A0A087Y521_POEFO Loading...

Adenylyl cyclase-associated protein

AlphaFold DB , UniProt , Accession A0A087Y521, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 480 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	I	43.5	Very low	67.3	Low	215 Å²	215	114.1 Å²	114.1	100%	1.103	58%	0.575	S	S	*	*				0	106.7	0	-62.2	171.7	0	0	0	105.5	T3	I1-T3 PolarHBondContact O-N 2.83Å
2	V	55.4	Low	68	Low	77 Å²	77	114.2 Å²	114.2	47%	0.467	57%	0.572	S	S	.	*			trans	-68.9	121.6	176.4	179.2	0	0	0	0	106.6	D6 L7	V2-D6 HydrophobicContact CG1-CB 4.03Å; V2-L7 HydrophobicContact CG1-CD1 4.17Å; V2-L7 HydrophobicContact CG1-CD2 4.45Å; V2-L7 HydrophobicContact CG1-CG 3.81Å
3	T	78.9	Confident	68.2	Low	81 Å²	81	115.7 Å²	115.7	50%	0.497	57%	0.567	S	S	.	*			trans	-72.8	149.8	179.1	54.9	0	0	0	0	109.3	I1 E5 D6 L7	I1-T3 PolarHBondContact O-N 2.83Å; T3-E5 PolarHBondContact O-N 3.46Å; T3-E5 VanDerWaalsContact O-N 3.16Å; T3-D6 PolarHBondContact O-N 2.83Å; T3-L7 PolarHBondContact O-N 2.99Å
4	M	63.1	Low	67.5	Low	152 Å²	152	111.4 Å²	111.4	75%	0.749	56%	0.559	S	S	*	*	H	α-helix	trans	-55.1	-32.9	178	-163.2	86.3	164.1	0	0	111.6	L7 M8	M4-L7 PolarHBondContact O-N 3.34Å; M4-M8 WeakPolarHBondContact O-CG 3.36Å; M4-M8 PolarHBondContact O-N 3.05Å
5	E	74.8	Confident	67.5	Low	151 Å²	151	107.5 Å²	107.5	71%	0.706	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-36.7	175.8	-84.5	161	143	0	0	113.8	T3 L7 M8 Q9	T3-E5 PolarHBondContact O-N 3.46Å; T3-E5 VanDerWaalsContact O-N 3.16Å; E5-L7 VanDerWaalsContact C-N 3.34Å; E5-M8 PolarHBondContact O-N 2.85Å; E5-Q9 PolarHBondContact O-N 2.86Å
6	D	70.5	Confident	67.4	Low	65 Å²	65	105.2 Å²	105.2	35%	0.348	54%	0.536	S	S	.	.	H	α-helix	trans	-69.7	-35.3	177.5	-170	57.6	0	0	0	111.2	V2 T3 R10	V2-D6 HydrophobicContact CG1-CB 4.03Å; T3-D6 PolarHBondContact O-N 2.83Å; D6-R10 WeakPolarHBondContact O-CB 3.36Å; D6-R10 WeakPolarHBondContact O-CD 3.42Å; D6-R10 WeakPolarHBondContact O-CG 3.42Å; D6-R10 PolarHBondContact O-N 3.44Å
7	L	63.5	Low	67.8	Low	93 Å²	93	106.5 Å²	106.5	49%	0.487	53%	0.533	S	S	.	.	H	α-helix	trans	-68.3	-40.9	171.8	-76.6	162.6	0	0	0	112	V2 T3 M4 E5 R10 L11	V2-L7 HydrophobicContact CG1-CD1 4.17Å; V2-L7 HydrophobicContact CG1-CD2 4.45Å; V2-L7 HydrophobicContact CG1-CG 3.81Å; T3-L7 PolarHBondContact O-N 2.99Å; M4-L7 PolarHBondContact O-N 3.34Å; E5-L7 VanDerWaalsContact C-N 3.34Å; L7-R10 PolarHBondContact O-N 2.85Å; L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 PolarHBondContact O-N 3.5Å
8	M	69.7	Low	67.2	Low	103 Å²	103	106.9 Å²	106.9	51%	0.507	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-45.8	177.2	-79.2	-175	64.2	0	0	112	M4 E5 R10 L11 E12	M4-M8 WeakPolarHBondContact O-CG 3.36Å; M4-M8 PolarHBondContact O-N 3.05Å; E5-M8 PolarHBondContact O-N 2.85Å; M8-R10 VanDerWaalsContact C-N 3.28Å; M8-R10 PolarHBondContact O-N 2.8Å; M8-L11 PolarHBondContact O-N 2.95Å; M8-L11 VanDerWaalsContact O-N 3.14Å; M8-E12 WeakPolarHBondContact O-CG 3.37Å; M8-E12 PolarHBondContact O-N 2.9Å
9	Q	74.1	Confident	66.8	Low	104 Å²	104	107.3 Å²	107.3	49%	0.486	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-35.5	176.9	-86.7	-170	-4.6	0	0	113.1	E5 R13	E5-Q9 PolarHBondContact O-N 2.86Å; Q9-R13 WeakPolarHBondContact O-CB 3.31Å; Q9-R13 PolarHBondContact O-N 3.09Å
10	R	80.2	Confident	66.4	Low	99 Å²	99	108.1 Å²	108.1	37%	0.374	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-37.9	175.7	-73.7	172.5	63.1	179.8	1.6	111.8	D6 L7 M8 A14	D6-R10 WeakPolarHBondContact O-CB 3.36Å; D6-R10 WeakPolarHBondContact O-CD 3.42Å; D6-R10 WeakPolarHBondContact O-CG 3.42Å; D6-R10 PolarHBondContact O-N 3.44Å; L7-R10 PolarHBondContact O-N 2.85Å; M8-R10 VanDerWaalsContact C-N 3.28Å; M8-R10 PolarHBondContact O-N 2.8Å; R10-A14 WeakPolarHBondContact O-CB 3.35Å; R10-A14 PolarHBondContact O-N 3.23Å
11	L	66.6	Low	66	Low	115 Å²	115	108 Å²	108	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-66.8	-44.6	175.1	-172.5	65.2	0	0	0	110.8	L7 M8 R13 A14 V15	L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 PolarHBondContact O-N 3.5Å; M8-L11 PolarHBondContact O-N 2.95Å; M8-L11 VanDerWaalsContact O-N 3.14Å; L11-R13 PolarHBondContact O-N 3.01Å; L11-A14 PolarHBondContact O-N 3.38Å; L11-V15 HydrophobicContact CG-CG2 4.47Å; L11-V15 WeakPolarHBondContact O-CB 3.47Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.43Å; L11-V15 PolarHBondContact O-N 2.6Å
12	E	75.9	Confident	66.1	Low	115 Å²	115	100.4 Å²	100.4	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-47.1	175.4	-74.5	174.5	177.8	0	0	111.3	M8 A14 V15 T16	M8-E12 WeakPolarHBondContact O-CG 3.37Å; M8-E12 PolarHBondContact O-N 2.9Å; E12-A14 VanDerWaalsContact C-N 3.32Å; E12-A14 PolarHBondContact O-N 3.04Å; E12-V15 PolarHBondContact O-N 2.82Å; E12-T16 PolarHBondContact O-N 2.92Å; E12-T16 PolarHBondContact O-OG1 3.49Å
13	R	70.6	Confident	66	Low	134 Å²	134	101.4 Å²	101.4	51%	0.506	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-38	174.6	-96.3	178.2	-95.5	136	-5.7	113.4	Q9 L11 R17	Q9-R13 WeakPolarHBondContact O-CB 3.31Å; Q9-R13 PolarHBondContact O-N 3.09Å; L11-R13 PolarHBondContact O-N 3.01Å; R13-R17 WeakPolarHBondContact O-CG 3.41Å; R13-R17 PolarHBondContact O-N 3.03Å; R13-R17 VanDerWaalsContact O-N 3.14Å
14	A	58.6	Low	64.5	Low	55 Å²	55	102 Å²	102	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-69.9	-38.3	177	0	0	0	0	0	111.9	R10 L11 E12 R17 M18	R10-A14 WeakPolarHBondContact O-CB 3.35Å; R10-A14 PolarHBondContact O-N 3.23Å; L11-A14 PolarHBondContact O-N 3.38Å; E12-A14 VanDerWaalsContact C-N 3.32Å; E12-A14 PolarHBondContact O-N 3.04Å; A14-R17 PolarHBondContact O-N 3.14Å; A14-M18 WeakPolarHBondContact O-CB 3.34Å; A14-M18 PolarHBondContact O-N 2.76Å
15	V	67.8	Low	63.5	Low	53 Å²	53	101.2 Å²	101.2	32%	0.321	51%	0.509	S	S	.	.	H	α-helix	trans	-66.7	-46.1	176.2	170.9	0	0	0	0	110.5	L11 E12 R17 M18 E19	L11-V15 HydrophobicContact CG-CG2 4.47Å; L11-V15 WeakPolarHBondContact O-CB 3.47Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.43Å; L11-V15 PolarHBondContact O-N 2.6Å; E12-V15 PolarHBondContact O-N 2.82Å; V15-R17 VanDerWaalsContact C-N 3.33Å; V15-R17 PolarHBondContact O-N 3.36Å; V15-M18 PolarHBondContact O-N 2.9Å; V15-M18 VanDerWaalsContact O-N 3.07Å; V15-E19 HydrophobicContact CG1-CG 4.31Å; V15-E19 WeakPolarHBondContact O-CG 3.34Å; V15-E19 PolarHBondContact O-N 3.45Å
16	T	65.2	Low	62	Low	71 Å²	71	100.1 Å²	100.1	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-43.1	176	-52	0	0	0	0	111.9	E12 M18 E19 E20	E12-T16 PolarHBondContact O-N 2.92Å; E12-T16 PolarHBondContact O-OG1 3.49Å; T16-M18 VanDerWaalsContact C-N 3.33Å; T16-M18 PolarHBondContact O-N 2.92Å; T16-E19 PolarHBondContact O-N 2.98Å; T16-E20 WeakPolarHBondContact O-CG 3.29Å; T16-E20 PolarHBondContact O-N 3.02Å
17	R	73.8	Confident	60.7	Low	127 Å²	127	100 Å²	100	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-39.2	174.5	-77.4	179.9	178.5	178.4	-3.1	112.2	R13 A14 V15 I21 D61	R13-R17 WeakPolarHBondContact O-CG 3.41Å; R13-R17 PolarHBondContact O-N 3.03Å; R13-R17 VanDerWaalsContact O-N 3.14Å; A14-R17 PolarHBondContact O-N 3.14Å; V15-R17 VanDerWaalsContact C-N 3.33Å; V15-R17 PolarHBondContact O-N 3.36Å; R17-I21 WeakPolarHBondContact O-CD1 3.39Å; R17-I21 WeakPolarHBondContact O-CG1 3.33Å; R17-I21 PolarHBondContact O-N 2.77Å; R17-D61 IonicContact CZ-OD2 2.83Å; R17-D61 IonicContact NH1-OD2 3.95Å; R17-D61 IonicContact NH2-OD1 3.95Å; R17-D61 IonicContact NH2-OD2 3.22Å; R17-D61 PolarHBondContact NH2-OD2 3.17Å
18	M	56.8	Low	59.6	Low	115 Å²	115	99 Å²	99	57%	0.567	51%	0.513	S	S	*	.	H	α-helix	trans	-72.3	-32.4	179.2	-172.2	172.4	57.1	0	0	112.6	A14 V15 T16 S22	A14-M18 WeakPolarHBondContact O-CB 3.34Å; A14-M18 PolarHBondContact O-N 2.76Å; V15-M18 PolarHBondContact O-N 2.9Å; V15-M18 VanDerWaalsContact O-N 3.07Å; T16-M18 VanDerWaalsContact C-N 3.33Å; T16-M18 PolarHBondContact O-N 2.92Å; M18-S22 WeakPolarHBondContact O-CB 3.35Å; M18-S22 PolarHBondContact O-N 2.9Å; M18-S22 PolarHBondContact O-OG 2.9Å
19	E	60.5	Low	58	Low	114 Å²	114	97.1 Å²	97.1	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-68.6	-43.6	172.8	-73.3	175.3	165.5	0	0	111.1	V15 T16 I21 S22 V23	V15-E19 HydrophobicContact CG1-CG 4.31Å; V15-E19 WeakPolarHBondContact O-CG 3.34Å; V15-E19 PolarHBondContact O-N 3.45Å; T16-E19 PolarHBondContact O-N 2.98Å; E19-I21 PolarHBondContact O-N 2.83Å; E19-S22 PolarHBondContact O-N 2.97Å; E19-V23 VanDerWaalsContact O-CG2 3.31Å; E19-V23 WeakPolarHBondContact O-CG2 3.37Å; E19-V23 PolarHBondContact O-N 3.04Å
20	E	57.7	Low	56.1	Low	123 Å²	123	98.5 Å²	98.5	58%	0.575	52%	0.52	S	S	*	.	H	α-helix	trans	-59.4	-46.6	172.9	-75.8	177.6	167.9	0	0	111.6	T16 S22 V23 T24	T16-E20 WeakPolarHBondContact O-CG 3.29Å; T16-E20 PolarHBondContact O-N 3.02Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 2.85Å; E20-V23 PolarHBondContact O-N 2.77Å; E20-T24 PolarHBondContact O-N 2.86Å; E20-T24 PolarHBondContact O-OG1 3.05Å
21	I	59	Low	54.3	Low	105 Å²	105	101.8 Å²	101.8	54%	0.538	54%	0.542	S	S	.	.	H	α-helix	trans	-62.9	-39.2	176.4	-68.3	164.5	0	0	0	111.5	R17 E19 T24 M25	R17-I21 WeakPolarHBondContact O-CD1 3.39Å; R17-I21 WeakPolarHBondContact O-CG1 3.33Å; R17-I21 PolarHBondContact O-N 2.77Å; E19-I21 PolarHBondContact O-N 2.83Å; I21-T24 PolarHBondContact O-N 3.49Å; I21-M25 WeakPolarHBondContact O-CG 3.42Å; I21-M25 PolarHBondContact O-N 2.92Å
22	S	45.6	Very low	52.9	Low	56 Å²	56	103.3 Å²	103.3	39%	0.392	55%	0.55	S	S	.	.	H	α-helix	trans	-67.3	-38.2	177.6	-71.5	0	0	0	0	112.5	M18 E19 E20 M25 Q26	M18-S22 WeakPolarHBondContact O-CB 3.35Å; M18-S22 PolarHBondContact O-N 2.9Å; M18-S22 PolarHBondContact O-OG 2.9Å; E19-S22 PolarHBondContact O-N 2.97Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 2.85Å; S22-M25 PolarHBondContact O-N 3.04Å; S22-Q26 WeakPolarHBondContact O-CB 3.45Å; S22-Q26 WeakPolarHBondContact O-CG 3.16Å; S22-Q26 PolarHBondContact O-N 2.66Å
23	V	52.5	Low	51	Low	98 Å²	98	105.2 Å²	105.2	59%	0.594	56%	0.563	S	S	*	*	H	α-helix	trans	-65.3	-41.3	175.2	171.6	0	0	0	0	110.4	E19 E20 Q26 A27	E19-V23 VanDerWaalsContact O-CG2 3.31Å; E19-V23 WeakPolarHBondContact O-CG2 3.37Å; E19-V23 PolarHBondContact O-N 3.04Å; E20-V23 PolarHBondContact O-N 2.77Å; V23-Q26 PolarHBondContact O-N 2.99Å; V23-A27 WeakPolarHBondContact O-CB 3.41Å; V23-A27 PolarHBondContact O-N 2.82Å
24	T	48.3	Very low	49.2	Very low	93 Å²	93	102 Å²	102	57%	0.571	57%	0.572	S	S	*	*	H	α-helix	trans	-66.8	-38.3	175.3	-50.7	0	0	0	0	112.5	E20 I21 S28	E20-T24 PolarHBondContact O-N 2.86Å; E20-T24 PolarHBondContact O-OG1 3.05Å; I21-T24 PolarHBondContact O-N 3.49Å; T24-S28 PolarHBondContact O-N 2.96Å; T24-S28 VanDerWaalsContact O-N 3.13Å; T24-S28 PolarHBondContact O-OG 2.81Å
25	M	41	Very low	47.8	Very low	136 Å²	136	106.7 Å²	106.7	67%	0.67	59%	0.59	S	S	*	*	H	α-helix	trans	-69.3	-37	174.3	-75.8	-167.7	87.4	0	0	112.6	I21 S22 S28 S29	I21-M25 WeakPolarHBondContact O-CG 3.42Å; I21-M25 PolarHBondContact O-N 2.92Å; S22-M25 PolarHBondContact O-N 3.04Å; M25-S28 WeakPolarHBondContact O-CB 3.09Å; M25-S28 PolarHBondContact O-N 3.14Å; M25-S29 PolarHBondContact O-N 2.84Å; M25-S29 PolarHBondContact O-OG 2.89Å
26	Q	43.3	Very low	46.4	Very low	129 Å²	129	110.2 Å²	110.2	60%	0.603	62%	0.615	S	S	*	*	H	α-helix	trans	-68.8	-36.8	176	-79	179.7	5	0	0	112.5	S22 V23 S28 S29 N30	S22-Q26 WeakPolarHBondContact O-CB 3.45Å; S22-Q26 WeakPolarHBondContact O-CG 3.16Å; S22-Q26 PolarHBondContact O-N 2.66Å; V23-Q26 PolarHBondContact O-N 2.99Å; Q26-S28 VanDerWaalsContact C-N 3.25Å; Q26-S28 PolarHBondContact O-N 3.32Å; Q26-S29 WeakPolarHBondContact CA-OG 3.44Å; Q26-S29 PolarHBondContact O-N 2.81Å; Q26-S29 PolarHBondContact O-OG 2.82Å; Q26-N30 PolarHBondContact O-N 3.06Å; Q26-N30 VanDerWaalsContact O-N 3.16Å
27	A	43.6	Very low	44.7	Very low	62 Å²	62	112.8 Å²	112.8	51%	0.512	63%	0.63	S	S	.	*	H	α-helix	trans	-62.7	-34.6	171	0	0	0	0	0	111.9	V23	V23-A27 WeakPolarHBondContact O-CB 3.41Å; V23-A27 PolarHBondContact O-N 2.82Å
28	S	40.9	Very low	42.8	Very low	73 Å²	73	114.7 Å²	114.7	51%	0.51	65%	0.65	S	S	.	*	H	α-helix	trans	-73.8	-34.9	177.1	-54	0	0	0	0	112.9	T24 M25 Q26	T24-S28 PolarHBondContact O-N 2.96Å; T24-S28 VanDerWaalsContact O-N 3.13Å; T24-S28 PolarHBondContact O-OG 2.81Å; M25-S28 WeakPolarHBondContact O-CB 3.09Å; M25-S28 PolarHBondContact O-N 3.14Å; Q26-S28 VanDerWaalsContact C-N 3.25Å; Q26-S28 PolarHBondContact O-N 3.32Å
29	S	35.7	Very low	41.6	Very low	63 Å²	63	112.4 Å²	112.4	44%	0.441	66%	0.656	S	S	.	*	H	α-helix	trans	-74.9	-29	177.6	52.4	0	0	0	0	113.8	M25 Q26 M31 L32	M25-S29 PolarHBondContact O-N 2.84Å; M25-S29 PolarHBondContact O-OG 2.89Å; Q26-S29 WeakPolarHBondContact CA-OG 3.44Å; Q26-S29 PolarHBondContact O-N 2.81Å; Q26-S29 PolarHBondContact O-OG 2.82Å; S29-M31 VanDerWaalsContact C-N 3.26Å; S29-M31 PolarHBondContact O-N 2.93Å; S29-L32 PolarHBondContact O-N 3.47Å
30	N	35.1	Very low	40.4	Very low	132 Å²	132	113.8 Å²	113.8	71%	0.706	67%	0.672	S	S	*	*	H	α-helix	trans	-73.3	-17.1	177.7	-79	-1.3	0	0	0	113.4	Q26 L32	Q26-N30 PolarHBondContact O-N 3.06Å; Q26-N30 VanDerWaalsContact O-N 3.16Å; N30-L32 VanDerWaalsContact C-N 3.35Å
31	M	41.3	Very low	39.5	Very low	168 Å²	168	114.7 Å²	114.7	83%	0.828	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-8.3	175.1	-73.3	-66.4	-140.9	0	0	114	S29	S29-M31 VanDerWaalsContact C-N 3.26Å; S29-M31 PolarHBondContact O-N 2.93Å
32	L	37.8	Very low	38.3	Very low	148 Å²	148	112.6 Å²	112.6	78%	0.775	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-2.7	178.9	-71.9	169.3	0	0	0	113.7	S29 N30	S29-L32 PolarHBondContact O-N 3.47Å; N30-L32 VanDerWaalsContact C-N 3.35Å
33	N	36.1	Very low	38.3	Very low	154 Å²	154	112.7 Å²	112.7	82%	0.824	70%	0.695	S	S	*	*	S	Bend	trans	-123.5	82.7	-179	-126.4	33.9	0	0	0	112.2
34	G	33.3	Very low	38.1	Very low	67 Å²	67	111.1 Å²	111.1	69%	0.691	68%	0.681	S	S	*	*			trans	72.9	94.1	150.1	0	0	0	0	0	118.2
35	N	28.1	Very low	38.6	Very low	153 Å²	153	110.1 Å²	110.1	82%	0.818	68%	0.678	S	S	*	*				-175.5	121.9	114.8	-107.2	12.7	0	0	0	110.9	V37	N35-V37 PolarHBondContact O-N 3.3Å
36	C	39.7	Very low	39.9	Very low	127 Å²	127	106.6 Å²	106.6	86%	0.858	66%	0.664	S	S	*	*			trans	-66.8	111.7	164.9	47.7	0	0	0	0	110
37	V	29.6	Very low	41.5	Very low	125 Å²	125	101.1 Å²	101.1	76%	0.758	64%	0.64	S	S	*	*			trans	-133.2	124.6	160.8	-171.9	0	0	0	0	108.2	N35	N35-V37 PolarHBondContact O-N 3.3Å
38	N	33.8	Very low	43.4	Very low	167 Å²	167	98.4 Å²	98.4	89%	0.893	62%	0.617	S	S	*	*			trans	-55	140	174.4	-78.2	-41.2	0	0	0	112.1
39	G	29.9	Very low	45.5	Very low	67 Å²	67	100.1 Å²	100.1	69%	0.691	62%	0.617	S	S	*	*			trans	116.2	111.7	140.7	0	0	0	0	0	117.7
40	V	36.1	Very low	47.9	Very low	144 Å²	144	99.5 Å²	99.5	87%	0.873	61%	0.611	S	S	*	*			trans	78.4	114.3	136.2	-169.2	0	0	0	0	118
41	D	38.4	Very low	50.5	Low	142 Å²	142	93.3 Å²	93.3	76%	0.759	58%	0.577	S	S	*	*			trans	70.5	59.7	145.7	-155.4	28.7	0	0	0	119.1
42	G	34.3	Very low	52.8	Low	60 Å²	60	86.6 Å²	86.6	62%	0.619	55%	0.545	S	S	*	.			trans	-135.2	-0	174.1	0	0	0	0	0	116.3	V46	G42-V46 WeakPolarHBondContact O-CG2 3.04Å
43	G	45.7	Very low	55.3	Low	59 Å²	59	84.3 Å²	84.3	61%	0.608	54%	0.537	S	S	*	.	S	Bend	trans	-97.2	-24.1	-174.4	0	0	0	0	0	115.5
44	E	48.4	Very low	58	Low	65 Å²	65	77.3 Å²	77.3	30%	0.304	50%	0.499	S	S	.	.	H	α-helix	trans	-87.4	-28.7	-167.6	-64.2	-175.3	169.6	0	0	113.2	S212	E44-S212 VanDerWaalsContact CD-OG 3.31Å; E44-S212 PolarHBondContact OE1-OG 2.77Å; E44-S212 PolarHBondContact OE2-OG 2.81Å
45	S	58.8	Low	60.8	Low	72 Å²	72	74.9 Å²	74.9	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-71.4	-30.7	173.8	-166.8	0	0	0	0	113.2	S47 V48 E49	S45-S47 PolarHBondContact O-N 2.87Å; S45-V48 PolarHBondContact O-N 2.91Å; S45-E49 PolarHBondContact O-N 3.12Å; S45-E49 PolarHBondContact OG-OE1 2.81Å
46	V	68.9	Low	63.8	Low	61 Å²	61	75.2 Å²	75.2	37%	0.37	47%	0.465	S	S	.	.	H	α-helix	trans	-67.9	-32.7	-170.2	-178.7	0	0	0	0	112.4	G42 E49 V50	G42-V46 WeakPolarHBondContact O-CG2 3.04Å; V46-E49 PolarHBondContact O-N 3Å; V46-V50 HydrophobicContact CG1-CG2 4.3Å; V46-V50 VanDerWaalsContact O-CG2 3.26Å; V46-V50 WeakPolarHBondContact O-CG2 3.5Å; V46-V50 PolarHBondContact O-N 2.99Å
47	S	75.8	Confident	66.4	Low	15 Å²	15	70 Å²	70	11%	0.105	43%	0.433	C	S	.	.	H	α-helix	trans	-65.8	-41.1	-179.5	-171	0	0	0	0	112.2	S45 V50 F51 F200 H205	S45-S47 PolarHBondContact O-N 2.87Å; S47-V50 PolarHBondContact O-N 3.13Å; S47-F51 PolarHBondContact O-N 2.86Å; S47-F200 VanDerWaalsContact O-CE2 3.23Å; S47-F200 WeakPolarHBondContact O-CE2 3.22Å; S47-F200 WeakPolarHBondContact OG-CE2 3.45Å; S47-F200 WeakPolarHBondContact OG-CZ 3.5Å; S47-H205 PolarHBondContact OG-NE2 2.81Å; S47-H205 VanDerWaalsContact OG-NE2 3.14Å
48	V	84.4	Confident	69.5	Low	5 Å²	5	64.9 Å²	64.9	3%	0.03	40%	0.402	C	S	.	.	H	α-helix	trans	-70.2	-37.6	179.3	-175.2	0	0	0	0	110.9	S45 V50 F51 D52 Q92	S45-V48 PolarHBondContact O-N 2.91Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.87Å; V48-F51 WeakPolarHBondContact O-CB 3.37Å; V48-F51 PolarHBondContact O-N 3.19Å; V48-D52 PolarHBondContact O-N 2.95Å; V48-Q92 HydrophobicContact CG1-CB 4.49Å; V48-Q92 HydrophobicContact CG2-CB 4.33Å
49	E	85	Confident	72.5	Confident	109 Å²	109	57 Å²	57	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-38.8	175.2	-69.7	169.1	-153.4	0	0	112.3	S45 V46 D52 V53	S45-E49 PolarHBondContact O-N 3.12Å; S45-E49 PolarHBondContact OG-OE1 2.81Å; V46-E49 PolarHBondContact O-N 3Å; E49-D52 WeakPolarHBondContact O-CB 3.42Å; E49-D52 PolarHBondContact O-N 2.99Å; E49-V53 PolarHBondContact O-N 2.83Å
50	V	86.1	Confident	75.7	Confident	50 Å²	50	55.9 Å²	55.9	30%	0.303	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-37.5	174.2	175.9	0	0	0	0	110.9	V46 S47 V48 D52 V53 F200	V46-V50 HydrophobicContact CG1-CG2 4.3Å; V46-V50 VanDerWaalsContact O-CG2 3.26Å; V46-V50 WeakPolarHBondContact O-CG2 3.5Å; V46-V50 PolarHBondContact O-N 2.99Å; S47-V50 PolarHBondContact O-N 3.13Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.87Å; V50-D52 VanDerWaalsContact C-N 3.27Å; V50-D52 PolarHBondContact O-N 3.05Å; V50-V53 WeakPolarHBondContact O-CB 3.37Å; V50-V53 PolarHBondContact O-N 2.91Å; V50-V53 VanDerWaalsContact O-N 3.16Å; V50-F200 HydrophobicContact CB-CD2 4.33Å; V50-F200 HydrophobicContact CB-CE2 4.47Å; V50-F200 HydrophobicContact CG1-CD2 3.86Å; V50-F200 HydrophobicContact CG1-CE2 4.48Å
51	F	89.9	Confident	78.7	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-33.8	172.7	-164.8	-97.2	0	0	0	112.2	S47 V48 V53 L54 L55 L84 Q87 R88 L91 M197 F200	S47-F51 PolarHBondContact O-N 2.86Å; V48-F51 WeakPolarHBondContact O-CB 3.37Å; V48-F51 PolarHBondContact O-N 3.19Å; F51-V53 PolarHBondContact O-N 2.84Å; F51-L54 WeakPolarHBondContact O-CB 3.45Å; F51-L54 PolarHBondContact O-N 2.85Å; F51-L55 HydrophobicContact CD1-CD1 3.97Å; F51-L55 HydrophobicContact CD1-CD2 4.41Å; F51-L55 HydrophobicContact CD1-CG 4.04Å; F51-L55 HydrophobicContact CE1-CD1 3.99Å; F51-L55 HydrophobicContact CE1-CD2 3.83Å; F51-L55 HydrophobicContact CE1-CG 3.96Å; F51-L55 HydrophobicContact CZ-CD2 4.47Å; F51-L55 PolarHBondContact O-N 2.76Å; F51-L55 VanDerWaalsContact O-N 3.16Å; F51-L84 HydrophobicContact CZ-CD2 4.01Å; F51-Q87 HydrophobicContact CZ-CB 4.26Å; F51-Q87 HydrophobicContact CZ-CG 4.07Å; F51-R88 HydrophobicContact CD1-CB 3.92Å; F51-R88 HydrophobicContact CD1-CG 3.98Å; F51-R88 HydrophobicContact CE1-CB 3.77Å; F51-R88 HydrophobicContact CE1-CG 4.34Å; F51-L91 HydrophobicContact CB-CD1 4.4Å; F51-L91 HydrophobicContact CD1-CD1 4.16Å; F51-L91 HydrophobicContact CD2-CD1 3.54Å; F51-L91 HydrophobicContact CE1-CD1 4.31Å; F51-L91 HydrophobicContact CE2-CD1 3.71Å; F51-L91 HydrophobicContact CG-CD1 3.77Å; F51-L91 HydrophobicContact CZ-CD1 4.1Å; F51-M197 HydrophobicContact CE2-CE 3.7Å; F51-M197 HydrophobicContact CE2-SD 3.88Å; F51-M197 HydrophobicContact CZ-CE 4.12Å; F51-F200 HydrophobicContact CB-CE2 4.19Å; F51-F200 HydrophobicContact CB-CZ 4.19Å; F51-F200 AromaticContact CD2-CD1 3.97Å; F51-F200 HydrophobicContact CD2-CD1 3.97Å; F51-F200 AromaticContact CD2-CE1 3.75Å; F51-F200 HydrophobicContact CD2-CE1 3.75Å; F51-F200 HydrophobicContact CD2-CG 4.44Å; F51-F200 HydrophobicContact CD2-CZ 4.06Å; F51-F200 HydrophobicContact CE2-CE1 4.41Å
52	D	89.9	Confident	81.5	Confident	27 Å²	27	45 Å²	45	14%	0.144	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-28.8	174.5	-77.6	-21	0	0	0	113.2	V48 E49 V50 L54 L55 K56 R88	V48-D52 PolarHBondContact O-N 2.95Å; E49-D52 WeakPolarHBondContact O-CB 3.42Å; E49-D52 PolarHBondContact O-N 2.99Å; V50-D52 VanDerWaalsContact C-N 3.27Å; V50-D52 PolarHBondContact O-N 3.05Å; D52-L54 VanDerWaalsContact C-N 3.35Å; D52-L55 PolarHBondContact O-N 3.13Å; D52-K56 WeakPolarHBondContact O-CB 3.33Å; D52-K56 VanDerWaalsContact O-CG 3.29Å; D52-K56 WeakPolarHBondContact O-CG 3.48Å; D52-K56 PolarHBondContact O-N 2.86Å; D52-R88 IonicContact OD1-CZ 4Å; D52-R88 IonicContact OD1-NE 2.78Å; D52-R88 PolarHBondContact OD1-NE 3.08Å; D52-R88 IonicContact OD1-NH2 2.93Å; D52-R88 PolarHBondContact OD1-NH2 3.09Å; D52-R88 IonicContact OD2-CZ 2.63Å; D52-R88 IonicContact OD2-NE 3.91Å; D52-R88 IonicContact OD2-NH2 3.23Å; D52-R88 PolarHBondContact OD2-NH2 2.98Å
53	V	90.1	Very high	84.6	Confident	101 Å²	101	43.1 Å²	43.1	61%	0.612	25%	0.254	S	S	*	.	H	α-helix	trans	-65.5	-40.2	172.9	-180	0	0	0	0	110.6	E49 V50 F51 L55 K56 G57	E49-V53 PolarHBondContact O-N 2.83Å; V50-V53 WeakPolarHBondContact O-CB 3.37Å; V50-V53 PolarHBondContact O-N 2.91Å; V50-V53 VanDerWaalsContact O-N 3.16Å; F51-V53 PolarHBondContact O-N 2.84Å; V53-L55 VanDerWaalsContact C-N 3.32Å; V53-L55 PolarHBondContact O-N 3.08Å; V53-K56 PolarHBondContact O-N 2.86Å; V53-G57 PolarHBondContact O-N 2.73Å
54	L	92.4	Very high	87.1	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-41.6	174.4	-177.1	156.9	0	0	0	111.3	F51 D52 P58 L59 L84 I193 E196 M197	F51-L54 WeakPolarHBondContact O-CB 3.45Å; F51-L54 PolarHBondContact O-N 2.85Å; D52-L54 VanDerWaalsContact C-N 3.35Å; L54-P58 VanDerWaalsContact O-CD 3.31Å; L54-P58 WeakPolarHBondContact O-CD 3.28Å; L54-L59 PolarHBondContact O-N 2.75Å; L54-L59 VanDerWaalsContact O-N 3.11Å; L54-L84 HydrophobicContact CD2-CD2 4.47Å; L54-I193 HydrophobicContact CD2-CG2 4.34Å; L54-E196 HydrophobicContact CD1-CB 4.09Å; L54-E196 HydrophobicContact CG-CB 4.39Å; L54-M197 HydrophobicContact CD1-CB 4.05Å; L54-M197 HydrophobicContact CD1-CE 4.05Å; L54-M197 HydrophobicContact CD1-SD 4.37Å
55	L	92.3	Very high	89.4	Confident	15 Å²	15	41.7 Å²	41.7	8%	0.079	24%	0.236	C	C	.	.	I	π-helix	trans	-69.4	-42.9	178.9	-60.2	-179.5	0	0	0	112.5	F51 D52 V53 L59 S60 L84 R88	F51-L55 HydrophobicContact CD1-CD1 3.97Å; F51-L55 HydrophobicContact CD1-CD2 4.41Å; F51-L55 HydrophobicContact CD1-CG 4.04Å; F51-L55 HydrophobicContact CE1-CD1 3.99Å; F51-L55 HydrophobicContact CE1-CD2 3.83Å; F51-L55 HydrophobicContact CE1-CG 3.96Å; F51-L55 HydrophobicContact CZ-CD2 4.47Å; F51-L55 PolarHBondContact O-N 2.76Å; F51-L55 VanDerWaalsContact O-N 3.16Å; D52-L55 PolarHBondContact O-N 3.13Å; V53-L55 VanDerWaalsContact C-N 3.32Å; V53-L55 PolarHBondContact O-N 3.08Å; L55-L59 HydrophobicContact CB-CD2 4.45Å; L55-L59 HydrophobicContact CD2-CD2 3.48Å; L55-L59 VanDerWaalsContact CD2-CD2 3.48Å; L55-S60 PolarHBondContact O-N 3.38Å; L55-L84 HydrophobicContact CD2-CB 3.9Å; L55-R88 HydrophobicContact CD1-CB 4.1Å; L55-R88 HydrophobicContact CD1-CG 4.01Å
56	K	91.3	Very high	91.3	Very high	160 Å²	160	38.3 Å²	38.3	70%	0.696	21%	0.213	S	C	*	.	I	π-helix	trans	-77.9	-26	-177.9	-69.6	170.3	-175.4	168.7	0	113.2	D52 V53 S60	D52-K56 WeakPolarHBondContact O-CB 3.33Å; D52-K56 VanDerWaalsContact O-CG 3.29Å; D52-K56 WeakPolarHBondContact O-CG 3.48Å; D52-K56 PolarHBondContact O-N 2.86Å; V53-K56 PolarHBondContact O-N 2.86Å; K56-S60 WeakPolarHBondContact O-CB 3.49Å
57	G	94.3	Very high	92.7	Very high	19 Å²	19	41.1 Å²	41.1	20%	0.196	22%	0.216	C	C	.	.	I	π-helix	trans	-97.9	-98.2	178.6	0	0	0	0	0	112.2	V53 L59 S60 D61	V53-G57 PolarHBondContact O-N 2.73Å; G57-L59 VanDerWaalsContact C-N 3.34Å; G57-L59 PolarHBondContact O-N 2.86Å; G57-S60 WeakPolarHBondContact O-CB 3.41Å; G57-S60 PolarHBondContact O-N 2.9Å; G57-S60 VanDerWaalsContact O-N 3.08Å; G57-D61 PolarHBondContact O-N 2.98Å
58	P	94.3	Very high	93.8	Very high	17 Å²	17	42.6 Å²	42.6	11%	0.11	23%	0.229	C	C	.	.	I	π-helix	trans	-48.4	-46.6	-174.5	-27.5	29.3	0	0	0	115.4	L54 D61 Y62 I193 E196	L54-P58 VanDerWaalsContact O-CD 3.31Å; L54-P58 WeakPolarHBondContact O-CD 3.28Å; P58-D61 PolarHBondContact O-N 3.39Å; P58-Y62 WeakPolarHBondContact O-CB 3.31Å; P58-Y62 PolarHBondContact O-N 3.4Å; P58-I193 HydrophobicContact CB-CG1 3.94Å; P58-E196 HydrophobicContact CG-CB 4.13Å; P58-E196 HydrophobicContact CG-CG 3.65Å
59	L	96.9	Very high	94.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.234	C	C	.	.	I	π-helix	trans	-66.8	-42.5	-179.6	176.2	61.7	0	0	0	111.7	L54 L55 G57 Y62 L63 V80 L84 I193	L54-L59 PolarHBondContact O-N 2.75Å; L54-L59 VanDerWaalsContact O-N 3.11Å; L55-L59 HydrophobicContact CB-CD2 4.45Å; L55-L59 HydrophobicContact CD2-CD2 3.48Å; L55-L59 VanDerWaalsContact CD2-CD2 3.48Å; G57-L59 VanDerWaalsContact C-N 3.34Å; G57-L59 PolarHBondContact O-N 2.86Å; L59-Y62 HydrophobicContact CD1-CD1 4.07Å; L59-Y62 WeakPolarHBondContact O-CB 3.37Å; L59-Y62 PolarHBondContact O-N 3.32Å; L59-L63 HydrophobicContact CD1-CD1 4.31Å; L59-L63 HydrophobicContact CD1-CG 4.24Å; L59-L63 HydrophobicContact CG-CD1 4.07Å; L59-L63 HydrophobicContact CG-CG 4.45Å; L59-L63 VanDerWaalsContact O-CG 3.28Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 3.25Å; L59-V80 HydrophobicContact CD1-CG1 4.48Å; L59-L84 HydrophobicContact CD1-CD1 3.65Å; L59-L84 HydrophobicContact CD2-CB 4.05Å; L59-L84 HydrophobicContact CD2-CD1 3.84Å; L59-L84 HydrophobicContact CG-CD1 4.23Å; L59-I193 HydrophobicContact CD1-CD1 4.14Å
60	S	97.4	Very high	94.9	Very high	43 Å²	43	38.9 Å²	38.9	30%	0.301	22%	0.215	S	C	.	.	H	α-helix	trans	-61	-44.9	176.2	-173.3	0	0	0	0	111.8	L55 K56 G57 Y62 L63 N64	L55-S60 PolarHBondContact O-N 3.38Å; K56-S60 WeakPolarHBondContact O-CB 3.49Å; G57-S60 WeakPolarHBondContact O-CB 3.41Å; G57-S60 PolarHBondContact O-N 2.9Å; G57-S60 VanDerWaalsContact O-N 3.08Å; S60-Y62 VanDerWaalsContact C-N 3.34Å; S60-Y62 PolarHBondContact O-N 3.25Å; S60-L63 PolarHBondContact O-N 2.87Å; S60-N64 WeakPolarHBondContact O-CB 3.43Å; S60-N64 PolarHBondContact O-N 2.84Å; S60-N64 PolarHBondContact O-ND2 2.74Å; S60-N64 VanDerWaalsContact O-ND2 3.1Å
61	D	97.4	Very high	95.4	Very high	56 Å²	56	39.7 Å²	39.7	30%	0.299	22%	0.224	S	C	.	.	H	α-helix	trans	-60.7	-43.4	176.1	-75.6	-12.1	0	0	0	110.9	R17 G57 P58 N64 C65 A189	R17-D61 IonicContact CZ-OD2 2.83Å; R17-D61 IonicContact NH1-OD2 3.95Å; R17-D61 IonicContact NH2-OD1 3.95Å; R17-D61 IonicContact NH2-OD2 3.22Å; R17-D61 PolarHBondContact NH2-OD2 3.17Å; G57-D61 PolarHBondContact O-N 2.98Å; P58-D61 PolarHBondContact O-N 3.39Å; D61-N64 PolarHBondContact O-N 2.84Å; D61-C65 PolarHBondContact O-N 3.44Å; D61-C65 PolarHBondContact O-SG 2.93Å; D61-A189 HydrophobicContact CB-CB 4.27Å
62	Y	98.6	Very high	95.7	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-44	175.1	165.4	-107.4	0	0	0	112.7	P58 L59 S60 C65 S66 A77 V80 W186 Y190 I193	P58-Y62 WeakPolarHBondContact O-CB 3.31Å; P58-Y62 PolarHBondContact O-N 3.4Å; L59-Y62 HydrophobicContact CD1-CD1 4.07Å; L59-Y62 WeakPolarHBondContact O-CB 3.37Å; L59-Y62 PolarHBondContact O-N 3.32Å; S60-Y62 VanDerWaalsContact C-N 3.34Å; S60-Y62 PolarHBondContact O-N 3.25Å; Y62-C65 PolarHBondContact O-N 3.28Å; Y62-S66 WeakPolarHBondContact CE2-OG 3.4Å; Y62-S66 VanDerWaalsContact O-CB 3.32Å; Y62-S66 WeakPolarHBondContact O-CB 3.35Å; Y62-S66 PolarHBondContact O-N 3.17Å; Y62-S66 PolarHBondContact O-OG 3.12Å; Y62-A77 HydrophobicContact CD1-CB 4.26Å; Y62-A77 HydrophobicContact CE1-CB 3.41Å; Y62-A77 VanDerWaalsContact CE1-CB 3.41Å; Y62-V80 HydrophobicContact CE1-CB 4.25Å; Y62-V80 HydrophobicContact CE1-CG1 4.18Å; Y62-W186 AromaticContact CD2-NE1 3.69Å; Y62-W186 AromaticContact CE2-CE2 3.54Å; Y62-W186 AromaticContact CE2-CZ2 3.72Å; Y62-W186 HydrophobicContact CE2-CZ2 3.72Å; Y62-W186 AromaticContact CE2-NE1 3.19Å; Y62-Y190 AromaticContact CD2-CD2 3.57Å; Y62-Y190 HydrophobicContact CD2-CD2 3.57Å; Y62-Y190 HydrophobicContact CD2-CG 4.09Å; Y62-Y190 HydrophobicContact CE1-CD2 4.29Å; Y62-Y190 AromaticContact CE2-CD2 3.25Å; Y62-Y190 HydrophobicContact CE2-CD2 3.25Å; Y62-Y190 HydrophobicContact CE2-CE2 4.05Å; Y62-Y190 AromaticContact CE2-CG 3.88Å; Y62-Y190 HydrophobicContact CE2-CG 3.88Å; Y62-Y190 HydrophobicContact CG-CD2 4.19Å; Y62-Y190 AromaticContact CZ-CD2 3.67Å; Y62-I193 HydrophobicContact CD1-CD1 3.86Å; Y62-I193 HydrophobicContact CG-CD1 3.82Å
