.6	Low	159 Å²	159	107.7 Å²	107.7	69%	0.691	57%	0.567	S	S	*	*	S	Bend	trans	-144.3	146.6	171.2	-76.5	-173.5	177.8	177.8	0	110.2	R673 V677	R673-K675 PolarHBondContact O-N 2.83Å; R673-K675 VanDerWaalsContact O-N 3.17Å; K675-V677 HydrophobicContact CB-CG2 4.17Å; K675-V677 PolarHBondContact O-N 2.84Å
676	D	58.3	Low	61.5	Low	132 Å²	132	107.2 Å²	107.2	71%	0.706	58%	0.577	S	S	*	*	S	Bend	trans	-77	47.9	178.3	-126.3	-3.9	0	0	0	111.5
677	V	56.3	Low	59.7	Low	87 Å²	87	111.3 Å²	111.3	53%	0.527	59%	0.593	S	S	.	*			trans	-122.8	82.7	-179.4	-164.4	0	0	0	0	107.8	K675 D679	K675-V677 HydrophobicContact CB-CG2 4.17Å; K675-V677 PolarHBondContact O-N 2.84Å; V677-D679 HydrophobicContact CG1-CB 4.01Å
678	D	56.5	Low	57.8	Low	21 Å²	21	114 Å²	114	11%	0.112	60%	0.603	C	S	.	*			trans	-97.8	24.5	155.4	-134	31.6	0	0	0	108.3	R666 R669 D680	R666-D678 WeakPolarHBondContact CG-OD2 3.4Å; R666-D678 IonicContact NE-OD2 3.48Å; R669-D678 IonicContact CZ-OD2 3.66Å; R669-D678 IonicContact NE-OD1 3.12Å; R669-D678 PolarHBondContact NE-OD1 2.89Å; R669-D678 IonicContact NE-OD2 3.95Å; R669-D678 IonicContact NH2-OD1 2.82Å; R669-D678 IonicContact NH2-OD2 3.95Å; R669-D678 PolarHBondContact NH2-OD2 3.41Å; D678-D680 PolarHBondContact O-N 3.26Å
679	D	52	Low	56	Low	125 Å²	125	116.7 Å²	116.7	67%	0.668	61%	0.613	S	S	*	*			trans	-77.7	78.3	163.5	-80.7	-21.9	0	0	0	107.2	V677 A681	V677-D679 HydrophobicContact CG1-CB 4.01Å; D679-A681 HydrophobicContact CB-CB 4.49Å; D679-A681 PolarHBondContact O-N 3.49Å
680	D	53.3	Low	53.9	Low	93 Å²	93	122.6 Å²	122.6	50%	0.497	64%	0.642	S	S	.	*			trans	-70	43.9	154.2	-70.3	-29	0	0	0	109.6	D678 L682	D678-D680 PolarHBondContact O-N 3.26Å; D680-L682 PolarHBondContact O-N 2.94Å
681	A	48	Very low	52.2	Low	88 Å²	88	126.5 Å²	126.5	73%	0.727	67%	0.667	S	S	*	*			trans	-78.8	31.2	155.3	0	0	0	0	0	110	D679 D683	D679-A681 HydrophobicContact CB-CB 4.49Å; D679-A681 PolarHBondContact O-N 3.49Å; A681-D683 PolarHBondContact O-N 2.64Å
682	L	45.3	Very low	50	Low	138 Å²	138	123.9 Å²	123.9	72%	0.723	66%	0.664	S	S	*	*	S	Bend	trans	-65.9	125.3	149	-74.9	162.5	0	0	0	104.4	D680 S684	D680-L682 PolarHBondContact O-N 2.94Å; L682-S684 PolarHBondContact O-N 3.49Å
683	D	44.6	Very low	48.2	Very low	161 Å²	161	122.3 Å²	122.3	86%	0.861	66%	0.66	S	S	*	*			trans	-46.7	75.1	167.1	-71.5	-49.5	0	0	0	110.8	A681 D685	A681-D683 PolarHBondContact O-N 2.64Å; D683-D685 PolarHBondContact O-N 2.72Å