63	L	98.4	Very high	96.1	Very high	22 Å²	22	40.6 Å²	40.6	12%	0.115	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-42.7	177.3	-72.3	168.2	0	0	0	111.4	L59 S60 S66 R67 A77 N81	L59-L63 HydrophobicContact CD1-CD1 4.31Å; L59-L63 HydrophobicContact CD1-CG 4.24Å; L59-L63 HydrophobicContact CG-CD1 4.07Å; L59-L63 HydrophobicContact CG-CG 4.45Å; L59-L63 VanDerWaalsContact O-CG 3.28Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 3.25Å; S60-L63 PolarHBondContact O-N 2.87Å; L63-S66 PolarHBondContact O-N 3.27Å; L63-R67 WeakPolarHBondContact O-CB 3.11Å; L63-R67 WeakPolarHBondContact O-CG 3.14Å; L63-R67 PolarHBondContact O-N 2.91Å; L63-A77 HydrophobicContact CD2-CB 3.98Å; L63-A77 WeakPolarHBondContact CD2-O 3.22Å; L63-N81 HydrophobicContact CD1-CB 3.99Å; L63-N81 HydrophobicContact CD2-CB 3.92Å; L63-N81 HydrophobicContact CG-CB 4.47Å
64	N	98.2	Very high	96.5	Very high	69 Å²	69	38.9 Å²	38.9	37%	0.369	21%	0.212	S	C	.	.	H	α-helix	trans	-62.6	-44.2	176.7	-67.6	-31.1	0	0	0	111.4	S60 D61 S66 R67 A68	S60-N64 WeakPolarHBondContact O-CB 3.43Å; S60-N64 PolarHBondContact O-N 2.84Å; S60-N64 PolarHBondContact O-ND2 2.74Å; S60-N64 VanDerWaalsContact O-ND2 3.1Å; D61-N64 PolarHBondContact O-N 2.84Å; N64-S66 VanDerWaalsContact C-N 3.34Å; N64-R67 VanDerWaalsContact OD1-CZ 3.23Å; N64-R67 PolarHBondContact OD1-NH1 3.45Å; N64-R67 PolarHBondContact OD1-NH2 2.74Å; N64-A68 WeakPolarHBondContact O-CB 3.35Å; N64-A68 PolarHBondContact O-N 3.32Å
65	C	98	Very high	96.8	Very high	25 Å²	25	44.5 Å²	44.5	17%	0.169	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-39.1	175.5	-64.3	0	0	0	0	112	D61 Y62 A68 I69 W186	D61-C65 PolarHBondContact O-N 3.44Å; D61-C65 PolarHBondContact O-SG 2.93Å; Y62-C65 PolarHBondContact O-N 3.28Å; C65-A68 WeakPolarHBondContact O-CB 3.22Å; C65-A68 PolarHBondContact O-N 3.34Å; C65-I69 WeakPolarHBondContact O-CG1 3.39Å; C65-I69 PolarHBondContact O-N 3.17Å; C65-W186 HydrophobicContact CB-CB 3.87Å; C65-W186 HydrophobicContact CB-CG 4.35Å
66	S	98.5	Very high	97.1	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-42.3	179.6	-59	0	0	0	0	111.7	Y62 L63 N64 A68 I69 G70 A77 W186	Y62-S66 WeakPolarHBondContact CE2-OG 3.4Å; Y62-S66 VanDerWaalsContact O-CB 3.32Å; Y62-S66 WeakPolarHBondContact O-CB 3.35Å; Y62-S66 PolarHBondContact O-N 3.17Å; Y62-S66 PolarHBondContact O-OG 3.12Å; L63-S66 PolarHBondContact O-N 3.27Å; N64-S66 VanDerWaalsContact C-N 3.34Å; S66-A68 VanDerWaalsContact C-N 3.3Å; S66-A68 PolarHBondContact O-N 2.79Å; S66-I69 PolarHBondContact O-N 2.64Å; S66-G70 PolarHBondContact O-N 2.81Å; S66-A77 VanDerWaalsContact OG-CB 3.29Å; S66-A77 WeakPolarHBondContact OG-CB 3.33Å; S66-W186 VanDerWaalsContact OG-CD1 3.24Å; S66-W186 PolarHBondContact OG-NE1 3.21Å
67	R	98.4	Very high	97.4	Very high	119 Å²	119	36.2 Å²	36.2	45%	0.449	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-37.5	171	-73.4	-172.2	-109.4	109.8	4.7	112.2	L63 N64 I69 G70 E74	L63-R67 WeakPolarHBondContact O-CB 3.11Å; L63-R67 WeakPolarHBondContact O-CG 3.14Å; L63-R67 PolarHBondContact O-N 2.91Å; N64-R67 VanDerWaalsContact OD1-CZ 3.23Å; N64-R67 PolarHBondContact OD1-NH1 3.45Å; N64-R67 PolarHBondContact OD1-NH2 2.74Å; R67-I69 VanDerWaalsContact C-N 3.29Å; R67-I69 PolarHBondContact O-N 2.82Å; R67-G70 PolarHBondContact O-N 3.09Å; R67-E74 HydrophobicContact CG-CG 3.95Å; R67-E74 WeakPolarHBondContact CG-OE1 3.2Å
68	A	97.5	Very high	97.6	Very high	46 Å²	46	40 Å²	40	38%	0.38	21%	0.213	S	C	.	.	H	α-helix	trans	-66.9	-29.6	176.8	0	0	0	0	0	112.8	N64 C65 S66 R182	N64-A68 WeakPolarHBondContact O-CB 3.35Å; N64-A68 PolarHBondContact O-N 3.32Å; C65-A68 WeakPolarHBondContact O-CB 3.22Å; C65-A68 PolarHBondContact O-N 3.34Å; S66-A68 VanDerWaalsContact C-N 3.3Å; S66-A68 PolarHBondContact O-N 2.79Å; A68-R182 PolarHBondContact O-NH1 3.34Å
69	I	97.8	Very high	97.8	Very high	25 Å²	25	40.2 Å²	40.2	13%	0.128	21%	0.212	C	C	.	.	H	α-helix	trans	-79.8	-44.3	172.6	-66.6	169.1	0	0	0	110.7	C65 S66 R67 V73 L131 R182 W186	C65-I69 WeakPolarHBondContact O-CG1 3.39Å; C65-I69 PolarHBondContact O-N 3.17Å; S66-I69 PolarHBondContact O-N 2.64Å; R67-I69 VanDerWaalsContact C-N 3.29Å; R67-I69 PolarHBondContact O-N 2.82Å; I69-V73 HydrophobicContact CB-CG1 4.36Å; I69-V73 HydrophobicContact CD1-CG1 4.31Å; I69-V73 HydrophobicContact CG2-CB 4.04Å; I69-V73 HydrophobicContact CG2-CG1 4.3Å; I69-V73 HydrophobicContact CG2-CG2 4.13Å; I69-L131 HydrophobicContact CG2-CD1 3.92Å; I69-L131 HydrophobicContact CG2-CD2 4.48Å; I69-R182 HydrophobicContact CG1-CB 4.3Å; I69-W186 HydrophobicContact CD1-CB 3.61Å; I69-W186 HydrophobicContact CD1-CD2 4.36Å; I69-W186 HydrophobicContact CD1-CG 3.64Å
70	G	95.8	Very high	97.9	Very high	11 Å²	11	40.1 Å²	40.1	11%	0.113	21%	0.212	C	C	.	.			trans	80.3	-163.9	179.1	0	0	0	0	0	114.4	S66 R67 V73 E74	S66-G70 PolarHBondContact O-N 2.81Å; R67-G70 PolarHBondContact O-N 3.09Å; G70-V73 PolarHBondContact O-N 2.85Å; G70-E74 PolarHBondContact O-N 2.78Å
71	S	95.1	Very high	97.9	Very high	68 Å²	68	40.3 Å²	40.3	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	58.7	-134	174.9	-157.7	0	0	0	0	113.5	V73	S71-V73 VanDerWaalsContact C-N 3.27Å; S71-V73 PolarHBondContact O-N 3.3Å
72	E	97	Very high	98	Very high	44 Å²	44	42.5 Å²	42.5	21%	0.206	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-27.2	179.9	-61.2	85.3	173.3	0	0	112.3	H76 F122 S129 L135	E72-H76 VanDerWaalsContact O-CB 3.26Å; E72-H76 WeakPolarHBondContact O-CB 3.49Å; E72-H76 PolarHBondContact O-N 3.32Å; E72-F122 HydrophobicContact CB-CE1 4.03Å; E72-F122 HydrophobicContact CB-CZ 4.09Å; E72-F122 HydrophobicContact CG-CZ 4.44Å; E72-F122 WeakPolarHBondContact O-CE1 3.46Å; E72-S129 PolarHBondContact OE2-OG 3.4Å; E72-L135 HydrophobicContact CB-CD1 4.11Å; E72-L135 HydrophobicContact CB-CD2 3.99Å
73	V	98.3	Very high	98	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-41.8	-178.6	175.1	0	0	0	0	111.2	I69 G70 S71 H76 A77 L131 H134 W186	I69-V73 HydrophobicContact CB-CG1 4.36Å; I69-V73 HydrophobicContact CD1-CG1 4.31Å; I69-V73 HydrophobicContact CG2-CB 4.04Å; I69-V73 HydrophobicContact CG2-CG1 4.3Å; I69-V73 HydrophobicContact CG2-CG2 4.13Å; G70-V73 PolarHBondContact O-N 2.85Å; S71-V73 VanDerWaalsContact C-N 3.27Å; S71-V73 PolarHBondContact O-N 3.3Å; V73-H76 PolarHBondContact O-N 3.02Å; V73-A77 WeakPolarHBondContact O-CB 3.49Å; V73-A77 PolarHBondContact O-N 2.77Å; V73-L131 HydrophobicContact CG2-CB 3.83Å; V73-L131 HydrophobicContact CG2-CD1 3.65Å; V73-L131 HydrophobicContact CG2-CG 4.26Å; V73-H134 HydrophobicContact CG2-CB 3.66Å; V73-W186 HydrophobicContact CG1-CZ2 4.28Å
74	E	98.4	Very high	97.9	Very high	65 Å²	65	41.5 Å²	41.5	30%	0.304	21%	0.213	S	C	.	.	H	α-helix	trans	-60.2	-51.4	174.3	177.2	174.4	-159.3	0	0	111.6	R67 G70 H76 A77 E78	R67-E74 HydrophobicContact CG-CG 3.95Å; R67-E74 WeakPolarHBondContact CG-OE1 3.2Å; G70-E74 PolarHBondContact O-N 2.78Å; E74-H76 VanDerWaalsContact C-N 3.32Å; E74-H76 PolarHBondContact O-N 3.17Å; E74-A77 WeakPolarHBondContact O-CB 3.46Å; E74-A77 PolarHBondContact O-N 3.37Å; E74-A77 VanDerWaalsContact O-N 3.12Å; E74-E78 PolarHBondContact O-N 2.86Å
75	K	98.3	Very high	97.9	Very high	125 Å²	125	41.6 Å²	41.6	54%	0.543	21%	0.211	S	C	.	.	H	α-helix	trans	-59.4	-43.5	178.5	-66.1	176.3	-176.1	175.6	0	111.9	A77 E78 M79 F122	K75-A77 VanDerWaalsContact C-N 3.26Å; K75-A77 PolarHBondContact O-N 3.05Å; K75-E78 PolarHBondContact O-N 3.39Å; K75-M79 WeakPolarHBondContact O-CG 3.32Å; K75-M79 PolarHBondContact O-N 2.86Å; K75-F122 HydrophobicContact CB-CE2 4.25Å; K75-F122 HydrophobicContact CB-CZ 3.88Å; K75-F122 HydrophobicContact CD-CZ 4.44Å
76	H	98.3	Very high	97.8	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-34.1	179.6	-153.2	-173.2	0	0	0	111.6	E72 V73 E74 M79 V80 I119 F122 L135	E72-H76 VanDerWaalsContact O-CB 3.26Å; E72-H76 WeakPolarHBondContact O-CB 3.49Å; E72-H76 PolarHBondContact O-N 3.32Å; V73-H76 PolarHBondContact O-N 3.02Å; E74-H76 VanDerWaalsContact C-N 3.32Å; E74-H76 PolarHBondContact O-N 3.17Å; H76-M79 PolarHBondContact O-N 3.16Å; H76-V80 WeakPolarHBondContact O-CG2 3.27Å; H76-V80 PolarHBondContact O-N 3.43Å; H76-I119 WeakPolarHBondContact NE2-CG2 3.11Å; H76-I119 PolarHBondContact NE2-O 2.76Å; H76-F122 HydrophobicContact CB-CD1 3.95Å; H76-F122 HydrophobicContact CB-CE1 3.79Å; H76-F122 AromaticContact CD2-CD1 3.53Å; H76-F122 AromaticContact CG-CD1 3.66Å; H76-F122 AromaticContact NE2-CD1 3.88Å; H76-L135 HydrophobicContact CB-CD2 3.96Å; H76-L135 PolarHBondContact CE1-O 3.29Å; H76-L135 VanDerWaalsContact ND1-CD2 3.33Å; H76-L135 WeakPolarHBondContact ND1-CD2 3.38Å
77	A	98.6	Very high	97.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-69.9	-36.3	175.9	0	0	0	0	0	113.3	Y62 L63 S66 V73 E74 K75 M79 V80 N81	Y62-A77 HydrophobicContact CD1-CB 4.26Å; Y62-A77 HydrophobicContact CE1-CB 3.41Å; Y62-A77 VanDerWaalsContact CE1-CB 3.41Å; L63-A77 HydrophobicContact CD2-CB 3.98Å; L63-A77 WeakPolarHBondContact CD2-O 3.22Å; S66-A77 VanDerWaalsContact OG-CB 3.29Å; S66-A77 WeakPolarHBondContact OG-CB 3.33Å; V73-A77 WeakPolarHBondContact O-CB 3.49Å; V73-A77 PolarHBondContact O-N 2.77Å; E74-A77 WeakPolarHBondContact O-CB 3.46Å; E74-A77 PolarHBondContact O-N 3.37Å; E74-A77 VanDerWaalsContact O-N 3.12Å; K75-A77 VanDerWaalsContact C-N 3.26Å; K75-A77 PolarHBondContact O-N 3.05Å; A77-M79 VanDerWaalsContact C-N 3.34Å; A77-V80 PolarHBondContact O-N 3.1Å; A77-N81 PolarHBondContact O-N 2.96Å
78	E	98.6	Very high	97.6	Very high	99 Å²	99	39 Å²	39	46%	0.463	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-44	173.1	-70	177	163	0	0	111.4	E74 K75 V80 N81 E82	E74-E78 PolarHBondContact O-N 2.86Å; K75-E78 PolarHBondContact O-N 3.39Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.88Å; E78-N81 WeakPolarHBondContact O-CB 3.34Å; E78-N81 PolarHBondContact O-N 3.37Å; E78-N81 VanDerWaalsContact O-N 3.11Å; E78-E82 PolarHBondContact O-N 3.23Å
79	M	98.7	Very high	97.5	Very high	20 Å²	20	43 Å²	43	10%	0.099	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-41.3	175.4	-57.9	171.2	79.2	0	0	111.9	K75 H76 A77 N81 E82 A83 E118 I119 F122	K75-M79 WeakPolarHBondContact O-CG 3.32Å; K75-M79 PolarHBondContact O-N 2.86Å; H76-M79 PolarHBondContact O-N 3.16Å; A77-M79 VanDerWaalsContact C-N 3.34Å; M79-N81 VanDerWaalsContact C-N 3.31Å; M79-N81 PolarHBondContact O-N 3.02Å; M79-E82 PolarHBondContact O-N 2.71Å; M79-A83 WeakPolarHBondContact O-CB 3.21Å; M79-A83 PolarHBondContact O-N 3.47Å; M79-E118 HydrophobicContact CE-CB 3.89Å; M79-E118 VanDerWaalsContact CE-CD 3.5Å; M79-E118 HydrophobicContact CE-CG 3.39Å; M79-E118 WeakPolarHBondContact CE-O 3.09Å; M79-I119 HydrophobicContact CB-CD1 4.21Å; M79-I119 HydrophobicContact CB-CG1 3.65Å; M79-I119 HydrophobicContact CE-CG1 4.21Å; M79-F122 HydrophobicContact CE-CB 4.02Å; M79-F122 HydrophobicContact SD-CB 3.83Å; M79-F122 HydrophobicContact SD-CD1 4.45Å; M79-F122 HydrophobicContact SD-CD2 3.85Å; M79-F122 HydrophobicContact SD-CG 3.79Å
80	V	98.6	Very high	97.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-39.2	174.9	171.6	0	0	0	0	111.4	L59 Y62 H76 A77 E78 A83 L84 I119 V138 I142	L59-V80 HydrophobicContact CD1-CG1 4.48Å; Y62-V80 HydrophobicContact CE1-CB 4.25Å; Y62-V80 HydrophobicContact CE1-CG1 4.18Å; H76-V80 WeakPolarHBondContact O-CG2 3.27Å; H76-V80 PolarHBondContact O-N 3.43Å; A77-V80 PolarHBondContact O-N 3.1Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.88Å; V80-A83 PolarHBondContact O-N 3.43Å; V80-L84 HydrophobicContact CG1-CD1 3.94Å; V80-L84 PolarHBondContact O-N 3.2Å; V80-I119 HydrophobicContact CG2-CD1 4.06Å; V80-I119 HydrophobicContact CG2-CG2 4.48Å; V80-V138 HydrophobicContact CG2-CG1 3.5Å; V80-V138 VanDerWaalsContact CG2-CG1 3.5Å; V80-I142 HydrophobicContact CG1-CD1 4.35Å; V80-I142 HydrophobicContact CG2-CD1 4.1Å
81	N	98.4	Very high	97.3	Very high	46 Å²	46	42.1 Å²	42.1	25%	0.246	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-46.6	175.5	171.2	71.7	0	0	0	111.5	L63 A77 E78 M79 A83 L84 Q85	L63-N81 HydrophobicContact CD1-CB 3.99Å; L63-N81 HydrophobicContact CD2-CB 3.92Å; L63-N81 HydrophobicContact CG-CB 4.47Å; A77-N81 PolarHBondContact O-N 2.96Å; E78-N81 WeakPolarHBondContact O-CB 3.34Å; E78-N81 PolarHBondContact O-N 3.37Å; E78-N81 VanDerWaalsContact O-N 3.11Å; M79-N81 VanDerWaalsContact C-N 3.31Å; M79-N81 PolarHBondContact O-N 3.02Å; N81-A83 VanDerWaalsContact C-N 3.31Å; N81-A83 PolarHBondContact O-N 2.8Å; N81-L84 PolarHBondContact O-N 2.72Å; N81-Q85 VanDerWaalsContact O-CG 3.27Å; N81-Q85 WeakPolarHBondContact O-CG 3.49Å; N81-Q85 PolarHBondContact O-N 2.92Å
82	E	98.3	Very high	97.1	Very high	103 Å²	103	42.5 Å²	42.5	48%	0.481	20%	0.198	S	C	.	.	H	α-helix	trans	-58.1	-44.5	175.3	-67.5	-178.4	162.8	0	0	111.6	E78 M79 L84 Q85 T86	E78-E82 PolarHBondContact O-N 3.23Å; M79-E82 PolarHBondContact O-N 2.71Å; E82-L84 PolarHBondContact O-N 2.97Å; E82-Q85 PolarHBondContact O-N 2.9Å; E82-T86 PolarHBondContact O-N 2.81Å; E82-T86 PolarHBondContact O-OG1 2.98Å
83	A	98.1	Very high	96.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-42.9	177.4	0	0	0	0	0	112.8	M79 V80 N81 T86 Q87 H115 I119 L145	M79-A83 WeakPolarHBondContact O-CB 3.21Å; M79-A83 PolarHBondContact O-N 3.47Å; V80-A83 PolarHBondContact O-N 3.43Å; N81-A83 VanDerWaalsContact C-N 3.31Å; N81-A83 PolarHBondContact O-N 2.8Å; A83-T86 PolarHBondContact O-N 3.5Å; A83-Q87 PolarHBondContact O-N 2.8Å; A83-H115 HydrophobicContact CB-CB 3.69Å; A83-I119 HydrophobicContact CB-CD1 3.91Å; A83-L145 HydrophobicContact CB-CD1 3.52Å
84	L	97.6	Very high	96.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.3	-31	177.4	-81.6	163.4	0	0	0	112.9	F51 L54 L55 L59 V80 N81 E82 Q87 R88 L145 I193 M197	F51-L84 HydrophobicContact CZ-CD2 4.01Å; L54-L84 HydrophobicContact CD2-CD2 4.47Å; L55-L84 HydrophobicContact CD2-CB 3.9Å; L59-L84 HydrophobicContact CD1-CD1 3.65Å; L59-L84 HydrophobicContact CD2-CB 4.05Å; L59-L84 HydrophobicContact CD2-CD1 3.84Å; L59-L84 HydrophobicContact CG-CD1 4.23Å; V80-L84 HydrophobicContact CG1-CD1 3.94Å; V80-L84 PolarHBondContact O-N 3.2Å; N81-L84 PolarHBondContact O-N 2.72Å; E82-L84 PolarHBondContact O-N 2.97Å; L84-Q87 WeakPolarHBondContact O-CB 3.46Å; L84-Q87 PolarHBondContact O-N 3.3Å; L84-R88 PolarHBondContact O-N 3.35Å; L84-L145 HydrophobicContact CD2-CD2 3.59Å; L84-L145 HydrophobicContact CG-CD2 4.13Å; L84-I193 HydrophobicContact CD1-CG2 4.26Å; L84-M197 HydrophobicContact CD2-CE 3.79Å
85	Q	97	Very high	96.2	Very high	72 Å²	72	40 Å²	40	34%	0.336	19%	0.188	S	C	.	.	H	α-helix	trans	-67	-41.4	170.8	-67.4	-66	-18	0	0	111.1	N81 E82 Q87 R88 Q89	N81-Q85 VanDerWaalsContact O-CG 3.27Å; N81-Q85 WeakPolarHBondContact O-CG 3.49Å; N81-Q85 PolarHBondContact O-N 2.92Å; E82-Q85 PolarHBondContact O-N 2.9Å; Q85-Q87 VanDerWaalsContact C-N 3.34Å; Q85-Q87 PolarHBondContact O-N 3.01Å; Q85-R88 WeakPolarHBondContact O-CB 3.12Å; Q85-R88 PolarHBondContact O-N 2.79Å; Q85-Q89 WeakPolarHBondContact O-CG 3.49Å; Q85-Q89 PolarHBondContact O-N 3.26Å
86	T	97.2	Very high	95.7	Very high	26 Å²	26	37.1 Å²	37.1	16%	0.16	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-41.9	172.8	-61.9	0	0	0	0	111.1	E82 A83 R88 Q89 F90 P111 I112 H115	E82-T86 PolarHBondContact O-N 2.81Å; E82-T86 PolarHBondContact O-OG1 2.98Å; A83-T86 PolarHBondContact O-N 3.5Å; T86-R88 VanDerWaalsContact C-N 3.34Å; T86-R88 PolarHBondContact O-N 2.81Å; T86-Q89 PolarHBondContact O-N 2.82Å; T86-F90 PolarHBondContact O-N 3.13Å; T86-P111 HydrophobicContact CG2-CB 3.8Å; T86-I112 HydrophobicContact CG2-CG1 3.97Å; T86-H115 PolarHBondContact OG1-CD2 2.83Å; T86-H115 PolarHBondContact OG1-NE2 2.9Å
87	Q	96.1	Very high	95.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-45	172.7	-165.1	98.4	13.3	0	0	111.9	F51 A83 L84 Q85 Q89 F90 L91 L145	F51-Q87 HydrophobicContact CZ-CB 4.26Å; F51-Q87 HydrophobicContact CZ-CG 4.07Å; A83-Q87 PolarHBondContact O-N 2.8Å; L84-Q87 WeakPolarHBondContact O-CB 3.46Å; L84-Q87 PolarHBondContact O-N 3.3Å; Q85-Q87 VanDerWaalsContact C-N 3.34Å; Q85-Q87 PolarHBondContact O-N 3.01Å; Q87-Q89 PolarHBondContact O-N 2.87Å; Q87-F90 WeakPolarHBondContact O-CB 3.18Å; Q87-F90 PolarHBondContact O-N 2.88Å; Q87-L91 HydrophobicContact CG-CD1 4.44Å; Q87-L91 WeakPolarHBondContact O-CG 3.25Å; Q87-L91 PolarHBondContact O-N 2.92Å; Q87-L145 PolarHBondContact NE2-O 3.12Å; Q87-L145 VanDerWaalsContact OE1-CB 3.26Å; Q87-L145 PolarHBondContact OE1-O 3Å
88	R	96	Very high	94.9	Very high	65 Å²	65	44 Å²	44	25%	0.245	21%	0.213	C	C	.	.	H	α-helix	trans	-58.8	-46.4	177.5	-174	-159.7	-177.9	-79.7	-9.3	111.6	F51 D52 L55 L84 Q85 T86 F90 L91 Q92	F51-R88 HydrophobicContact CD1-CB 3.92Å; F51-R88 HydrophobicContact CD1-CG 3.98Å; F51-R88 HydrophobicContact CE1-CB 3.77Å; F51-R88 HydrophobicContact CE1-CG 4.34Å; D52-R88 IonicContact OD1-CZ 4Å; D52-R88 IonicContact OD1-NE 2.78Å; D52-R88 PolarHBondContact OD1-NE 3.08Å; D52-R88 IonicContact OD1-NH2 2.93Å; D52-R88 PolarHBondContact OD1-NH2 3.09Å; D52-R88 IonicContact OD2-CZ 2.63Å; D52-R88 IonicContact OD2-NE 3.91Å; D52-R88 IonicContact OD2-NH2 3.23Å; D52-R88 PolarHBondContact OD2-NH2 2.98Å; L55-R88 HydrophobicContact CD1-CB 4.1Å; L55-R88 HydrophobicContact CD1-CG 4.01Å; L84-R88 PolarHBondContact O-N 3.35Å; Q85-R88 WeakPolarHBondContact O-CB 3.12Å; Q85-R88 PolarHBondContact O-N 2.79Å; T86-R88 VanDerWaalsContact C-N 3.34Å; T86-R88 PolarHBondContact O-N 2.81Å; R88-F90 VanDerWaalsContact C-N 3.29Å; R88-F90 PolarHBondContact O-N 3.44Å; R88-L91 PolarHBondContact O-N 3.09Å; R88-Q92 PolarHBondContact O-N 3.1Å
89	Q	94.5	Very high	94.6	Very high	130 Å²	130	45.1 Å²	45.1	61%	0.607	22%	0.218	S	C	*	.	H	α-helix	trans	-61.1	-41.4	177.8	-69.3	175.8	7.4	0	0	111.2	Q85 T86 Q87 Q92 M93	Q85-Q89 WeakPolarHBondContact O-CG 3.49Å; Q85-Q89 PolarHBondContact O-N 3.26Å; T86-Q89 PolarHBondContact O-N 2.82Å; Q87-Q89 PolarHBondContact O-N 2.87Å; Q89-Q92 PolarHBondContact O-N 2.95Å; Q89-M93 PolarHBondContact O-N 2.89Å
90	F	94.9	Very high	94.1	Very high	10 Å²	10	44.7 Å²	44.7	4%	0.044	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-42.6	175.6	-174	-92	0	0	0	112.4	T86 Q87 R88 Q92 M93 A94 L105 L108 L109 I112 V148 L209 W211	T86-F90 PolarHBondContact O-N 3.13Å; Q87-F90 WeakPolarHBondContact O-CB 3.18Å; Q87-F90 PolarHBondContact O-N 2.88Å; R88-F90 VanDerWaalsContact C-N 3.29Å; R88-F90 PolarHBondContact O-N 3.44Å; F90-Q92 VanDerWaalsContact C-N 3.34Å; F90-Q92 PolarHBondContact O-N 3.16Å; F90-M93 HydrophobicContact CD2-CE 3.52Å; F90-M93 HydrophobicContact CE2-CE 3.71Å; F90-M93 HydrophobicContact CG-CE 4.32Å; F90-M93 WeakPolarHBondContact O-CB 3.22Å; F90-M93 PolarHBondContact O-N 3.03Å; F90-A94 WeakPolarHBondContact O-CB 3.28Å; F90-A94 PolarHBondContact O-N 2.95Å; F90-L105 HydrophobicContact CZ-CD1 4.17Å; F90-L108 HydrophobicContact CE2-CB 3.9Å; F90-L109 HydrophobicContact CE1-CD2 4.05Å; F90-L109 HydrophobicContact CE2-CD2 3.89Å; F90-L109 HydrophobicContact CE2-CG 4.3Å; F90-L109 HydrophobicContact CZ-CD2 3.56Å; F90-L109 HydrophobicContact CZ-CG 4.18Å; F90-I112 HydrophobicContact CB-CD1 3.96Å; F90-I112 HydrophobicContact CD1-CD1 4.25Å; F90-I112 HydrophobicContact CD2-CD1 4.32Å; F90-I112 HydrophobicContact CG-CD1 3.93Å; F90-V148 HydrophobicContact CD1-CB 4.31Å; F90-V148 HydrophobicContact CD1-CG1 4.26Å; F90-V148 HydrophobicContact CD1-CG2 4.39Å; F90-V148 HydrophobicContact CE1-CB 3.92Å; F90-V148 HydrophobicContact CE1-CG1 4.29Å; F90-V148 HydrophobicContact CE1-CG2 4.11Å; F90-L209 HydrophobicContact CD1-CD2 4.29Å; F90-L209 HydrophobicContact CE1-CD2 3.49Å; F90-L209 VanDerWaalsContact CE1-CD2 3.49Å; F90-L209 HydrophobicContact CZ-CD2 4.32Å; F90-W211 HydrophobicContact CE1-CH2 4.49Å; F90-W211 AromaticContact CZ-CH2 3.91Å; F90-W211 HydrophobicContact CZ-CH2 3.91Å; F90-W211 HydrophobicContact CZ-CZ2 4.17Å
91	L	94.4	Very high	93.6	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-38.4	175.5	-69.1	173.4	0	0	0	112.4	F51 Q87 R88 M93 A94 S95 W147 V148 F200 L209	F51-L91 HydrophobicContact CB-CD1 4.4Å; F51-L91 HydrophobicContact CD1-CD1 4.16Å; F51-L91 HydrophobicContact CD2-CD1 3.54Å; F51-L91 HydrophobicContact CE1-CD1 4.31Å; F51-L91 HydrophobicContact CE2-CD1 3.71Å; F51-L91 HydrophobicContact CG-CD1 3.77Å; F51-L91 HydrophobicContact CZ-CD1 4.1Å; Q87-L91 HydrophobicContact CG-CD1 4.44Å; Q87-L91 WeakPolarHBondContact O-CG 3.25Å; Q87-L91 PolarHBondContact O-N 2.92Å; R88-L91 PolarHBondContact O-N 3.09Å; L91-M93 VanDerWaalsContact C-N 3.34Å; L91-A94 PolarHBondContact O-N 2.93Å; L91-S95 PolarHBondContact O-N 2.92Å; L91-W147 HydrophobicContact CD2-CH2 3.98Å; L91-W147 HydrophobicContact CD2-CZ2 3.92Å; L91-V148 HydrophobicContact CD2-CG1 4.18Å; L91-F200 HydrophobicContact CD1-CE1 3.99Å; L91-F200 HydrophobicContact CD1-CZ 4.14Å; L91-L209 HydrophobicContact CD2-CD1 3.48Å; L91-L209 VanDerWaalsContact CD2-CD1 3.48Å
92	Q	92.8	Very high	92.7	Very high	76 Å²	76	51.5 Å²	51.5	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-65.6	-36.8	174.8	-179.9	64.8	72	0	0	112.7	V48 R88 Q89 F90 S95 T96	V48-Q92 HydrophobicContact CG1-CB 4.49Å; V48-Q92 HydrophobicContact CG2-CB 4.33Å; R88-Q92 PolarHBondContact O-N 3.1Å; Q89-Q92 PolarHBondContact O-N 2.95Å; F90-Q92 VanDerWaalsContact C-N 3.34Å; F90-Q92 PolarHBondContact O-N 3.16Å; Q92-S95 PolarHBondContact NE2-OG 2.85Å; Q92-S95 PolarHBondContact O-OG 2.85Å; Q92-T96 PolarHBondContact O-OG1 3.43Å
93	M	92	Very high	92	Very high	44 Å²	44	53.4 Å²	53.4	22%	0.217	27%	0.268	C	S	.	.	H	α-helix	trans	-67	-46.7	173	178.3	178.7	63.1	0	0	110.4	Q89 F90 L91 S95 T96 H97 L108 A218	Q89-M93 PolarHBondContact O-N 2.89Å; F90-M93 HydrophobicContact CD2-CE 3.52Å; F90-M93 HydrophobicContact CE2-CE 3.71Å; F90-M93 HydrophobicContact CG-CE 4.32Å; F90-M93 WeakPolarHBondContact O-CB 3.22Å; F90-M93 PolarHBondContact O-N 3.03Å; L91-M93 VanDerWaalsContact C-N 3.34Å; M93-S95 PolarHBondContact O-N 3.49Å; M93-T96 PolarHBondContact O-N 2.78Å; M93-T96 PolarHBondContact O-OG1 3.02Å; M93-H97 WeakPolarHBondContact O-CB 3.43Å; M93-H97 PolarHBondContact O-N 3.38Å; M93-H97 PolarHBondContact O-ND1 2.63Å; M93-H97 VanDerWaalsContact O-ND1 3.13Å; M93-L108 HydrophobicContact CE-CB 4.17Å; M93-L108 HydrophobicContact CE-CD1 4.12Å; M93-L108 HydrophobicContact CE-CD2 3.82Å; M93-L108 HydrophobicContact CE-CG 4.26Å; M93-L108 HydrophobicContact SD-CD2 3.86Å; M93-A218 HydrophobicContact CG-CB 4.4Å; M93-A218 HydrophobicContact SD-CB 4.35Å
94	A	92.1	Very high	91.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-32.3	178.2	0	0	0	0	0	112.7	F90 L91 T96 L209 W211 S212	F90-A94 WeakPolarHBondContact O-CB 3.28Å; F90-A94 PolarHBondContact O-N 2.95Å; L91-A94 PolarHBondContact O-N 2.93Å; A94-T96 PolarHBondContact O-N 2.82Å; A94-L209 HydrophobicContact CB-CD1 4.25Å; A94-L209 HydrophobicContact CB-CD2 3.87Å; A94-L209 HydrophobicContact CB-CG 4.21Å; A94-W211 HydrophobicContact CB-CD2 4.15Å; A94-W211 HydrophobicContact CB-CE3 3.81Å; A94-W211 HydrophobicContact CB-CH2 4.46Å; A94-W211 HydrophobicContact CB-CZ3 3.98Å; A94-W211 CarbonylContact O-C 3.51Å; A94-W211 WeakPolarHBondContact O-CA 3.41Å; A94-S212 PolarHBondContact O-N 3.49Å
95	S	90.4	Very high	91.1	Very high	14 Å²	14	56.6 Å²	56.6	10%	0.098	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.4	177	71	0	0	0	0	114.4	L91 Q92 M93 S212	L91-S95 PolarHBondContact O-N 2.92Å; Q92-S95 PolarHBondContact NE2-OG 2.85Å; Q92-S95 PolarHBondContact O-OG 2.85Å; M93-S95 PolarHBondContact O-N 3.49Å; S95-S212 WeakPolarHBondContact O-CB 3.47Å
96	T	87.8	Confident	90.6	Very high	66 Å²	66	57.8 Å²	57.8	41%	0.405	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-12.7	-176.4	49.7	0	0	0	0	113.8	Q92 M93 A94	Q92-T96 PolarHBondContact O-OG1 3.43Å; M93-T96 PolarHBondContact O-N 2.78Å; M93-T96 PolarHBondContact O-OG1 3.02Å; A94-T96 PolarHBondContact O-N 2.82Å
97	H	89.4	Confident	90.3	Very high	62 Å²	62	60.4 Å²	60.4	29%	0.287	30%	0.302	S	S	.	.	S	Bend	trans	-124	152.4	-175.6	-65.3	73.3	0	0	0	111.2	M93 S212 Q216 A218	M93-H97 WeakPolarHBondContact O-CB 3.43Å; M93-H97 PolarHBondContact O-N 3.38Å; M93-H97 PolarHBondContact O-ND1 2.63Å; M93-H97 VanDerWaalsContact O-ND1 3.13Å; H97-S212 PolarHBondContact O-N 3.39Å; H97-S212 VanDerWaalsContact O-N 3.12Å; H97-Q216 WeakPolarHBondContact CA-O 3.3Å; H97-Q216 WeakPolarHBondContact CB-O 3.39Å; H97-A218 HydrophobicContact CB-CB 3.78Å
98	Q	90.9	Very high	90.1	Very high	83 Å²	83	61.3 Å²	61.3	39%	0.388	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-72.7	154.6	171.2	-67.6	-177	-9.1	0	0	111.1	S212 K213 Q216 A218	Q98-S212 WeakPolarHBondContact CA-O 3.38Å; Q98-K213 PolarHBondContact NE2-O 3.39Å; Q98-Q216 PolarHBondContact N-O 3.26Å; Q98-A218 PolarHBondContact O-N 3.15Å; Q98-A218 VanDerWaalsContact O-N 3.12Å
99	E	90.6	Very high	90	Very high	123 Å²	123	59.6 Å²	59.6	58%	0.575	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-55.4	123.8	175.6	-172.7	170.5	-168.9	0	0	110.4	W211	E99-W211 HydrophobicContact CB-CB 4.07Å; E99-W211 HydrophobicContact CB-CD2 3.89Å; E99-W211 HydrophobicContact CB-CG 3.61Å; E99-W211 HydrophobicContact CG-CD2 4.22Å; E99-W211 HydrophobicContact CG-CG 4.17Å
100	P	89.6	Confident	89.9	Confident	12 Å²	12	57 Å²	57	8%	0.078	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-81.6	171.9	-174.8	35.1	-38	0	0	0	112.1	E104 L105 L108 W211 A218	P100-E104 HydrophobicContact CB-CB 4.09Å; P100-L105 HydrophobicContact CG-CB 4Å; P100-L105 HydrophobicContact CG-CD1 4.17Å; P100-L108 HydrophobicContact CB-CD1 4.33Å; P100-L108 HydrophobicContact CG-CD1 3.83Å; P100-W211 VanDerWaalsContact CD-CH2 3.46Å; P100-W211 HydrophobicContact CG-CH2 4.02Å; P100-W211 HydrophobicContact CG-CZ3 4.34Å; P100-A218 HydrophobicContact CB-CB 4.13Å; P100-A218 WeakPolarHBondContact CB-O 3.2Å; P100-A218 HydrophobicContact CG-CB 4.13Å
101	A	88.2	Confident	90	Very high	61 Å²	61	59.5 Å²	59.5	50%	0.504	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-61.5	149.9	172.4	0	0	0	0	0	110.7	M103 E104 L105	A101-M103 PolarHBondContact O-N 3.36Å; A101-E104 PolarHBondContact O-N 3.5Å; A101-L105 PolarHBondContact O-N 3.44Å
102	Q	79.8	Confident	90.1	Very high	127 Å²	127	59.5 Å²	59.5	59%	0.593	31%	0.306	S	S	*	.	H	α-helix	trans	-52.9	-33.6	-173.8	-176.5	60.4	70.1	0	0	114.7	Q106	Q102-Q106 WeakPolarHBondContact O-CG 3.42Å; Q102-Q106 PolarHBondContact O-N 2.94Å
103	M	83.8	Confident	90.3	Very high	143 Å²	143	57.5 Å²	57.5	70%	0.704	30%	0.301	S	S	*	.	H	α-helix	trans	-71.8	-44.8	177.5	-172.8	175.9	-67.1	0	0	111.6	A101 L105 Q106 D107	A101-M103 PolarHBondContact O-N 3.36Å; M103-L105 VanDerWaalsContact C-N 3.31Å; M103-L105 PolarHBondContact O-N 3.4Å; M103-Q106 WeakPolarHBondContact O-CB 3.4Å; M103-Q106 PolarHBondContact O-N 3.29Å; M103-D107 PolarHBondContact O-N 3.37Å
104	E	87.8	Confident	90.5	Very high	54 Å²	54	59 Å²	59	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-66.8	-35.1	176.2	-65.9	-176.4	127.9	0	0	111.2	P100 A101 Q106 D107 L108 S219	P100-E104 HydrophobicContact CB-CB 4.09Å; A101-E104 PolarHBondContact O-N 3.5Å; E104-Q106 VanDerWaalsContact C-N 3.29Å; E104-Q106 PolarHBondContact O-N 3.06Å; E104-D107 PolarHBondContact O-N 2.68Å; E104-L108 VanDerWaalsContact O-CG 3.25Å; E104-L108 WeakPolarHBondContact O-CG 3.26Å; E104-L108 PolarHBondContact O-N 3.33Å; E104-S219 PolarHBondContact OE1-OG 3.2Å
105	L	87.8	Confident	90.8	Very high	14 Å²	14	60.6 Å²	60.6	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-40.1	173.2	-175.7	55.8	0	0	0	112	F90 P100 A101 M103 L108 L109 W211	F90-L105 HydrophobicContact CZ-CD1 4.17Å; P100-L105 HydrophobicContact CG-CB 4Å; P100-L105 HydrophobicContact CG-CD1 4.17Å; A101-L105 PolarHBondContact O-N 3.44Å; M103-L105 VanDerWaalsContact C-N 3.31Å; M103-L105 PolarHBondContact O-N 3.4Å; L105-L108 PolarHBondContact O-N 2.81Å; L105-L109 HydrophobicContact CD1-CD1 4.09Å; L105-L109 HydrophobicContact CD1-CG 4.17Å; L105-L109 HydrophobicContact CG-CD1 3.92Å; L105-L109 HydrophobicContact CG-CG 4.45Å; L105-L109 WeakPolarHBondContact O-CB 3.26Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.37Å; L105-W211 HydrophobicContact CD1-CH2 3.86Å; L105-W211 HydrophobicContact CD1-CZ2 3.57Å
106	Q	87.3	Confident	91.1	Very high	97 Å²	97	61 Å²	61	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.1	-73.7	178.6	-2	0	0	111.7	Q102 M103 E104 L109 K110	Q102-Q106 WeakPolarHBondContact O-CG 3.42Å; Q102-Q106 PolarHBondContact O-N 2.94Å; M103-Q106 WeakPolarHBondContact O-CB 3.4Å; M103-Q106 PolarHBondContact O-N 3.29Å; E104-Q106 VanDerWaalsContact C-N 3.29Å; E104-Q106 PolarHBondContact O-N 3.06Å; Q106-L109 PolarHBondContact O-N 2.89Å; Q106-K110 PolarHBondContact O-N 3.16Å
107	D	90.7	Very high	91.5	Very high	81 Å²	81	60.8 Å²	60.8	43%	0.433	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-40.1	177.5	-65.8	-28.9	0	0	0	111.5	M103 E104 L109 K110 T220	M103-D107 PolarHBondContact O-N 3.37Å; E104-D107 PolarHBondContact O-N 2.68Å; D107-L109 VanDerWaalsContact C-N 3.31Å; D107-L109 PolarHBondContact O-N 2.83Å; D107-K110 VanDerWaalsContact O-CB 3.25Å; D107-K110 WeakPolarHBondContact O-CB 3.28Å; D107-K110 PolarHBondContact O-N 3.04Å; D107-T220 HydrophobicContact CB-CG2 3.69Å
108	L	91.6	Very high	91.9	Very high	20 Å²	20	62.3 Å²	62.3	11%	0.105	32%	0.32	C	S	.	.	H	α-helix	trans	-68.7	-28	177.7	-66.8	167.4	0	0	0	113.1	F90 M93 P100 E104 L105 P111 A218 T220	F90-L108 HydrophobicContact CE2-CB 3.9Å; M93-L108 HydrophobicContact CE-CB 4.17Å; M93-L108 HydrophobicContact CE-CD1 4.12Å; M93-L108 HydrophobicContact CE-CD2 3.82Å; M93-L108 HydrophobicContact CE-CG 4.26Å; M93-L108 HydrophobicContact SD-CD2 3.86Å; P100-L108 HydrophobicContact CB-CD1 4.33Å; P100-L108 HydrophobicContact CG-CD1 3.83Å; E104-L108 VanDerWaalsContact O-CG 3.25Å; E104-L108 WeakPolarHBondContact O-CG 3.26Å; E104-L108 PolarHBondContact O-N 3.33Å; L105-L108 PolarHBondContact O-N 2.81Å; L108-P111 WeakPolarHBondContact O-CD 3.38Å; L108-A218 HydrophobicContact CD1-CB 3.71Å; L108-T220 HydrophobicContact CD2-CG2 3.51Å; L108-T220 HydrophobicContact CG-CG2 3.82Å
109	L	93.6	Very high	92.3	Very high	28 Å²	28	58.4 Å²	58.4	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-82.4	-14.4	176	-72.3	170.3	0	0	0	113.3	F90 L105 Q106 D107 I112 S113 V148 A149	F90-L109 HydrophobicContact CE1-CD2 4.05Å; F90-L109 HydrophobicContact CE2-CD2 3.89Å; F90-L109 HydrophobicContact CE2-CG 4.3Å; F90-L109 HydrophobicContact CZ-CD2 3.56Å; F90-L109 HydrophobicContact CZ-CG 4.18Å; L105-L109 HydrophobicContact CD1-CD1 4.09Å; L105-L109 HydrophobicContact CD1-CG 4.17Å; L105-L109 HydrophobicContact CG-CD1 3.92Å; L105-L109 HydrophobicContact CG-CG 4.45Å; L105-L109 WeakPolarHBondContact O-CB 3.26Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.37Å; Q106-L109 PolarHBondContact O-N 2.89Å; D107-L109 VanDerWaalsContact C-N 3.31Å; D107-L109 PolarHBondContact O-N 2.83Å; L109-I112 HydrophobicContact CD2-CD1 4.43Å; L109-I112 PolarHBondContact O-N 3.31Å; L109-I112 VanDerWaalsContact O-N 3.15Å; L109-S113 PolarHBondContact O-N 3.01Å; L109-S113 VanDerWaalsContact O-N 3.08Å; L109-V148 HydrophobicContact CD2-CG2 3.58Å; L109-A149 HydrophobicContact CD1-CB 3.82Å
110	K	93.3	Very high	92.6	Very high	76 Å²	76	55.6 Å²	55.6	33%	0.33	29%	0.288	S	S	.	.	H	α-helix	trans	-54.6	-44.9	-175.9	-171.5	-179.4	-179.7	77.2	0	113.5	Q106 D107 I112 S113 D114 N274	Q106-K110 PolarHBondContact O-N 3.16Å; D107-K110 VanDerWaalsContact O-CB 3.25Å; D107-K110 WeakPolarHBondContact O-CB 3.28Å; D107-K110 PolarHBondContact O-N 3.04Å; K110-I112 VanDerWaalsContact C-N 3.32Å; K110-I112 PolarHBondContact O-N 3.36Å; K110-S113 WeakPolarHBondContact O-CB 3.09Å; K110-S113 PolarHBondContact O-N 3.44Å; K110-S113 VanDerWaalsContact O-N 3.11Å; K110-D114 VanDerWaalsContact O-CG 3.3Å; K110-D114 PolarHBondContact O-N 3.08Å; K110-N274 PolarHBondContact NZ-ND2 2.98Å; K110-N274 PolarHBondContact NZ-OD1 3.41Å
111	P	97.1	Very high	92.9	Very high	62 Å²	62	57.9 Å²	57.9	40%	0.403	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-38.4	178.4	-25.2	36.6	0	0	0	113.7	T86 L108 D114 H115	T86-P111 HydrophobicContact CG2-CB 3.8Å; L108-P111 WeakPolarHBondContact O-CD 3.38Å; P111-D114 PolarHBondContact O-N 3.04Å; P111-H115 PolarHBondContact O-CD2 3.22Å; P111-H115 PolarHBondContact O-N 3.25Å; P111-H115 VanDerWaalsContact O-N 3.17Å
112	I	96.3	Very high	93.4	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-43.8	175.9	-62.7	173.7	0	0	0	109.8	T86 F90 L109 K110 D114 H115 I116 L145 V148	T86-I112 HydrophobicContact CG2-CG1 3.97Å; F90-I112 HydrophobicContact CB-CD1 3.96Å; F90-I112 HydrophobicContact CD1-CD1 4.25Å; F90-I112 HydrophobicContact CD2-CD1 4.32Å; F90-I112 HydrophobicContact CG-CD1 3.93Å; L109-I112 HydrophobicContact CD2-CD1 4.43Å; L109-I112 PolarHBondContact O-N 3.31Å; L109-I112 VanDerWaalsContact O-N 3.15Å; K110-I112 VanDerWaalsContact C-N 3.32Å; K110-I112 PolarHBondContact O-N 3.36Å; I112-D114 VanDerWaalsContact C-N 3.34Å; I112-D114 PolarHBondContact O-N 3.26Å; I112-H115 PolarHBondContact O-N 3.19Å; I112-I116 HydrophobicContact CG2-CD1 3.99Å; I112-I116 WeakPolarHBondContact O-CG1 3.23Å; I112-I116 PolarHBondContact O-N 3.15Å; I112-L145 HydrophobicContact CG2-CB 4.11Å; I112-V148 HydrophobicContact CD1-CG2 4.11Å
113	S	95.8	Very high	94.3	Very high	35 Å²	35	52.1 Å²	52.1	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-42.2	177.1	-174.6	0	0	0	0	112.4	L109 K110 I116 Q117	L109-S113 PolarHBondContact O-N 3.01Å; L109-S113 VanDerWaalsContact O-N 3.08Å; K110-S113 WeakPolarHBondContact O-CB 3.09Å; K110-S113 PolarHBondContact O-N 3.44Å; K110-S113 VanDerWaalsContact O-N 3.11Å; S113-I116 PolarHBondContact O-N 2.86Å; S113-Q117 PolarHBondContact O-N 2.74Å
114	D	96.9	Very high	94.8	Very high	75 Å²	75	48 Å²	48	40%	0.401	24%	0.24	S	C	.	.	H	α-helix	trans	-64.5	-43.8	-179.5	-69.8	-16.8	0	0	0	110.5	K110 P111 I112 Q117 E118	K110-D114 VanDerWaalsContact O-CG 3.3Å; K110-D114 PolarHBondContact O-N 3.08Å; P111-D114 PolarHBondContact O-N 3.04Å; I112-D114 VanDerWaalsContact C-N 3.34Å; I112-D114 PolarHBondContact O-N 3.26Å; D114-Q117 PolarHBondContact O-N 3.44Å; D114-E118 WeakPolarHBondContact O-CB 3.36Å; D114-E118 PolarHBondContact O-N 2.74Å
115	H	98.3	Very high	95.3	Very high	33 Å²	33	55.2 Å²	55.2	15%	0.153	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-43.8	173.6	-78.4	-59.3	0	0	0	113.2	A83 T86 P111 I112 Q117 E118 I119	A83-H115 HydrophobicContact CB-CB 3.69Å; T86-H115 PolarHBondContact OG1-CD2 2.83Å; T86-H115 PolarHBondContact OG1-NE2 2.9Å; P111-H115 PolarHBondContact O-CD2 3.22Å; P111-H115 PolarHBondContact O-N 3.25Å; P111-H115 VanDerWaalsContact O-N 3.17Å; I112-H115 PolarHBondContact O-N 3.19Å; H115-Q117 VanDerWaalsContact C-N 3.29Å; H115-Q117 PolarHBondContact O-N 3.04Å; H115-E118 IonicContact ND1-OE2 3.9Å; H115-E118 PolarHBondContact O-N 3.37Å; H115-I119 WeakPolarHBondContact O-CB 3.08Å; H115-I119 WeakPolarHBondContact O-CD1 2.89Å; H115-I119 VanDerWaalsContact O-CG1 3.26Å; H115-I119 WeakPolarHBondContact O-CG1 3.16Å; H115-I119 PolarHBondContact O-N 2.95Å
116	I	97.6	Very high	95.7	Very high	23 Å²	23	56.6 Å²	56.6	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-55.8	-48.8	175.9	-72.2	165.8	0	0	0	109.8	I112 S113 E118 I119 Q120 I142 P143 L145	I112-I116 HydrophobicContact CG2-CD1 3.99Å; I112-I116 WeakPolarHBondContact O-CG1 3.23Å; I112-I116 PolarHBondContact O-N 3.15Å; S113-I116 PolarHBondContact O-N 2.86Å; I116-E118 PolarHBondContact O-N 3.12Å; I116-I119 PolarHBondContact O-N 2.85Å; I116-Q120 WeakPolarHBondContact O-CG 3.39Å; I116-Q120 PolarHBondContact O-N 2.96Å; I116-I142 HydrophobicContact CG1-CG1 4.47Å; I116-I142 HydrophobicContact CG2-CG2 4.25Å; I116-P143 HydrophobicContact CG2-CG 4.31Å; I116-L145 HydrophobicContact CD1-CB 4.08Å; I116-L145 HydrophobicContact CG1-CB 4.29Å
117	Q	95.9	Very high	96.1	Very high	62 Å²	62	60 Å²	60	29%	0.29	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-38.8	-179.3	-173.7	172.5	42.5	0	0	111.9	S113 D114 H115 Q120 N121 S267	S113-Q117 PolarHBondContact O-N 2.74Å; D114-Q117 PolarHBondContact O-N 3.44Å; H115-Q117 VanDerWaalsContact C-N 3.29Å; H115-Q117 PolarHBondContact O-N 3.04Å; Q117-Q120 PolarHBondContact O-N 3.36Å; Q117-N121 VanDerWaalsContact O-CB 3.29Å; Q117-N121 WeakPolarHBondContact O-CB 3.19Å; Q117-N121 PolarHBondContact O-N 2.64Å; Q117-N121 PolarHBondContact O-ND2 3.04Å; Q117-S267 PolarHBondContact NE2-OG 3.06Å; Q117-S267 VanDerWaalsContact NE2-OG 3.16Å
118	E	98.1	Very high	96.3	Very high	94 Å²	94	60 Å²	60	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-47.5	177.1	-157.2	-167.6	170.3	0	0	111.7	M79 D114 H115 I116 Q120 N121 F122	M79-E118 HydrophobicContact CE-CB 3.89Å; M79-E118 VanDerWaalsContact CE-CD 3.5Å; M79-E118 HydrophobicContact CE-CG 3.39Å; M79-E118 WeakPolarHBondContact CE-O 3.09Å; D114-E118 WeakPolarHBondContact O-CB 3.36Å; D114-E118 PolarHBondContact O-N 2.74Å; H115-E118 IonicContact ND1-OE2 3.9Å; H115-E118 PolarHBondContact O-N 3.37Å; I116-E118 PolarHBondContact O-N 3.12Å; E118-Q120 VanDerWaalsContact C-N 3.34Å; E118-Q120 PolarHBondContact O-N 3.39Å; E118-N121 PolarHBondContact O-N 3.3Å; E118-F122 PolarHBondContact O-N 3.43Å
119	I	98.5	Very high	96.6	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-41.6	178.2	-70	167	0	0	0	110.7	H76 M79 V80 A83 H115 I116 F122 R123 V138 I142	H76-I119 WeakPolarHBondContact NE2-CG2 3.11Å; H76-I119 PolarHBondContact NE2-O 2.76Å; M79-I119 HydrophobicContact CB-CD1 4.21Å; M79-I119 HydrophobicContact CB-CG1 3.65Å; M79-I119 HydrophobicContact CE-CG1 4.21Å; V80-I119 HydrophobicContact CG2-CD1 4.06Å; V80-I119 HydrophobicContact CG2-CG2 4.48Å; A83-I119 HydrophobicContact CB-CD1 3.91Å; H115-I119 WeakPolarHBondContact O-CB 3.08Å; H115-I119 WeakPolarHBondContact O-CD1 2.89Å; H115-I119 VanDerWaalsContact O-CG1 3.26Å; H115-I119 WeakPolarHBondContact O-CG1 3.16Å; H115-I119 PolarHBondContact O-N 2.95Å; I116-I119 PolarHBondContact O-N 2.85Å; I119-F122 PolarHBondContact O-N 2.76Å; I119-R123 PolarHBondContact O-N 3.32Å; I119-V138 HydrophobicContact CG2-CG1 3.7Å; I119-I142 HydrophobicContact CB-CG1 4.34Å; I119-I142 HydrophobicContact CB-CG2 4.25Å; I119-I142 HydrophobicContact CD1-CD1 3.86Å; I119-I142 HydrophobicContact CD1-CG1 3.64Å; I119-I142 HydrophobicContact CG2-CB 4.03Å; I119-I142 HydrophobicContact CG2-CG1 3.99Å; I119-I142 HydrophobicContact CG2-CG2 3.78Å
120	Q	97.5	Very high	96.7	Very high	64 Å²	64	63.5 Å²	63.5	30%	0.299	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-47.4	175.4	-73	179.9	-32.8	0	0	111.7	I116 Q117 E118 F122 R123 E124 S139 I142	I116-Q120 WeakPolarHBondContact O-CG 3.39Å; I116-Q120 PolarHBondContact O-N 2.96Å; Q117-Q120 PolarHBondContact O-N 3.36Å; E118-Q120 VanDerWaalsContact C-N 3.34Å; E118-Q120 PolarHBondContact O-N 3.39Å; Q120-F122 VanDerWaalsContact C-N 3.26Å; Q120-F122 PolarHBondContact O-N 2.87Å; Q120-R123 WeakPolarHBondContact O-CB 3.05Å; Q120-R123 PolarHBondContact O-N 3.22Å; Q120-R123 VanDerWaalsContact O-N 3.14Å; Q120-E124 PolarHBondContact O-N 3.16Å; Q120-E124 VanDerWaalsContact O-N 3.13Å; Q120-S139 WeakPolarHBondContact CG-O 3.14Å; Q120-S139 PolarHBondContact NE2-O 3.39Å; Q120-I142 HydrophobicContact CG-CG2 4.05Å
121	N	95.8	Very high	96.9	Very high	61 Å²	61	60.7 Å²	60.7	33%	0.326	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-33.8	178	-75.8	-28.7	0	0	0	112.7	Q117 E118 R123 E124 R125	Q117-N121 VanDerWaalsContact O-CB 3.29Å; Q117-N121 WeakPolarHBondContact O-CB 3.19Å; Q117-N121 PolarHBondContact O-N 2.64Å; Q117-N121 PolarHBondContact O-ND2 3.04Å; E118-N121 PolarHBondContact O-N 3.3Å; N121-R123 VanDerWaalsContact C-N 3.33Å; N121-R123 PolarHBondContact O-N 3.49Å; N121-E124 PolarHBondContact O-N 3.07Å; N121-R125 VanDerWaalsContact O-CG 3.32Å; N121-R125 WeakPolarHBondContact O-CG 3.38Å; N121-R125 PolarHBondContact O-N 3.2Å
122	F	98.4	Very high	97	Very high	35 Å²	35	60.2 Å²	60.2	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-45.9	174.8	-177.1	-94	0	0	0	111.2	E72 K75 H76 M79 E118 I119 Q120 E124 R125 N126 L135	E72-F122 HydrophobicContact CB-CE1 4.03Å; E72-F122 HydrophobicContact CB-CZ 4.09Å; E72-F122 HydrophobicContact CG-CZ 4.44Å; E72-F122 WeakPolarHBondContact O-CE1 3.46Å; K75-F122 HydrophobicContact CB-CE2 4.25Å; K75-F122 HydrophobicContact CB-CZ 3.88Å; K75-F122 HydrophobicContact CD-CZ 4.44Å; H76-F122 HydrophobicContact CB-CD1 3.95Å; H76-F122 HydrophobicContact CB-CE1 3.79Å; H76-F122 AromaticContact CD2-CD1 3.53Å; H76-F122 AromaticContact CG-CD1 3.66Å; H76-F122 AromaticContact NE2-CD1 3.88Å; M79-F122 HydrophobicContact CE-CB 4.02Å; M79-F122 HydrophobicContact SD-CB 3.83Å; M79-F122 HydrophobicContact SD-CD1 4.45Å; M79-F122 HydrophobicContact SD-CD2 3.85Å; M79-F122 HydrophobicContact SD-CG 3.79Å; E118-F122 PolarHBondContact O-N 3.43Å; I119-F122 PolarHBondContact O-N 2.76Å; Q120-F122 VanDerWaalsContact C-N 3.26Å; Q120-F122 PolarHBondContact O-N 2.87Å; F122-E124 PolarHBondContact O-N 3.13Å; F122-R125 PolarHBondContact O-N 3.4Å; F122-N126 PolarHBondContact O-N 3.09Å; F122-N126 PolarHBondContact O-ND2 3.27Å; F122-L135 HydrophobicContact CD1-CD2 4.47Å; F122-L135 HydrophobicContact CE1-CD2 4.05Å
123	R	98.1	Very high	97.1	Very high	31 Å²	31	61.6 Å²	61.6	12%	0.117	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-43.6	174.2	178.4	-90.5	-174.7	177.1	8.4	111.7	I119 Q120 N121 R125 N126 R127 F132 L135 S136 S139	I119-R123 PolarHBondContact O-N 3.32Å; Q120-R123 WeakPolarHBondContact O-CB 3.05Å; Q120-R123 PolarHBondContact O-N 3.22Å; Q120-R123 VanDerWaalsContact O-N 3.14Å; N121-R123 VanDerWaalsContact C-N 3.33Å; N121-R123 PolarHBondContact O-N 3.49Å; R123-R125 VanDerWaalsContact C-N 3.31Å; R123-R125 PolarHBondContact O-N 3.14Å; R123-N126 CarbonylContact O-C 3.42Å; R123-N126 PolarHBondContact O-N 2.77Å; R123-N126 VanDerWaalsContact O-N 3.09Å; R123-R127 PolarHBondContact O-N 3.11Å; R123-F132 HydrophobicContact CG-CE2 4Å; R123-F132 VanDerWaalsContact NH2-CE1 3.26Å; R123-L135 HydrophobicContact CB-CB 4.05Å; R123-L135 HydrophobicContact CG-CB 3.75Å; R123-S136 VanDerWaalsContact CZ-OG 3.31Å; R123-S136 PolarHBondContact NE-OG 2.92Å; R123-S136 PolarHBondContact NH2-OG 3.39Å; R123-S139 WeakPolarHBondContact CG-OG 3.31Å
124	E	95.3	Very high	97.2	Very high	58 Å²	58	60 Å²	60	27%	0.271	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-34.3	-179.4	-62.8	-50	147.2	0	0	113.7	Q120 N121 F122 N126 R127	Q120-E124 PolarHBondContact O-N 3.16Å; Q120-E124 VanDerWaalsContact O-N 3.13Å; N121-E124 PolarHBondContact O-N 3.07Å; F122-E124 PolarHBondContact O-N 3.13Å; E124-N126 VanDerWaalsContact C-N 3.28Å; E124-R127 WeakPolarHBondContact O-CG 3.35Å; E124-R127 IonicContact OE2-CZ 2.74Å; E124-R127 IonicContact OE2-NE 2.71Å; E124-R127 PolarHBondContact OE2-NE 3.43Å; E124-R127 IonicContact OE2-NH2 2.72Å; E124-R127 PolarHBondContact OE2-NH2 2.91Å
125	R	97.8	Very high	97.3	Very high	204 Å²	204	56.5 Å²	56.5	77%	0.77	29%	0.286	S	S	*	.	H	α-helix	trans	-74.6	-19.5	175.4	-68.9	171.8	-174	174.3	3.5	112.9	N121 F122 R123	N121-R125 VanDerWaalsContact O-CG 3.32Å; N121-R125 WeakPolarHBondContact O-CG 3.38Å; N121-R125 PolarHBondContact O-N 3.2Å; F122-R125 PolarHBondContact O-N 3.4Å; R123-R125 VanDerWaalsContact C-N 3.31Å; R123-R125 PolarHBondContact O-N 3.14Å
126	N	96.8	Very high	97.3	Very high	43 Å²	43	54.9 Å²	54.9	23%	0.23	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	33.9	-176.5	-67.4	-76.1	0	0	0	112.7	F122 R123 E124 G128 S129 L135	F122-N126 PolarHBondContact O-N 3.09Å; F122-N126 PolarHBondContact O-ND2 3.27Å; R123-N126 CarbonylContact O-C 3.42Å; R123-N126 PolarHBondContact O-N 2.77Å; R123-N126 VanDerWaalsContact O-N 3.09Å; E124-N126 VanDerWaalsContact C-N 3.28Å; N126-G128 PolarHBondContact O-N 2.98Å; N126-G128 VanDerWaalsContact O-N 3.11Å; N126-S129 VanDerWaalsContact O-CB 3.29Å; N126-S129 WeakPolarHBondContact O-CB 3.1Å; N126-S129 PolarHBondContact O-N 3.47Å; N126-L135 HydrophobicContact CB-CD1 3.74Å
127	R	95.6	Very high	97.3	Very high	168 Å²	168	53.8 Å²	53.8	63%	0.634	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.2	179.1	-77.8	172.6	-180	172.2	0.5	115.3	R123 E124 F132	R123-R127 PolarHBondContact O-N 3.11Å; E124-R127 WeakPolarHBondContact O-CG 3.35Å; E124-R127 IonicContact OE2-CZ 2.74Å; E124-R127 IonicContact OE2-NE 2.71Å; E124-R127 PolarHBondContact OE2-NE 3.43Å; E124-R127 IonicContact OE2-NH2 2.72Å; E124-R127 PolarHBondContact OE2-NH2 2.91Å; R127-F132 VanDerWaalsContact CA-CE2 3.49Å; R127-F132 HydrophobicContact CB-CE2 4.14Å; R127-F132 HydrophobicContact CB-CZ 4.45Å; R127-F132 HydrophobicContact CG-CE2 3.85Å; R127-F132 HydrophobicContact CG-CZ 4.01Å
128	G	95.1	Very high	97.5	Very high	82 Å²	82	50.9 Å²	50.9	85%	0.845	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.2	176.8	0	0	0	0	0	114.9	N126	N126-G128 PolarHBondContact O-N 2.98Å; N126-G128 VanDerWaalsContact O-N 3.11Å
129	S	96.8	Very high	97.5	Very high	15 Å²	15	46.4 Å²	46.4	11%	0.105	24%	0.239	C	C	.	.			trans	-64.4	138.8	-177.6	179	0	0	0	0	111.4	E72 N126 L131 F132	E72-S129 PolarHBondContact OE2-OG 3.4Å; N126-S129 VanDerWaalsContact O-CB 3.29Å; N126-S129 WeakPolarHBondContact O-CB 3.1Å; N126-S129 PolarHBondContact O-N 3.47Å; S129-L131 PolarHBondContact O-N 2.83Å; S129-L131 PolarHBondContact OG-N 3.22Å; S129-L131 VanDerWaalsContact OG-N 3.08Å; S129-F132 VanDerWaalsContact O-CB 3.28Å; S129-F132 WeakPolarHBondContact O-CB 3.4Å; S129-F132 PolarHBondContact O-N 3.11Å
130	S	96.4	Very high	97.3	Very high	107 Å²	107	49.8 Å²	49.8	75%	0.748	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.6	169.8	55.4	0	0	0	0	112.5
131	L	97.6	Very high	97.4	Very high	16 Å²	16	46.8 Å²	46.8	8%	0.084	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	18.3	178.2	-59.7	172.4	0	0	0	111.9	I69 V73 S129 N133 H134 L135	I69-L131 HydrophobicContact CG2-CD1 3.92Å; I69-L131 HydrophobicContact CG2-CD2 4.48Å; V73-L131 HydrophobicContact CG2-CB 3.83Å; V73-L131 HydrophobicContact CG2-CD1 3.65Å; V73-L131 HydrophobicContact CG2-CG 4.26Å; S129-L131 PolarHBondContact O-N 2.83Å; S129-L131 PolarHBondContact OG-N 3.22Å; S129-L131 VanDerWaalsContact OG-N 3.08Å; L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.3Å; L131-N133 VanDerWaalsContact O-N 3.1Å; L131-H134 WeakPolarHBondContact O-CA 3.27Å; L131-H134 VanDerWaalsContact O-CB 3.24Å; L131-H134 WeakPolarHBondContact O-CB 3.45Å; L131-H134 PolarHBondContact O-N 3.47Å; L131-H134 PolarHBondContact O-ND1 3.27Å; L131-L135 PolarHBondContact O-N 2.87Å
132	F	98	Very high	97.5	Very high	52 Å²	52	43.9 Å²	43.9	23%	0.228	23%	0.225	C	C	.	.	H	α-helix	trans	-55	-34	-173.4	-171.5	-116.2	0	0	0	114.9	R123 R127 S129 H134 L135 S136	R123-F132 HydrophobicContact CG-CE2 4Å; R123-F132 VanDerWaalsContact NH2-CE1 3.26Å; R127-F132 VanDerWaalsContact CA-CE2 3.49Å; R127-F132 HydrophobicContact CB-CE2 4.14Å; R127-F132 HydrophobicContact CB-CZ 4.45Å; R127-F132 HydrophobicContact CG-CE2 3.85Å; R127-F132 HydrophobicContact CG-CZ 4.01Å; S129-F132 VanDerWaalsContact O-CB 3.28Å; S129-F132 WeakPolarHBondContact O-CB 3.4Å; S129-F132 PolarHBondContact O-N 3.11Å; F132-H134 VanDerWaalsContact C-N 3.26Å; F132-H134 PolarHBondContact O-N 3.23Å; F132-L135 PolarHBondContact O-N 3.32Å; F132-S136 WeakPolarHBondContact O-CB 3.43Å; F132-S136 PolarHBondContact O-N 3.03Å
133	N	98.2	Very high	97.5	Very high	36 Å²	36	43.4 Å²	43.4	19%	0.193	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-29.1	175	-72.9	-41.1	0	0	0	112.6	L131 A137 R171 V172	L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.3Å; L131-N133 VanDerWaalsContact O-N 3.1Å; N133-A137 WeakPolarHBondContact O-CB 3.26Å; N133-A137 PolarHBondContact O-N 3.29Å; N133-R171 HydrophobicContact CB-CB 4.45Å; N133-V172 HydrophobicContact CB-CG2 3.75Å
134	H	98.8	Very high	97.4	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-69.3	-48.4	172.5	-59.7	74.1	0	0	0	110	V73 L131 F132 S136 A137 V138 V172 H183 W186	V73-H134 HydrophobicContact CG2-CB 3.66Å; L131-H134 WeakPolarHBondContact O-CA 3.27Å; L131-H134 VanDerWaalsContact O-CB 3.24Å; L131-H134 WeakPolarHBondContact O-CB 3.45Å; L131-H134 PolarHBondContact O-N 3.47Å; L131-H134 PolarHBondContact O-ND1 3.27Å; F132-H134 VanDerWaalsContact C-N 3.26Å; F132-H134 PolarHBondContact O-N 3.23Å; H134-S136 VanDerWaalsContact C-N 3.28Å; H134-S136 PolarHBondContact O-N 3.11Å; H134-A137 WeakPolarHBondContact O-CB 3.45Å; H134-A137 PolarHBondContact O-N 3.33Å; H134-V138 PolarHBondContact O-N 3.08Å; H134-V138 VanDerWaalsContact O-N 3.12Å; H134-V172 VanDerWaalsContact NE2-CG1 3.27Å; H134-V172 WeakPolarHBondContact NE2-CG1 3.24Å; H134-H183 AromaticContact CE1-CE1 3.89Å; H134-H183 AromaticContact CE1-ND1 3.24Å; H134-H183 PolarHBondContact CE1-ND1 3.35Å; H134-H183 AromaticContact NE2-CE1 3.77Å; H134-H183 AromaticContact NE2-CG 3.85Å; H134-H183 AromaticContact NE2-ND1 2.85Å; H134-H183 PolarHBondContact NE2-ND1 3.32Å; H134-W186 HydrophobicContact CB-CH2 3.69Å; H134-W186 HydrophobicContact CB-CZ2 4.01Å; H134-W186 HydrophobicContact CB-CZ3 4.12Å; H134-W186 AromaticContact CD2-CD2 3.76Å; H134-W186 AromaticContact CD2-CE3 3.42Å; H134-W186 VanDerWaalsContact CD2-CE3 3.42Å; H134-W186 AromaticContact CD2-CH2 3.83Å; H134-W186 AromaticContact CD2-CZ3 3.46Å; H134-W186 VanDerWaalsContact CD2-CZ3 3.46Å; H134-W186 WeakPolarHBondContact CD2-CZ3 3.45Å
135	L	98.6	Very high	97.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-38.9	178.9	-52.5	-175.8	0	0	0	111.4	E72 H76 F122 R123 N126 L131 F132 V138 S139	E72-L135 HydrophobicContact CB-CD1 4.11Å; E72-L135 HydrophobicContact CB-CD2 3.99Å; H76-L135 HydrophobicContact CB-CD2 3.96Å; H76-L135 PolarHBondContact CE1-O 3.29Å; H76-L135 VanDerWaalsContact ND1-CD2 3.33Å; H76-L135 WeakPolarHBondContact ND1-CD2 3.38Å; F122-L135 HydrophobicContact CD1-CD2 4.47Å; F122-L135 HydrophobicContact CE1-CD2 4.05Å; R123-L135 HydrophobicContact CB-CB 4.05Å; R123-L135 HydrophobicContact CG-CB 3.75Å; N126-L135 HydrophobicContact CB-CD1 3.74Å; L131-L135 PolarHBondContact O-N 2.87Å; F132-L135 PolarHBondContact O-N 3.32Å; L135-V138 PolarHBondContact O-N 3.24Å; L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.98Å; L135-S139 PolarHBondContact O-OG 2.86Å
136	S	98.4	Very high	97.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-69	-39.2	174.9	-87.2	0	0	0	0	113.2	R123 F132 H134 V138 E140	R123-S136 VanDerWaalsContact CZ-OG 3.31Å; R123-S136 PolarHBondContact NE-OG 2.92Å; R123-S136 PolarHBondContact NH2-OG 3.39Å; F132-S136 WeakPolarHBondContact O-CB 3.43Å; F132-S136 PolarHBondContact O-N 3.03Å; H134-S136 VanDerWaalsContact C-N 3.28Å; H134-S136 PolarHBondContact O-N 3.11Å; S136-V138 PolarHBondContact O-N 3.36Å; S136-E140 WeakPolarHBondContact O-CB 3.48Å; S136-E140 WeakPolarHBondContact O-CG 3.34Å; S136-E140 PolarHBondContact O-N 2.99Å; S136-E140 VanDerWaalsContact O-N 3.12Å
137	A	98.5	Very high	97.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.2	-40.9	172.9	0	0	0	0	0	110.6	N133 H134 S141 T169 W186 Y190	N133-A137 WeakPolarHBondContact O-CB 3.26Å; N133-A137 PolarHBondContact O-N 3.29Å; H134-A137 WeakPolarHBondContact O-CB 3.45Å; H134-A137 PolarHBondContact O-N 3.33Å; A137-S141 PolarHBondContact O-OG 3.12Å; A137-T169 HydrophobicContact CB-CG2 3.67Å; A137-W186 HydrophobicContact CB-CH2 4.19Å; A137-Y190 HydrophobicContact CB-CE1 4.49Å
138	V	98.8	Very high	97.5	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-73.5	-51	179.6	178.2	0	0	0	0	112.9	V80 I119 H134 L135 S136 E140 S141 I142 W186 Y190	V80-V138 HydrophobicContact CG2-CG1 3.5Å; V80-V138 VanDerWaalsContact CG2-CG1 3.5Å; I119-V138 HydrophobicContact CG2-CG1 3.7Å; H134-V138 PolarHBondContact O-N 3.08Å; H134-V138 VanDerWaalsContact O-N 3.12Å; L135-V138 PolarHBondContact O-N 3.24Å; S136-V138 PolarHBondContact O-N 3.36Å; V138-E140 VanDerWaalsContact C-N 3.31Å; V138-E140 PolarHBondContact O-N 3.26Å; V138-S141 PolarHBondContact O-N 2.89Å; V138-I142 WeakPolarHBondContact O-CB 3.15Å; V138-I142 PolarHBondContact O-N 3.17Å; V138-W186 HydrophobicContact CG2-CH2 4.28Å; V138-W186 HydrophobicContact CG2-CZ2 4.05Å; V138-Y190 WeakPolarHBondContact CA-OH 3.43Å; V138-Y190 HydrophobicContact CG2-CD2 4.49Å; V138-Y190 HydrophobicContact CG2-CE1 4.2Å; V138-Y190 HydrophobicContact CG2-CE2 3.91Å
139	S	97.8	Very high	97.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.8	-34.4	-174.5	66.5	0	0	0	0	113.5	Q120 R123 L135	Q120-S139 WeakPolarHBondContact CG-O 3.14Å; Q120-S139 PolarHBondContact NE2-O 3.39Å; R123-S139 WeakPolarHBondContact CG-OG 3.31Å; L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.98Å; L135-S139 PolarHBondContact O-OG 2.86Å
140	E	96.1	Very high	97	Very high	71 Å²	71	20.8 Å²	20.8	33%	0.332	13%	0.131	S	C	.	.	H	α-helix	trans	-82.2	-20.1	-176.7	-57.3	-57.4	122.5	0	0	112.5	S136 V138 A164 Y168	S136-E140 WeakPolarHBondContact O-CB 3.48Å; S136-E140 WeakPolarHBondContact O-CG 3.34Å; S136-E140 PolarHBondContact O-N 2.99Å; S136-E140 VanDerWaalsContact O-N 3.12Å; V138-E140 VanDerWaalsContact C-N 3.31Å; V138-E140 PolarHBondContact O-N 3.26Å; E140-A164 HydrophobicContact CB-CB 4.44Å; E140-Y168 HydrophobicContact CB-CD2 4.4Å; E140-Y168 HydrophobicContact CB-CE2 3.98Å; E140-Y168 HydrophobicContact CG-CD2 4.21Å; E140-Y168 HydrophobicContact CG-CE2 3.5Å
141	S	98.4	Very high	96.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-107.4	-17.1	178.1	67.3	0	0	0	0	115.2	A137 V138 P143 A144 M161 Y190 W194	A137-S141 PolarHBondContact O-OG 3.12Å; V138-S141 PolarHBondContact O-N 2.89Å; S141-P143 VanDerWaalsContact O-N 3.15Å; S141-A144 WeakPolarHBondContact O-CB 3.24Å; S141-A144 PolarHBondContact O-N 3.07Å; S141-M161 WeakPolarHBondContact CB-O 3.32Å; S141-Y190 PolarHBondContact OG-OH 2.99Å; S141-W194 PolarHBondContact OG-NE1 2.9Å
142	I	98.5	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-55.8	-26.9	178.4	-162.8	66.1	0	0	0	114.9	V80 I116 I119 Q120 V138 A144 L145 W194	V80-I142 HydrophobicContact CG1-CD1 4.35Å; V80-I142 HydrophobicContact CG2-CD1 4.1Å; I116-I142 HydrophobicContact CG1-CG1 4.47Å; I116-I142 HydrophobicContact CG2-CG2 4.25Å; I119-I142 HydrophobicContact CB-CG1 4.34Å; I119-I142 HydrophobicContact CB-CG2 4.25Å; I119-I142 HydrophobicContact CD1-CD1 3.86Å; I119-I142 HydrophobicContact CD1-CG1 3.64Å; I119-I142 HydrophobicContact CG2-CB 4.03Å; I119-I142 HydrophobicContact CG2-CG1 3.99Å; I119-I142 HydrophobicContact CG2-CG2 3.78Å; Q120-I142 HydrophobicContact CG-CG2 4.05Å; V138-I142 WeakPolarHBondContact O-CB 3.15Å; V138-I142 PolarHBondContact O-N 3.17Å; I142-A144 PolarHBondContact O-N 3.07Å; I142-L145 HydrophobicContact CD1-CD1 3.6Å; I142-L145 HydrophobicContact CD1-CG 4.01Å; I142-L145 HydrophobicContact CG1-CD1 4.08Å; I142-L145 PolarHBondContact O-N 3.04Å; I142-W194 HydrophobicContact CD1-CH2 4.13Å; I142-W194 HydrophobicContact CD1-CZ2 4.42Å
143	P	97.7	Very high	95.5	Very high	25 Å²	25	29.5 Å²	29.5	16%	0.162	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-57.3	-14	171.5	-26	37.3	0	0	0	114.4	I116 S141 L145 G146 Y157 M161	I116-P143 HydrophobicContact CG2-CG 4.31Å; S141-P143 VanDerWaalsContact O-N 3.15Å; P143-L145 PolarHBondContact O-N 2.98Å; P143-L145 VanDerWaalsContact O-N 3.13Å; P143-G146 PolarHBondContact O-N 3.3Å; P143-Y157 WeakPolarHBondContact O-CE1 3.28Å; P143-Y157 PolarHBondContact O-OH 2.98Å; P143-M161 HydrophobicContact CB-SD 3.96Å; P143-M161 HydrophobicContact CG-SD 4.49Å
144	A	97.3	Very high	95.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-49.1	-34.1	169	0	0	0	0	0	113	S141 I142 G146 W147 V158 M161 W194	S141-A144 WeakPolarHBondContact O-CB 3.24Å; S141-A144 PolarHBondContact O-N 3.07Å; I142-A144 PolarHBondContact O-N 3.07Å; A144-G146 PolarHBondContact O-N 2.89Å; A144-G146 VanDerWaalsContact O-N 3.15Å; A144-W147 WeakPolarHBondContact O-CB 3.31Å; A144-W147 VanDerWaalsContact O-CD1 3.22Å; A144-W147 PolarHBondContact O-N 2.95Å; A144-V158 HydrophobicContact CB-CG1 4.31Å; A144-V158 HydrophobicContact CB-CG2 4.43Å; A144-M161 HydrophobicContact CB-CB 3.7Å; A144-M161 HydrophobicContact CB-CG 3.95Å; A144-W194 HydrophobicContact CB-CD2 4.35Å; A144-W194 HydrophobicContact CB-CE3 3.68Å; A144-W194 HydrophobicContact CB-CH2 3.86Å; A144-W194 HydrophobicContact CB-CZ2 4.48Å; A144-W194 HydrophobicContact CB-CZ3 3.42Å; A144-W194 VanDerWaalsContact CB-CZ3 3.42Å
145	L	97.7	Very high	95	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-57.5	-26.8	175.3	-67.4	-172.8	0	0	0	112.9	A83 L84 Q87 I112 I116 I142 P143 W147 W194 M197	A83-L145 HydrophobicContact CB-CD1 3.52Å; L84-L145 HydrophobicContact CD2-CD2 3.59Å; L84-L145 HydrophobicContact CG-CD2 4.13Å; Q87-L145 PolarHBondContact NE2-O 3.12Å; Q87-L145 VanDerWaalsContact OE1-CB 3.26Å; Q87-L145 PolarHBondContact OE1-O 3Å; I112-L145 HydrophobicContact CG2-CB 4.11Å; I116-L145 HydrophobicContact CD1-CB 4.08Å; I116-L145 HydrophobicContact CG1-CB 4.29Å; I142-L145 HydrophobicContact CD1-CD1 3.6Å; I142-L145 HydrophobicContact CD1-CG 4.01Å; I142-L145 HydrophobicContact CG1-CD1 4.08Å; I142-L145 PolarHBondContact O-N 3.04Å; P143-L145 PolarHBondContact O-N 2.98Å; P143-L145 VanDerWaalsContact O-N 3.13Å; L145-W147 PolarHBondContact O-N 3.32Å; L145-W194 HydrophobicContact CD2-CH2 4.26Å; L145-W194 HydrophobicContact CD2-CZ3 4.17Å; L145-W194 HydrophobicContact CG-CH2 4.38Å; L145-M197 HydrophobicContact CD2-CE 4.47Å
146	G	95.5	Very high	94.7	Very high	19 Å²	19	31.7 Å²	31.7	20%	0.196	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-67.1	-1.2	174.1	0	0	0	0	0	115.5	P143 A144 V148 A149	P143-G146 PolarHBondContact O-N 3.3Å; A144-G146 PolarHBondContact O-N 2.89Å; A144-G146 VanDerWaalsContact O-N 3.15Å; G146-V148 PolarHBondContact O-N 3.38Å; G146-V148 VanDerWaalsContact O-N 3.07Å; G146-A149 PolarHBondContact O-N 2.98Å