684	S	41	Very low	46.5	Very low	103 Å²	103	121.8 Å²	121.8	72%	0.72	67%	0.669	S	S	*	*			trans	-68.1	91.6	157.4	150	0	0	0	0	101.8	L682 S686	L682-S684 PolarHBondContact O-N 3.49Å; S684-S686 VanDerWaalsContact C-N 3.27Å; S684-S686 PolarHBondContact O-N 2.78Å
685	D	41.3	Very low	45.1	Very low	110 Å²	110	125.6 Å²	125.6	59%	0.588	67%	0.672	S	S	*	*			trans	-30.1	101.8	161.2	-82.1	-38.2	0	0	0	106.8	D683 Y687	D683-D685 PolarHBondContact O-N 2.72Å; D685-Y687 HydrophobicContact CB-CD2 3.85Å; D685-Y687 HydrophobicContact CB-CE2 3.55Å; D685-Y687 WeakPolarHBondContact O-CD2 3.38Å; D685-Y687 PolarHBondContact O-N 3.33Å
686	S	40.6	Very low	43.8	Very low	105 Å²	105	123 Å²	123	73%	0.734	67%	0.674	S	S	*	*			trans	-67.8	83	169.1	51.3	0	0	0	0	103.3	S684 E688	S684-S686 VanDerWaalsContact C-N 3.27Å; S684-S686 PolarHBondContact O-N 2.78Å; S686-E688 PolarHBondContact O-N 2.94Å
687	Y	42	Very low	42.7	Very low	186 Å²	186	125.1 Å²	125.1	73%	0.729	68%	0.68	S	S	*	*			trans	-61.4	89.1	156.8	-67.8	-77.1	0	0	0	103.8	D685 I689	D685-Y687 HydrophobicContact CB-CD2 3.85Å; D685-Y687 HydrophobicContact CB-CE2 3.55Å; D685-Y687 WeakPolarHBondContact O-CD2 3.38Å; D685-Y687 PolarHBondContact O-N 3.33Å; Y687-I689 PolarHBondContact O-N 3.17Å
688	E	41.7	Very low	41.7	Very low	165 Å²	165	128.6 Å²	128.6	77%	0.771	69%	0.691	S	S	*	*			trans	-50.1	96.9	146.6	-85.8	-179	152.4	0	0	104.4	S686 E690	S686-E688 PolarHBondContact O-N 2.94Å; E688-E690 PolarHBondContact O-N 2.83Å
689	I	44.5	Very low	40.6	Very low	139 Å²	139	133 Å²	133	71%	0.713	72%	0.718	S	S	*	*			trans	-70.4	81.3	160.9	-57.1	176.6	0	0	0	103.4	Y687 T691	Y687-I689 PolarHBondContact O-N 3.17Å; I689-T691 HydrophobicContact CG2-CG2 3.87Å; I689-T691 PolarHBondContact O-N 3.48Å
690	E	36.6	Very low	39.6	Very low	151 Å²	151	137 Å²	137	71%	0.706	73%	0.73	S	S	*	*			trans	-59.4	95.3	154.7	-79.4	-171.5	149.8	0	0	105.3	E688 E692	E688-E690 PolarHBondContact O-N 2.83Å; E690-E692 PolarHBondContact O-N 2.93Å
691	T	39.8	Very low	38.7	Very low	112 Å²	112	140.6 Å²	140.6	69%	0.687	74%	0.744	S	S	*	*			trans	-67.9	80	160.1	48.9	0	0	0	0	106.7	I689 T693	I689-T691 HydrophobicContact CG2-CG2 3.87Å; I689-T691 PolarHBondContact O-N 3.48Å; T691-T693 PolarHBondContact O-N 2.58Å; T691-T693 PolarHBondContact O-OG1 3.15Å
692	E	36.2	Very low	38.3	Very low	152 Å²	152	147.9 Å²	147.9	71%	0.71	77%	0.771	S	S	*	*			trans	-58.3	97.6	158.4	-89.5	-165.5	153.6	0	0	106.4	E690 L694	E690-E692 PolarHBondContact O-N 2.93Å; E692-L694 PolarHBondContact O-N 3.09Å