147	W	97.4	Very high	94.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.9	179.8	76.4	-96.2	0	0	0	113.3	L91 A144 L145 A149 V150 P154 Y157 V158 F200 I201 H205 L209	L91-W147 HydrophobicContact CD2-CH2 3.98Å; L91-W147 HydrophobicContact CD2-CZ2 3.92Å; A144-W147 WeakPolarHBondContact O-CB 3.31Å; A144-W147 VanDerWaalsContact O-CD1 3.22Å; A144-W147 PolarHBondContact O-N 2.95Å; L145-W147 PolarHBondContact O-N 3.32Å; W147-A149 PolarHBondContact O-N 2.91Å; W147-A149 VanDerWaalsContact O-N 3.17Å; W147-V150 WeakPolarHBondContact O-CB 3.35Å; W147-V150 PolarHBondContact O-N 3.23Å; W147-P154 HydrophobicContact CB-CB 4.24Å; W147-P154 HydrophobicContact CE3-CB 3.76Å; W147-Y157 HydrophobicContact CB-CD1 3.93Å; W147-Y157 HydrophobicContact CB-CE1 4.28Å; W147-V158 HydrophobicContact CB-CG2 3.66Å; W147-V158 HydrophobicContact CG-CG2 4.05Å; W147-F200 HydrophobicContact CH2-CE1 4.17Å; W147-F200 HydrophobicContact CZ2-CD1 4.38Å; W147-F200 AromaticContact CZ2-CE1 3.88Å; W147-F200 HydrophobicContact CZ2-CE1 3.88Å; W147-I201 HydrophobicContact CB-CD1 4.16Å; W147-I201 HydrophobicContact CD2-CD1 3.45Å; W147-I201 VanDerWaalsContact CD2-CD1 3.45Å; W147-I201 HydrophobicContact CD2-CG1 3.79Å; W147-I201 HydrophobicContact CE3-CD1 3.85Å; W147-I201 HydrophobicContact CE3-CG1 3.84Å; W147-I201 HydrophobicContact CE3-CG2 4.48Å; W147-I201 HydrophobicContact CG-CD1 3.59Å; W147-I201 HydrophobicContact CG-CG1 4.44Å; W147-I201 HydrophobicContact CH2-CG1 4.08Å; W147-I201 HydrophobicContact CZ2-CD1 4.43Å; W147-I201 HydrophobicContact CZ2-CG1 4Å; W147-I201 HydrophobicContact CZ3-CG1 4Å; W147-H205 HydrophobicContact CH2-CB 3.89Å; W147-H205 AromaticContact CH2-CD2 3.48Å; W147-H205 VanDerWaalsContact CH2-CD2 3.48Å; W147-H205 WeakPolarHBondContact CH2-CD2 3.39Å; W147-H205 AromaticContact CH2-CG 3.69Å; W147-H205 HydrophobicContact CZ3-CB 3.62Å; W147-H205 AromaticContact CZ3-CG 3.91Å; W147-L209 HydrophobicContact CH2-CD1 4.06Å; W147-L209 HydrophobicContact CZ3-CB 4.45Å; W147-L209 HydrophobicContact CZ3-CD1 4.4Å
148	V	95.8	Very high	94.4	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.055	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-62.4	-18.8	177	-71.1	0	0	0	0	113.3	F90 L91 L109 I112 G146 L209	F90-V148 HydrophobicContact CD1-CB 4.31Å; F90-V148 HydrophobicContact CD1-CG1 4.26Å; F90-V148 HydrophobicContact CD1-CG2 4.39Å; F90-V148 HydrophobicContact CE1-CB 3.92Å; F90-V148 HydrophobicContact CE1-CG1 4.29Å; F90-V148 HydrophobicContact CE1-CG2 4.11Å; L91-V148 HydrophobicContact CD2-CG1 4.18Å; L109-V148 HydrophobicContact CD2-CG2 3.58Å; I112-V148 HydrophobicContact CD1-CG2 4.11Å; G146-V148 PolarHBondContact O-N 3.38Å; G146-V148 VanDerWaalsContact O-N 3.07Å; V148-L209 HydrophobicContact CB-CD2 4.23Å; V148-L209 HydrophobicContact CG1-CD1 4.44Å; V148-L209 HydrophobicContact CG1-CD2 4.42Å
149	A	92.1	Very high	94.3	Very high	61 Å²	61	39 Å²	39	50%	0.504	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-97.5	-1.3	173.2	0	0	0	0	0	113.2	L109 G146 W147	L109-A149 HydrophobicContact CD1-CB 3.82Å; G146-A149 PolarHBondContact O-N 2.98Å; W147-A149 PolarHBondContact O-N 2.91Å; W147-A149 VanDerWaalsContact O-N 3.17Å
150	V	90.4	Very high	94.1	Very high	37 Å²	37	44.8 Å²	44.8	22%	0.224	25%	0.245	C	C	.	.			trans	-93.8	114.6	-176.7	178.8	0	0	0	0	110.2	W147 P154 Y157	W147-V150 WeakPolarHBondContact O-CB 3.35Å; W147-V150 PolarHBondContact O-N 3.23Å; V150-P154 HydrophobicContact CB-CB 4.34Å; V150-P154 HydrophobicContact CG1-CB 4.48Å; V150-Y157 HydrophobicContact CG2-CD1 3.89Å; V150-Y157 HydrophobicContact CG2-CD2 4.28Å; V150-Y157 HydrophobicContact CG2-CE1 4.2Å; V150-Y157 HydrophobicContact CG2-CG 3.93Å
151	S	85.4	Confident	94.2	Very high	93 Å²	93	43 Å²	43	65%	0.65	24%	0.237	S	C	*	.			trans	-82.1	151	171.6	-65.4	0	0	0	0	111.6	K153	S151-K153 PolarHBondContact O-N 3.42Å
152	Q	84.3	Confident	94.1	Very high	128 Å²	128	43.8 Å²	43.8	60%	0.598	24%	0.241	S	C	*	.	S	Bend	trans	70.6	-41.6	172.5	-54.4	-71.4	-60.8	0	0	116.7	T207	Q152-T207 WeakPolarHBondContact CA-O 3.35Å; Q152-T207 PolarHBondContact N-O 3.3Å
153	K	90.7	Very high	93.8	Very high	137 Å²	137	47.4 Å²	47.4	60%	0.596	26%	0.26	S	S	*	.			trans	-139.2	52.1	-173.8	-62.4	-173.7	179.2	-176.7	0	114.5	S151 G155 P156 Y157	S151-K153 PolarHBondContact O-N 3.42Å; K153-G155 PolarHBondContact O-N 2.92Å; K153-P156 HydrophobicContact CB-CB 4.41Å; K153-P156 HydrophobicContact CB-CG 4.1Å; K153-P156 WeakPolarHBondContact O-CD 3.26Å; K153-Y157 PolarHBondContact O-N 3.38Å
154	P	91.7	Very high	93.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-35.3	178.1	26.6	-35.4	0	0	0	113.7	W147 V150 Y157 V158 I201 H205	W147-P154 HydrophobicContact CB-CB 4.24Å; W147-P154 HydrophobicContact CE3-CB 3.76Å; V150-P154 HydrophobicContact CB-CB 4.34Å; V150-P154 HydrophobicContact CG1-CB 4.48Å; P154-Y157 WeakPolarHBondContact O-CB 3.24Å; P154-Y157 PolarHBondContact O-N 3Å; P154-V158 PolarHBondContact O-N 2.97Å; P154-V158 VanDerWaalsContact O-N 3.08Å; P154-I201 HydrophobicContact CB-CG2 3.82Å; P154-I201 HydrophobicContact CG-CG2 3.59Å; P154-H205 VanDerWaalsContact CG-O 3.27Å; P154-H205 WeakPolarHBondContact CG-O 3.47Å
155	G	93.6	Very high	93.5	Very high	15 Å²	15	47.7 Å²	47.7	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-55	177.8	0	0	0	0	0	113.2	K153 Y157 V158 K159	K153-G155 PolarHBondContact O-N 2.92Å; G155-Y157 VanDerWaalsContact C-N 3.26Å; G155-Y157 PolarHBondContact O-N 3.03Å; G155-V158 PolarHBondContact O-N 3.3Å; G155-K159 PolarHBondContact O-N 3.39Å
156	P	93.5	Very high	93.5	Very high	70 Å²	70	49.6 Å²	49.6	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-55	-37.8	173.1	-29.6	36.7	0	0	0	114	K153 K159 E160	K153-P156 HydrophobicContact CB-CB 4.41Å; K153-P156 HydrophobicContact CB-CG 4.1Å; K153-P156 WeakPolarHBondContact O-CD 3.26Å; P156-K159 WeakPolarHBondContact O-CB 2.82Å; P156-K159 PolarHBondContact O-N 2.88Å; P156-E160 PolarHBondContact O-N 2.86Å
157	Y	92.9	Very high	93.5	Very high	58 Å²	58	53.9 Å²	53.9	23%	0.227	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-48.5	175.1	171.1	-100.5	0	0	0	112.3	P143 W147 V150 K153 P154 G155 K159 E160 M161	P143-Y157 WeakPolarHBondContact O-CE1 3.28Å; P143-Y157 PolarHBondContact O-OH 2.98Å; W147-Y157 HydrophobicContact CB-CD1 3.93Å; W147-Y157 HydrophobicContact CB-CE1 4.28Å; V150-Y157 HydrophobicContact CG2-CD1 3.89Å; V150-Y157 HydrophobicContact CG2-CD2 4.28Å; V150-Y157 HydrophobicContact CG2-CE1 4.2Å; V150-Y157 HydrophobicContact CG2-CG 3.93Å; K153-Y157 PolarHBondContact O-N 3.38Å; P154-Y157 WeakPolarHBondContact O-CB 3.24Å; P154-Y157 PolarHBondContact O-N 3Å; G155-Y157 VanDerWaalsContact C-N 3.26Å; G155-Y157 PolarHBondContact O-N 3.03Å; Y157-K159 VanDerWaalsContact C-N 3.26Å; Y157-K159 PolarHBondContact O-N 2.91Å; Y157-E160 PolarHBondContact O-N 3.42Å; Y157-M161 HydrophobicContact CE1-CG 4.44Å; Y157-M161 HydrophobicContact CE2-CE 4.26Å; Y157-M161 WeakPolarHBondContact O-CG 3.08Å; Y157-M161 PolarHBondContact O-N 3.02Å
158	V	97.7	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-34.5	175.9	176.1	0	0	0	0	111.5	A144 W147 P154 G155 M161 N162 W194 M197 Q198 I201	A144-V158 HydrophobicContact CB-CG1 4.31Å; A144-V158 HydrophobicContact CB-CG2 4.43Å; W147-V158 HydrophobicContact CB-CG2 3.66Å; W147-V158 HydrophobicContact CG-CG2 4.05Å; P154-V158 PolarHBondContact O-N 2.97Å; P154-V158 VanDerWaalsContact O-N 3.08Å; G155-V158 PolarHBondContact O-N 3.3Å; V158-M161 PolarHBondContact O-N 2.95Å; V158-N162 PolarHBondContact O-N 3.15Å; V158-W194 HydrophobicContact CG1-CB 4.48Å; V158-W194 HydrophobicContact CG1-CE3 4.35Å; V158-M197 HydrophobicContact CG1-CB 4.26Å; V158-M197 HydrophobicContact CG1-CG 4.08Å; V158-M197 HydrophobicContact CG2-CG 4.4Å; V158-Q198 HydrophobicContact CB-CG 4.04Å; V158-Q198 HydrophobicContact CG1-CG 3.82Å; V158-I201 HydrophobicContact CB-CD1 4.38Å; V158-I201 HydrophobicContact CG2-CD1 3.56Å
159	K	95.8	Very high	93.7	Very high	96 Å²	96	55.5 Å²	55.5	42%	0.417	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-46.7	174.9	-169.7	-166.2	168.5	-64.2	0	111.8	G155 P156 Y157 M161 N162 D163	G155-K159 PolarHBondContact O-N 3.39Å; P156-K159 WeakPolarHBondContact O-CB 2.82Å; P156-K159 PolarHBondContact O-N 2.88Å; Y157-K159 VanDerWaalsContact C-N 3.26Å; Y157-K159 PolarHBondContact O-N 2.91Å; K159-M161 VanDerWaalsContact C-N 3.28Å; K159-M161 PolarHBondContact O-N 3.36Å; K159-N162 CarbonylContact O-C 3.6Å; K159-N162 WeakPolarHBondContact O-CB 3.44Å; K159-N162 PolarHBondContact O-N 2.93Å; K159-N162 VanDerWaalsContact O-N 3.11Å; K159-D163 IonicContact NZ-OD1 2.85Å; K159-D163 PolarHBondContact NZ-OD1 3.16Å; K159-D163 IonicContact NZ-OD2 2.73Å; K159-D163 PolarHBondContact NZ-OD2 3.3Å; K159-D163 VanDerWaalsContact O-CG 3.29Å; K159-D163 PolarHBondContact O-N 3.33Å
160	E	94.6	Very high	94	Very high	122 Å²	122	57 Å²	57	57%	0.57	30%	0.295	S	S	*	.	H	α-helix	trans	-60.2	-40.2	178.5	-71.8	174.2	-169.5	0	0	111.6	P156 Y157 D163 A164	P156-E160 PolarHBondContact O-N 2.86Å; Y157-E160 PolarHBondContact O-N 3.42Å; E160-D163 WeakPolarHBondContact O-CB 3.39Å; E160-D163 PolarHBondContact O-N 3.34Å; E160-A164 PolarHBondContact O-N 2.89Å; E160-A164 VanDerWaalsContact O-N 3.08Å
161	M	96.4	Very high	94.3	Very high	34 Å²	34	60.3 Å²	60.3	17%	0.167	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-38.6	174.5	-61.2	-60.5	110.6	0	0	111.9	S141 P143 A144 Y157 V158 K159 D163 A164 A165	S141-M161 WeakPolarHBondContact CB-O 3.32Å; P143-M161 HydrophobicContact CB-SD 3.96Å; P143-M161 HydrophobicContact CG-SD 4.49Å; A144-M161 HydrophobicContact CB-CB 3.7Å; A144-M161 HydrophobicContact CB-CG 3.95Å; Y157-M161 HydrophobicContact CE1-CG 4.44Å; Y157-M161 HydrophobicContact CE2-CE 4.26Å; Y157-M161 WeakPolarHBondContact O-CG 3.08Å; Y157-M161 PolarHBondContact O-N 3.02Å; V158-M161 PolarHBondContact O-N 2.95Å; K159-M161 VanDerWaalsContact C-N 3.28Å; K159-M161 PolarHBondContact O-N 3.36Å; M161-D163 VanDerWaalsContact C-N 3.33Å; M161-A164 WeakPolarHBondContact O-CB 3.49Å; M161-A164 PolarHBondContact O-N 3.14Å; M161-A165 PolarHBondContact O-N 2.94Å
162	N	97.1	Very high	94.9	Very high	16 Å²	16	56 Å²	56	9%	0.086	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-34.7	174.2	-167.1	36.4	0	0	0	112.4	V158 K159 A164 A165 T166 L191 W194	V158-N162 PolarHBondContact O-N 3.15Å; K159-N162 CarbonylContact O-C 3.6Å; K159-N162 WeakPolarHBondContact O-CB 3.44Å; K159-N162 PolarHBondContact O-N 2.93Å; K159-N162 VanDerWaalsContact O-N 3.11Å; N162-A164 VanDerWaalsContact C-N 3.28Å; N162-A164 PolarHBondContact O-N 3.03Å; N162-A165 WeakPolarHBondContact O-CB 3.45Å; N162-A165 PolarHBondContact O-N 3.11Å; N162-T166 WeakPolarHBondContact O-CB 2.99Å; N162-T166 PolarHBondContact O-N 3.36Å; N162-T166 PolarHBondContact O-OG1 2.97Å; N162-L191 VanDerWaalsContact OD1-CD2 3.29Å; N162-L191 WeakPolarHBondContact OD1-CD2 3.28Å; N162-W194 HydrophobicContact CB-CB 3.78Å; N162-W194 HydrophobicContact CB-CG 4.32Å; N162-W194 WeakPolarHBondContact OD1-CB 3.35Å
163	D	92.3	Very high	95.6	Very high	76 Å²	76	51.7 Å²	51.7	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-36.8	173.9	-65.6	-25.2	0	0	0	110.4	K159 E160 M161 T166 F167	K159-D163 IonicContact NZ-OD1 2.85Å; K159-D163 PolarHBondContact NZ-OD1 3.16Å; K159-D163 IonicContact NZ-OD2 2.73Å; K159-D163 PolarHBondContact NZ-OD2 3.3Å; K159-D163 VanDerWaalsContact O-CG 3.29Å; K159-D163 PolarHBondContact O-N 3.33Å; E160-D163 WeakPolarHBondContact O-CB 3.39Å; E160-D163 PolarHBondContact O-N 3.34Å; M161-D163 VanDerWaalsContact C-N 3.33Å; D163-T166 WeakPolarHBondContact O-CB 3.33Å; D163-T166 PolarHBondContact O-N 3.48Å; D163-F167 PolarHBondContact O-N 2.9Å; D163-F167 VanDerWaalsContact O-N 3.11Å
164	A	91.8	Very high	95.9	Very high	31 Å²	31	53 Å²	53	26%	0.256	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-44.8	171.8	0	0	0	0	0	112.4	E140 E160 M161 N162 T166 F167 Y168	E140-A164 HydrophobicContact CB-CB 4.44Å; E160-A164 PolarHBondContact O-N 2.89Å; E160-A164 VanDerWaalsContact O-N 3.08Å; M161-A164 WeakPolarHBondContact O-CB 3.49Å; M161-A164 PolarHBondContact O-N 3.14Å; N162-A164 VanDerWaalsContact C-N 3.28Å; N162-A164 PolarHBondContact O-N 3.03Å; A164-T166 VanDerWaalsContact C-N 3.28Å; A164-T166 PolarHBondContact O-N 2.76Å; A164-F167 WeakPolarHBondContact O-CB 3.26Å; A164-F167 PolarHBondContact O-N 3.38Å; A164-Y168 WeakPolarHBondContact O-CD2 3.13Å
165	A	97.8	Very high	96.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-43.5	171.6	0	0	0	0	0	111.6	M161 N162 F167 Y168 T169 Y190 L191	M161-A165 PolarHBondContact O-N 2.94Å; N162-A165 WeakPolarHBondContact O-CB 3.45Å; N162-A165 PolarHBondContact O-N 3.11Å; A165-F167 VanDerWaalsContact C-N 3.27Å; A165-F167 PolarHBondContact O-N 3.19Å; A165-Y168 PolarHBondContact O-N 3.39Å; A165-T169 WeakPolarHBondContact O-CG2 3.41Å; A165-T169 PolarHBondContact O-N 2.84Å; A165-T169 PolarHBondContact O-OG1 2.91Å; A165-Y190 HydrophobicContact CB-CD1 4.45Å; A165-Y190 HydrophobicContact CB-CE1 3.99Å; A165-L191 HydrophobicContact CB-CD2 3.75Å
166	T	96.8	Very high	96.3	Very high	40 Å²	40	58.3 Å²	58.3	25%	0.245	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-38.5	-178.4	-60.4	0	0	0	0	111.6	N162 D163 A164 Y168 T169 N170	N162-T166 WeakPolarHBondContact O-CB 2.99Å; N162-T166 PolarHBondContact O-N 3.36Å; N162-T166 PolarHBondContact O-OG1 2.97Å; D163-T166 WeakPolarHBondContact O-CB 3.33Å; D163-T166 PolarHBondContact O-N 3.48Å; A164-T166 VanDerWaalsContact C-N 3.28Å; A164-T166 PolarHBondContact O-N 2.76Å; T166-Y168 PolarHBondContact O-N 2.86Å; T166-T169 WeakPolarHBondContact CA-OG1 3.14Å; T166-T169 PolarHBondContact O-OG1 3.26Å; T166-N170 VanDerWaalsContact O-CB 3.31Å; T166-N170 WeakPolarHBondContact O-CB 3.42Å; T166-N170 PolarHBondContact O-N 2.93Å; T166-N170 PolarHBondContact O-ND2 3.34Å; T166-N170 VanDerWaalsContact O-ND2 3.14Å
167	F	96.3	Very high	96.3	Very high	108 Å²	108	60.9 Å²	60.9	47%	0.474	29%	0.285	S	S	.	.	H	α-helix	trans	-57.3	-45	176.8	177.3	-99	0	0	0	113.1	D163 A164 A165 R171	D163-F167 PolarHBondContact O-N 2.9Å; D163-F167 VanDerWaalsContact O-N 3.11Å; A164-F167 WeakPolarHBondContact O-CB 3.26Å; A164-F167 PolarHBondContact O-N 3.38Å; A165-F167 VanDerWaalsContact C-N 3.27Å; A165-F167 PolarHBondContact O-N 3.19Å; F167-R171 VanDerWaalsContact CE1-NH2 3.28Å
168	Y	98.2	Very high	96.4	Very high	44 Å²	44	66 Å²	66	17%	0.173	31%	0.311	C	S	.	.	H	α-helix	trans	-82.2	-38.2	-179.2	-67.6	-79.7	0	0	0	112.7	E140 A164 A165 T166 N170 R171 V172	E140-Y168 HydrophobicContact CB-CD2 4.4Å; E140-Y168 HydrophobicContact CB-CE2 3.98Å; E140-Y168 HydrophobicContact CG-CD2 4.21Å; E140-Y168 HydrophobicContact CG-CE2 3.5Å; A164-Y168 WeakPolarHBondContact O-CD2 3.13Å; A165-Y168 PolarHBondContact O-N 3.39Å; T166-Y168 PolarHBondContact O-N 2.86Å; Y168-N170 VanDerWaalsContact C-N 3.27Å; Y168-N170 PolarHBondContact O-N 3.28Å; Y168-R171 WeakPolarHBondContact O-CA 3.25Å; Y168-R171 VanDerWaalsContact O-CB 3.29Å; Y168-R171 WeakPolarHBondContact O-CB 3.41Å; Y168-R171 PolarHBondContact O-N 3.06Å; Y168-V172 PolarHBondContact O-N 3.35Å; Y168-V172 VanDerWaalsContact O-N 3.13Å
169	T	98.6	Very high	96.3	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-31.1	175.6	53	0	0	0	0	112.3	A137 A165 T166 R171 V172 L173 W186 V187 L191	A137-T169 HydrophobicContact CB-CG2 3.67Å; A165-T169 WeakPolarHBondContact O-CG2 3.41Å; A165-T169 PolarHBondContact O-N 2.84Å; A165-T169 PolarHBondContact O-OG1 2.91Å; T166-T169 WeakPolarHBondContact CA-OG1 3.14Å; T166-T169 PolarHBondContact O-OG1 3.26Å; T169-R171 PolarHBondContact O-N 3.37Å; T169-V172 CarbonylContact O-C 3.58Å; T169-V172 WeakPolarHBondContact O-CA 3.3Å; T169-V172 WeakPolarHBondContact O-CB 3.47Å; T169-V172 PolarHBondContact O-N 3.38Å; T169-V172 VanDerWaalsContact O-N 3.1Å; T169-L173 WeakPolarHBondContact O-CG 3.29Å; T169-L173 PolarHBondContact O-N 3.12Å; T169-W186 HydrophobicContact CG2-CZ3 4.15Å; T169-V187 HydrophobicContact CG2-CB 4.49Å; T169-V187 HydrophobicContact CG2-CG1 4.14Å; T169-V187 HydrophobicContact CG2-CG2 4.02Å; T169-L191 HydrophobicContact CG2-CD2 4.32Å; T169-L191 HydrophobicContact CG2-CG 4.48Å
170	N	97.9	Very high	96.3	Very high	91 Å²	91	69.6 Å²	69.6	49%	0.487	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-32.6	170	-79.6	-26.9	0	0	0	112.8	T166 Y168 K174	T166-N170 VanDerWaalsContact O-CB 3.31Å; T166-N170 WeakPolarHBondContact O-CB 3.42Å; T166-N170 PolarHBondContact O-N 2.93Å; T166-N170 PolarHBondContact O-ND2 3.34Å; T166-N170 VanDerWaalsContact O-ND2 3.14Å; Y168-N170 VanDerWaalsContact C-N 3.27Å; Y168-N170 PolarHBondContact O-N 3.28Å; N170-K174 WeakPolarHBondContact O-CB 3.22Å; N170-K174 PolarHBondContact O-N 3.34Å
171	R	97.9	Very high	96.4	Very high	108 Å²	108	70 Å²	70	41%	0.408	33%	0.33	S	S	.	.	H	α-helix	trans	-71.9	-40.9	173.5	-58.1	176.3	176.3	-166.8	-5.1	110.9	N133 F167 Y168 T169 L173 K174 D175	N133-R171 HydrophobicContact CB-CB 4.45Å; F167-R171 VanDerWaalsContact CE1-NH2 3.28Å; Y168-R171 WeakPolarHBondContact O-CA 3.25Å; Y168-R171 VanDerWaalsContact O-CB 3.29Å; Y168-R171 WeakPolarHBondContact O-CB 3.41Å; Y168-R171 PolarHBondContact O-N 3.06Å; T169-R171 PolarHBondContact O-N 3.37Å; R171-L173 VanDerWaalsContact C-N 3.35Å; R171-L173 PolarHBondContact O-N 2.95Å; R171-K174 WeakPolarHBondContact O-CB 3.29Å; R171-K174 PolarHBondContact O-N 2.94Å; R171-D175 VanDerWaalsContact O-CG 3.23Å; R171-D175 PolarHBondContact O-N 3.15Å
172	V	98.3	Very high	96.4	Very high	1 Å²	1	73.9 Å²	73.9	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-57.5	-48.2	171.6	176.8	0	0	0	0	110.7	N133 H134 Y168 T169 K174 D175 Y176 H183 V187	N133-V172 HydrophobicContact CB-CG2 3.75Å; H134-V172 VanDerWaalsContact NE2-CG1 3.27Å; H134-V172 WeakPolarHBondContact NE2-CG1 3.24Å; Y168-V172 PolarHBondContact O-N 3.35Å; Y168-V172 VanDerWaalsContact O-N 3.13Å; T169-V172 CarbonylContact O-C 3.58Å; T169-V172 WeakPolarHBondContact O-CA 3.3Å; T169-V172 WeakPolarHBondContact O-CB 3.47Å; T169-V172 PolarHBondContact O-N 3.38Å; T169-V172 VanDerWaalsContact O-N 3.1Å; V172-K174 VanDerWaalsContact C-N 3.32Å; V172-K174 PolarHBondContact O-N 2.91Å; V172-D175 PolarHBondContact O-N 2.87Å; V172-Y176 HydrophobicContact CG1-CD2 4.07Å; V172-Y176 WeakPolarHBondContact O-CB 3.28Å; V172-Y176 WeakPolarHBondContact O-CD2 3.26Å; V172-Y176 PolarHBondContact O-N 3.36Å; V172-H183 HydrophobicContact CG1-CB 3.99Å; V172-V187 HydrophobicContact CB-CG2 3.92Å; V172-V187 HydrophobicContact CG1-CG2 3.71Å
173	L	97.8	Very high	96.5	Very high	39 Å²	39	73.5 Å²	73.5	20%	0.204	34%	0.34	C	S	.	.	H	α-helix	trans	-60.6	-42.5	176.4	-68.9	177.4	0	0	0	111.5	T169 R171 D175 K177 V184 V187	T169-L173 WeakPolarHBondContact O-CG 3.29Å; T169-L173 PolarHBondContact O-N 3.12Å; R171-L173 VanDerWaalsContact C-N 3.35Å; R171-L173 PolarHBondContact O-N 2.95Å; L173-D175 VanDerWaalsContact C-N 3.29Å; L173-D175 PolarHBondContact O-N 3.13Å; L173-K177 WeakPolarHBondContact O-CB 3.06Å; L173-K177 WeakPolarHBondContact O-CG 3.04Å; L173-K177 PolarHBondContact O-N 3.05Å; L173-V184 HydrophobicContact CD2-CB 4.19Å; L173-V184 HydrophobicContact CD2-CG1 3.92Å; L173-V184 HydrophobicContact CD2-CG2 4.08Å; L173-V187 HydrophobicContact CD1-CG1 4.01Å; L173-V187 HydrophobicContact CD2-CB 4.05Å; L173-V187 HydrophobicContact CD2-CG1 4.05Å; L173-V187 HydrophobicContact CD2-CG2 4.15Å; L173-V187 HydrophobicContact CG-CB 4.35Å; L173-V187 HydrophobicContact CG-CG1 3.98Å; L173-V187 HydrophobicContact CG-CG2 4.2Å
174	K	97.6	Very high	96.8	Very high	164 Å²	164	71 Å²	71	71%	0.713	33%	0.327	S	S	*	.	H	α-helix	trans	-57.9	-44.1	176.5	-176.4	-172.5	174.6	-170.1	0	111.8	N170 R171 V172	N170-K174 WeakPolarHBondContact O-CB 3.22Å; N170-K174 PolarHBondContact O-N 3.34Å; R171-K174 WeakPolarHBondContact O-CB 3.29Å; R171-K174 PolarHBondContact O-N 2.94Å; V172-K174 VanDerWaalsContact C-N 3.32Å; V172-K174 PolarHBondContact O-N 2.91Å
175	D	95.6	Very high	97.1	Very high	74 Å²	74	72.6 Å²	72.6	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-79.7	-31.3	-173.6	-63.3	-18.5	0	0	0	112.1	R171 V172 L173 I179	R171-D175 VanDerWaalsContact O-CG 3.23Å; R171-D175 PolarHBondContact O-N 3.15Å; V172-D175 PolarHBondContact O-N 2.87Å; L173-D175 VanDerWaalsContact C-N 3.29Å; L173-D175 PolarHBondContact O-N 3.13Å; D175-I179 WeakPolarHBondContact O-CD1 3.43Å
176	Y	96.9	Very high	97.1	Very high	52 Å²	52	72.7 Å²	72.7	20%	0.204	33%	0.332	C	S	.	.	H	α-helix	trans	-118.2	-11.5	-168.8	-65.8	-88.1	0	0	0	116.1	V172 E178 I179 D180 H183	V172-Y176 HydrophobicContact CG1-CD2 4.07Å; V172-Y176 WeakPolarHBondContact O-CB 3.28Å; V172-Y176 WeakPolarHBondContact O-CD2 3.26Å; V172-Y176 PolarHBondContact O-N 3.36Å; Y176-E178 VanDerWaalsContact C-N 3.26Å; Y176-E178 PolarHBondContact O-N 2.68Å; Y176-E178 VanDerWaalsContact O-N 3.11Å; Y176-I179 PolarHBondContact O-N 3.14Å; Y176-D180 HydrophobicContact CD1-CB 4.48Å; Y176-D180 PolarHBondContact O-N 2.81Å; Y176-H183 HydrophobicContact CD1-CB 4.28Å; Y176-H183 AromaticContact CD1-CD2 3.42Å; Y176-H183 VanDerWaalsContact CD1-CD2 3.42Å; Y176-H183 WeakPolarHBondContact CD1-CD2 3.12Å; Y176-H183 AromaticContact CD1-CG 3.66Å; Y176-H183 AromaticContact CD1-NE2 3.69Å; Y176-H183 HydrophobicContact CD2-CB 4.3Å; Y176-H183 AromaticContact CE1-CD2 3.92Å; Y176-H183 AromaticContact CE1-CE1 3.82Å; Y176-H183 AromaticContact CE1-NE2 3.67Å; Y176-H183 HydrophobicContact CG-CB 3.8Å; Y176-H183 AromaticContact CG-CD2 3.86Å; Y176-H183 AromaticContact CG-CG 3.62Å
177	K	93.8	Very high	97.2	Very high	125 Å²	125	70.8 Å²	70.8	54%	0.543	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-34	-171.8	66.5	-177.6	-172.7	166.7	0	115.5	L173 V184	L173-K177 WeakPolarHBondContact O-CB 3.06Å; L173-K177 WeakPolarHBondContact O-CG 3.04Å; L173-K177 PolarHBondContact O-N 3.05Å; K177-V184 HydrophobicContact CB-CG2 4.16Å
178	E	95.1	Very high	97.3	Very high	164 Å²	164	71 Å²	71	77%	0.766	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-2.2	177.5	-52.8	-53	148.5	0	0	112.6	Y176	Y176-E178 VanDerWaalsContact C-N 3.26Å; Y176-E178 PolarHBondContact O-N 2.68Å; Y176-E178 VanDerWaalsContact O-N 3.11Å
179	I	95.8	Very high	97.3	Very high	135 Å²	135	69.5 Å²	69.5	69%	0.692	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-55	-172.3	-53.5	-169.9	0	0	0	110.3	D175 Y176	D175-I179 WeakPolarHBondContact O-CD1 3.43Å; Y176-I179 PolarHBondContact O-N 3.14Å
180	D	95.8	Very high	97.3	Very high	37 Å²	37	69.5 Å²	69.5	20%	0.198	32%	0.319	C	S	.	.			trans	-147.4	113.1	-175.2	-173.8	-12.6	0	0	0	111	Y176 R182 H183	Y176-D180 HydrophobicContact CD1-CB 4.48Å; Y176-D180 PolarHBondContact O-N 2.81Å; D180-R182 PolarHBondContact O-N 2.9Å; D180-R182 VanDerWaalsContact OD1-CB 3.31Å; D180-R182 WeakPolarHBondContact OD1-CB 3.26Å; D180-R182 WeakPolarHBondContact OD1-CG 3.27Å; D180-R182 PolarHBondContact OD1-N 3.01Å; D180-R182 IonicContact OD1-NE 3.78Å; D180-R182 PolarHBondContact OD1-NE 3.13Å; D180-R182 IonicContact OD2-CZ 3.2Å; D180-R182 IonicContact OD2-NE 3.77Å; D180-R182 PolarHBondContact OD2-NE 3.44Å; D180-R182 IonicContact OD2-NH2 2.66Å; D180-R182 PolarHBondContact OD2-NH2 3.26Å; D180-H183 PolarHBondContact O-N 3.26Å; D180-H183 IonicContact OD2-CD2 3.33Å; D180-H183 IonicContact OD2-NE2 2.82Å
181	R	96.6	Very high	97.3	Very high	132 Å²	132	66.6 Å²	66.6	50%	0.498	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-26.3	-177.9	-169.6	-178.4	179.2	135	13	113	H183 V184 D185	R181-H183 PolarHBondContact O-N 3.01Å; R181-V184 WeakPolarHBondContact O-CA 3.34Å; R181-V184 WeakPolarHBondContact O-CB 3.44Å; R181-V184 PolarHBondContact O-N 3.4Å; R181-D185 IonicContact NE-OD1 2.65Å; R181-D185 IonicContact NE-OD2 3.79Å; R181-D185 PolarHBondContact O-N 3.19Å
182	R	97.7	Very high	97.3	Very high	114 Å²	114	63.4 Å²	63.4	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-57.1	-36.6	-179.9	-64.4	179.5	-65.2	167.9	-0.6	112	A68 I69 D180 W186	A68-R182 PolarHBondContact O-NH1 3.34Å; I69-R182 HydrophobicContact CG1-CB 4.3Å; D180-R182 PolarHBondContact O-N 2.9Å; D180-R182 VanDerWaalsContact OD1-CB 3.31Å; D180-R182 WeakPolarHBondContact OD1-CB 3.26Å; D180-R182 WeakPolarHBondContact OD1-CG 3.27Å; D180-R182 PolarHBondContact OD1-N 3.01Å; D180-R182 IonicContact OD1-NE 3.78Å; D180-R182 PolarHBondContact OD1-NE 3.13Å; D180-R182 IonicContact OD2-CZ 3.2Å; D180-R182 IonicContact OD2-NE 3.77Å; D180-R182 PolarHBondContact OD2-NE 3.44Å; D180-R182 IonicContact OD2-NH2 2.66Å; D180-R182 PolarHBondContact OD2-NH2 3.26Å; R182-W186 VanDerWaalsContact O-CB 3.28Å; R182-W186 WeakPolarHBondContact O-CB 3.33Å; R182-W186 PolarHBondContact O-N 3.39Å
183	H	98.3	Very high	97.3	Very high	9 Å²	9	63.4 Å²	63.4	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-71.8	-34.7	177.4	-65.5	-90	0	0	0	112.4	H134 V172 Y176 D180 R181 V187	H134-H183 AromaticContact CE1-CE1 3.89Å; H134-H183 AromaticContact CE1-ND1 3.24Å; H134-H183 PolarHBondContact CE1-ND1 3.35Å; H134-H183 AromaticContact NE2-CE1 3.77Å; H134-H183 AromaticContact NE2-CG 3.85Å; H134-H183 AromaticContact NE2-ND1 2.85Å; H134-H183 PolarHBondContact NE2-ND1 3.32Å; V172-H183 HydrophobicContact CG1-CB 3.99Å; Y176-H183 HydrophobicContact CD1-CB 4.28Å; Y176-H183 AromaticContact CD1-CD2 3.42Å; Y176-H183 VanDerWaalsContact CD1-CD2 3.42Å; Y176-H183 WeakPolarHBondContact CD1-CD2 3.12Å; Y176-H183 AromaticContact CD1-CG 3.66Å; Y176-H183 AromaticContact CD1-NE2 3.69Å; Y176-H183 HydrophobicContact CD2-CB 4.3Å; Y176-H183 AromaticContact CE1-CD2 3.92Å; Y176-H183 AromaticContact CE1-CE1 3.82Å; Y176-H183 AromaticContact CE1-NE2 3.67Å; Y176-H183 HydrophobicContact CG-CB 3.8Å; Y176-H183 AromaticContact CG-CD2 3.86Å; Y176-H183 AromaticContact CG-CG 3.62Å; D180-H183 PolarHBondContact O-N 3.26Å; D180-H183 IonicContact OD2-CD2 3.33Å; D180-H183 IonicContact OD2-NE2 2.82Å; R181-H183 PolarHBondContact O-N 3.01Å; H183-V187 WeakPolarHBondContact O-CG2 3.27Å; H183-V187 PolarHBondContact O-N 3.47Å
184	V	98.3	Very high	97.3	Very high	23 Å²	23	61.5 Å²	61.5	14%	0.139	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-48.2	174.6	-178.6	0	0	0	0	110.2	L173 K177 R181 W186 V187 H188	L173-V184 HydrophobicContact CD2-CB 4.19Å; L173-V184 HydrophobicContact CD2-CG1 3.92Å; L173-V184 HydrophobicContact CD2-CG2 4.08Å; K177-V184 HydrophobicContact CB-CG2 4.16Å; R181-V184 WeakPolarHBondContact O-CA 3.34Å; R181-V184 WeakPolarHBondContact O-CB 3.44Å; R181-V184 PolarHBondContact O-N 3.4Å; V184-W186 VanDerWaalsContact C-N 3.29Å; V184-W186 PolarHBondContact O-N 2.94Å; V184-V187 PolarHBondContact O-N 3.22Å; V184-H188 PolarHBondContact O-CD2 3.45Å; V184-H188 PolarHBondContact O-N 3.3Å; V184-H188 VanDerWaalsContact O-N 3.08Å
185	D	97.8	Very high	97.3	Very high	65 Å²	65	56.8 Å²	56.8	35%	0.348	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-38.8	178.1	-63.8	-24.1	0	0	0	110.5	R181 H188 A189	R181-D185 IonicContact NE-OD1 2.65Å; R181-D185 IonicContact NE-OD2 3.79Å; R181-D185 PolarHBondContact O-N 3.19Å; D185-H188 PolarHBondContact O-N 2.87Å; D185-A189 WeakPolarHBondContact O-CB 3.41Å; D185-A189 PolarHBondContact O-N 3.3Å
186	W	98.8	Very high	97.3	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-45.6	172.3	-179.6	90.3	0	0	0	113.1	Y62 C65 S66 I69 V73 H134 A137 V138 T169 R182 V184 H188 A189 Y190	Y62-W186 AromaticContact CD2-NE1 3.69Å; Y62-W186 AromaticContact CE2-CE2 3.54Å; Y62-W186 AromaticContact CE2-CZ2 3.72Å; Y62-W186 HydrophobicContact CE2-CZ2 3.72Å; Y62-W186 AromaticContact CE2-NE1 3.19Å; C65-W186 HydrophobicContact CB-CB 3.87Å; C65-W186 HydrophobicContact CB-CG 4.35Å; S66-W186 VanDerWaalsContact OG-CD1 3.24Å; S66-W186 PolarHBondContact OG-NE1 3.21Å; I69-W186 HydrophobicContact CD1-CB 3.61Å; I69-W186 HydrophobicContact CD1-CD2 4.36Å; I69-W186 HydrophobicContact CD1-CG 3.64Å; V73-W186 HydrophobicContact CG1-CZ2 4.28Å; H134-W186 HydrophobicContact CB-CH2 3.69Å; H134-W186 HydrophobicContact CB-CZ2 4.01Å; H134-W186 HydrophobicContact CB-CZ3 4.12Å; H134-W186 AromaticContact CD2-CD2 3.76Å; H134-W186 AromaticContact CD2-CE3 3.42Å; H134-W186 VanDerWaalsContact CD2-CE3 3.42Å; H134-W186 AromaticContact CD2-CH2 3.83Å; H134-W186 AromaticContact CD2-CZ3 3.46Å; H134-W186 VanDerWaalsContact CD2-CZ3 3.46Å; H134-W186 WeakPolarHBondContact CD2-CZ3 3.45Å; A137-W186 HydrophobicContact CB-CH2 4.19Å; V138-W186 HydrophobicContact CG2-CH2 4.28Å; V138-W186 HydrophobicContact CG2-CZ2 4.05Å; T169-W186 HydrophobicContact CG2-CZ3 4.15Å; R182-W186 VanDerWaalsContact O-CB 3.28Å; R182-W186 WeakPolarHBondContact O-CB 3.33Å; R182-W186 PolarHBondContact O-N 3.39Å; V184-W186 VanDerWaalsContact C-N 3.29Å; V184-W186 PolarHBondContact O-N 2.94Å; W186-H188 PolarHBondContact O-N 3.18Å; W186-A189 PolarHBondContact O-N 3.4Å; W186-Y190 WeakPolarHBondContact O-CB 3.38Å; W186-Y190 PolarHBondContact O-N 3.5Å
187	V	98.8	Very high	97.3	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-48.5	177.3	162.7	0	0	0	0	110.5	T169 V172 L173 H183 V184 Y190 L191	T169-V187 HydrophobicContact CG2-CB 4.49Å; T169-V187 HydrophobicContact CG2-CG1 4.14Å; T169-V187 HydrophobicContact CG2-CG2 4.02Å; V172-V187 HydrophobicContact CB-CG2 3.92Å; V172-V187 HydrophobicContact CG1-CG2 3.71Å; L173-V187 HydrophobicContact CD1-CG1 4.01Å; L173-V187 HydrophobicContact CD2-CB 4.05Å; L173-V187 HydrophobicContact CD2-CG1 4.05Å; L173-V187 HydrophobicContact CD2-CG2 4.15Å; L173-V187 HydrophobicContact CG-CB 4.35Å; L173-V187 HydrophobicContact CG-CG1 3.98Å; L173-V187 HydrophobicContact CG-CG2 4.2Å; H183-V187 WeakPolarHBondContact O-CG2 3.27Å; H183-V187 PolarHBondContact O-N 3.47Å; V184-V187 PolarHBondContact O-N 3.22Å; V187-Y190 PolarHBondContact O-N 3.12Å; V187-L191 HydrophobicContact CG1-CD1 3.93Å; V187-L191 WeakPolarHBondContact O-CG 3.49Å; V187-L191 PolarHBondContact O-N 3.43Å
188	H	98.1	Very high	97.4	Very high	113 Å²	113	51.1 Å²	51.1	52%	0.523	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-43.1	179.7	-68	-51.5	0	0	0	112.1	V184 D185 W186 S192	V184-H188 PolarHBondContact O-CD2 3.45Å; V184-H188 PolarHBondContact O-N 3.3Å; V184-H188 VanDerWaalsContact O-N 3.08Å; D185-H188 PolarHBondContact O-N 2.87Å; W186-H188 PolarHBondContact O-N 3.18Å; H188-S192 WeakPolarHBondContact O-CB 3.37Å; H188-S192 PolarHBondContact O-N 3.17Å
189	A	98.2	Very high	97.3	Very high	11 Å²	11	45.4 Å²	45.4	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-43.9	177.6	0	0	0	0	0	111.8	D61 D185 W186 S192 I193	D61-A189 HydrophobicContact CB-CB 4.27Å; D185-A189 WeakPolarHBondContact O-CB 3.41Å; D185-A189 PolarHBondContact O-N 3.3Å; W186-A189 PolarHBondContact O-N 3.4Å; A189-S192 WeakPolarHBondContact O-CB 3.33Å; A189-S192 PolarHBondContact O-N 3.44Å; A189-I193 PolarHBondContact O-N 3.5Å
190	Y	98.7	Very high	97.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-47.8	-179.9	-172.1	-116.4	0	0	0	112.7	Y62 A137 V138 S141 A165 W186 V187 S192 I193 W194	Y62-Y190 AromaticContact CD2-CD2 3.57Å; Y62-Y190 HydrophobicContact CD2-CD2 3.57Å; Y62-Y190 HydrophobicContact CD2-CG 4.09Å; Y62-Y190 HydrophobicContact CE1-CD2 4.29Å; Y62-Y190 AromaticContact CE2-CD2 3.25Å; Y62-Y190 HydrophobicContact CE2-CD2 3.25Å; Y62-Y190 HydrophobicContact CE2-CE2 4.05Å; Y62-Y190 AromaticContact CE2-CG 3.88Å; Y62-Y190 HydrophobicContact CE2-CG 3.88Å; Y62-Y190 HydrophobicContact CG-CD2 4.19Å; Y62-Y190 AromaticContact CZ-CD2 3.67Å; A137-Y190 HydrophobicContact CB-CE1 4.49Å; V138-Y190 WeakPolarHBondContact CA-OH 3.43Å; V138-Y190 HydrophobicContact CG2-CD2 4.49Å; V138-Y190 HydrophobicContact CG2-CE1 4.2Å; V138-Y190 HydrophobicContact CG2-CE2 3.91Å; S141-Y190 PolarHBondContact OG-OH 2.99Å; A165-Y190 HydrophobicContact CB-CD1 4.45Å; A165-Y190 HydrophobicContact CB-CE1 3.99Å; W186-Y190 WeakPolarHBondContact O-CB 3.38Å; W186-Y190 PolarHBondContact O-N 3.5Å; V187-Y190 PolarHBondContact O-N 3.12Å; Y190-S192 PolarHBondContact O-N 3.44Å; Y190-I193 HydrophobicContact CD2-CD1 4.14Å; Y190-I193 WeakPolarHBondContact O-CB 3.45Å; Y190-I193 PolarHBondContact O-N 3.28Å; Y190-W194 AromaticContact CE1-NE1 3.46Å; Y190-W194 HydrophobicContact CE2-CZ2 4.36Å; Y190-W194 AromaticContact CE2-NE1 3.99Å; Y190-W194 AromaticContact CZ-CE2 3.97Å; Y190-W194 AromaticContact CZ-NE1 3.35Å; Y190-W194 WeakPolarHBondContact OH-CZ2 3.45Å; Y190-W194 PolarHBondContact OH-NE1 2.85Å
191	L	98.3	Very high	97.2	Very high	31 Å²	31	37.6 Å²	37.6	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-26	179	-63.3	177	0	0	0	112.5	N162 A165 T169 V187 I193 W194 T195	N162-L191 VanDerWaalsContact OD1-CD2 3.29Å; N162-L191 WeakPolarHBondContact OD1-CD2 3.28Å; A165-L191 HydrophobicContact CB-CD2 3.75Å; T169-L191 HydrophobicContact CG2-CD2 4.32Å; T169-L191 HydrophobicContact CG2-CG 4.48Å; V187-L191 HydrophobicContact CG1-CD1 3.93Å; V187-L191 WeakPolarHBondContact O-CG 3.49Å; V187-L191 PolarHBondContact O-N 3.43Å; L191-I193 VanDerWaalsContact C-N 3.31Å; L191-I193 PolarHBondContact O-N 3.13Å; L191-W194 PolarHBondContact O-N 3.45Å; L191-T195 PolarHBondContact O-N 3.21Å; L191-T195 VanDerWaalsContact O-N 3.11Å; L191-T195 PolarHBondContact O-OG1 3.07Å
192	S	97.8	Very high	97	Very high	41 Å²	41	38.9 Å²	38.9	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-62.6	-37.3	174.7	-171.4	0	0	0	0	111.9	H188 A189 Y190 W194 T195 E196	H188-S192 WeakPolarHBondContact O-CB 3.37Å; H188-S192 PolarHBondContact O-N 3.17Å; A189-S192 WeakPolarHBondContact O-CB 3.33Å; A189-S192 PolarHBondContact O-N 3.44Å; Y190-S192 PolarHBondContact O-N 3.44Å; S192-W194 VanDerWaalsContact C-N 3.3Å; S192-W194 PolarHBondContact O-N 3.48Å; S192-T195 PolarHBondContact O-N 3.08Å; S192-T195 VanDerWaalsContact O-N 3.16Å; S192-E196 WeakPolarHBondContact O-CG 3.41Å; S192-E196 PolarHBondContact O-N 3.11Å
193	I	98.3	Very high	96.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-53.4	-49.1	176	-62.8	171.4	0	0	0	110.6	L54 P58 L59 Y62 L84 A189 Y190 L191 M197	L54-I193 HydrophobicContact CD2-CG2 4.34Å; P58-I193 HydrophobicContact CB-CG1 3.94Å; L59-I193 HydrophobicContact CD1-CD1 4.14Å; Y62-I193 HydrophobicContact CD1-CD1 3.86Å; Y62-I193 HydrophobicContact CG-CD1 3.82Å; L84-I193 HydrophobicContact CD1-CG2 4.26Å; A189-I193 PolarHBondContact O-N 3.5Å; Y190-I193 HydrophobicContact CD2-CD1 4.14Å; Y190-I193 WeakPolarHBondContact O-CB 3.45Å; Y190-I193 PolarHBondContact O-N 3.28Å; L191-I193 VanDerWaalsContact C-N 3.31Å; L191-I193 PolarHBondContact O-N 3.13Å; I193-M197 VanDerWaalsContact O-CB 3.28Å; I193-M197 WeakPolarHBondContact O-CB 3.43Å; I193-M197 PolarHBondContact O-N 3Å
194	W	97.8	Very high	96.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-75.3	-27.7	-177.5	-54	126.3	0	0	0	113.5	S141 I142 A144 L145 V158 N162 Y190 L191 S192 Q198	S141-W194 PolarHBondContact OG-NE1 2.9Å; I142-W194 HydrophobicContact CD1-CH2 4.13Å; I142-W194 HydrophobicContact CD1-CZ2 4.42Å; A144-W194 HydrophobicContact CB-CD2 4.35Å; A144-W194 HydrophobicContact CB-CE3 3.68Å; A144-W194 HydrophobicContact CB-CH2 3.86Å; A144-W194 HydrophobicContact CB-CZ2 4.48Å; A144-W194 HydrophobicContact CB-CZ3 3.42Å; A144-W194 VanDerWaalsContact CB-CZ3 3.42Å; L145-W194 HydrophobicContact CD2-CH2 4.26Å; L145-W194 HydrophobicContact CD2-CZ3 4.17Å; L145-W194 HydrophobicContact CG-CH2 4.38Å; V158-W194 HydrophobicContact CG1-CB 4.48Å; V158-W194 HydrophobicContact CG1-CE3 4.35Å; N162-W194 HydrophobicContact CB-CB 3.78Å; N162-W194 HydrophobicContact CB-CG 4.32Å; N162-W194 WeakPolarHBondContact OD1-CB 3.35Å; Y190-W194 AromaticContact CE1-NE1 3.46Å; Y190-W194 HydrophobicContact CE2-CZ2 4.36Å; Y190-W194 AromaticContact CE2-NE1 3.99Å; Y190-W194 AromaticContact CZ-CE2 3.97Å; Y190-W194 AromaticContact CZ-NE1 3.35Å; Y190-W194 WeakPolarHBondContact OH-CZ2 3.45Å; Y190-W194 PolarHBondContact OH-NE1 2.85Å; L191-W194 PolarHBondContact O-N 3.45Å; S192-W194 VanDerWaalsContact C-N 3.3Å; S192-W194 PolarHBondContact O-N 3.48Å; W194-Q198 WeakPolarHBondContact O-CG 3.46Å; W194-Q198 PolarHBondContact O-N 3.44Å; W194-Q198 VanDerWaalsContact O-N 3.11Å; W194-Q198 PolarHBondContact O-NE2 2.96Å
195	T	96.3	Very high	96.1	Very high	65 Å²	65	41.4 Å²	41.4	40%	0.399	21%	0.209	S	C	.	.	H	α-helix	trans	-69.6	-47.2	174.3	-56.2	0	0	0	0	110.3	L191 S192 Q198 S199	L191-T195 PolarHBondContact O-N 3.21Å; L191-T195 VanDerWaalsContact O-N 3.11Å; L191-T195 PolarHBondContact O-OG1 3.07Å; S192-T195 PolarHBondContact O-N 3.08Å; S192-T195 VanDerWaalsContact O-N 3.16Å; T195-Q198 WeakPolarHBondContact O-CB 3.49Å; T195-Q198 PolarHBondContact O-N 2.84Å; T195-S199 PolarHBondContact O-N 3.34Å; T195-S199 VanDerWaalsContact O-N 3.09Å; T195-S199 PolarHBondContact O-OG 3.14Å
196	E	95.8	Very high	95.7	Very high	86 Å²	86	42.6 Å²	42.6	40%	0.402	22%	0.219	S	C	.	.	H	α-helix	trans	-68	-35.2	175.9	-66.9	-54.1	144.9	0	0	112	L54 P58 S192 Q198 S199 F200	L54-E196 HydrophobicContact CD1-CB 4.09Å; L54-E196 HydrophobicContact CG-CB 4.39Å; P58-E196 HydrophobicContact CG-CB 4.13Å; P58-E196 HydrophobicContact CG-CG 3.65Å; S192-E196 WeakPolarHBondContact O-CG 3.41Å; S192-E196 PolarHBondContact O-N 3.11Å; E196-Q198 VanDerWaalsContact C-N 3.33Å; E196-Q198 PolarHBondContact O-N 3.37Å; E196-S199 WeakPolarHBondContact O-CB 3.49Å; E196-S199 PolarHBondContact O-N 3.49Å; E196-F200 WeakPolarHBondContact O-CB 3.31Å; E196-F200 PolarHBondContact O-N 2.94Å
197	M	97	Very high	95.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-42.7	172.2	-173.5	70.8	70.4	0	0	111.7	F51 L54 L84 L145 V158 I193 F200 I201	F51-M197 HydrophobicContact CE2-CE 3.7Å; F51-M197 HydrophobicContact CE2-SD 3.88Å; F51-M197 HydrophobicContact CZ-CE 4.12Å; L54-M197 HydrophobicContact CD1-CB 4.05Å; L54-M197 HydrophobicContact CD1-CE 4.05Å; L54-M197 HydrophobicContact CD1-SD 4.37Å; L84-M197 HydrophobicContact CD2-CE 3.79Å; L145-M197 HydrophobicContact CD2-CE 4.47Å; V158-M197 HydrophobicContact CG1-CB 4.26Å; V158-M197 HydrophobicContact CG1-CG 4.08Å; V158-M197 HydrophobicContact CG2-CG 4.4Å; I193-M197 VanDerWaalsContact O-CB 3.28Å; I193-M197 WeakPolarHBondContact O-CB 3.43Å; I193-M197 PolarHBondContact O-N 3Å; M197-F200 PolarHBondContact O-N 3.13Å; M197-F200 HydrophobicContact SD-CD1 4.3Å; M197-I201 HydrophobicContact CG-CD1 3.88Å; M197-I201 WeakPolarHBondContact O-CB 3.47Å; M197-I201 WeakPolarHBondContact O-CD1 3.35Å; M197-I201 VanDerWaalsContact O-CG1 3.22Å; M197-I201 WeakPolarHBondContact O-CG1 3.4Å; M197-I201 PolarHBondContact O-N 3.2Å; M197-I201 HydrophobicContact SD-CD1 4.44Å
198	Q	95.4	Very high	94.9	Very high	46 Å²	46	47.7 Å²	47.7	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-42.4	175	-76.3	169.8	78	0	0	111.9	V158 W194 T195 E196 I201 K202	V158-Q198 HydrophobicContact CB-CG 4.04Å; V158-Q198 HydrophobicContact CG1-CG 3.82Å; W194-Q198 WeakPolarHBondContact O-CG 3.46Å; W194-Q198 PolarHBondContact O-N 3.44Å; W194-Q198 VanDerWaalsContact O-N 3.11Å; W194-Q198 PolarHBondContact O-NE2 2.96Å; T195-Q198 WeakPolarHBondContact O-CB 3.49Å; T195-Q198 PolarHBondContact O-N 2.84Å; E196-Q198 VanDerWaalsContact C-N 3.33Å; E196-Q198 PolarHBondContact O-N 3.37Å; Q198-I201 PolarHBondContact O-N 3.49Å; Q198-K202 VanDerWaalsContact O-CB 3.26Å; Q198-K202 WeakPolarHBondContact O-CB 3.38Å; Q198-K202 PolarHBondContact O-N 3.34Å
199	S	94.2	Very high	94.7	Very high	44 Å²	44	43.3 Å²	43.3	31%	0.308	23%	0.233	S	C	.	.	H	α-helix	trans	-60.1	-46.6	175.3	-67.7	0	0	0	0	111.5	T195 E196 K202 Q203	T195-S199 PolarHBondContact O-N 3.34Å; T195-S199 VanDerWaalsContact O-N 3.09Å; T195-S199 PolarHBondContact O-OG 3.14Å; E196-S199 WeakPolarHBondContact O-CB 3.49Å; E196-S199 PolarHBondContact O-N 3.49Å; S199-K202 PolarHBondContact O-N 3.04Å; S199-Q203 VanDerWaalsContact O-CG 3.31Å; S199-Q203 WeakPolarHBondContact O-CG 3.43Å; S199-Q203 PolarHBondContact O-N 3.47Å
200	F	94.6	Very high	94.4	Very high	7 Å²	7	45.1 Å²	45.1	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-52	175.9	170.1	-108.6	0	0	0	111.9	S47 V50 F51 L91 W147 E196 M197 K202 Q203 H204 H205	S47-F200 VanDerWaalsContact O-CE2 3.23Å; S47-F200 WeakPolarHBondContact O-CE2 3.22Å; S47-F200 WeakPolarHBondContact OG-CE2 3.45Å; S47-F200 WeakPolarHBondContact OG-CZ 3.5Å; V50-F200 HydrophobicContact CB-CD2 4.33Å; V50-F200 HydrophobicContact CB-CE2 4.47Å; V50-F200 HydrophobicContact CG1-CD2 3.86Å; V50-F200 HydrophobicContact CG1-CE2 4.48Å; F51-F200 HydrophobicContact CB-CE2 4.19Å; F51-F200 HydrophobicContact CB-CZ 4.19Å; F51-F200 AromaticContact CD2-CD1 3.97Å; F51-F200 HydrophobicContact CD2-CD1 3.97Å; F51-F200 AromaticContact CD2-CE1 3.75Å; F51-F200 HydrophobicContact CD2-CE1 3.75Å; F51-F200 HydrophobicContact CD2-CG 4.44Å; F51-F200 HydrophobicContact CD2-CZ 4.06Å; F51-F200 HydrophobicContact CE2-CE1 4.41Å; L91-F200 HydrophobicContact CD1-CE1 3.99Å; L91-F200 HydrophobicContact CD1-CZ 4.14Å; W147-F200 HydrophobicContact CH2-CE1 4.17Å; W147-F200 HydrophobicContact CZ2-CD1 4.38Å; W147-F200 AromaticContact CZ2-CE1 3.88Å; W147-F200 HydrophobicContact CZ2-CE1 3.88Å; E196-F200 WeakPolarHBondContact O-CB 3.31Å; E196-F200 PolarHBondContact O-N 2.94Å; M197-F200 PolarHBondContact O-N 3.13Å; M197-F200 HydrophobicContact SD-CD1 4.3Å; F200-K202 VanDerWaalsContact C-N 3.3Å; F200-K202 PolarHBondContact O-N 3.06Å; F200-Q203 PolarHBondContact O-N 3.06Å; F200-Q203 VanDerWaalsContact O-N 3.16Å; F200-H204 AromaticContact CD2-CD2 3.65Å; F200-H204 HydrophobicContact CE2-CB 4.29Å; F200-H204 AromaticContact CE2-CD2 3.76Å; F200-H204 PolarHBondContact O-CD2 3.45Å; F200-H204 PolarHBondContact O-N 3.42Å; F200-H205 AromaticContact CE1-CD2 3.6Å; F200-H205 AromaticContact CE1-NE2 3.96Å; F200-H205 AromaticContact CZ-CD2 3.59Å; F200-H205 AromaticContact CZ-NE2 3.55Å
201	I	95.3	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-42.1	178.6	-68.7	165.8	0	0	0	110.7	W147 P154 V158 M197 Q198 Q203 H205 T206	W147-I201 HydrophobicContact CB-CD1 4.16Å; W147-I201 HydrophobicContact CD2-CD1 3.45Å; W147-I201 VanDerWaalsContact CD2-CD1 3.45Å; W147-I201 HydrophobicContact CD2-CG1 3.79Å; W147-I201 HydrophobicContact CE3-CD1 3.85Å; W147-I201 HydrophobicContact CE3-CG1 3.84Å; W147-I201 HydrophobicContact CE3-CG2 4.48Å; W147-I201 HydrophobicContact CG-CD1 3.59Å; W147-I201 HydrophobicContact CG-CG1 4.44Å; W147-I201 HydrophobicContact CH2-CG1 4.08Å; W147-I201 HydrophobicContact CZ2-CD1 4.43Å; W147-I201 HydrophobicContact CZ2-CG1 4Å; W147-I201 HydrophobicContact CZ3-CG1 4Å; P154-I201 HydrophobicContact CB-CG2 3.82Å; P154-I201 HydrophobicContact CG-CG2 3.59Å; V158-I201 HydrophobicContact CB-CD1 4.38Å; V158-I201 HydrophobicContact CG2-CD1 3.56Å; M197-I201 HydrophobicContact CG-CD1 3.88Å; M197-I201 WeakPolarHBondContact O-CB 3.47Å; M197-I201 WeakPolarHBondContact O-CD1 3.35Å; M197-I201 VanDerWaalsContact O-CG1 3.22Å; M197-I201 WeakPolarHBondContact O-CG1 3.4Å; M197-I201 PolarHBondContact O-N 3.2Å; M197-I201 HydrophobicContact SD-CD1 4.44Å; Q198-I201 PolarHBondContact O-N 3.49Å; I201-Q203 VanDerWaalsContact C-N 3.28Å; I201-Q203 PolarHBondContact O-N 3.44Å; I201-H205 HydrophobicContact CG2-CB 4.35Å; I201-H205 CarbonylContact O-C 3.56Å; I201-H205 VanDerWaalsContact O-CA 3.27Å; I201-H205 WeakPolarHBondContact O-CA 3.05Å; I201-H205 PolarHBondContact O-N 3.08Å; I201-T206 PolarHBondContact O-N 2.92Å
202	K	92.6	Very high	93.6	Very high	160 Å²	160	45.6 Å²	45.6	70%	0.696	25%	0.249	S	C	*	.	H	α-helix	trans	-61.7	-37.9	179	-175.9	178.6	177.2	-175.5	0	111.8	Q198 S199 F200 T206	Q198-K202 VanDerWaalsContact O-CB 3.26Å; Q198-K202 WeakPolarHBondContact O-CB 3.38Å; Q198-K202 PolarHBondContact O-N 3.34Å; S199-K202 PolarHBondContact O-N 3.04Å; F200-K202 VanDerWaalsContact C-N 3.3Å; F200-K202 PolarHBondContact O-N 3.06Å; K202-T206 PolarHBondContact O-OG1 3.38Å
203	Q	91.1	Very high	93	Very high	133 Å²	133	52.3 Å²	52.3	62%	0.621	27%	0.273	S	S	*	.	H	α-helix	trans	-79.4	-39.4	-177.2	-69.8	175.4	37.7	0	0	113.1	S199 F200 I201	S199-Q203 VanDerWaalsContact O-CG 3.31Å; S199-Q203 WeakPolarHBondContact O-CG 3.43Å; S199-Q203 PolarHBondContact O-N 3.47Å; F200-Q203 PolarHBondContact O-N 3.06Å; F200-Q203 VanDerWaalsContact O-N 3.16Å; I201-Q203 VanDerWaalsContact C-N 3.28Å; I201-Q203 PolarHBondContact O-N 3.44Å
204	H	90.4	Very high	91.8	Very high	55 Å²	55	56.6 Å²	56.6	26%	0.255	30%	0.299	S	S	.	.	H	α-helix	trans	-115.3	-21.4	-169.5	-59.8	-78.1	0	0	0	114.6	F200	F200-H204 AromaticContact CD2-CD2 3.65Å; F200-H204 HydrophobicContact CE2-CB 4.29Å; F200-H204 AromaticContact CE2-CD2 3.76Å; F200-H204 PolarHBondContact O-CD2 3.45Å; F200-H204 PolarHBondContact O-N 3.42Å
205	H	92.2	Very high	90.7	Very high	11 Å²	11	59.1 Å²	59.1	5%	0.051	33%	0.325	C	S	.	.			trans	-139.9	38.6	-167.6	-59.5	-60	0	0	0	113	S47 W147 P154 F200 I201 T207 G208 A210	S47-H205 PolarHBondContact OG-NE2 2.81Å; S47-H205 VanDerWaalsContact OG-NE2 3.14Å; W147-H205 HydrophobicContact CH2-CB 3.89Å; W147-H205 AromaticContact CH2-CD2 3.48Å; W147-H205 VanDerWaalsContact CH2-CD2 3.48Å; W147-H205 WeakPolarHBondContact CH2-CD2 3.39Å; W147-H205 AromaticContact CH2-CG 3.69Å; W147-H205 HydrophobicContact CZ3-CB 3.62Å; W147-H205 AromaticContact CZ3-CG 3.91Å; P154-H205 VanDerWaalsContact CG-O 3.27Å; P154-H205 WeakPolarHBondContact CG-O 3.47Å; F200-H205 AromaticContact CE1-CD2 3.6Å; F200-H205 AromaticContact CE1-NE2 3.96Å; F200-H205 AromaticContact CZ-CD2 3.59Å; F200-H205 AromaticContact CZ-NE2 3.55Å; I201-H205 HydrophobicContact CG2-CB 4.35Å; I201-H205 CarbonylContact O-C 3.56Å; I201-H205 VanDerWaalsContact O-CA 3.27Å; I201-H205 WeakPolarHBondContact O-CA 3.05Å; I201-H205 PolarHBondContact O-N 3.08Å; H205-T207 VanDerWaalsContact C-N 3.27Å; H205-T207 PolarHBondContact O-N 3.16Å; H205-T207 VanDerWaalsContact O-N 3.12Å; H205-G208 CarbonylContact C-O 3.56Å; H205-G208 WeakPolarHBondContact CA-O 3.48Å; H205-G208 WeakPolarHBondContact CB-O 3.46Å; H205-G208 PolarHBondContact O-N 3.38Å; H205-G208 VanDerWaalsContact O-N 3.15Å; H205-A210 WeakPolarHBondContact ND1-CB 3.41Å; H205-A210 PolarHBondContact ND1-N 2.87Å
206	T	90.1	Very high	89.8	Confident	89 Å²	89	61.3 Å²	61.3	55%	0.546	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-41.3	-168.2	-49.5	0	0	0	0	113.8	I201 K202	I201-T206 PolarHBondContact O-N 2.92Å; K202-T206 PolarHBondContact O-OG1 3.38Å
207	T	90.7	Very high	89.1	Confident	97 Å²	97	59.6 Å²	59.6	60%	0.595	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	13.9	-174.4	54.3	0	0	0	0	113.4	Q152 H205	Q152-T207 WeakPolarHBondContact CA-O 3.35Å; Q152-T207 PolarHBondContact N-O 3.3Å; H205-T207 VanDerWaalsContact C-N 3.27Å; H205-T207 PolarHBondContact O-N 3.16Å; H205-T207 VanDerWaalsContact O-N 3.12Å
208	G	90.4	Very high	88.3	Confident	12 Å²	12	59.6 Å²	59.6	12%	0.124	33%	0.331	C	S	.	.	S	Bend	trans	132.1	170	-172.6	0	0	0	0	0	110.9	H205 A210	H205-G208 CarbonylContact C-O 3.56Å; H205-G208 WeakPolarHBondContact CA-O 3.48Å; H205-G208 WeakPolarHBondContact CB-O 3.46Å; H205-G208 PolarHBondContact O-N 3.38Å; H205-G208 VanDerWaalsContact O-N 3.15Å; G208-A210 PolarHBondContact O-N 3.41Å
209	L	93.3	Very high	87.5	Confident	21 Å²	21	59.7 Å²	59.7	11%	0.11	34%	0.337	C	S	.	.			trans	-56.5	132.4	174	-179.7	64.2	0	0	0	110.3	F90 L91 A94 W147 V148 W211	F90-L209 HydrophobicContact CD1-CD2 4.29Å; F90-L209 HydrophobicContact CE1-CD2 3.49Å; F90-L209 VanDerWaalsContact CE1-CD2 3.49Å; F90-L209 HydrophobicContact CZ-CD2 4.32Å; L91-L209 HydrophobicContact CD2-CD1 3.48Å; L91-L209 VanDerWaalsContact CD2-CD1 3.48Å; A94-L209 HydrophobicContact CB-CD1 4.25Å; A94-L209 HydrophobicContact CB-CD2 3.87Å; A94-L209 HydrophobicContact CB-CG 4.21Å; W147-L209 HydrophobicContact CH2-CD1 4.06Å; W147-L209 HydrophobicContact CZ3-CB 4.45Å; W147-L209 HydrophobicContact CZ3-CD1 4.4Å; V148-L209 HydrophobicContact CB-CD2 4.23Å; V148-L209 HydrophobicContact CG1-CD1 4.44Å; V148-L209 HydrophobicContact CG1-CD2 4.42Å; L209-W211 HydrophobicContact CD2-CD2 4.5Å; L209-W211 HydrophobicContact CD2-CH2 4.5Å; L209-W211 HydrophobicContact CD2-CZ2 3.79Å
210	A	92.1	Very high	86.3	Confident	50 Å²	50	61.1 Å²	61.1	41%	0.413	34%	0.344	S	S	.	.			trans	-93.1	115.6	176.9	0	0	0	0	0	107.9	H205 G208	H205-A210 WeakPolarHBondContact ND1-CB 3.41Å; H205-A210 PolarHBondContact ND1-N 2.87Å; G208-A210 PolarHBondContact O-N 3.41Å
211	W	92.3	Very high	84.9	Confident	34 Å²	34	68.2 Å²	68.2	13%	0.129	38%	0.375	C	S	.	.			trans	-89.7	154.8	173.2	-62.6	86.7	0	0	0	110.3	F90 A94 E99 P100 L105 L209 A218	F90-W211 HydrophobicContact CE1-CH2 4.49Å; F90-W211 AromaticContact CZ-CH2 3.91Å; F90-W211 HydrophobicContact CZ-CH2 3.91Å; F90-W211 HydrophobicContact CZ-CZ2 4.17Å; A94-W211 HydrophobicContact CB-CD2 4.15Å; A94-W211 HydrophobicContact CB-CE3 3.81Å; A94-W211 HydrophobicContact CB-CH2 4.46Å; A94-W211 HydrophobicContact CB-CZ3 3.98Å; A94-W211 CarbonylContact O-C 3.51Å; A94-W211 WeakPolarHBondContact O-CA 3.41Å; E99-W211 HydrophobicContact CB-CB 4.07Å; E99-W211 HydrophobicContact CB-CD2 3.89Å; E99-W211 HydrophobicContact CB-CG 3.61Å; E99-W211 HydrophobicContact CG-CD2 4.22Å; E99-W211 HydrophobicContact CG-CG 4.17Å; P100-W211 VanDerWaalsContact CD-CH2 3.46Å; P100-W211 HydrophobicContact CG-CH2 4.02Å; P100-W211 HydrophobicContact CG-CZ3 4.34Å; L105-W211 HydrophobicContact CD1-CH2 3.86Å; L105-W211 HydrophobicContact CD1-CZ2 3.57Å; L209-W211 HydrophobicContact CD2-CD2 4.5Å; L209-W211 HydrophobicContact CD2-CH2 4.5Å; L209-W211 HydrophobicContact CD2-CZ2 3.79Å; W211-A218 HydrophobicContact CZ3-CB 3.98Å
212	S	88.4	Confident	82.6	Confident	6 Å²	6	73 Å²	73	4%	0.042	41%	0.406	C	S	.	.			trans	-61	143.1	172.7	-171.9	0	0	0	0	110.1	E44 A94 S95 H97 Q98 T214	E44-S212 VanDerWaalsContact CD-OG 3.31Å; E44-S212 PolarHBondContact OE1-OG 2.77Å; E44-S212 PolarHBondContact OE2-OG 2.81Å; A94-S212 PolarHBondContact O-N 3.49Å; S95-S212 WeakPolarHBondContact O-CB 3.47Å; H97-S212 PolarHBondContact O-N 3.39Å; H97-S212 VanDerWaalsContact O-N 3.12Å; Q98-S212 WeakPolarHBondContact CA-O 3.38Å; S212-T214 VanDerWaalsContact C-N 3.28Å; S212-T214 WeakPolarHBondContact CB-O 3.46Å; S212-T214 PolarHBondContact OG-N 3.24Å; S212-T214 PolarHBondContact OG-O 2.86Å; S212-T214 PolarHBondContact OG-OG1 3.36Å
213	K	85.4	Confident	80.2	Confident	182 Å²	182	70.4 Å²	70.4	79%	0.791	40%	0.399	S	S	*	.	S	Bend	trans	-83.1	-13.3	174.5	-65.4	-178.7	-178.5	175.3	0	111.9	Q98	Q98-K213 PolarHBondContact NE2-O 3.39Å
214	T	73.1	Confident	77.8	Confident	91 Å²	91	73.2 Å²	73.2	56%	0.558	41%	0.41	S	S	*	.	S	Bend	trans	-122.9	158.6	-176.4	45.5	0	0	0	0	110.1	S212	S212-T214 VanDerWaalsContact C-N 3.28Å; S212-T214 WeakPolarHBondContact CB-O 3.46Å; S212-T214 PolarHBondContact OG-N 3.24Å; S212-T214 PolarHBondContact OG-O 2.86Å; S212-T214 PolarHBondContact OG-OG1 3.36Å
215	G	73	Confident	75.1	Confident	52 Å²	52	73.8 Å²	73.8	54%	0.536	42%	0.42	S	S	.	.	S	Bend	trans	98.7	-178.5	-177.6	0	0	0	0	0	113.8
216	Q	77.8	Confident	72.5	Confident	112 Å²	112	78 Å²	78	52%	0.523	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-78.2	155.8	178.5	-61.1	-167	53.5	0	0	110.6	H97 Q98 D223	H97-Q216 WeakPolarHBondContact CA-O 3.3Å; H97-Q216 WeakPolarHBondContact CB-O 3.39Å; Q98-Q216 PolarHBondContact N-O 3.26Å; Q216-D223 PolarHBondContact NE2-OD2 3.48Å; Q216-D223 PolarHBondContact OE1-OD2 3.35Å
217	A	81.3	Confident	69.7	Low	50 Å²	50	83.7 Å²	83.7	41%	0.413	47%	0.466	S	S	.	.	B	Isolated β-bridge	trans	-63	137.3	170.2	0	0	0	0	0	109.5	S219	A217-S219 PolarHBondContact O-N 2.95Å
218	A	81.2	Confident	67	Low	0 Å²	0	89.2 Å²	89.2	0%	0	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-60.1	132	178.4	0	0	0	0	0	110.2	M93 H97 Q98 P100 L108 W211	M93-A218 HydrophobicContact CG-CB 4.4Å; M93-A218 HydrophobicContact SD-CB 4.35Å; H97-A218 HydrophobicContact CB-CB 3.78Å; Q98-A218 PolarHBondContact O-N 3.15Å; Q98-A218 VanDerWaalsContact O-N 3.12Å; P100-A218 HydrophobicContact CB-CB 4.13Å; P100-A218 WeakPolarHBondContact CB-O 3.2Å; P100-A218 HydrophobicContact CG-CB 4.13Å; L108-A218 HydrophobicContact CD1-CB 3.71Å; W211-A218 HydrophobicContact CZ3-CB 3.98Å
219	S	78.1	Confident	64.3	Low	48 Å²	48	96.8 Å²	96.8	34%	0.336	52%	0.515	S	S	.	.			trans	-138	150.9	176.9	-166	0	0	0	0	110.5	E104 A217 K221	E104-S219 PolarHBondContact OE1-OG 3.2Å; A217-S219 PolarHBondContact O-N 2.95Å; S219-K221 PolarHBondContact O-N 3.39Å
220	T	69.9	Low	61.3	Low	73 Å²	73	98.9 Å²	98.9	45%	0.448	54%	0.542	S	S	.	.	S	Bend	trans	-78.4	-8.5	174	51.2	0	0	0	0	112.7	D107 L108	D107-T220 HydrophobicContact CB-CG2 3.69Å; L108-T220 HydrophobicContact CD2-CG2 3.51Å; L108-T220 HydrophobicContact CG-CG2 3.82Å
221	K	64.1	Low	58.7	Low	156 Å²	156	102.5 Å²	102.5	68%	0.678	56%	0.561	S	S	*	*	S	Bend	trans	-84	132.1	178.8	-66.3	177.5	-175.1	167.6	0	109.9	S219 D223	S219-K221 PolarHBondContact O-N 3.39Å; K221-D223 PolarHBondContact O-N 3.2Å
222	P	47	Very low	55.9	Low	102 Å²	102	108.6 Å²	108.6	66%	0.662	60%	0.595	S	S	*	*			trans	-62	123.9	173.2	23.9	-30.5	0	0	0	109.5	F224	P222-F224 HydrophobicContact CB-CD2 4.47Å; P222-F224 HydrophobicContact CB-CE2 4.36Å; P222-F224 HydrophobicContact CG-CE2 4.34Å; P222-F224 PolarHBondContact O-N 3.4Å
223	D	43.2	Very low	53	Low	104 Å²	104	112.5 Å²	112.5	56%	0.556	63%	0.627	S	S	*	*			trans	-74.1	93.2	-178.9	-140.7	12.7	0	0	0	108.8	Q216 K221 S225	Q216-D223 PolarHBondContact NE2-OD2 3.48Å; Q216-D223 PolarHBondContact OE1-OD2 3.35Å; K221-D223 PolarHBondContact O-N 3.2Å; D223-S225 PolarHBondContact O-N 2.81Å
224	F	39.4	Very low	50.7	Low	192 Å²	192	109.4 Å²	109.4	84%	0.842	63%	0.626	S	S	*	*			trans	-84.3	72.6	167.2	-82.5	-84	0	0	0	109	P222	P222-F224 HydrophobicContact CB-CD2 4.47Å; P222-F224 HydrophobicContact CB-CE2 4.36Å; P222-F224 HydrophobicContact CG-CE2 4.34Å; P222-F224 PolarHBondContact O-N 3.4Å
225	S	34.2	Very low	49	Very low	68 Å²	68	111.6 Å²	111.6	48%	0.476	64%	0.639	S	S	.	*			trans	-109.1	106.9	164.5	60.9	0	0	0	0	109.3	D223 F227	D223-S225 PolarHBondContact O-N 2.81Å; S225-F227 PolarHBondContact O-N 2.89Å
226	P	38	Very low	47	Very low	99 Å²	99	115.1 Å²	115.1	64%	0.643	66%	0.655	S	S	*	*			trans	-70.5	123.7	169.5	27.9	-29	0	0	0	108.8	Y228	P226-Y228 HydrophobicContact CB-CD2 4.01Å; P226-Y228 HydrophobicContact CB-CE2 3.89Å; P226-Y228 HydrophobicContact CG-CD2 4.11Å; P226-Y228 HydrophobicContact CG-CE2 4.03Å; P226-Y228 PolarHBondContact O-N 3.1Å
227	F	31.7	Very low	44.7	Very low	209 Å²	209	117.1 Å²	117.1	92%	0.917	67%	0.669	S	S	*	*			trans	-56	116.6	163	-77.2	-93.9	0	0	0	108.7	S225	S225-F227 PolarHBondContact O-N 2.89Å
228	Y	33.8	Very low	42.2	Very low	212 Å²	212	121.9 Å²	121.9	83%	0.831	69%	0.686	S	S	*	*			trans	-120	124.1	166.4	-89.9	-80.1	0	0	0	109.9	P226	P226-Y228 HydrophobicContact CB-CD2 4.01Å; P226-Y228 HydrophobicContact CB-CE2 3.89Å; P226-Y228 HydrophobicContact CG-CD2 4.11Å; P226-Y228 HydrophobicContact CG-CE2 4.03Å; P226-Y228 PolarHBondContact O-N 3.1Å
229	D	32.5	Very low	39.6	Very low	171 Å²	171	128.5 Å²	128.5	91%	0.914	72%	0.722	S	S	*	*			trans	-94.2	113.5	178.9	-161.2	10.8	0	0	0	109.9
230	G	29.8	Very low	37.1	Very low	65 Å²	65	130.2 Å²	130.2	67%	0.67	73%	0.734	S	S	*	*			trans	68.9	171.5	162.7	0	0	0	0	0	120.9
231	P	39.3	Very low	35.1	Very low	126 Å²	126	132 Å²	132	82%	0.818	75%	0.75	S	S	*	*			cis	-131.4	154.3	-45	36.6	-20.3	0	0	0	115.7
232	I	33.5	Very low	33.6	Very low	163 Å²	163	130 Å²	130	84%	0.836	75%	0.752	S	S	*	*			trans	31.1	114.7	153.7	-49.8	178.7	0	0	0	123.2
233	A	27.7	Very low	33	Very low	87 Å²	87	131.1 Å²	131.1	72%	0.719	76%	0.759	S	S	*	*			trans	68.5	162.5	142.1	0	0	0	0	0	122.3
234	P	37.1	Very low	32.5	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	77%	0.772	S	S	*	*			cis	-130.9	172.7	-11.8	24.7	-0.1	0	0	0	116.4
235	V	37	Very low	32	Very low	136 Å²	136	128.7 Å²	128.7	82%	0.824	77%	0.771	S	S	*	*			trans	-14.3	137.8	167.2	-79	0	0	0	0	121.9
236	S	29.6	Very low	31.9	Very low	127 Å²	127	130 Å²	130	89%	0.888	79%	0.786	S	S	*	*			trans	-169.1	162.7	130.4	-93.6	0	0	0	0	115
237	L	29.5	Very low	31.7	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	80%	0.795	S	S	*	*			trans	-88.8	161.9	-157.2	-68.7	159.6	0	0	0	115.6
238	L	28.6	Very low	31.6	Very low	150 Å²	150	126.7 Å²	126.7	79%	0.785	79%	0.789	S	S	*	*			trans	78.1	129	141.6	-75.7	158.4	0	0	0	121.8
239	D	26.8	Very low	31.4	Very low	140 Å²	140	122.3 Å²	122.3	75%	0.749	78%	0.784	S	S	*	*			trans	95.6	105.6	133.6	-116.6	0.6	0	0	0	122.9
240	S	26.5	Very low	31.1	Very low	84 Å²	84	123.5 Å²	123.5	59%	0.587	78%	0.781	S	S	*	*				69.7	129.4	121.6	69.8	0	0	0	0	124.5
241	S	28	Very low	30.9	Very low	111 Å²	111	127.1 Å²	127.1	78%	0.776	79%	0.79	S	S	*	*			trans	90.1	162	144.2	-42.5	0	0	0	0	119
242	P	31.9	Very low	30.4	Very low	114 Å²	114	128.9 Å²	128.9	74%	0.74	79%	0.793	S	S	*	*				-125.3	178.1	-71.3	36.5	-19.2	0	0	0	112.1
243	P	34.7	Very low	30.2	Very low	124 Å²	124	128 Å²	128	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.6	146.7	-170.5	35	-31.3	0	0	0	113.3
244	P	33.3	Very low	30.3	Very low	127 Å²	127	130 Å²	130	83%	0.825	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-97.8	152.3	167.6	34.9	-27.9	0	0	0	113.2
245	S	29.1	Very low	29.8	Very low	118 Å²	118	130 Å²	130	83%	0.825	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-75.9	160.1	-164.8	-45.7	0	0	0	0	116.2
246	A	32.1	Very low	29.4	Very low	95 Å²	95	132.5 Å²	132.5	79%	0.785	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.7	161.2	169	0	0	0	0	0	113.7
247	P	32.4	Very low	29.5	Very low	128 Å²	128	132.5 Å²	132.5	83%	0.831	79%	0.788	S	S	*	*			trans	-116.5	157.1	148	26.2	-9.8	0	0	0	113.7
248	S	30.5	Very low	29.4	Very low	112 Å²	112	134 Å²	134	78%	0.783	79%	0.791	S	S	*	*			trans	-84.1	148.7	-165.4	-57.2	0	0	0	0	116.4
249	V	28.9	Very low	29.3	Very low	120 Å²	120	133.5 Å²	133.5	73%	0.727	79%	0.794	S	S	*	*				46.7	122.9	127.2	-174.3	0	0	0	0	119.8
250	F	26.6	Very low	29.3	Very low	195 Å²	195	130.7 Å²	130.7	86%	0.855	80%	0.798	S	S	*	*				-166.2	125.7	120.2	-94.5	-71.7	0	0	0	110.2
251	T	26.1	Very low	29.5	Very low	142 Å²	142	132.6 Å²	132.6	87%	0.871	81%	0.811	S	S	*	*				163.5	134.9	128.5	38	0	0	0	0	110.8
252	D	28.6	Very low	29.6	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	81%	0.813	S	S	*	*			trans	-146.3	131.8	159.5	-122.7	-20.3	0	0	0	106
253	D	29.4	Very low	29.9	Very low	145 Å²	145	132.8 Å²	132.8	78%	0.775	82%	0.816	S	S	*	*				179.3	139.4	112.6	-162.1	35.4	0	0	0	114.2
254	D	29	Very low	30.3	Very low	127 Å²	127	131.2 Å²	131.2	68%	0.679	81%	0.806	S	S	*	*			trans	24.2	136.4	162.3	-108.2	-46.1	0	0	0	126.5
255	S	28	Very low	30.9	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	80%	0.802	S	S	*	*				-175.6	128.7	116.7	-77.2	0	0	0	0	113.8
256	K	27.8	Very low	31.8	Very low	189 Å²	189	134.6 Å²	134.6	82%	0.822	80%	0.797	S	S	*	*			trans	-75.2	159.8	171.6	-131.1	172.8	-172.1	170.3	0	112.5