693	T	40.5	Very low	38	Very low	112 Å²	112	148.4 Å²	148.4	69%	0.687	77%	0.773	S	S	*	*			trans	-74	88.3	169.1	-44.9	0	0	0	0	104.9	T691 L695	T691-T693 PolarHBondContact O-N 2.58Å; T691-T693 PolarHBondContact O-OG1 3.15Å; T693-L695 HydrophobicContact CG2-CG 4.44Å; T693-L695 PolarHBondContact O-N 2.92Å
694	L	32.2	Very low	37.6	Very low	152 Å²	152	147.7 Å²	147.7	80%	0.796	77%	0.768	S	S	*	*			trans	-65	77	165.1	-84.7	158.5	0	0	0	107.9	E692 S696	E692-L694 PolarHBondContact O-N 3.09Å; L694-S696 PolarHBondContact O-N 3.17Å
695	L	36.1	Very low	37.4	Very low	146 Å²	146	150.2 Å²	150.2	76%	0.764	77%	0.771	S	S	*	*			trans	-64	97.1	147.6	-82.9	156.9	0	0	0	104.4	T693 E697	T693-L695 HydrophobicContact CG2-CG 4.44Å; T693-L695 PolarHBondContact O-N 2.92Å; L695-E697 PolarHBondContact O-N 2.72Å
696	S	33	Very low	37.2	Very low	104 Å²	104	152.6 Å²	152.6	73%	0.727	78%	0.782	S	S	*	*			trans	-63.1	83.7	164.3	61.7	0	0	0	0	107.7	L694 Q698	L694-S696 PolarHBondContact O-N 3.17Å; S696-Q698 PolarHBondContact O-N 3.23Å
697	E	35.2	Very low	37	Very low	177 Å²	177	155.6 Å²	155.6	83%	0.827	79%	0.785	S	S	*	*			trans	-63.6	97.9	149.6	-80	-174.5	156.6	0	0	105.1	L695 T699	L695-E697 PolarHBondContact O-N 2.72Å; E697-T699 VanDerWaalsContact C-N 3.31Å; E697-T699 PolarHBondContact O-N 3.06Å
698	Q	35	Very low	36.6	Very low	161 Å²	161	153.5 Å²	153.5	75%	0.752	79%	0.789	S	S	*	*			trans	-57.3	108.6	157.6	-82.8	-172.6	-28.3	0	0	106.3	S696 F700	S696-Q698 PolarHBondContact O-N 3.23Å; Q698-F700 PolarHBondContact O-N 2.91Å
699	T	33	Very low	36.3	Very low	112 Å²	112	152.7 Å²	152.7	69%	0.687	79%	0.79	S	S	*	*			trans	-46.2	109.1	171	-31	0	0	0	0	108.6	E697 Q701	E697-T699 VanDerWaalsContact C-N 3.31Å; E697-T699 PolarHBondContact O-N 3.06Å; T699-Q701 VanDerWaalsContact C-N 3.33Å; T699-Q701 HydrophobicContact CG2-CG 4Å; T699-Q701 PolarHBondContact O-N 3.48Å; T699-Q701 VanDerWaalsContact O-N 3.13Å
700	F	30.9	Very low	35.6	Very low	210 Å²	210	153.8 Å²	153.8	92%	0.921	80%	0.796	S	S	*	*			trans	-62.4	103.6	148.8	-84.6	-94.5	0	0	0	106	Q698	Q698-F700 PolarHBondContact O-N 2.91Å
701	Q	35.9	Very low	35.6	Very low	168 Å²	168	154 Å²	154	79%	0.785	80%	0.803	S	S	*	*			trans	-122.9	110.7	155.5	-94.6	-177.8	-7.6	0	0	106.7	T699	T699-Q701 VanDerWaalsContact C-N 3.33Å; T699-Q701 HydrophobicContact CG2-CG 4Å; T699-Q701 PolarHBondContact O-N 3.48Å; T699-Q701 VanDerWaalsContact O-N 3.13Å
702	D	38.9	Very low	35.2	Very low	242 Å²	242	157.8 Å²	157.8	100%	1.294	81%	0.814	S	S	*	*			trans	13.4	0	159	-62.6	-28.2	0	0	0	120.2

Retrieved 702 of 702 residues in 969.9 ms (Link to these results)

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