257	P	31.7	Very low	32.6	Very low	126 Å²	126	132.2 Å²	132.2	82%	0.818	78%	0.775	S	S	*	*				-149.4	-176.5	102	36.3	-16.6	0	0	0	116.8
258	Q	27.2	Very low	33.2	Very low	184 Å²	184	128.4 Å²	128.4	86%	0.86	75%	0.754	S	S	*	*			trans	-76.4	167.5	-158.3	-72.4	168.2	-64.1	0	0	118.8
259	T	27.5	Very low	34	Very low	141 Å²	141	128.2 Å²	128.2	87%	0.865	74%	0.744	S	S	*	*			trans	-46.5	143.7	171.9	49.7	0	0	0	0	119.1
260	G	26.8	Very low	34.9	Very low	80 Å²	80	128 Å²	128	83%	0.825	73%	0.733	S	S	*	*			trans	-160	131.2	155.8	0	0	0	0	0	110.9
261	S	29.1	Very low	36.1	Very low	124 Å²	124	121.3 Å²	121.3	87%	0.867	71%	0.714	S	S	*	*			trans	-82.6	135.1	-167	54.7	0	0	0	0	115.4
262	A	31.6	Very low	37.2	Very low	97 Å²	97	121.7 Å²	121.7	80%	0.802	71%	0.706	S	S	*	*			trans	-176.5	131.2	139.4	0	0	0	0	0	109.5
263	T	38.6	Very low	38.1	Very low	133 Å²	133	119.2 Å²	119.2	82%	0.816	69%	0.692	S	S	*	*			trans	-70.8	137.8	-176.9	40.5	0	0	0	0	114.2
264	P	42.5	Very low	38.9	Very low	90 Å²	90	117.2 Å²	117.2	58%	0.584	68%	0.682	S	S	*	*			trans	-130.1	101.4	144.7	30.4	-12.8	0	0	0	111	H266 S267	P264-H266 PolarHBondContact O-N 3.29Å; P264-H266 VanDerWaalsContact O-N 3.17Å; P264-S267 PolarHBondContact O-N 2.98Å
265	E	46.1	Very low	39.7	Very low	161 Å²	161	117 Å²	117	75%	0.752	68%	0.676	S	S	*	*	H	α-helix	trans	-65.2	-16.4	-174.6	-79.7	-175.9	139.6	0	0	114.9
266	H	48.3	Very low	41	Very low	156 Å²	156	114.2 Å²	114.2	72%	0.722	67%	0.666	S	S	*	*	H	α-helix	trans	-85.8	-21.9	175.5	-83.3	-105.2	0	0	0	113.9	P264	P264-H266 PolarHBondContact O-N 3.29Å; P264-H266 VanDerWaalsContact O-N 3.17Å
267	S	47.1	Very low	42	Very low	44 Å²	44	114 Å²	114	31%	0.308	67%	0.671	S	S	.	*	H	α-helix	trans	-81.3	-21	173	-166.1	0	0	0	0	112.4	Q117 P264 A271	Q117-S267 PolarHBondContact NE2-OG 3.06Å; Q117-S267 VanDerWaalsContact NE2-OG 3.16Å; P264-S267 PolarHBondContact O-N 2.98Å; S267-A271 WeakPolarHBondContact O-CB 3.49Å; S267-A271 PolarHBondContact O-N 3.11Å; S267-A271 VanDerWaalsContact O-N 3.13Å
268	A	45.8	Very low	42.8	Very low	48 Å²	48	112.8 Å²	112.8	40%	0.397	66%	0.657	S	S	.	*	H	α-helix	trans	-70	-36.7	178.9	0	0	0	0	0	112.1	F270 A271 Q272	A268-F270 PolarHBondContact O-N 3.4Å; A268-A271 PolarHBondContact O-N 3.16Å; A268-Q272 WeakPolarHBondContact O-CB 3.1Å; A268-Q272 PolarHBondContact O-N 2.95Å; A268-Q272 VanDerWaalsContact O-N 3.12Å
269	L	47.3	Very low	43.9	Very low	109 Å²	109	110 Å²	110	57%	0.571	65%	0.647	S	S	*	*	H	α-helix	trans	-63.6	-38.5	177.9	-85.2	157	0	0	0	112.6	L273	L269-L273 WeakPolarHBondContact O-CD1 3.45Å
270	F	48.6	Very low	44.9	Very low	115 Å²	115	108.2 Å²	108.2	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-81.3	-30.4	178	-73.4	-81.1	0	0	0	113.5	A268 Q272 L273 N274	A268-F270 PolarHBondContact O-N 3.4Å; F270-Q272 VanDerWaalsContact C-N 3.32Å; F270-Q272 PolarHBondContact O-N 2.87Å; F270-L273 PolarHBondContact O-N 3.22Å; F270-N274 PolarHBondContact O-ND2 3.47Å
271	A	51.4	Low	46.1	Very low	55 Å²	55	112.4 Å²	112.4	46%	0.455	63%	0.631	S	S	.	*	H	α-helix	trans	-67.5	-33	174.1	0	0	0	0	0	112.4	S267 A268 L273 N274	S267-A271 WeakPolarHBondContact O-CB 3.49Å; S267-A271 PolarHBondContact O-N 3.11Å; S267-A271 VanDerWaalsContact O-N 3.13Å; A268-A271 PolarHBondContact O-N 3.16Å; A271-L273 VanDerWaalsContact C-N 3.29Å; A271-L273 PolarHBondContact O-N 3.22Å; A271-N274 PolarHBondContact O-N 3.13Å
272	Q	49.4	Very low	47.4	Very low	150 Å²	150	110 Å²	110	70%	0.701	63%	0.627	S	S	*	*	H	α-helix	trans	-76.5	-17.8	179.7	-149.4	146.8	9.7	0	0	113.2	A268 F270	A268-Q272 WeakPolarHBondContact O-CB 3.1Å; A268-Q272 PolarHBondContact O-N 2.95Å; A268-Q272 VanDerWaalsContact O-N 3.12Å; F270-Q272 VanDerWaalsContact C-N 3.32Å; F270-Q272 PolarHBondContact O-N 2.87Å
273	L	47.3	Very low	48.1	Very low	110 Å²	110	112.2 Å²	112.2	58%	0.576	62%	0.624	S	S	*	*	H	α-helix	trans	-82.2	-20.7	174	-85.7	155.5	0	0	0	113.6	L269 F270 A271 Q275	L269-L273 WeakPolarHBondContact O-CD1 3.45Å; F270-L273 PolarHBondContact O-N 3.22Å; A271-L273 VanDerWaalsContact C-N 3.29Å; A271-L273 PolarHBondContact O-N 3.22Å; L273-Q275 PolarHBondContact O-N 2.95Å
274	N	44.9	Very low	48.7	Very low	104 Å²	104	115.5 Å²	115.5	56%	0.556	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	11.9	-175.6	-73.8	-39.2	0	0	0	115.3	K110 F270 A271	K110-N274 PolarHBondContact NZ-ND2 2.98Å; K110-N274 PolarHBondContact NZ-OD1 3.41Å; F270-N274 PolarHBondContact O-ND2 3.47Å; A271-N274 PolarHBondContact O-N 3.13Å
275	Q	47.5	Very low	49.2	Very low	121 Å²	121	119.1 Å²	119.1	57%	0.565	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-5.6	-170.8	-71.5	-171.5	4.5	0	0	116.8	L273	L273-Q275 PolarHBondContact O-N 2.95Å
276	G	54.9	Low	49.2	Very low	61 Å²	61	114.9 Å²	114.9	63%	0.629	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	46.4	-150.5	170.5	0	0	0	0	0	116.4	D278	G276-D278 PolarHBondContact O-N 3.26Å; G276-D278 VanDerWaalsContact O-N 3.08Å
277	M	48.6	Very low	49.8	Very low	186 Å²	186	109.7 Å²	109.7	92%	0.916	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-67.5	-0.1	-173.2	-84.7	-171.7	-82.7	0	0	116.1	I279	M277-I279 PolarHBondContact O-N 3.04Å
278	D	47.5	Very low	50.2	Low	99 Å²	99	111 Å²	111	53%	0.529	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-86.1	-1.6	-176.9	-97.1	-25	0	0	0	114.7	G276 T280 K281	G276-D278 PolarHBondContact O-N 3.26Å; G276-D278 VanDerWaalsContact O-N 3.08Å; D278-T280 PolarHBondContact O-N 3.29Å; D278-T280 VanDerWaalsContact O-N 3.11Å; D278-K281 PolarHBondContact O-N 2.9Å; D278-K281 VanDerWaalsContact OD1-CD 3.3Å; D278-K281 WeakPolarHBondContact OD1-CD 3.44Å; D278-K281 WeakPolarHBondContact OD1-CE 3.34Å; D278-K281 IonicContact OD1-NZ 3.35Å; D278-K281 PolarHBondContact OD1-NZ 3.47Å; D278-K281 IonicContact OD2-NZ 3.74Å
279	I	51.4	Low	50.7	Low	127 Å²	127	114.9 Å²	114.9	65%	0.651	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-66.2	-15.1	-178.5	-149.1	163	0	0	0	114	M277	M277-I279 PolarHBondContact O-N 3.04Å
280	T	47.4	Very low	51.1	Low	102 Å²	102	116.3 Å²	116.3	63%	0.626	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-88.2	-7	-179.1	58.6	0	0	0	0	114.1	D278 G282	D278-T280 PolarHBondContact O-N 3.29Å; D278-T280 VanDerWaalsContact O-N 3.11Å; T280-G282 VanDerWaalsContact C-N 3.3Å; T280-G282 PolarHBondContact O-N 3.45Å
281	K	53.3	Low	51.5	Low	168 Å²	168	114.1 Å²	114.1	73%	0.73	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-77.8	-11.3	179.7	-72.1	179.6	179.2	160.2	0	114.1	D278	D278-K281 PolarHBondContact O-N 2.9Å; D278-K281 VanDerWaalsContact OD1-CD 3.3Å; D278-K281 WeakPolarHBondContact OD1-CD 3.44Å; D278-K281 WeakPolarHBondContact OD1-CE 3.34Å; D278-K281 IonicContact OD1-NZ 3.35Å; D278-K281 PolarHBondContact OD1-NZ 3.47Å; D278-K281 IonicContact OD2-NZ 3.74Å
282	G	56.8	Low	51.7	Low	75 Å²	75	117.3 Å²	117.3	77%	0.773	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-96.1	-0.8	-178.8	0	0	0	0	0	116.3	T280	T280-G282 VanDerWaalsContact C-N 3.3Å; T280-G282 PolarHBondContact O-N 3.45Å
283	L	45.1	Very low	52	Low	142 Å²	142	117 Å²	117	74%	0.743	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-85.6	120.5	-177.5	-72.9	166.5	0	0	0	111.1	H285	L283-H285 PolarHBondContact O-N 3.21Å
284	K	51.5	Low	52.3	Low	202 Å²	202	117.2 Å²	117.2	88%	0.878	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-63.9	123	176.7	-154.6	176.8	-173.8	179.4	0	109.9	V286	K284-V286 PolarHBondContact O-N 2.95Å
285	H	52.8	Low	52.5	Low	167 Å²	167	115 Å²	115	77%	0.773	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-66.2	125.1	179.7	-172.9	-90.2	0	0	0	111	L283	L283-H285 PolarHBondContact O-N 3.21Å
286	V	46.7	Very low	52.8	Low	71 Å²	71	114.4 Å²	114.4	43%	0.43	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-83.8	119.3	179.9	-179.5	0	0	0	0	109.1	K284 Q290	K284-V286 PolarHBondContact O-N 2.95Å; V286-Q290 HydrophobicContact CG1-CB 3.58Å
287	S	60.6	Low	52.9	Low	47 Å²	47	118 Å²	118	33%	0.329	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-68.8	155.3	177.4	66.5	0	0	0	0	111.5	E289 Q290	S287-E289 VanDerWaalsContact CB-OE2 3.28Å; S287-E289 WeakPolarHBondContact CB-OE2 3.38Å; S287-E289 PolarHBondContact O-N 3.43Å; S287-E289 PolarHBondContact OG-OE2 3.01Å; S287-Q290 PolarHBondContact O-N 3.33Å
288	D	55.1	Low	53	Low	71 Å²	71	115.5 Å²	115.5	38%	0.38	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-61.7	-17.1	-172.9	-90.8	2.9	0	0	0	113.7	Q290 K291 K294	D288-Q290 VanDerWaalsContact C-N 3.3Å; D288-Q290 PolarHBondContact O-N 3.47Å; D288-K291 PolarHBondContact O-N 3.02Å; D288-K291 WeakPolarHBondContact OD1-CD 3.39Å; D288-K291 WeakPolarHBondContact OD1-CE 3.44Å; D288-K291 IonicContact OD1-NZ 2.75Å; D288-K291 PolarHBondContact OD1-NZ 3.17Å; D288-K294 HydrophobicContact CB-CD 4.35Å; D288-K294 IonicContact OD1-NZ 3.58Å; D288-K294 IonicContact OD2-NZ 2.76Å; D288-K294 PolarHBondContact OD2-NZ 2.96Å
289	E	55.8	Low	53	Low	130 Å²	130	122.2 Å²	122.2	61%	0.607	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-71.4	-21.6	175.1	-55	95.3	-162	0	0	114	S287 N295	S287-E289 VanDerWaalsContact CB-OE2 3.28Å; S287-E289 WeakPolarHBondContact CB-OE2 3.38Å; S287-E289 PolarHBondContact O-N 3.43Å; S287-E289 PolarHBondContact OG-OE2 3.01Å; E289-N295 PolarHBondContact O-ND2 3.23Å
290	Q	55.9	Low	52.5	Low	139 Å²	139	120.8 Å²	120.8	65%	0.65	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-94.9	-0.5	-179.1	-67.5	-173.4	-50.5	0	0	113.3	V286 S287 D288	V286-Q290 HydrophobicContact CG1-CB 3.58Å; S287-Q290 PolarHBondContact O-N 3.33Å; D288-Q290 VanDerWaalsContact C-N 3.3Å; D288-Q290 PolarHBondContact O-N 3.47Å
291	K	58.6	Low	51.9	Low	70 Å²	70	125.6 Å²	125.6	30%	0.304	64%	0.642	S	S	.	*			trans	-89.1	110.3	176	-63.3	178.5	-172.2	162.7	0	109	D288 H293 K294	D288-K291 PolarHBondContact O-N 3.02Å; D288-K291 WeakPolarHBondContact OD1-CD 3.39Å; D288-K291 WeakPolarHBondContact OD1-CE 3.44Å; D288-K291 IonicContact OD1-NZ 2.75Å; D288-K291 PolarHBondContact OD1-NZ 3.17Å; K291-H293 PolarHBondContact O-N 2.88Å; K291-K294 PolarHBondContact O-N 3.1Å
292	T	53.6	Low	51.1	Low	122 Å²	122	121.8 Å²	121.8	75%	0.748	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-12.3	-175.9	46.6	0	0	0	0	115.6
293	H	57.4	Low	49.9	Very low	144 Å²	144	123.6 Å²	123.6	67%	0.667	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-9.5	173.6	75.7	-78.4	0	0	0	114.3	K291	K291-H293 PolarHBondContact O-N 2.88Å
294	K	53.3	Low	49.9	Very low	114 Å²	114	121.9 Å²	121.9	50%	0.496	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.8	-6.3	-179.2	-63.8	-162.2	179.3	-174.8	0	114.4	D288 K291	D288-K294 HydrophobicContact CB-CD 4.35Å; D288-K294 IonicContact OD1-NZ 3.58Å; D288-K294 IonicContact OD2-NZ 2.76Å; D288-K294 PolarHBondContact OD2-NZ 2.96Å; K291-K294 PolarHBondContact O-N 3.1Å
295	N	48.2	Very low	49	Very low	58 Å²	58	119.4 Å²	119.4	31%	0.31	64%	0.635	S	S	.	*			trans	-127.5	92.4	-175.4	-150.5	-17.5	0	0	0	111.9	E289 N297	E289-N295 PolarHBondContact O-ND2 3.23Å; N295-N297 PolarHBondContact O-N 3.35Å; N295-N297 VanDerWaalsContact O-N 3.16Å
296	P	55	Low	48	Very low	107 Å²	107	120.3 Å²	120.3	70%	0.695	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-65.4	-15.2	-172.1	-22.4	33.1	0	0	0	116	L298	P296-L298 PolarHBondContact O-N 2.81Å
297	N	56	Low	47.3	Very low	137 Å²	137	122.9 Å²	122.9	73%	0.733	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-81.4	-5.4	-172.7	-70.9	-39.8	0	0	0	115	N295 R299	N295-N297 PolarHBondContact O-N 3.35Å; N295-N297 VanDerWaalsContact O-N 3.16Å; N297-R299 VanDerWaalsContact C-N 3.3Å; N297-R299 PolarHBondContact O-N 3.12Å
298	L	51.2	Low	46	Very low	133 Å²	133	129.6 Å²	129.6	70%	0.696	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-87.2	6.8	177	-70.3	168.9	0	0	0	113.6	P296	P296-L298 PolarHBondContact O-N 2.81Å
299	R	47.7	Very low	45	Very low	240 Å²	240	133.4 Å²	133.4	91%	0.906	70%	0.696	S	S	*	*	S	Bend	trans	-105.3	7.7	-169.6	-155	171.4	-177.6	172	1.6	115.8	N297	N297-R299 VanDerWaalsContact C-N 3.3Å; N297-R299 PolarHBondContact O-N 3.12Å
300	S	40.4	Very low	44.3	Very low	98 Å²	98	132.8 Å²	132.8	69%	0.685	70%	0.703	S	S	*	*			trans	-127.6	89.9	-172.2	56	0	0	0	0	113.9
301	Q	35.3	Very low	43.1	Very low	202 Å²	202	135.5 Å²	135.5	94%	0.944	72%	0.716	S	S	*	*			trans	-154.9	128.1	138.4	-107.2	179.7	10.8	0	0	108.8
302	A	35.1	Very low	42.1	Very low	89 Å²	89	141.4 Å²	141.4	74%	0.736	74%	0.744	S	S	*	*			trans	-126.5	144.4	-160.2	0	0	0	0	0	113.3
303	S	31.5	Very low	41.1	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	75%	0.749	S	S	*	*			trans	80.6	160.9	141.4	-53.7	0	0	0	0	120.1
304	P	45.8	Very low	40.2	Very low	106 Å²	106	139 Å²	139	69%	0.688	75%	0.754	S	S	*	*			cis	-141.6	149.8	8.2	17.5	10.5	0	0	0	121.1
305	I	33.1	Very low	39.3	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	77%	0.769	S	S	*	*			trans	69.8	121.3	132.5	-44.5	156.5	0	0	0	122.5
306	K	32.3	Very low	39	Very low	186 Å²	186	143.2 Å²	143.2	81%	0.809	80%	0.795	S	S	*	*				172.7	113.3	110.9	-88	-174	-173.2	177.7	0	115.7
307	T	32.1	Very low	38	Very low	124 Å²	124	147.9 Å²	147.9	76%	0.761	80%	0.804	S	S	*	*			trans	57.9	123.4	136.8	52.5	0	0	0	0	125.7
308	K	33.3	Very low	37.2	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	81%	0.808	S	S	*	*			trans	103.8	111.5	136.4	-78.3	-177.4	178.9	-172.2	0	121.7
309	D	34.4	Very low	36.7	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	82%	0.815	S	S	*	*			trans	61.9	151.7	142	-75.5	-43.2	0	0	0	123.6
310	P	39.4	Very low	36.7	Very low	117 Å²	117	137.6 Å²	137.6	76%	0.76	81%	0.809	S	S	*	*			trans	-100.8	132.1	-143.8	36.2	-30.3	0	0	0	114.1
311	Q	32.1	Very low	37.1	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	82%	0.819	S	S	*	*			trans	-125.2	137.9	164.8	-85.8	-170	-29	0	0	111.9	A313	Q311-A313 PolarHBondContact O-N 2.86Å
312	H	37.3	Very low	38.2	Very low	195 Å²	195	140 Å²	140	90%	0.903	81%	0.807	S	S	*	*			trans	-33.5	122.6	174.8	-99	-94.6	0	0	0	114.5	S314	H312-S314 PolarHBondContact O-N 3.23Å
313	A	31.8	Very low	40.1	Very low	101 Å²	101	143.9 Å²	143.9	84%	0.835	80%	0.802	S	S	*	*			trans	-77	106.7	169.4	0	0	0	0	0	110.3	Q311	Q311-A313 PolarHBondContact O-N 2.86Å
314	S	38	Very low	42.7	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-82.8	125	156.2	56.6	0	0	0	0	108.9	H312	H312-S314 PolarHBondContact O-N 3.23Å
315	T	35.8	Very low	45	Very low	131 Å²	131	144.3 Å²	144.3	80%	0.804	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.7	174.8	43.4	0	0	0	0	111.3	K317	T315-K317 PolarHBondContact O-N 3.29Å
316	P	40.3	Very low	48	Very low	130 Å²	130	139.1 Å²	139.1	84%	0.844	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-74.6	127.3	179.2	27	-30.9	0	0	0	111.4
317	K	35.4	Very low	51.1	Low	206 Å²	206	133.3 Å²	133.3	90%	0.896	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-70.4	139.2	175.1	-151.4	172.6	-175.2	177.2	0	109.8	T315	T315-K317 PolarHBondContact O-N 3.29Å
318	A	38.1	Very low	54.1	Low	99 Å²	99	131.6 Å²	131.6	82%	0.818	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-52.1	137.2	-177.6	0	0	0	0	0	113.1
319	A	41.6	Very low	57.1	Low	102 Å²	102	125.9 Å²	125.9	84%	0.843	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-67.6	128.6	-176.4	0	0	0	0	0	111.8
320	A	48.6	Very low	59.9	Low	93 Å²	93	123.7 Å²	123.7	77%	0.769	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-66.4	141.2	172.2	0	0	0	0	0	110.6	K322	A320-K322 PolarHBondContact O-N 3.34Å; A320-K322 VanDerWaalsContact O-N 3.15Å
321	Q	47.1	Very low	62.5	Low	194 Å²	194	121.4 Å²	121.4	91%	0.907	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-56.1	116.9	171	-88.9	170.3	-33	0	0	110.2	R323	Q321-R323 PolarHBondContact O-N 3.33Å
322	K	58	Low	65.5	Low	157 Å²	157	118.2 Å²	118.2	68%	0.683	67%	0.671	S	S	*	*			trans	-72.5	107.8	177.7	-108.5	177.8	173.1	178.8	0	110.3	A320 E340	A320-K322 PolarHBondContact O-N 3.34Å; A320-K322 VanDerWaalsContact O-N 3.15Å; K322-E340 WeakPolarHBondContact CE-OE1 3.4Å; K322-E340 WeakPolarHBondContact CE-OE2 3.31Å; K322-E340 IonicContact NZ-OE1 2.72Å; K322-E340 IonicContact NZ-OE2 2.64Å; K322-E340 PolarHBondContact NZ-OE2 3.02Å
323	R	75.5	Confident	68.3	Low	169 Å²	169	112.8 Å²	112.8	64%	0.638	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-68.5	150.7	164	-69.5	-178.7	-178	178.1	-0.3	109.3	Q321 N338	Q321-R323 PolarHBondContact O-N 3.33Å; R323-N338 HydrophobicContact CB-CB 4.26Å; R323-N338 WeakPolarHBondContact CB-ND2 3.37Å
324	L	87.5	Confident	71.5	Confident	153 Å²	153	109.9 Å²	109.9	80%	0.801	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-67.1	137.9	-179.6	-67.6	173.7	0	0	0	110.5	N338	L324-N338 PolarHBondContact O-ND2 3.4Å
325	P	93.6	Very high	74.3	Confident	74 Å²	74	107.4 Å²	107.4	48%	0.481	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-61.5	138.2	171.9	-21	32	0	0	0	111.1	E337 F339	P325-E337 CarbonylContact C-O 3.54Å; P325-E337 VanDerWaalsContact CA-O 3.29Å; P325-E337 WeakPolarHBondContact CA-O 3.26Å; P325-F339 HydrophobicContact CB-CD1 3.7Å; P325-F339 HydrophobicContact CB-CE1 3.62Å; P325-F339 HydrophobicContact CB-CE2 4.47Å; P325-F339 HydrophobicContact CB-CG 4.16Å; P325-F339 HydrophobicContact CB-CZ 4.03Å
326	L	95.7	Very high	77.3	Confident	43 Å²	43	101.1 Å²	101.1	23%	0.225	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123.3	-176.1	-175.4	69.2	0	0	0	110.3	E328 R335 V336 E337 F339	L326-E328 HydrophobicContact CD1-CB 4.48Å; L326-E328 HydrophobicContact CD1-CG 3.87Å; L326-E328 HydrophobicContact CD2-CG 4.19Å; L326-E328 HydrophobicContact CG-CG 3.98Å; L326-R335 HydrophobicContact CD2-CB 4.25Å; L326-V336 CarbonylContact O-C 3.36Å; L326-V336 VanDerWaalsContact O-CA 3.28Å; L326-V336 WeakPolarHBondContact O-CA 3.48Å; L326-E337 HydrophobicContact CB-CB 4.27Å; L326-E337 PolarHBondContact N-O 3.41Å; L326-E337 PolarHBondContact O-N 3.46Å; L326-F339 VanDerWaalsContact O-CE2 3.22Å; L326-F339 WeakPolarHBondContact O-CE2 3.41Å
327	L	96.6	Very high	80	Confident	64 Å²	64	96 Å²	96	34%	0.335	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	101.2	166.3	-169.6	151.1	0	0	0	108.4	W334 R335 V336 F339 L345	L327-W334 HydrophobicContact CD2-CE3 4.48Å; L327-W334 HydrophobicContact CD2-CZ3 4.11Å; L327-R335 VanDerWaalsContact CA-O 3.26Å; L327-R335 WeakPolarHBondContact CA-O 3.39Å; L327-V336 HydrophobicContact CD1-CG2 4.32Å; L327-V336 HydrophobicContact CG-CG2 4.29Å; L327-F339 HydrophobicContact CB-CE2 3.78Å; L327-F339 HydrophobicContact CB-CZ 3.7Å; L327-F339 HydrophobicContact CD1-CE2 4.47Å; L327-L345 HydrophobicContact CD1-CB 4.35Å; L327-L345 HydrophobicContact CD1-CD2 4.06Å
328	E	96.1	Very high	82.9	Confident	88 Å²	88	87.5 Å²	87.5	41%	0.411	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.7	178.9	71.3	-177.8	-179.4	0	0	112.7	L326 R335	L326-E328 HydrophobicContact CD1-CB 4.48Å; L326-E328 HydrophobicContact CD1-CG 3.87Å; L326-E328 HydrophobicContact CD2-CG 4.19Å; L326-E328 HydrophobicContact CG-CG 3.98Å; E328-R335 PolarHBondContact N-O 3.31Å; E328-R335 VanDerWaalsContact N-O 3.13Å; E328-R335 PolarHBondContact O-N 3Å
329	L	95.9	Very high	85.6	Confident	69 Å²	69	84.1 Å²	84.1	36%	0.361	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	107.6	172	178.1	60.2	0	0	0	109.5	W334 Q354	L329-W334 HydrophobicContact CB-CD2 3.92Å; L329-W334 HydrophobicContact CB-CE3 3.86Å; L329-W334 HydrophobicContact CB-CH2 3.88Å; L329-W334 HydrophobicContact CB-CZ2 3.94Å; L329-W334 HydrophobicContact CB-CZ3 3.85Å; L329-W334 HydrophobicContact CD1-CD2 4.03Å; L329-W334 HydrophobicContact CD1-CG 4Å; L329-W334 HydrophobicContact CD2-CZ2 4.09Å; L329-W334 HydrophobicContact CG-CD2 4.48Å; L329-W334 HydrophobicContact CG-CZ2 4.42Å; L329-Q354 HydrophobicContact CD1-CG 4.48Å
330	E	92.9	Very high	88.1	Confident	104 Å²	104	83.5 Å²	83.5	49%	0.486	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	97.8	174.7	-167.2	-179.1	168.2	0	0	109.3	K332 K333 R335	E330-K332 PolarHBondContact O-N 2.91Å; E330-K333 PolarHBondContact N-O 3.02Å; E330-K333 PolarHBondContact O-N 3.36Å; E330-R335 WeakPolarHBondContact OE2-CD 3.21Å; E330-R335 IonicContact OE2-CZ 3.68Å; E330-R335 IonicContact OE2-NE 3.62Å; E330-R335 IonicContact OE2-NH1 2.84Å; E330-R335 PolarHBondContact OE2-NH1 3.29Å
331	G	94.3	Very high	90.4	Very high	69 Å²	69	86.2 Å²	86.2	71%	0.711	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	-96	-175.8	0	0	0	0	0	112.5
332	K	94.3	Very high	92.7	Very high	128 Å²	128	81 Å²	81	56%	0.557	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	1.4	175.5	-63.6	-179.6	-176.2	176.4	0	112.8	E330 K353 Q354 V355	E330-K332 PolarHBondContact O-N 2.91Å; K332-K353 HydrophobicContact CD-CD 4.28Å; K332-K353 HydrophobicContact CD-CG 4.12Å; K332-K353 HydrophobicContact CG-CG 4.49Å; K332-Q354 CarbonylContact O-C 3.55Å; K332-Q354 WeakPolarHBondContact O-CA 3.32Å; K332-Q354 WeakPolarHBondContact O-CB 3.35Å; K332-V355 PolarHBondContact O-N 2.64Å
333	K	97.3	Very high	94.5	Very high	82 Å²	82	78.6 Å²	78.6	36%	0.357	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.9	-173.5	-174.1	-179.7	178.4	-176.1	0	109.3	E330 R335 V355	E330-K333 PolarHBondContact N-O 3.02Å; E330-K333 PolarHBondContact O-N 3.36Å; K333-R335 HydrophobicContact CD-CG 4.47Å; K333-R335 HydrophobicContact CG-CG 4.36Å; K333-R335 PolarHBondContact O-N 3.14Å; K333-V355 CarbonylContact C-O 3.43Å; K333-V355 WeakPolarHBondContact CA-O 3.32Å
334	W	98.3	Very high	95.3	Very high	39 Å²	39	75.3 Å²	75.3	15%	0.148	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	122.9	166.6	-77.3	103.2	0	0	0	108.8	L327 L329 I347 V355 V356 Y357	L327-W334 HydrophobicContact CD2-CE3 4.48Å; L327-W334 HydrophobicContact CD2-CZ3 4.11Å; L329-W334 HydrophobicContact CB-CD2 3.92Å; L329-W334 HydrophobicContact CB-CE3 3.86Å; L329-W334 HydrophobicContact CB-CH2 3.88Å; L329-W334 HydrophobicContact CB-CZ2 3.94Å; L329-W334 HydrophobicContact CB-CZ3 3.85Å; L329-W334 HydrophobicContact CD1-CD2 4.03Å; L329-W334 HydrophobicContact CD1-CG 4Å; L329-W334 HydrophobicContact CD2-CZ2 4.09Å; L329-W334 HydrophobicContact CG-CD2 4.48Å; L329-W334 HydrophobicContact CG-CZ2 4.42Å; W334-I347 HydrophobicContact CB-CD1 3.85Å; W334-I347 HydrophobicContact CD2-CD1 4.06Å; W334-I347 HydrophobicContact CD2-CG1 4.44Å; W334-I347 HydrophobicContact CD2-CG2 3.87Å; W334-I347 HydrophobicContact CE3-CD1 4.26Å; W334-I347 HydrophobicContact CE3-CG1 4.39Å; W334-I347 HydrophobicContact CE3-CG2 4.38Å; W334-I347 HydrophobicContact CG-CD1 3.9Å; W334-I347 HydrophobicContact CG-CG2 4.25Å; W334-I347 HydrophobicContact CH2-CG2 4.38Å; W334-I347 HydrophobicContact CZ2-CG2 3.86Å; W334-V355 PolarHBondContact N-O 2.72Å; W334-V356 HydrophobicContact CB-CB 4.44Å; W334-V356 HydrophobicContact CB-CG1 4.33Å; W334-V356 HydrophobicContact CB-CG2 4.18Å; W334-Y357 PolarHBondContact O-N 3.19Å
335	R	98	Very high	95.8	Very high	61 Å²	61	68.6 Å²	68.6	23%	0.23	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.5	175.9	-66.9	-179.7	64.6	-160.5	-8.4	108.6	L326 L327 E328 E330 K333 E337	L326-R335 HydrophobicContact CD2-CB 4.25Å; L327-R335 VanDerWaalsContact CA-O 3.26Å; L327-R335 WeakPolarHBondContact CA-O 3.39Å; E328-R335 PolarHBondContact N-O 3.31Å; E328-R335 VanDerWaalsContact N-O 3.13Å; E328-R335 PolarHBondContact O-N 3Å; E330-R335 WeakPolarHBondContact OE2-CD 3.21Å; E330-R335 IonicContact OE2-CZ 3.68Å; E330-R335 IonicContact OE2-NE 3.62Å; E330-R335 IonicContact OE2-NH1 2.84Å; E330-R335 PolarHBondContact OE2-NH1 3.29Å; K333-R335 HydrophobicContact CD-CG 4.47Å; K333-R335 HydrophobicContact CG-CG 4.36Å; K333-R335 PolarHBondContact O-N 3.14Å; R335-E337 HydrophobicContact CB-CG 4.29Å; R335-E337 IonicContact CZ-OE1 3.74Å; R335-E337 IonicContact CZ-OE2 3.87Å; R335-E337 IonicContact NE-OE1 3.13Å; R335-E337 PolarHBondContact NE-OE1 3.13Å; R335-E337 IonicContact NE-OE2 3.66Å; R335-E337 IonicContact NH2-OE1 3.67Å; R335-E337 PolarHBondContact NH2-OE1 3.43Å; R335-E337 IonicContact NH2-OE2 2.68Å; R335-E337 PolarHBondContact NH2-OE2 3.49Å
336	V	97.9	Very high	96	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	96.1	175.3	-174.9	0	0	0	0	107.4	L326 L327 F339 L345 I347 V356 Y357 V358 F359 L366	L326-V336 CarbonylContact O-C 3.36Å; L326-V336 VanDerWaalsContact O-CA 3.28Å; L326-V336 WeakPolarHBondContact O-CA 3.48Å; L327-V336 HydrophobicContact CD1-CG2 4.32Å; L327-V336 HydrophobicContact CG-CG2 4.29Å; V336-F339 HydrophobicContact CG1-CD2 3.74Å; V336-F339 HydrophobicContact CG1-CE2 3.9Å; V336-L345 HydrophobicContact CG1-CD1 4.09Å; V336-I347 HydrophobicContact CG2-CD1 4.06Å; V336-V356 HydrophobicContact CG2-CG1 4.46Å; V336-Y357 PolarHBondContact N-O 2.88Å; V336-V358 HydrophobicContact CB-CG1 4.24Å; V336-V358 HydrophobicContact CB-CG2 4.34Å; V336-V358 HydrophobicContact CG1-CG1 4.28Å; V336-V358 CarbonylContact O-C 2.99Å; V336-V358 VanDerWaalsContact O-CA 3.25Å; V336-V358 WeakPolarHBondContact O-CA 3.48Å; V336-F359 PolarHBondContact O-N 3.04Å; V336-L366 HydrophobicContact CB-CD2 4.33Å; V336-L366 HydrophobicContact CG1-CD1 4.42Å; V336-L366 HydrophobicContact CG1-CD2 4.25Å; V336-L366 HydrophobicContact CG2-CD1 4.28Å; V336-L366 HydrophobicContact CG2-CD2 4.01Å
337	E	97.4	Very high	96.1	Very high	21 Å²	21	65.4 Å²	65.4	10%	0.098	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.6	-166.9	-50.2	-171.9	174.4	0	0	112.6	P325 L326 R335 F339 F359	P325-E337 CarbonylContact C-O 3.54Å; P325-E337 VanDerWaalsContact CA-O 3.29Å; P325-E337 WeakPolarHBondContact CA-O 3.26Å; L326-E337 HydrophobicContact CB-CB 4.27Å; L326-E337 PolarHBondContact N-O 3.41Å; L326-E337 PolarHBondContact O-N 3.46Å; R335-E337 HydrophobicContact CB-CG 4.29Å; R335-E337 IonicContact CZ-OE1 3.74Å; R335-E337 IonicContact CZ-OE2 3.87Å; R335-E337 IonicContact NE-OE1 3.13Å; R335-E337 PolarHBondContact NE-OE1 3.13Å; R335-E337 IonicContact NE-OE2 3.66Å; R335-E337 IonicContact NH2-OE1 3.67Å; R335-E337 PolarHBondContact NH2-OE1 3.43Å; R335-E337 IonicContact NH2-OE2 2.68Å; R335-E337 PolarHBondContact NH2-OE2 3.49Å; E337-F339 PolarHBondContact O-N 3.29Å; E337-F339 VanDerWaalsContact O-N 3.09Å; E337-F359 CarbonylContact C-O 3.57Å; E337-F359 VanDerWaalsContact CA-O 3.24Å; E337-F359 WeakPolarHBondContact CA-O 3.45Å; E337-F359 HydrophobicContact CG-CB 4.09Å
338	N	95.4	Very high	96	Very high	28 Å²	28	67.5 Å²	67.5	15%	0.15	33%	0.334	C	S	.	.	S	Bend	trans	57.6	23.8	168.1	-43.8	-60.6	0	0	0	115.6	R323 L324 F359	R323-N338 HydrophobicContact CB-CB 4.26Å; R323-N338 WeakPolarHBondContact CB-ND2 3.37Å; L324-N338 PolarHBondContact O-ND2 3.4Å; N338-F359 PolarHBondContact N-O 3.26Å
339	F	95.2	Very high	95.6	Very high	28 Å²	28	71.4 Å²	71.4	12%	0.123	35%	0.352	C	S	.	.			trans	-72.4	136.8	171.7	-75	-80.3	0	0	0	111.2	P325 L326 L327 V336 E337 K342 L345 C361 S362 S364	P325-F339 HydrophobicContact CB-CD1 3.7Å; P325-F339 HydrophobicContact CB-CE1 3.62Å; P325-F339 HydrophobicContact CB-CE2 4.47Å; P325-F339 HydrophobicContact CB-CG 4.16Å; P325-F339 HydrophobicContact CB-CZ 4.03Å; L326-F339 VanDerWaalsContact O-CE2 3.22Å; L326-F339 WeakPolarHBondContact O-CE2 3.41Å; L327-F339 HydrophobicContact CB-CE2 3.78Å; L327-F339 HydrophobicContact CB-CZ 3.7Å; L327-F339 HydrophobicContact CD1-CE2 4.47Å; V336-F339 HydrophobicContact CG1-CD2 3.74Å; V336-F339 HydrophobicContact CG1-CE2 3.9Å; E337-F339 PolarHBondContact O-N 3.29Å; E337-F339 VanDerWaalsContact O-N 3.09Å; F339-K342 HydrophobicContact CB-CB 4.33Å; F339-K342 HydrophobicContact CD1-CB 4.12Å; F339-K342 HydrophobicContact CD1-CG 4.1Å; F339-L345 HydrophobicContact CB-CD1 3.89Å; F339-L345 HydrophobicContact CD1-CD1 4.2Å; F339-L345 HydrophobicContact CD1-CD2 3.75Å; F339-L345 HydrophobicContact CD2-CD1 3.74Å; F339-L345 HydrophobicContact CD2-CD2 4.17Å; F339-L345 HydrophobicContact CE1-CD2 3.63Å; F339-L345 HydrophobicContact CE2-CD1 4.31Å; F339-L345 HydrophobicContact CE2-CD2 4.04Å; F339-L345 HydrophobicContact CG-CD1 3.67Å; F339-L345 HydrophobicContact CG-CD2 4.03Å; F339-L345 HydrophobicContact CG-CG 4.47Å; F339-L345 HydrophobicContact CZ-CD2 3.78Å; F339-C361 CarbonylContact O-C 3.5Å; F339-C361 VanDerWaalsContact O-CA 3.24Å; F339-C361 WeakPolarHBondContact O-CA 3.37Å; F339-S362 PolarHBondContact O-N 2.92Å; F339-S364 PolarHBondContact O-OG 3Å
340	E	95.4	Very high	95.5	Very high	90 Å²	90	69.4 Å²	69.4	42%	0.421	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-126.3	134	173.2	-65.2	-174.4	-171.5	0	0	110	K322 K342 S362	K322-E340 WeakPolarHBondContact CE-OE1 3.4Å; K322-E340 WeakPolarHBondContact CE-OE2 3.31Å; K322-E340 IonicContact NZ-OE1 2.72Å; K322-E340 IonicContact NZ-OE2 2.64Å; K322-E340 PolarHBondContact NZ-OE2 3.02Å; E340-K342 PolarHBondContact O-N 3.05Å; E340-S362 VanDerWaalsContact CA-O 3.28Å; E340-S362 WeakPolarHBondContact CA-O 3.4Å
341	Q	95.9	Very high	95.6	Very high	150 Å²	150	68.8 Å²	68.8	70%	0.701	34%	0.34	S	S	*	.	S	Bend	trans	57.8	32	175.1	-54.7	-172	-57.8	0	0	114.1	S362 N363 S364	Q341-S362 PolarHBondContact N-O 3.22Å; Q341-N363 WeakPolarHBondContact CA-O 3.22Å; Q341-N363 HydrophobicContact CG-CB 4.46Å; Q341-N363 PolarHBondContact N-O 2.68Å; Q341-S364 PolarHBondContact N-OG 2.84Å
342	K	95.3	Very high	95.5	Very high	83 Å²	83	70.7 Å²	70.7	36%	0.361	33%	0.333	S	S	.	.			trans	-115	116.6	-176.6	-162	63.3	171.5	143.9	0	110.6	F339 E340 D344 L345 S364 T365	F339-K342 HydrophobicContact CB-CB 4.33Å; F339-K342 HydrophobicContact CD1-CB 4.12Å; F339-K342 HydrophobicContact CD1-CG 4.1Å; E340-K342 PolarHBondContact O-N 3.05Å; K342-D344 WeakPolarHBondContact CD-OD1 3.44Å; K342-D344 WeakPolarHBondContact CE-OD1 3.28Å; K342-D344 WeakPolarHBondContact CG-OD1 3.36Å; K342-D344 IonicContact NZ-OD1 2.74Å; K342-D344 PolarHBondContact NZ-OD1 3.41Å; K342-D344 IonicContact NZ-OD2 3.06Å; K342-D344 PolarHBondContact NZ-OD2 3.47Å; K342-L345 HydrophobicContact CB-CD1 4.43Å; K342-L345 HydrophobicContact CB-CD2 4.4Å; K342-L345 HydrophobicContact CB-CG 4.28Å; K342-L345 HydrophobicContact CG-CD2 3.64Å; K342-L345 HydrophobicContact CG-CG 3.88Å; K342-S364 PolarHBondContact N-OG 3.18Å; K342-S364 CarbonylContact O-C 3.48Å; K342-S364 WeakPolarHBondContact O-CA 3.19Å; K342-S364 WeakPolarHBondContact O-CB 3.29Å; K342-S364 PolarHBondContact O-OG 3.34Å; K342-T365 PolarHBondContact O-N 2.99Å
343	H	95.1	Very high	95.5	Very high	107 Å²	107	69.7 Å²	69.7	50%	0.495	33%	0.329	S	S	.	.			trans	-113.9	4.5	-169.6	-64.6	-70.5	0	0	0	114.5	N363 T365	H343-N363 PolarHBondContact CE1-O 2.96Å; H343-N363 PolarHBondContact NE2-ND2 3.41Å; H343-N363 PolarHBondContact NE2-O 3.14Å; H343-T365 PolarHBondContact ND1-OG1 3.36Å
344	D	94.1	Very high	95.5	Very high	101 Å²	101	66.1 Å²	66.1	54%	0.54	31%	0.314	S	S	.	.			trans	-119.1	24.4	-176.3	59.6	-34.3	0	0	0	111.7	K342 V346	K342-D344 WeakPolarHBondContact CD-OD1 3.44Å; K342-D344 WeakPolarHBondContact CE-OD1 3.28Å; K342-D344 WeakPolarHBondContact CG-OD1 3.36Å; K342-D344 IonicContact NZ-OD1 2.74Å; K342-D344 PolarHBondContact NZ-OD1 3.41Å; K342-D344 IonicContact NZ-OD2 3.06Å; K342-D344 PolarHBondContact NZ-OD2 3.47Å; D344-V346 PolarHBondContact O-N 3.08Å
345	L	97	Very high	95.5	Very high	12 Å²	12	65.9 Å²	65.9	6%	0.063	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	122.9	175.7	-57	172.3	0	0	0	109.1	L327 V336 F339 K342 T365 L366 Q367	L327-L345 HydrophobicContact CD1-CB 4.35Å; L327-L345 HydrophobicContact CD1-CD2 4.06Å; V336-L345 HydrophobicContact CG1-CD1 4.09Å; F339-L345 HydrophobicContact CB-CD1 3.89Å; F339-L345 HydrophobicContact CD1-CD1 4.2Å; F339-L345 HydrophobicContact CD1-CD2 3.75Å; F339-L345 HydrophobicContact CD2-CD1 3.74Å; F339-L345 HydrophobicContact CD2-CD2 4.17Å; F339-L345 HydrophobicContact CE1-CD2 3.63Å; F339-L345 HydrophobicContact CE2-CD1 4.31Å; F339-L345 HydrophobicContact CE2-CD2 4.04Å; F339-L345 HydrophobicContact CG-CD1 3.67Å; F339-L345 HydrophobicContact CG-CD2 4.03Å; F339-L345 HydrophobicContact CG-CG 4.47Å; F339-L345 HydrophobicContact CZ-CD2 3.78Å; K342-L345 HydrophobicContact CB-CD1 4.43Å; K342-L345 HydrophobicContact CB-CD2 4.4Å; K342-L345 HydrophobicContact CB-CG 4.28Å; K342-L345 HydrophobicContact CG-CD2 3.64Å; K342-L345 HydrophobicContact CG-CG 3.88Å; L345-T365 WeakPolarHBondContact CB-O 3.42Å; L345-T365 PolarHBondContact N-O 2.88Å; L345-L366 HydrophobicContact CB-CB 4.43Å; L345-L366 HydrophobicContact CB-CD1 3.74Å; L345-L366 WeakPolarHBondContact O-CA 3.38Å; L345-Q367 PolarHBondContact O-N 2.84Å
346	V	97.9	Very high	95.5	Very high	47 Å²	47	63 Å²	63	29%	0.285	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.2	-179.8	-169	0	0	0	0	110.6	D344 E348 Q367	D344-V346 PolarHBondContact O-N 3.08Å; V346-E348 HydrophobicContact CG1-CG 3.95Å; V346-E348 VanDerWaalsContact CG1-OE1 3.26Å; V346-E348 WeakPolarHBondContact CG1-OE1 3.35Å; V346-Q367 CarbonylContact C-O 3.59Å; V346-Q367 WeakPolarHBondContact CA-O 3.25Å; V346-Q367 HydrophobicContact CG1-CB 4.26Å; V346-Q367 HydrophobicContact CG2-CB 4.31Å
347	I	97.4	Very high	95.5	Very high	2 Å²	2	65 Å²	65	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	101.4	165.8	-57.8	174.5	0	0	0	106.6	W334 V336 T350 V356 L366 Q367 V368 K369	W334-I347 HydrophobicContact CB-CD1 3.85Å; W334-I347 HydrophobicContact CD2-CD1 4.06Å; W334-I347 HydrophobicContact CD2-CG1 4.44Å; W334-I347 HydrophobicContact CD2-CG2 3.87Å; W334-I347 HydrophobicContact CE3-CD1 4.26Å; W334-I347 HydrophobicContact CE3-CG1 4.39Å; W334-I347 HydrophobicContact CE3-CG2 4.38Å; W334-I347 HydrophobicContact CG-CD1 3.9Å; W334-I347 HydrophobicContact CG-CG2 4.25Å; W334-I347 HydrophobicContact CH2-CG2 4.38Å; W334-I347 HydrophobicContact CZ2-CG2 3.86Å; V336-I347 HydrophobicContact CG2-CD1 4.06Å; I347-T350 HydrophobicContact CG2-CG2 3.62Å; I347-V356 HydrophobicContact CD1-CG1 3.98Å; I347-V356 HydrophobicContact CD1-CG2 4.16Å; I347-L366 HydrophobicContact CD1-CD1 4.42Å; I347-L366 HydrophobicContact CG1-CD1 4.3Å; I347-Q367 PolarHBondContact N-O 3.11Å; I347-V368 HydrophobicContact CD1-CG2 4.32Å; I347-K369 PolarHBondContact O-N 2.9Å
348	E	93.9	Very high	95.6	Very high	109 Å²	109	64 Å²	64	51%	0.509	31%	0.309	S	S	.	.			trans	-78.7	-46.6	-174.6	-67.5	-73.4	166.4	0	0	112.3	V346 K369	V346-E348 HydrophobicContact CG1-CG 3.95Å; V346-E348 VanDerWaalsContact CG1-OE1 3.26Å; V346-E348 WeakPolarHBondContact CG1-OE1 3.35Å; E348-K369 IonicContact OE1-NZ 2.83Å; E348-K369 PolarHBondContact OE1-NZ 2.91Å; E348-K369 VanDerWaalsContact OE2-CD 3.26Å; E348-K369 WeakPolarHBondContact OE2-CD 3.33Å; E348-K369 WeakPolarHBondContact OE2-CE 3.23Å; E348-K369 IonicContact OE2-NZ 3.86Å; E348-K369 PolarHBondContact OE2-NZ 3.15Å
349	E	88.6	Confident	95.7	Very high	169 Å²	169	64.6 Å²	64.6	79%	0.79	31%	0.31	S	S	*	.			trans	-107.3	102.7	-174.3	-65.7	-178.2	-171.1	0	0	111
350	T	94.1	Very high	95.7	Very high	27 Å²	27	64.1 Å²	64.1	17%	0.166	31%	0.313	C	S	.	.			trans	-111.9	150	176.9	60	0	0	0	0	112.7	I347 V368 K369 G370 K371 I372	I347-T350 HydrophobicContact CG2-CG2 3.62Å; T350-V368 HydrophobicContact CG2-CG1 3.92Å; T350-K369 WeakPolarHBondContact CB-O 3.29Å; T350-K369 WeakPolarHBondContact CG2-O 3.48Å; T350-K369 PolarHBondContact OG1-O 3.32Å; T350-G370 WeakPolarHBondContact OG1-CA 3.42Å; T350-K371 PolarHBondContact OG1-N 3.11Å; T350-K371 VanDerWaalsContact OG1-N 3.17Å; T350-I372 HydrophobicContact CG2-CD1 3.72Å
351	E	94.6	Very high	95.8	Very high	92 Å²	92	59.9 Å²	59.9	43%	0.43	29%	0.294	S	S	.	.			trans	-116.3	150	171.2	-61.5	-180	-154.3	0	0	111.9	K353 Q354 K371	E351-K353 HydrophobicContact CB-CG 4.48Å; E351-K353 PolarHBondContact O-N 3.17Å; E351-K353 IonicContact OE1-NZ 3.63Å; E351-K353 WeakPolarHBondContact OE2-CE 3.39Å; E351-K353 IonicContact OE2-NZ 3.44Å; E351-K353 PolarHBondContact OE2-NZ 3.49Å; E351-Q354 HydrophobicContact CB-CG 3.98Å; E351-Q354 WeakPolarHBondContact O-CB 3.17Å; E351-Q354 PolarHBondContact O-N 2.83Å; E351-K371 CarbonylContact C-O 3.55Å
352	L	93.1	Very high	95.9	Very high	108 Å²	108	54.8 Å²	54.8	57%	0.565	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-28.8	179.5	-81.5	162.7	0	0	0	115.1	K371 N373 V391	L352-K371 HydrophobicContact CD2-CB 4.43Å; L352-K371 HydrophobicContact CD2-CD 3.67Å; L352-K371 HydrophobicContact CD2-CG 3.66Å; L352-K371 PolarHBondContact N-O 3.19Å; L352-N373 WeakPolarHBondContact O-CA 3.46Å; L352-N373 VanDerWaalsContact O-CB 3.32Å; L352-N373 WeakPolarHBondContact O-CB 3.37Å; L352-N373 PolarHBondContact O-N 3.46Å; L352-V391 HydrophobicContact CD2-CG2 3.63Å
353	K	93.7	Very high	96	Very high	108 Å²	108	53.5 Å²	53.5	47%	0.47	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.7	-177.3	74.2	-167.5	-169.2	-135	0	113.4	K332 E351	K332-K353 HydrophobicContact CD-CD 4.28Å; K332-K353 HydrophobicContact CD-CG 4.12Å; K332-K353 HydrophobicContact CG-CG 4.49Å; E351-K353 HydrophobicContact CB-CG 4.48Å; E351-K353 PolarHBondContact O-N 3.17Å; E351-K353 IonicContact OE1-NZ 3.63Å; E351-K353 WeakPolarHBondContact OE2-CE 3.39Å; E351-K353 IonicContact OE2-NZ 3.44Å; E351-K353 PolarHBondContact OE2-NZ 3.49Å
354	Q	97.4	Very high	96.1	Very high	7 Å²	7	48.4 Å²	48.4	3%	0.033	25%	0.248	C	C	.	.			trans	-83.2	159.4	-176.6	-69.9	170.1	-6.2	0	0	111	L329 K332 E351 I372 N373	L329-Q354 HydrophobicContact CD1-CG 4.48Å; K332-Q354 CarbonylContact O-C 3.55Å; K332-Q354 WeakPolarHBondContact O-CA 3.32Å; K332-Q354 WeakPolarHBondContact O-CB 3.35Å; E351-Q354 HydrophobicContact CB-CG 3.98Å; E351-Q354 WeakPolarHBondContact O-CB 3.17Å; E351-Q354 PolarHBondContact O-N 2.83Å; Q354-I372 VanDerWaalsContact C-CG1 3.43Å; Q354-I372 HydrophobicContact CB-CD1 3.71Å; Q354-I372 HydrophobicContact CB-CG1 3.88Å; Q354-I372 WeakPolarHBondContact O-CG1 3.42Å; Q354-N373 WeakPolarHBondContact O-CB 3.26Å; Q354-N373 PolarHBondContact O-N 3.25Å
355	V	97.8	Very high	96.3	Very high	33 Å²	33	45.9 Å²	45.9	20%	0.2	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.6	175.7	175.9	0	0	0	0	108.2	K332 K333 W334 N373 S374 I376	K332-V355 PolarHBondContact O-N 2.64Å; K333-V355 CarbonylContact C-O 3.43Å; K333-V355 WeakPolarHBondContact CA-O 3.32Å; W334-V355 PolarHBondContact N-O 2.72Å; V355-N373 HydrophobicContact CG2-CB 4.21Å; V355-S374 WeakPolarHBondContact CA-O 3.38Å; V355-S374 WeakPolarHBondContact CG1-OG 3.39Å; V355-S374 WeakPolarHBondContact CG2-OG 3.12Å; V355-I376 HydrophobicContact CG1-CD1 4.47Å
356	V	98.7	Very high	96.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.4	172.7	-174	0	0	0	0	109.6	W334 V336 I347 V358 L366 V368 I372 S374 I375 I376	W334-V356 HydrophobicContact CB-CB 4.44Å; W334-V356 HydrophobicContact CB-CG1 4.33Å; W334-V356 HydrophobicContact CB-CG2 4.18Å; V336-V356 HydrophobicContact CG2-CG1 4.46Å; I347-V356 HydrophobicContact CD1-CG1 3.98Å; I347-V356 HydrophobicContact CD1-CG2 4.16Å; V356-V358 HydrophobicContact CG1-CG2 3.95Å; V356-L366 HydrophobicContact CG1-CD2 4.28Å; V356-V368 HydrophobicContact CG1-CG2 4.41Å; V356-V368 HydrophobicContact CG2-CG1 3.97Å; V356-V368 HydrophobicContact CG2-CG2 4.27Å; V356-I372 HydrophobicContact CG2-CD1 3.42Å; V356-I372 VanDerWaalsContact CG2-CD1 3.42Å; V356-I372 HydrophobicContact CG2-CG1 4.3Å; V356-S374 PolarHBondContact N-O 3.33Å; V356-I375 HydrophobicContact CB-CB 4.47Å; V356-I375 HydrophobicContact CB-CG1 4.17Å; V356-I375 HydrophobicContact CB-CG2 4.12Å; V356-I375 HydrophobicContact CG1-CG2 4.45Å; V356-I375 HydrophobicContact CG2-CG1 4.37Å; V356-I375 CarbonylContact O-C 3.53Å; V356-I375 WeakPolarHBondContact O-CA 3.37Å; V356-I376 PolarHBondContact O-N 2.91Å
357	Y	98.6	Very high	96.4	Very high	43 Å²	43	46.3 Å²	46.3	17%	0.169	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.2	175	-176.7	-109.2	0	0	0	109.5	W334 V336 F359 I376 D378	W334-Y357 PolarHBondContact O-N 3.19Å; V336-Y357 PolarHBondContact N-O 2.88Å; Y357-F359 HydrophobicContact CD1-CB 4.3Å; Y357-F359 HydrophobicContact CE1-CB 3.67Å; Y357-F359 HydrophobicContact CE1-CD2 4.44Å; Y357-F359 HydrophobicContact CE1-CG 4.28Å; Y357-F359 WeakPolarHBondContact OH-CD2 3.41Å; Y357-I376 CarbonylContact C-O 3.59Å; Y357-I376 WeakPolarHBondContact CA-O 3.49Å; Y357-I376 HydrophobicContact CD2-CB 3.87Å; Y357-I376 HydrophobicContact CD2-CG2 3.76Å; Y357-I376 HydrophobicContact CE2-CB 4.44Å; Y357-I376 HydrophobicContact CE2-CG2 3.81Å; Y357-D378 HydrophobicContact CE2-CB 4.24Å; Y357-D378 PolarHBondContact OH-OD2 2.97Å
358	V	98.6	Very high	96.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.3	-179.4	-166.7	0	0	0	0	108.4	V336 V356 C361 L366 I376 V377 D378 L383	V336-V358 HydrophobicContact CB-CG1 4.24Å; V336-V358 HydrophobicContact CB-CG2 4.34Å; V336-V358 HydrophobicContact CG1-CG1 4.28Å; V336-V358 CarbonylContact O-C 2.99Å; V336-V358 VanDerWaalsContact O-CA 3.25Å; V336-V358 WeakPolarHBondContact O-CA 3.48Å; V356-V358 HydrophobicContact CG1-CG2 3.95Å; V358-C361 HydrophobicContact CG1-CB 4.22Å; V358-L366 HydrophobicContact CG1-CD2 4.49Å; V358-L366 HydrophobicContact CG2-CD2 3.47Å; V358-L366 VanDerWaalsContact CG2-CD2 3.47Å; V358-I376 PolarHBondContact N-O 2.86Å; V358-V377 HydrophobicContact CB-CG2 4.29Å; V358-V377 HydrophobicContact CG2-CG2 4.32Å; V358-V377 CarbonylContact O-C 3.52Å; V358-V377 WeakPolarHBondContact O-CA 3.31Å; V358-D378 PolarHBondContact O-N 2.99Å; V358-L383 HydrophobicContact CG1-CD2 3.85Å
359	F	98.1	Very high	96.6	Very high	40 Å²	40	43.8 Å²	43.8	18%	0.175	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.9	-175.5	-179.4	-96.8	0	0	0	112.7	V336 E337 N338 Y357 C361 D378 N379	V336-F359 PolarHBondContact O-N 3.04Å; E337-F359 CarbonylContact C-O 3.57Å; E337-F359 VanDerWaalsContact CA-O 3.24Å; E337-F359 WeakPolarHBondContact CA-O 3.45Å; E337-F359 HydrophobicContact CG-CB 4.09Å; N338-F359 PolarHBondContact N-O 3.26Å; Y357-F359 HydrophobicContact CD1-CB 4.3Å; Y357-F359 HydrophobicContact CE1-CB 3.67Å; Y357-F359 HydrophobicContact CE1-CD2 4.44Å; Y357-F359 HydrophobicContact CE1-CG 4.28Å; Y357-F359 WeakPolarHBondContact OH-CD2 3.41Å; F359-C361 PolarHBondContact O-N 3.16Å; F359-D378 VanDerWaalsContact CA-O 3.3Å; F359-D378 WeakPolarHBondContact CA-O 3.48Å; F359-D378 HydrophobicContact CD2-CB 4.1Å; F359-N379 HydrophobicContact CD2-CB 4.15Å; F359-N379 HydrophobicContact CE2-CB 3.74Å; F359-N379 HydrophobicContact CZ-CB 4.31Å
360	G	95.4	Very high	97	Very high	19 Å²	19	37 Å²	37	20%	0.196	20%	0.198	C	C	.	.	S	Bend	trans	64.5	16.1	167.8	0	0	0	0	0	115	D378 N379	G360-D378 PolarHBondContact N-O 3.2Å; G360-D378 VanDerWaalsContact N-O 3.1Å; G360-N379 VanDerWaalsContact CA-O 3.29Å; G360-N379 WeakPolarHBondContact CA-O 3.11Å
361	C	96.6	Very high	97.1	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.007	21%	0.211	C	C	.	.			trans	-79.2	137.9	-179.9	-67.2	0	0	0	0	110.5	F339 V358 F359 C380 K381 L383	F339-C361 CarbonylContact O-C 3.5Å; F339-C361 VanDerWaalsContact O-CA 3.24Å; F339-C361 WeakPolarHBondContact O-CA 3.37Å; V358-C361 HydrophobicContact CG1-CB 4.22Å; F359-C361 PolarHBondContact O-N 3.16Å; C361-C380 PolarHBondContact N-SG 3.45Å; C361-C380 VanDerWaalsContact N-SG 3.39Å; C361-C380 CarbonylContact O-C 3.51Å; C361-C380 VanDerWaalsContact O-CA 3.26Å; C361-C380 WeakPolarHBondContact O-CA 3.04Å; C361-C380 WeakPolarHBondContact O-CB 3.39Å; C361-K381 PolarHBondContact O-N 2.97Å; C361-L383 HydrophobicContact CB-CD1 4.01Å
362	S	97.2	Very high	97.2	Very high	42 Å²	42	36.3 Å²	36.3	29%	0.294	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.9	-177	-169.9	0	0	0	0	111.7	F339 E340 Q341 S364 K381	F339-S362 PolarHBondContact O-N 2.92Å; E340-S362 VanDerWaalsContact CA-O 3.28Å; E340-S362 WeakPolarHBondContact CA-O 3.4Å; Q341-S362 PolarHBondContact N-O 3.22Å; S362-S364 VanDerWaalsContact C-N 3.31Å; S362-S364 PolarHBondContact O-N 3.48Å; S362-S364 PolarHBondContact O-OG 3Å; S362-K381 CarbonylContact C-O 3.57Å; S362-K381 WeakPolarHBondContact CA-O 3.33Å
363	N	97.1	Very high	97.4	Very high	56 Å²	56	34.3 Å²	34.3	30%	0.299	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.4	52.6	177.8	-167.3	76.5	0	0	0	112	Q341 H343 K381 K382	Q341-N363 WeakPolarHBondContact CA-O 3.22Å; Q341-N363 HydrophobicContact CG-CB 4.46Å; Q341-N363 PolarHBondContact N-O 2.68Å; H343-N363 PolarHBondContact CE1-O 2.96Å; H343-N363 PolarHBondContact NE2-ND2 3.41Å; H343-N363 PolarHBondContact NE2-O 3.14Å; N363-K381 PolarHBondContact N-O 2.97Å; N363-K382 CarbonylContact C-O 3.51Å; N363-K382 WeakPolarHBondContact CA-O 3.39Å; N363-K382 HydrophobicContact CB-CB 4.41Å; N363-K382 PolarHBondContact N-O 3.08Å
364	S	97.9	Very high	97.6	Very high	1 Å²	1	30 Å²	30	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	163.1	-170.3	-66.3	0	0	0	0	110.7	F339 Q341 K342 S362 K382 L383 G384	F339-S364 PolarHBondContact O-OG 3Å; Q341-S364 PolarHBondContact N-OG 2.84Å; K342-S364 PolarHBondContact N-OG 3.18Å; K342-S364 CarbonylContact O-C 3.48Å; K342-S364 WeakPolarHBondContact O-CA 3.19Å; K342-S364 WeakPolarHBondContact O-CB 3.29Å; K342-S364 PolarHBondContact O-OG 3.34Å; S362-S364 VanDerWaalsContact C-N 3.31Å; S362-S364 PolarHBondContact O-N 3.48Å; S362-S364 PolarHBondContact O-OG 3Å; S364-K382 PolarHBondContact N-O 3.22Å; S364-L383 WeakPolarHBondContact O-CA 3.31Å; S364-G384 PolarHBondContact O-N 3.24Å
365	T	97.9	Very high	97.7	Very high	47 Å²	47	29.7 Å²	29.7	29%	0.288	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	128.8	177.6	-52.2	0	0	0	0	109.5	K342 H343 L345 G384	K342-T365 PolarHBondContact O-N 2.99Å; H343-T365 PolarHBondContact ND1-OG1 3.36Å; L345-T365 WeakPolarHBondContact CB-O 3.42Å; L345-T365 PolarHBondContact N-O 2.88Å; T365-G384 CarbonylContact C-O 3.42Å; T365-G384 VanDerWaalsContact CA-O 3.28Å; T365-G384 WeakPolarHBondContact CA-O 3.38Å
366	L	98.3	Very high	97.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.1	177.1	176	65.1	0	0	0	110.2	V336 L345 I347 V356 V358 V368 G384 L385 V386	V336-L366 HydrophobicContact CB-CD2 4.33Å; V336-L366 HydrophobicContact CG1-CD1 4.42Å; V336-L366 HydrophobicContact CG1-CD2 4.25Å; V336-L366 HydrophobicContact CG2-CD1 4.28Å; V336-L366 HydrophobicContact CG2-CD2 4.01Å; L345-L366 HydrophobicContact CB-CB 4.43Å; L345-L366 HydrophobicContact CB-CD1 3.74Å; L345-L366 WeakPolarHBondContact O-CA 3.38Å; I347-L366 HydrophobicContact CD1-CD1 4.42Å; I347-L366 HydrophobicContact CG1-CD1 4.3Å; V356-L366 HydrophobicContact CG1-CD2 4.28Å; V358-L366 HydrophobicContact CG1-CD2 4.49Å; V358-L366 HydrophobicContact CG2-CD2 3.47Å; V358-L366 VanDerWaalsContact CG2-CD2 3.47Å; L366-V368 HydrophobicContact CD2-CG2 4.11Å; L366-V368 HydrophobicContact CG-CG2 4.07Å; L366-G384 PolarHBondContact N-O 2.85Å; L366-L385 HydrophobicContact CB-CD1 4.26Å; L366-L385 HydrophobicContact CD2-CD1 4.05Å; L366-L385 HydrophobicContact CG-CD1 4.13Å; L366-L385 WeakPolarHBondContact O-CA 3.38Å; L366-V386 PolarHBondContact O-N 2.91Å
367	Q	98.5	Very high	97.7	Very high	69 Å²	69	30 Å²	30	32%	0.322	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.5	170.3	-172.3	175.3	7.6	0	0	110.6	L345 V346 I347 K369 V386	L345-Q367 PolarHBondContact O-N 2.84Å; V346-Q367 CarbonylContact C-O 3.59Å; V346-Q367 WeakPolarHBondContact CA-O 3.25Å; V346-Q367 HydrophobicContact CG1-CB 4.26Å; V346-Q367 HydrophobicContact CG2-CB 4.31Å; I347-Q367 PolarHBondContact N-O 3.11Å; Q367-K369 HydrophobicContact CG-CG 4.19Å; Q367-V386 CarbonylContact C-O 3.54Å; Q367-V386 VanDerWaalsContact CA-O 3.3Å; Q367-V386 WeakPolarHBondContact CA-O 3.44Å; Q367-V386 HydrophobicContact CG-CB 4.46Å
368	V	98.3	Very high	97.7	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.024	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	106.3	176	-175.3	0	0	0	0	108.7	I347 T350 V356 L366 L385 V386 F387 E388	I347-V368 HydrophobicContact CD1-CG2 4.32Å; T350-V368 HydrophobicContact CG2-CG1 3.92Å; V356-V368 HydrophobicContact CG1-CG2 4.41Å; V356-V368 HydrophobicContact CG2-CG1 3.97Å; V356-V368 HydrophobicContact CG2-CG2 4.27Å; L366-V368 HydrophobicContact CD2-CG2 4.11Å; L366-V368 HydrophobicContact CG-CG2 4.07Å; V368-L385 HydrophobicContact CG2-CD1 4.04Å; V368-V386 PolarHBondContact N-O 2.74Å; V368-F387 HydrophobicContact CB-CB 3.98Å; V368-F387 VanDerWaalsContact O-CA 3.28Å; V368-F387 WeakPolarHBondContact O-CA 3.27Å; V368-E388 PolarHBondContact O-N 2.87Å
369	K	97.8	Very high	97.6	Very high	53 Å²	53	32.7 Å²	32.7	23%	0.23	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	158	-179.7	-61.3	-170.6	-169.1	163.8	0	111.4	I347 E348 T350 Q367	I347-K369 PolarHBondContact O-N 2.9Å; E348-K369 IonicContact OE1-NZ 2.83Å; E348-K369 PolarHBondContact OE1-NZ 2.91Å; E348-K369 VanDerWaalsContact OE2-CD 3.26Å; E348-K369 WeakPolarHBondContact OE2-CD 3.33Å; E348-K369 WeakPolarHBondContact OE2-CE 3.23Å; E348-K369 IonicContact OE2-NZ 3.86Å; E348-K369 PolarHBondContact OE2-NZ 3.15Å; T350-K369 WeakPolarHBondContact CB-O 3.29Å; T350-K369 WeakPolarHBondContact CG2-O 3.48Å; T350-K369 PolarHBondContact OG1-O 3.32Å; Q367-K369 HydrophobicContact CG-CG 4.19Å
370	G	96.3	Very high	97.6	Very high	27 Å²	27	30.8 Å²	30.8	28%	0.278	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	81.3	-143.7	178.2	0	0	0	0	0	114.1	T350 E388 N389	T350-G370 WeakPolarHBondContact OG1-CA 3.42Å; G370-E388 WeakPolarHBondContact CA-OE2 3.37Å; G370-E388 VanDerWaalsContact N-CD 3.34Å; G370-E388 PolarHBondContact N-OE2 2.84Å; G370-E388 WeakPolarHBondContact O-CB 3.48Å; G370-N389 PolarHBondContact O-N 3.35Å; G370-N389 VanDerWaalsContact O-N 3.13Å
371	K	96.4	Very high	97.8	Very high	104 Å²	104	35.5 Å²	35.5	45%	0.452	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	118.1	-171.5	-174.4	170.4	176.1	177.7	0	110.8	T350 E351 L352 N389 V391	T350-K371 PolarHBondContact OG1-N 3.11Å; T350-K371 VanDerWaalsContact OG1-N 3.17Å; E351-K371 CarbonylContact C-O 3.55Å; L352-K371 HydrophobicContact CD2-CB 4.43Å; L352-K371 HydrophobicContact CD2-CD 3.67Å; L352-K371 HydrophobicContact CD2-CG 3.66Å; L352-K371 PolarHBondContact N-O 3.19Å; K371-N389 WeakPolarHBondContact CA-O 3.48Å; K371-N389 HydrophobicContact CB-CB 3.92Å; K371-N389 HydrophobicContact CD-CB 4.16Å; K371-N389 HydrophobicContact CG-CB 3.68Å; K371-V391 HydrophobicContact CD-CG2 4.36Å; K371-V391 HydrophobicContact CG-CG2 4.13Å
372	I	97.3	Very high	97.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	167	-174.4	-151.9	135.8	0	0	0	111.4	T350 Q354 V356 I375 N389 A390 V391	T350-I372 HydrophobicContact CG2-CD1 3.72Å; Q354-I372 VanDerWaalsContact C-CG1 3.43Å; Q354-I372 HydrophobicContact CB-CD1 3.71Å; Q354-I372 HydrophobicContact CB-CG1 3.88Å; Q354-I372 WeakPolarHBondContact O-CG1 3.42Å; V356-I372 HydrophobicContact CG2-CD1 3.42Å; V356-I372 VanDerWaalsContact CG2-CD1 3.42Å; V356-I372 HydrophobicContact CG2-CG1 4.3Å; I372-I375 HydrophobicContact CG2-CD1 4.3Å; I372-I375 HydrophobicContact CG2-CG1 3.87Å; I372-N389 PolarHBondContact N-O 3.29Å; I372-A390 WeakPolarHBondContact O-CA 3.35Å; I372-V391 PolarHBondContact O-N 3.33Å
373	N	97.9	Very high	97.9	Very high	66 Å²	66	40 Å²	40	35%	0.353	20%	0.201	S	C	.	.	S	Bend	trans	-70.9	-57.6	178.2	-168.4	17.8	0	0	0	110.8	L352 Q354 V355 V391 G392	L352-N373 WeakPolarHBondContact O-CA 3.46Å; L352-N373 VanDerWaalsContact O-CB 3.32Å; L352-N373 WeakPolarHBondContact O-CB 3.37Å; L352-N373 PolarHBondContact O-N 3.46Å; Q354-N373 WeakPolarHBondContact O-CB 3.26Å; Q354-N373 PolarHBondContact O-N 3.25Å; V355-N373 HydrophobicContact CG2-CB 4.21Å; N373-V391 PolarHBondContact O-N 2.65Å; N373-G392 WeakPolarHBondContact O-CA 3.39Å; N373-G392 PolarHBondContact O-N 2.83Å
374	S	97.9	Very high	98	Very high	18 Å²	18	37.9 Å²	37.9	13%	0.126	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	163.2	-178.2	55.4	0	0	0	0	111.7	V355 V356 I393	V355-S374 WeakPolarHBondContact CA-O 3.38Å; V355-S374 WeakPolarHBondContact CG1-OG 3.39Å; V355-S374 WeakPolarHBondContact CG2-OG 3.12Å; V356-S374 PolarHBondContact N-O 3.33Å; S374-I393 WeakPolarHBondContact CA-O 3.38Å; S374-I393 WeakPolarHBondContact CB-O 3.33Å
375	I	98.8	Very high	98	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.4	175.6	-54.8	174.1	0	0	0	108.4	V356 I372 V377 L385 F387 I393 V394 E395	V356-I375 HydrophobicContact CB-CB 4.47Å; V356-I375 HydrophobicContact CB-CG1 4.17Å; V356-I375 HydrophobicContact CB-CG2 4.12Å; V356-I375 HydrophobicContact CG1-CG2 4.45Å; V356-I375 HydrophobicContact CG2-CG1 4.37Å; V356-I375 CarbonylContact O-C 3.53Å; V356-I375 WeakPolarHBondContact O-CA 3.37Å; I372-I375 HydrophobicContact CG2-CD1 4.3Å; I372-I375 HydrophobicContact CG2-CG1 3.87Å; I375-V377 HydrophobicContact CG2-CG2 4.39Å; I375-L385 HydrophobicContact CG2-CD2 3.74Å; I375-F387 HydrophobicContact CD1-CB 3.69Å; I375-F387 HydrophobicContact CD1-CD1 4.21Å; I375-F387 HydrophobicContact CD1-CD2 3.83Å; I375-F387 HydrophobicContact CD1-CG 3.63Å; I375-I393 PolarHBondContact N-O 3.22Å; I375-V394 HydrophobicContact CB-CG1 4.26Å; I375-V394 HydrophobicContact CB-CG2 4.18Å; I375-V394 HydrophobicContact CD1-CG2 4.46Å; I375-V394 HydrophobicContact CG1-CG2 4.47Å; I375-V394 CarbonylContact O-C 3.58Å; I375-V394 VanDerWaalsContact O-CA 3.31Å; I375-V394 WeakPolarHBondContact O-CA 3.47Å; I375-E395 PolarHBondContact O-N 2.91Å
376	I	98.8	Very high	98	Very high	39 Å²	39	37.2 Å²	37.2	20%	0.2	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	125.3	176.9	-59	166.2	0	0	0	107.8	V355 V356 Y357 V358 E395 I397	V355-I376 HydrophobicContact CG1-CD1 4.47Å; V356-I376 PolarHBondContact O-N 2.91Å; Y357-I376 CarbonylContact C-O 3.59Å; Y357-I376 WeakPolarHBondContact CA-O 3.49Å; Y357-I376 HydrophobicContact CD2-CB 3.87Å; Y357-I376 HydrophobicContact CD2-CG2 3.76Å; Y357-I376 HydrophobicContact CE2-CB 4.44Å; Y357-I376 HydrophobicContact CE2-CG2 3.81Å; V358-I376 PolarHBondContact N-O 2.86Å; I376-E395 CarbonylContact C-O 3.48Å; I376-E395 WeakPolarHBondContact CA-O 3.46Å; I376-E395 HydrophobicContact CG1-CB 4.47Å; I376-I397 HydrophobicContact CG2-CD1 4.38Å
377	V	98.8	Very high	98	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.8	174.7	179	0	0	0	0	107.8	V358 I375 C380 L383 L385 E395 I396 I397	V358-V377 HydrophobicContact CB-CG2 4.29Å; V358-V377 HydrophobicContact CG2-CG2 4.32Å; V358-V377 CarbonylContact O-C 3.52Å; V358-V377 WeakPolarHBondContact O-CA 3.31Å; I375-V377 HydrophobicContact CG2-CG2 4.39Å; V377-C380 HydrophobicContact CG1-CB 3.78Å; V377-L383 HydrophobicContact CG1-CD2 3.6Å; V377-L383 HydrophobicContact CG2-CD2 4.31Å; V377-L385 HydrophobicContact CG2-CD2 3.7Å; V377-E395 PolarHBondContact N-O 3.37Å; V377-I396 HydrophobicContact CB-CG1 4.43Å; V377-I396 CarbonylContact O-C 3.49Å; V377-I396 WeakPolarHBondContact O-CA 3.45Å; V377-I397 PolarHBondContact O-N 2.84Å
378	D	98.3	Very high	98	Very high	29 Å²	29	37.2 Å²	37.2	16%	0.155	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.2	-178.7	-173.6	23.4	0	0	0	111.7	Y357 V358 F359 G360 C380 I397 N398	Y357-D378 HydrophobicContact CE2-CB 4.24Å; Y357-D378 PolarHBondContact OH-OD2 2.97Å; V358-D378 PolarHBondContact O-N 2.99Å; F359-D378 VanDerWaalsContact CA-O 3.3Å; F359-D378 WeakPolarHBondContact CA-O 3.48Å; F359-D378 HydrophobicContact CD2-CB 4.1Å; G360-D378 PolarHBondContact N-O 3.2Å; G360-D378 VanDerWaalsContact N-O 3.1Å; D378-C380 PolarHBondContact O-N 3.16Å; D378-C380 VanDerWaalsContact O-N 3.08Å; D378-C380 PolarHBondContact O-SG 3.39Å; D378-I397 VanDerWaalsContact CA-O 3.31Å; D378-I397 WeakPolarHBondContact CA-O 3.32Å; D378-N398 WeakPolarHBondContact OD1-CB 3.41Å; D378-N398 PolarHBondContact OD1-ND2 2.95Å
379	N	96.9	Very high	97.9	Very high	71 Å²	71	39.2 Å²	39.2	38%	0.38	20%	0.199	S	C	.	.	S	Bend	trans	52.8	33.5	174.9	-170.1	40.3	0	0	0	114.4	F359 G360 I397 N398 S399	F359-N379 HydrophobicContact CD2-CB 4.15Å; F359-N379 HydrophobicContact CE2-CB 3.74Å; F359-N379 HydrophobicContact CZ-CB 4.31Å; G360-N379 VanDerWaalsContact CA-O 3.29Å; G360-N379 WeakPolarHBondContact CA-O 3.11Å; N379-I397 PolarHBondContact N-O 3.35Å; N379-I397 VanDerWaalsContact N-O 3.1Å; N379-N398 WeakPolarHBondContact CA-O 3.39Å; N379-S399 PolarHBondContact N-OG 3.46Å
380	C	97.8	Very high	97.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.			trans	-97.1	153.8	-179.6	-68.5	0	0	0	0	111.6	C361 V377 D378 L383 S399 R400 I402	C361-C380 PolarHBondContact N-SG 3.45Å; C361-C380 VanDerWaalsContact N-SG 3.39Å; C361-C380 CarbonylContact O-C 3.51Å; C361-C380 VanDerWaalsContact O-CA 3.26Å; C361-C380 WeakPolarHBondContact O-CA 3.04Å; C361-C380 WeakPolarHBondContact O-CB 3.39Å; V377-C380 HydrophobicContact CG1-CB 3.78Å; D378-C380 PolarHBondContact O-N 3.16Å; D378-C380 VanDerWaalsContact O-N 3.08Å; D378-C380 PolarHBondContact O-SG 3.39Å; C380-L383 HydrophobicContact CB-CB 4.09Å; C380-L383 HydrophobicContact CB-CD2 3.96Å; C380-S399 PolarHBondContact N-OG 3.39Å; C380-S399 CarbonylContact O-C 3.54Å; C380-S399 VanDerWaalsContact O-CA 3.24Å; C380-S399 WeakPolarHBondContact O-CA 3.41Å; C380-S399 WeakPolarHBondContact O-CB 3.33Å; C380-R400 PolarHBondContact O-N 2.93Å; C380-I402 HydrophobicContact CB-CD1 4.03Å
381	K	98.3	Very high	97.9	Very high	118 Å²	118	38.9 Å²	38.9	51%	0.513	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128.4	-179.7	-63.9	179.6	-175.7	170	0	110.8	C361 S362 N363 L383 R400	C361-K381 PolarHBondContact O-N 2.97Å; S362-K381 CarbonylContact C-O 3.57Å; S362-K381 WeakPolarHBondContact CA-O 3.33Å; N363-K381 PolarHBondContact N-O 2.97Å; K381-L383 VanDerWaalsContact C-N 3.3Å; K381-L383 PolarHBondContact O-N 2.89Å; K381-R400 CarbonylContact C-O 3.59Å; K381-R400 VanDerWaalsContact CA-O 3.23Å; K381-R400 WeakPolarHBondContact CA-O 3.45Å; K381-R400 HydrophobicContact CG-CB 4.39Å
382	K	97.9	Very high	97.9	Very high	134 Å²	134	35 Å²	35	58%	0.583	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	53.3	48.1	-178.5	-60.4	-175.7	176.2	-172.4	0	111.8	N363 S364 R400 S401	N363-K382 CarbonylContact C-O 3.51Å; N363-K382 WeakPolarHBondContact CA-O 3.39Å; N363-K382 HydrophobicContact CB-CB 4.41Å; N363-K382 PolarHBondContact N-O 3.08Å; S364-K382 PolarHBondContact N-O 3.22Å; K382-R400 PolarHBondContact N-O 3.21Å; K382-S401 WeakPolarHBondContact CA-O 3.22Å; K382-S401 PolarHBondContact N-O 3.25Å
383	L	98.6	Very high	97.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.3	179.5	-179.6	76.6	0	0	0	109.5	V358 C361 S364 V377 C380 K381 S401 I402 Q403	V358-L383 HydrophobicContact CG1-CD2 3.85Å; C361-L383 HydrophobicContact CB-CD1 4.01Å; S364-L383 WeakPolarHBondContact O-CA 3.31Å; V377-L383 HydrophobicContact CG1-CD2 3.6Å; V377-L383 HydrophobicContact CG2-CD2 4.31Å; C380-L383 HydrophobicContact CB-CB 4.09Å; C380-L383 HydrophobicContact CB-CD2 3.96Å; K381-L383 VanDerWaalsContact C-N 3.3Å; K381-L383 PolarHBondContact O-N 2.89Å; L383-S401 PolarHBondContact N-O 3.34Å; L383-I402 HydrophobicContact CB-CD1 3.71Å; L383-Q403 PolarHBondContact O-N 3.41Å
384	G	98.6	Very high	97.9	Very high	13 Å²	13	34.4 Å²	34.4	13%	0.134	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.1	162.6	0	0	0	0	0	110.2	S364 T365 L366 Q403	S364-G384 PolarHBondContact O-N 3.24Å; T365-G384 CarbonylContact C-O 3.42Å; T365-G384 VanDerWaalsContact CA-O 3.28Å; T365-G384 WeakPolarHBondContact CA-O 3.38Å; L366-G384 PolarHBondContact N-O 2.85Å; G384-Q403 CarbonylContact C-O 3.47Å; G384-Q403 WeakPolarHBondContact CA-O 3.49Å
385	L	98.6	Very high	97.9	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.9	174.4	173.3	59.8	0	0	0	109.1	L366 V368 I375 V377 F387 Q403 L404 Q405	L366-L385 HydrophobicContact CB-CD1 4.26Å; L366-L385 HydrophobicContact CD2-CD1 4.05Å; L366-L385 HydrophobicContact CG-CD1 4.13Å; L366-L385 WeakPolarHBondContact O-CA 3.38Å; V368-L385 HydrophobicContact CG2-CD1 4.04Å; I375-L385 HydrophobicContact CG2-CD2 3.74Å; V377-L385 HydrophobicContact CG2-CD2 3.7Å; L385-F387 HydrophobicContact CG-CD1 4.45Å; L385-Q403 PolarHBondContact N-O 3.5Å; L385-L404 HydrophobicContact CB-CD1 3.87Å; L385-L404 HydrophobicContact CD2-CD1 3.45Å; L385-L404 VanDerWaalsContact CD2-CD1 3.45Å; L385-L404 HydrophobicContact CG-CD1 3.64Å; L385-L404 CarbonylContact O-C 3.56Å; L385-L404 WeakPolarHBondContact O-CA 3.48Å; L385-Q405 PolarHBondContact O-N 3.21Å
386	V	98.6	Very high	97.9	Very high	32 Å²	32	36.2 Å²	36.2	19%	0.194	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.8	172.7	-175	0	0	0	0	108.2	L366 Q367 V368 Q405 L407	L366-V386 PolarHBondContact O-N 2.91Å; Q367-V386 CarbonylContact C-O 3.54Å; Q367-V386 VanDerWaalsContact CA-O 3.3Å; Q367-V386 WeakPolarHBondContact CA-O 3.44Å; Q367-V386 HydrophobicContact CG-CB 4.46Å; V368-V386 PolarHBondContact N-O 2.74Å; V386-Q405 WeakPolarHBondContact CA-O 3.36Å; V386-Q405 HydrophobicContact CG2-CB 4.31Å; V386-L407 HydrophobicContact CG1-CD1 3.9Å; V386-L407 HydrophobicContact CG1-CD2 4.24Å; V386-L407 HydrophobicContact CG1-CG 3.98Å
387	F	98.4	Very high	97.9	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.013	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	152.1	177.5	72.7	-77	0	0	0	112.3	V368 I375 L385 A390 V394 L404 Q405 V406 L407 V410	V368-F387 HydrophobicContact CB-CB 3.98Å; V368-F387 VanDerWaalsContact O-CA 3.28Å; V368-F387 WeakPolarHBondContact O-CA 3.27Å; I375-F387 HydrophobicContact CD1-CB 3.69Å; I375-F387 HydrophobicContact CD1-CD1 4.21Å; I375-F387 HydrophobicContact CD1-CD2 3.83Å; I375-F387 HydrophobicContact CD1-CG 3.63Å; L385-F387 HydrophobicContact CG-CD1 4.45Å; F387-A390 HydrophobicContact CD2-CB 4.3Å; F387-A390 HydrophobicContact CE2-CB 3.81Å; F387-V394 HydrophobicContact CE1-CG2 4.32Å; F387-V394 HydrophobicContact CE2-CG2 3.94Å; F387-V394 HydrophobicContact CZ-CG2 3.7Å; F387-L404 HydrophobicContact CD1-CD1 3.83Å; F387-L404 HydrophobicContact CE1-CD1 3.55Å; F387-L404 HydrophobicContact CE1-CD2 4.19Å; F387-L404 HydrophobicContact CE1-CG 3.9Å; F387-Q405 WeakPolarHBondContact CD1-O 3.34Å; F387-Q405 PolarHBondContact N-O 3.26Å; F387-V406 HydrophobicContact CD1-CB 4.45Å; F387-V406 HydrophobicContact CD2-CG2 4.27Å; F387-V406 HydrophobicContact CE1-CB 3.7Å; F387-V406 HydrophobicContact CE1-CG2 4.19Å; F387-V406 HydrophobicContact CE2-CB 4.06Å; F387-V406 HydrophobicContact CE2-CG2 3.6Å; F387-V406 HydrophobicContact CZ-CB 3.49Å; F387-V406 VanDerWaalsContact CZ-CB 3.49Å; F387-V406 HydrophobicContact CZ-CG2 3.55Å; F387-V406 CarbonylContact O-C 3.56Å; F387-V406 WeakPolarHBondContact O-CA 3.34Å; F387-L407 PolarHBondContact O-N 3.08Å; F387-V410 HydrophobicContact CE2-CB 4.08Å; F387-V410 HydrophobicContact CE2-CG2 4.48Å; F387-V410 HydrophobicContact CZ-CB 4.06Å; F387-V410 HydrophobicContact CZ-CG1 4.13Å; F387-V410 HydrophobicContact CZ-CG2 4.33Å
388	E	97.2	Very high	97.8	Very high	66 Å²	66	39 Å²	39	31%	0.308	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-69.6	179.6	-76.7	176.2	-157.9	0	0	111.8	V368 G370 L407 G408	V368-E388 PolarHBondContact O-N 2.87Å; G370-E388 WeakPolarHBondContact CA-OE2 3.37Å; G370-E388 VanDerWaalsContact N-CD 3.34Å; G370-E388 PolarHBondContact N-OE2 2.84Å; G370-E388 WeakPolarHBondContact O-CB 3.48Å; E388-L407 HydrophobicContact CG-CB 4.45Å; E388-L407 HydrophobicContact CG-CD1 4.23Å; E388-G408 CarbonylContact O-C 3.54Å; E388-G408 WeakPolarHBondContact O-CA 3.47Å; E388-G408 PolarHBondContact O-N 3.33Å
389	N	96.9	Very high	97.8	Very high	46 Å²	46	37.9 Å²	37.9	25%	0.246	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.6	-175.5	-60.5	-88.3	0	0	0	112.5	G370 K371 I372 V409	G370-N389 PolarHBondContact O-N 3.35Å; G370-N389 VanDerWaalsContact O-N 3.13Å; K371-N389 WeakPolarHBondContact CA-O 3.48Å; K371-N389 HydrophobicContact CB-CB 3.92Å; K371-N389 HydrophobicContact CD-CB 4.16Å; K371-N389 HydrophobicContact CG-CB 3.68Å; I372-N389 PolarHBondContact N-O 3.29Å; N389-V409 WeakPolarHBondContact CA-O 3.29Å; N389-V409 PolarHBondContact OD1-N 2.83Å
390	A	97.1	Very high	97.8	Very high	3 Å²	3	40.6 Å²	40.6	3%	0.025	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.4	168.6	0	0	0	0	0	109.5	I372 F387 V394 V409 V410 P411	I372-A390 WeakPolarHBondContact O-CA 3.35Å; F387-A390 HydrophobicContact CD2-CB 4.3Å; F387-A390 HydrophobicContact CE2-CB 3.81Å; A390-V394 HydrophobicContact CB-CG2 3.83Å; A390-V409 PolarHBondContact N-O 3.18Å; A390-V410 HydrophobicContact CB-CB 4.43Å; A390-V410 HydrophobicContact CB-CG2 4.15Å; A390-P411 WeakPolarHBondContact O-CD 3.3Å
391	V	96.4	Very high	97.8	Very high	70 Å²	70	43.1 Å²	43.1	42%	0.424	22%	0.221	S	C	.	.	S	Bend	trans	-74.9	-38.4	179.8	176.4	0	0	0	0	111.6	L352 K371 I372 N373 P411	L352-V391 HydrophobicContact CD2-CG2 3.63Å; K371-V391 HydrophobicContact CD-CG2 4.36Å; K371-V391 HydrophobicContact CG-CG2 4.13Å; I372-V391 PolarHBondContact O-N 3.33Å; N373-V391 PolarHBondContact O-N 2.65Å; V391-P411 WeakPolarHBondContact O-CG 3.4Å
392	G	96.1	Very high	97.9	Very high	22 Å²	22	37.6 Å²	37.6	23%	0.227	20%	0.197	C	C	.	.	S	Bend	trans	-108.2	-137.7	178.3	0	0	0	0	0	111.1	N373 P411	N373-G392 WeakPolarHBondContact O-CA 3.39Å; N373-G392 PolarHBondContact O-N 2.83Å; G392-P411 WeakPolarHBondContact O-CD 3.08Å; G392-P411 VanDerWaalsContact O-CG 3.22Å; G392-P411 WeakPolarHBondContact O-CG 3.25Å
393	I	97.5	Very high	97.9	Very high	55 Å²	55	36 Å²	36	28%	0.282	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	148.2	-170.4	-166.7	165	0	0	0	112.7	S374 I375 E395 T412	S374-I393 WeakPolarHBondContact CA-O 3.38Å; S374-I393 WeakPolarHBondContact CB-O 3.33Å; I375-I393 PolarHBondContact N-O 3.22Å; I393-E395 HydrophobicContact CB-CG 4.42Å; I393-E395 HydrophobicContact CD1-CG 3.87Å; I393-E395 HydrophobicContact CG1-CG 3.78Å; I393-E395 HydrophobicContact CG2-CG 3.87Å; I393-T412 WeakPolarHBondContact CA-O 3.48Å; I393-T412 HydrophobicContact CD1-CG2 3.92Å; I393-T412 HydrophobicContact CG1-CG2 4.07Å
394	V	98.7	Very high	97.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.9	161.8	176.6	0	0	0	0	108.6	I375 F387 A390 I396 L404 V410 T412 I413 S414	I375-V394 HydrophobicContact CB-CG1 4.26Å; I375-V394 HydrophobicContact CB-CG2 4.18Å; I375-V394 HydrophobicContact CD1-CG2 4.46Å; I375-V394 HydrophobicContact CG1-CG2 4.47Å; I375-V394 CarbonylContact O-C 3.58Å; I375-V394 VanDerWaalsContact O-CA 3.31Å; I375-V394 WeakPolarHBondContact O-CA 3.47Å; F387-V394 HydrophobicContact CE1-CG2 4.32Å; F387-V394 HydrophobicContact CE2-CG2 3.94Å; F387-V394 HydrophobicContact CZ-CG2 3.7Å; A390-V394 HydrophobicContact CB-CG2 3.83Å; V394-I396 HydrophobicContact CG1-CD1 4.14Å; V394-L404 HydrophobicContact CG1-CD1 4.22Å; V394-L404 HydrophobicContact CG1-CD2 4.03Å; V394-V410 HydrophobicContact CB-CG2 4.43Å; V394-V410 HydrophobicContact CG2-CG2 3.84Å; V394-T412 PolarHBondContact N-O 3.41Å; V394-I413 HydrophobicContact CB-CG1 4.3Å; V394-I413 CarbonylContact O-C 3.6Å; V394-I413 WeakPolarHBondContact O-CA 3.28Å; V394-S414 PolarHBondContact O-N 3.48Å
395	E	98.4	Very high	97.8	Very high	57 Å²	57	38.3 Å²	38.3	27%	0.266	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133	-176	-60	-168.3	105.2	0	0	111.4	I375 I376 V377 I393 I397 S414	I375-E395 PolarHBondContact O-N 2.91Å; I376-E395 CarbonylContact C-O 3.48Å; I376-E395 WeakPolarHBondContact CA-O 3.46Å; I376-E395 HydrophobicContact CG1-CB 4.47Å; V377-E395 PolarHBondContact N-O 3.37Å; I393-E395 HydrophobicContact CB-CG 4.42Å; I393-E395 HydrophobicContact CD1-CG 3.87Å; I393-E395 HydrophobicContact CG1-CG 3.78Å; I393-E395 HydrophobicContact CG2-CG 3.87Å; E395-I397 HydrophobicContact CB-CD1 4.23Å; E395-I397 HydrophobicContact CB-CG1 4.25Å; E395-S414 CarbonylContact C-O 3.53Å; E395-S414 WeakPolarHBondContact CA-O 3.43Å
396	I	98.7	Very high	97.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.5	174.3	-56.8	83.1	0	0	0	107.3	V377 V394 I402 L404 I413 S414 I415 N416 T418	V377-I396 HydrophobicContact CB-CG1 4.43Å; V377-I396 CarbonylContact O-C 3.49Å; V377-I396 WeakPolarHBondContact O-CA 3.45Å; V394-I396 HydrophobicContact CG1-CD1 4.14Å; I396-I402 HydrophobicContact CG2-CB 4.41Å; I396-I402 HydrophobicContact CG2-CG1 4.01Å; I396-I402 HydrophobicContact CG2-CG2 4.33Å; I396-L404 HydrophobicContact CD1-CD2 4.25Å; I396-I413 HydrophobicContact CD1-CG2 3.86Å; I396-S414 PolarHBondContact N-O 2.99Å; I396-I415 HydrophobicContact CD1-CG1 4.36Å; I396-N416 PolarHBondContact O-N 2.99Å; I396-T418 HydrophobicContact CG2-CG2 3.83Å
397	I	97.8	Very high	97.7	Very high	38 Å²	38	40.8 Å²	40.8	20%	0.195	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.8	-169.4	-45.3	179	0	0	0	109.5	I376 V377 D378 N379 E395 S399 N416	I376-I397 HydrophobicContact CG2-CD1 4.38Å; V377-I397 PolarHBondContact O-N 2.84Å; D378-I397 VanDerWaalsContact CA-O 3.31Å; D378-I397 WeakPolarHBondContact CA-O 3.32Å; N379-I397 PolarHBondContact N-O 3.35Å; N379-I397 VanDerWaalsContact N-O 3.1Å; E395-I397 HydrophobicContact CB-CD1 4.23Å; E395-I397 HydrophobicContact CB-CG1 4.25Å; I397-S399 PolarHBondContact O-N 3.25Å; I397-S399 PolarHBondContact O-OG 3Å; I397-N416 VanDerWaalsContact CA-O 3.26Å; I397-N416 WeakPolarHBondContact CA-O 3.45Å
398	N	96.6	Very high	97.6	Very high	59 Å²	59	41.2 Å²	41.2	32%	0.316	22%	0.216	S	C	.	.	S	Bend	trans	50.8	29.3	174	-56.7	-57.3	0	0	0	115.2	D378 N379 N416 K417	D378-N398 WeakPolarHBondContact OD1-CB 3.41Å; D378-N398 PolarHBondContact OD1-ND2 2.95Å; N379-N398 WeakPolarHBondContact CA-O 3.39Å; N398-N416 PolarHBondContact N-O 3.18Å; N398-N416 VanDerWaalsContact N-O 3.16Å; N398-K417 CarbonylContact C-O 3.46Å; N398-K417 WeakPolarHBondContact CA-O 3.2Å; N398-K417 PolarHBondContact N-O 3.01Å; N398-K417 WeakPolarHBondContact OD1-CD 3.34Å; N398-K417 VanDerWaalsContact OD1-CE 3.26Å; N398-K417 WeakPolarHBondContact OD1-CE 3.45Å; N398-K417 PolarHBondContact OD1-NZ 3.11Å
399	S	98.1	Very high	97.6	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.042	22%	0.222	C	C	.	.			trans	-112.5	168	-166.8	-70.1	0	0	0	0	112.3	N379 C380 I397 T418 E419	N379-S399 PolarHBondContact N-OG 3.46Å; C380-S399 PolarHBondContact N-OG 3.39Å; C380-S399 CarbonylContact O-C 3.54Å; C380-S399 VanDerWaalsContact O-CA 3.24Å; C380-S399 WeakPolarHBondContact O-CA 3.41Å; C380-S399 WeakPolarHBondContact O-CB 3.33Å; I397-S399 PolarHBondContact O-N 3.25Å; I397-S399 PolarHBondContact O-OG 3Å; S399-T418 PolarHBondContact N-OG1 2.93Å; S399-T418 WeakPolarHBondContact O-CA 3.29Å; S399-T418 WeakPolarHBondContact O-CG2 3.36Å; S399-E419 PolarHBondContact O-N 3.19Å; S399-E419 VanDerWaalsContact O-N 3.08Å
400	R	98.2	Very high	97.6	Very high	127 Å²	127	39.4 Å²	39.4	48%	0.479	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	136.8	178.6	-169.7	177.7	-172.4	-164	2.5	112.8	C380 K381 K382 E419	C380-R400 PolarHBondContact O-N 2.93Å; K381-R400 CarbonylContact C-O 3.59Å; K381-R400 VanDerWaalsContact CA-O 3.23Å; K381-R400 WeakPolarHBondContact CA-O 3.45Å; K381-R400 HydrophobicContact CG-CB 4.39Å; K382-R400 PolarHBondContact N-O 3.21Å; R400-E419 CarbonylContact C-O 3.53Å; R400-E419 WeakPolarHBondContact CA-O 3.07Å; R400-E419 HydrophobicContact CG-CB 4.27Å; R400-E419 WeakPolarHBondContact CG-O 3.42Å; R400-E419 IonicContact CZ-OE1 2.85Å; R400-E419 IonicContact NE-OE1 2.74Å; R400-E419 PolarHBondContact NE-OE1 3.42Å; R400-E419 IonicContact NE-OE2 3.7Å; R400-E419 IonicContact NH2-OE1 3.75Å; R400-E419 PolarHBondContact NH2-OE1 3Å
401	S	97.9	Very high	97.6	Very high	53 Å²	53	41.8 Å²	41.8	37%	0.371	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.4	60.8	178.9	-49.9	0	0	0	0	111.7	K382 L383 E419 G420	K382-S401 WeakPolarHBondContact CA-O 3.22Å; K382-S401 PolarHBondContact N-O 3.25Å; L383-S401 PolarHBondContact N-O 3.34Å; S401-E419 PolarHBondContact N-O 3.11Å; S401-G420 CarbonylContact C-O 3.59Å; S401-G420 WeakPolarHBondContact CA-O 3.41Å; S401-G420 PolarHBondContact N-O 3.09Å
402	I	98.7	Very high	97.7	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.9	-179.2	-54.7	-60.9	0	0	0	109.6	C380 L383 I396 T418 G420 C421 Q422	C380-I402 HydrophobicContact CB-CD1 4.03Å; L383-I402 HydrophobicContact CB-CD1 3.71Å; I396-I402 HydrophobicContact CG2-CB 4.41Å; I396-I402 HydrophobicContact CG2-CG1 4.01Å; I396-I402 HydrophobicContact CG2-CG2 4.33Å; I402-T418 HydrophobicContact CG1-CG2 4.36Å; I402-G420 PolarHBondContact N-O 3.39Å; I402-C421 CarbonylContact O-C 3.58Å; I402-C421 WeakPolarHBondContact O-CA 3.29Å; I402-Q422 PolarHBondContact O-N 3.46Å
403	Q	98.5	Very high	97.9	Very high	100 Å²	100	39 Å²	39	47%	0.467	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.8	170.6	-67.4	-176.3	-34.2	0	0	108.3	L383 G384 L385 Q422	L383-Q403 PolarHBondContact O-N 3.41Å; G384-Q403 CarbonylContact C-O 3.47Å; G384-Q403 WeakPolarHBondContact CA-O 3.49Å; L385-Q403 PolarHBondContact N-O 3.5Å; Q403-Q422 WeakPolarHBondContact CA-O 3.5Å; Q403-Q422 HydrophobicContact CG-CB 4.34Å
404	L	98	Very high	97.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.2	-179.4	-179	72.1	0	0	0	109.2	L385 F387 V394 I396 I413 Q422 V423 Y424	L385-L404 HydrophobicContact CB-CD1 3.87Å; L385-L404 HydrophobicContact CD2-CD1 3.45Å; L385-L404 VanDerWaalsContact CD2-CD1 3.45Å; L385-L404 HydrophobicContact CG-CD1 3.64Å; L385-L404 CarbonylContact O-C 3.56Å; L385-L404 WeakPolarHBondContact O-CA 3.48Å; F387-L404 HydrophobicContact CD1-CD1 3.83Å; F387-L404 HydrophobicContact CE1-CD1 3.55Å; F387-L404 HydrophobicContact CE1-CD2 4.19Å; F387-L404 HydrophobicContact CE1-CG 3.9Å; V394-L404 HydrophobicContact CG1-CD1 4.22Å; V394-L404 HydrophobicContact CG1-CD2 4.03Å; I396-L404 HydrophobicContact CD1-CD2 4.25Å; L404-I413 HydrophobicContact CD2-CD1 3.87Å; L404-I413 HydrophobicContact CD2-CG1 4.28Å; L404-I413 HydrophobicContact CD2-CG2 4.09Å; L404-Q422 PolarHBondContact N-O 3.48Å; L404-V423 HydrophobicContact CB-CG2 4.49Å; L404-V423 HydrophobicContact CD2-CG1 4.25Å; L404-V423 HydrophobicContact CD2-CG2 4.41Å; L404-V423 CarbonylContact O-C 3.35Å; L404-V423 WeakPolarHBondContact O-CA 3.28Å; L404-Y424 WeakPolarHBondContact O-CD2 3.24Å; L404-Y424 PolarHBondContact O-N 2.76Å
405	Q	98.1	Very high	97.9	Very high	63 Å²	63	37.3 Å²	37.3	29%	0.294	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122	172.6	-174.9	176.1	13.2	0	0	110.6	L385 V386 F387 L407	L385-Q405 PolarHBondContact O-N 3.21Å; V386-Q405 WeakPolarHBondContact CA-O 3.36Å; V386-Q405 HydrophobicContact CG2-CB 4.31Å; F387-Q405 WeakPolarHBondContact CD1-O 3.34Å; F387-Q405 PolarHBondContact N-O 3.26Å; Q405-L407 HydrophobicContact CG-CD2 4.13Å
406	V	97.7	Very high	97.8	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.6	170.3	61.4	0	0	0	0	109.3	F387 V410 Y424 L425 S426 A429	F387-V406 HydrophobicContact CD1-CB 4.45Å; F387-V406 HydrophobicContact CD2-CG2 4.27Å; F387-V406 HydrophobicContact CE1-CB 3.7Å; F387-V406 HydrophobicContact CE1-CG2 4.19Å; F387-V406 HydrophobicContact CE2-CB 4.06Å; F387-V406 HydrophobicContact CE2-CG2 3.6Å; F387-V406 HydrophobicContact CZ-CB 3.49Å; F387-V406 VanDerWaalsContact CZ-CB 3.49Å; F387-V406 HydrophobicContact CZ-CG2 3.55Å; F387-V406 CarbonylContact O-C 3.56Å; F387-V406 WeakPolarHBondContact O-CA 3.34Å; V406-V410 HydrophobicContact CB-CG1 4.2Å; V406-V410 HydrophobicContact CG1-CG1 4.07Å; V406-V410 HydrophobicContact CG2-CB 4.35Å; V406-V410 HydrophobicContact CG2-CG1 3.94Å; V406-Y424 PolarHBondContact N-O 3.48Å; V406-L425 HydrophobicContact CG1-CD2 4Å; V406-S426 WeakPolarHBondContact O-CB 3.46Å; V406-S426 PolarHBondContact O-N 3.47Å; V406-A429 HydrophobicContact CG1-CB 3.75Å
407	L	97.1	Very high	97.7	Very high	82 Å²	82	43.2 Å²	43.2	43%	0.429	23%	0.225	S	C	.	.	S	Bend	trans	-95.1	-31.5	176.9	-55.6	179.7	0	0	0	112.1	V386 F387 E388 Q405 S426	V386-L407 HydrophobicContact CG1-CD1 3.9Å; V386-L407 HydrophobicContact CG1-CD2 4.24Å; V386-L407 HydrophobicContact CG1-CG 3.98Å; F387-L407 PolarHBondContact O-N 3.08Å; E388-L407 HydrophobicContact CG-CB 4.45Å; E388-L407 HydrophobicContact CG-CD1 4.23Å; Q405-L407 HydrophobicContact CG-CD2 4.13Å; L407-S426 WeakPolarHBondContact O-CB 3.41Å
408	G	96.3	Very high	97.6	Very high	13 Å²	13	41.5 Å²	41.5	13%	0.134	22%	0.216	C	C	.	.	S	Bend	trans	-112.7	-128.1	179.5	0	0	0	0	0	111.8	E388 S426	E388-G408 CarbonylContact O-C 3.54Å; E388-G408 WeakPolarHBondContact O-CA 3.47Å; E388-G408 PolarHBondContact O-N 3.33Å; G408-S426 PolarHBondContact O-OG 2.88Å
409	V	96.4	Very high	97.7	Very high	72 Å²	72	42 Å²	42	44%	0.436	22%	0.217	S	C	.	.			trans	-109.2	140.4	-173.9	-176.5	0	0	0	0	111.6	N389 A390 A428	N389-V409 WeakPolarHBondContact CA-O 3.29Å; N389-V409 PolarHBondContact OD1-N 2.83Å; A390-V409 PolarHBondContact N-O 3.18Å; V409-A428 HydrophobicContact CG2-CB 3.84Å
410	V	97.8	Very high	97.6	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	22%	0.221	C	C	.	.			trans	-142.5	131.4	166.4	57.3	0	0	0	0	108.4	F387 A390 V394 V406 T412 I413 A429 C432	F387-V410 HydrophobicContact CE2-CB 4.08Å; F387-V410 HydrophobicContact CE2-CG2 4.48Å; F387-V410 HydrophobicContact CZ-CB 4.06Å; F387-V410 HydrophobicContact CZ-CG1 4.13Å; F387-V410 HydrophobicContact CZ-CG2 4.33Å; A390-V410 HydrophobicContact CB-CB 4.43Å; A390-V410 HydrophobicContact CB-CG2 4.15Å; V394-V410 HydrophobicContact CB-CG2 4.43Å; V394-V410 HydrophobicContact CG2-CG2 3.84Å; V406-V410 HydrophobicContact CB-CG1 4.2Å; V406-V410 HydrophobicContact CG1-CG1 4.07Å; V406-V410 HydrophobicContact CG2-CB 4.35Å; V406-V410 HydrophobicContact CG2-CG1 3.94Å; V410-T412 WeakPolarHBondContact CG2-O 3.49Å; V410-I413 HydrophobicContact CG1-CD1 3.97Å; V410-I413 HydrophobicContact CG1-CG1 4.18Å; V410-I413 HydrophobicContact CG2-CG1 4.09Å; V410-A429 HydrophobicContact CG1-CB 4.12Å; V410-C432 HydrophobicContact CG1-CB 4.38Å; V410-C432 WeakPolarHBondContact O-CB 3.45Å
411	P	97.6	Very high	97.5	Very high	52 Å²	52	36.2 Å²	36.2	34%	0.338	20%	0.198	S	C	.	.	S	Bend	trans	-80	-33.9	179.9	29.3	-35.6	0	0	0	113.6	A390 V391 G392 C432 D433	A390-P411 WeakPolarHBondContact O-CD 3.3Å; V391-P411 WeakPolarHBondContact O-CG 3.4Å; G392-P411 WeakPolarHBondContact O-CD 3.08Å; G392-P411 VanDerWaalsContact O-CG 3.22Å; G392-P411 WeakPolarHBondContact O-CG 3.25Å; P411-C432 WeakPolarHBondContact O-CA 3.27Å; P411-D433 PolarHBondContact O-N 3.22Å
412	T	98.2	Very high	97.5	Very high	35 Å²	35	36.3 Å²	36.3	22%	0.215	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	134.8	-174.7	-50.5	0	0	0	0	111.2	I393 V394 V410 D433 V435	I393-T412 WeakPolarHBondContact CA-O 3.48Å; I393-T412 HydrophobicContact CD1-CG2 3.92Å; I393-T412 HydrophobicContact CG1-CG2 4.07Å; V394-T412 PolarHBondContact N-O 3.41Å; V410-T412 WeakPolarHBondContact CG2-O 3.49Å; T412-D433 CarbonylContact C-O 3.6Å; T412-D433 WeakPolarHBondContact CA-O 3.43Å; T412-D433 HydrophobicContact CG2-CB 4.29Å; T412-V435 HydrophobicContact CG2-CG2 4.24Å
413	I	98.6	Very high	97.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125	169.7	-63.6	165.5	0	0	0	108.1	V394 I396 L404 V410 I415 V423 L425 D433 I434 V435	V394-I413 HydrophobicContact CB-CG1 4.3Å; V394-I413 CarbonylContact O-C 3.6Å; V394-I413 WeakPolarHBondContact O-CA 3.28Å; I396-I413 HydrophobicContact CD1-CG2 3.86Å; L404-I413 HydrophobicContact CD2-CD1 3.87Å; L404-I413 HydrophobicContact CD2-CG1 4.28Å; L404-I413 HydrophobicContact CD2-CG2 4.09Å; V410-I413 HydrophobicContact CG1-CD1 3.97Å; V410-I413 HydrophobicContact CG1-CG1 4.18Å; V410-I413 HydrophobicContact CG2-CG1 4.09Å; I413-I415 HydrophobicContact CG2-CG1 4.14Å; I413-V423 HydrophobicContact CD1-CG1 3.54Å; I413-L425 HydrophobicContact CD1-CD2 3.96Å; I413-D433 PolarHBondContact N-O 2.88Å; I413-I434 HydrophobicContact CB-CD1 3.84Å; I413-I434 HydrophobicContact CD1-CD1 4.1Å; I413-I434 HydrophobicContact CG1-CD1 4.44Å; I413-I434 HydrophobicContact CG2-CD1 4.49Å; I413-I434 WeakPolarHBondContact O-CA 3.33Å; I413-V435 PolarHBondContact O-N 3.01Å
414	S	98.4	Very high	97.5	Very high	18 Å²	18	34 Å²	34	13%	0.126	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.2	178.2	172.1	0	0	0	0	110.7	V394 E395 I396 V435	V394-S414 PolarHBondContact O-N 3.48Å; E395-S414 CarbonylContact C-O 3.53Å; E395-S414 WeakPolarHBondContact CA-O 3.43Å; I396-S414 PolarHBondContact N-O 2.99Å; S414-V435 CarbonylContact C-O 3.59Å; S414-V435 VanDerWaalsContact CA-O 3.22Å; S414-V435 WeakPolarHBondContact CA-O 3.35Å
415	I	98.4	Very high	97.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	102.4	-177.2	-51.2	172	0	0	0	108.9	I396 I413 T418 C421 V423 I434 V435 S436 A437 S439 M442	I396-I415 HydrophobicContact CD1-CG1 4.36Å; I413-I415 HydrophobicContact CG2-CG1 4.14Å; I415-T418 HydrophobicContact CG2-CG2 4.11Å; I415-C421 HydrophobicContact CD1-CB 4.34Å; I415-C421 HydrophobicContact CG2-CB 4.16Å; I415-V423 HydrophobicContact CD1-CG2 4.04Å; I415-I434 HydrophobicContact CD1-CG2 4.43Å; I415-V435 PolarHBondContact N-O 3.39Å; I415-S436 VanDerWaalsContact O-CA 3.27Å; I415-S436 WeakPolarHBondContact O-CA 3.26Å; I415-A437 PolarHBondContact O-N 2.95Å; I415-S439 VanDerWaalsContact C-OG 3.3Å; I415-S439 PolarHBondContact O-OG 3.34Å; I415-M442 HydrophobicContact CB-SD 3.94Å; I415-M442 HydrophobicContact CD1-CG 4.41Å; I415-M442 HydrophobicContact CD1-SD 4.02Å; I415-M442 HydrophobicContact CG2-CG 4.31Å; I415-M442 HydrophobicContact CG2-SD 3.71Å
416	N	96.8	Very high	97.4	Very high	54 Å²	54	31.7 Å²	31.7	29%	0.289	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.4	-174.5	-168.7	0.8	0	0	0	111.7	I396 I397 N398 T418 A437 S439	I396-N416 PolarHBondContact O-N 2.99Å; I397-N416 VanDerWaalsContact CA-O 3.26Å; I397-N416 WeakPolarHBondContact CA-O 3.45Å; N398-N416 PolarHBondContact N-O 3.18Å; N398-N416 VanDerWaalsContact N-O 3.16Å; N416-T418 PolarHBondContact O-N 3.46Å; N416-T418 VanDerWaalsContact O-N 3.17Å; N416-T418 PolarHBondContact O-OG1 3.4Å; N416-A437 CarbonylContact C-O 3.48Å; N416-A437 VanDerWaalsContact CA-O 3.27Å; N416-A437 WeakPolarHBondContact CA-O 3.49Å; N416-A437 PolarHBondContact OD1-O 3.35Å; N416-A437 VanDerWaalsContact OD1-O 3.12Å; N416-S439 WeakPolarHBondContact CA-OG 3.45Å
417	K	96	Very high	97.3	Very high	127 Å²	127	37.8 Å²	37.8	55%	0.552	20%	0.197	S	C	*	.	S	Bend	trans	50.3	43.5	176.7	-166.6	167.6	157	-141.8	0	112.4	N398 A437 K438 S439	N398-K417 CarbonylContact C-O 3.46Å; N398-K417 WeakPolarHBondContact CA-O 3.2Å; N398-K417 PolarHBondContact N-O 3.01Å; N398-K417 WeakPolarHBondContact OD1-CD 3.34Å; N398-K417 VanDerWaalsContact OD1-CE 3.26Å; N398-K417 WeakPolarHBondContact OD1-CE 3.45Å; N398-K417 PolarHBondContact OD1-NZ 3.11Å; K417-A437 PolarHBondContact N-O 3.16Å; K417-K438 VanDerWaalsContact CA-O 3.25Å; K417-K438 WeakPolarHBondContact CA-O 3.26Å; K417-S439 PolarHBondContact N-OG 3.33Å; K417-S439 VanDerWaalsContact N-OG 3.09Å
418	T	97.2	Very high	97.2	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	20%	0.2	C	C	.	.			trans	-125	135.8	-174.9	-66.3	0	0	0	0	110.7	I396 S399 I402 I415 N416 C421 S439 S440	I396-T418 HydrophobicContact CG2-CG2 3.83Å; S399-T418 PolarHBondContact N-OG1 2.93Å; S399-T418 WeakPolarHBondContact O-CA 3.29Å; S399-T418 WeakPolarHBondContact O-CG2 3.36Å; I402-T418 HydrophobicContact CG1-CG2 4.36Å; I415-T418 HydrophobicContact CG2-CG2 4.11Å; N416-T418 PolarHBondContact O-N 3.46Å; N416-T418 VanDerWaalsContact O-N 3.17Å; N416-T418 PolarHBondContact O-OG1 3.4Å; T418-C421 HydrophobicContact CG2-CB 4.13Å; T418-S439 PolarHBondContact N-OG 2.92Å; T418-S439 VanDerWaalsContact N-OG 3.13Å; T418-S439 CarbonylContact O-C 3.5Å; T418-S439 WeakPolarHBondContact O-CA 3.38Å; T418-S439 WeakPolarHBondContact O-CB 3.5Å; T418-S440 PolarHBondContact O-N 3.33Å
419	E	97.3	Very high	97.2	Very high	69 Å²	69	36.2 Å²	36.2	32%	0.322	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.9	179.8	179.9	-163.3	134.5	0	0	109.5	S399 R400 S401 S440	S399-E419 PolarHBondContact O-N 3.19Å; S399-E419 VanDerWaalsContact O-N 3.08Å; R400-E419 CarbonylContact C-O 3.53Å; R400-E419 WeakPolarHBondContact CA-O 3.07Å; R400-E419 HydrophobicContact CG-CB 4.27Å; R400-E419 WeakPolarHBondContact CG-O 3.42Å; R400-E419 IonicContact CZ-OE1 2.85Å; R400-E419 IonicContact NE-OE1 2.74Å; R400-E419 PolarHBondContact NE-OE1 3.42Å; R400-E419 IonicContact NE-OE2 3.7Å; R400-E419 IonicContact NH2-OE1 3.75Å; R400-E419 PolarHBondContact NH2-OE1 3Å; S401-E419 PolarHBondContact N-O 3.11Å; E419-S440 CarbonylContact C-O 3.58Å; E419-S440 WeakPolarHBondContact CA-O 3.47Å
420	G	95.7	Very high	97.2	Very high	13 Å²	13	37.2 Å²	37.2	13%	0.134	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.8	92	-177.7	0	0	0	0	0	111.2	S401 I402 S440 E441	S401-G420 CarbonylContact C-O 3.59Å; S401-G420 WeakPolarHBondContact CA-O 3.41Å; S401-G420 PolarHBondContact N-O 3.09Å; I402-G420 PolarHBondContact N-O 3.39Å; G420-S440 PolarHBondContact N-O 3.23Å; G420-E441 WeakPolarHBondContact CA-O 3.5Å
421	C	97.6	Very high	97	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	118.6	177.2	-167.7	0	0	0	0	110.9	I402 I415 T418 E441 M442 N443	I402-C421 CarbonylContact O-C 3.58Å; I402-C421 WeakPolarHBondContact O-CA 3.29Å; I415-C421 HydrophobicContact CD1-CB 4.34Å; I415-C421 HydrophobicContact CG2-CB 4.16Å; T418-C421 HydrophobicContact CG2-CB 4.13Å; C421-E441 PolarHBondContact N-O 2.93Å; C421-M442 HydrophobicContact CB-CG 4.33Å; C421-M442 WeakPolarHBondContact O-CA 3.32Å; C421-N443 PolarHBondContact O-N 2.76Å
422	Q	98.1	Very high	96.9	Very high	54 Å²	54	42.7 Å²	42.7	25%	0.252	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.7	174.5	-68.8	-178	-20.7	0	0	109.5	I402 Q403 L404 Y424 N443 L445	I402-Q422 PolarHBondContact O-N 3.46Å; Q403-Q422 WeakPolarHBondContact CA-O 3.5Å; Q403-Q422 HydrophobicContact CG-CB 4.34Å; L404-Q422 PolarHBondContact N-O 3.48Å; Q422-Y424 HydrophobicContact CB-CD2 4.46Å; Q422-Y424 HydrophobicContact CB-CE2 3.74Å; Q422-Y424 PolarHBondContact OE1-OH 3.24Å; Q422-N443 WeakPolarHBondContact CA-O 3.32Å; Q422-L445 HydrophobicContact CB-CD1 3.83Å; Q422-L445 HydrophobicContact CG-CD1 4.3Å
423	V	98.4	Very high	96.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	109.4	-178.9	178.9	0	0	0	0	109.6	L404 I413 I415 L425 N443 I444 L445	L404-V423 HydrophobicContact CB-CG2 4.49Å; L404-V423 HydrophobicContact CD2-CG1 4.25Å; L404-V423 HydrophobicContact CD2-CG2 4.41Å; L404-V423 CarbonylContact O-C 3.35Å; L404-V423 WeakPolarHBondContact O-CA 3.28Å; I413-V423 HydrophobicContact CD1-CG1 3.54Å; I415-V423 HydrophobicContact CD1-CG2 4.04Å; V423-L425 HydrophobicContact CG1-CD2 3.74Å; V423-L425 HydrophobicContact CG1-CG 4.32Å; V423-N443 PolarHBondContact N-O 2.92Å; V423-I444 HydrophobicContact CB-CD1 3.76Å; V423-I444 HydrophobicContact CG1-CD1 4.41Å; V423-I444 HydrophobicContact CG2-CD1 4.02Å; V423-L445 PolarHBondContact O-N 2.92Å
424	Y	98.2	Very high	96.8	Very high	52 Å²	52	48.6 Å²	48.6	20%	0.204	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	107.5	176.3	-60.5	-105.7	0	0	0	108.9	L404 V406 Q422 L445 Y453	L404-Y424 WeakPolarHBondContact O-CD2 3.24Å; L404-Y424 PolarHBondContact O-N 2.76Å; V406-Y424 PolarHBondContact N-O 3.48Å; Q422-Y424 HydrophobicContact CB-CD2 4.46Å; Q422-Y424 HydrophobicContact CB-CE2 3.74Å; Q422-Y424 PolarHBondContact OE1-OH 3.24Å; Y424-L445 HydrophobicContact CD1-CB 3.91Å; Y424-L445 HydrophobicContact CD1-CD1 4.3Å; Y424-L445 HydrophobicContact CD1-CD2 4.03Å; Y424-L445 HydrophobicContact CD1-CG 4.29Å; Y424-L445 HydrophobicContact CD2-CD1 4.15Å; Y424-L445 HydrophobicContact CE1-CB 4.31Å; Y424-L445 HydrophobicContact CE1-CD1 4.16Å; Y424-L445 HydrophobicContact CE1-CD2 3.54Å; Y424-L445 HydrophobicContact CE1-CG 4.2Å; Y424-L445 HydrophobicContact CE2-CD1 3.95Å; Y424-L445 HydrophobicContact CG-CB 4.22Å; Y424-L445 HydrophobicContact CG-CD1 4.29Å; Y424-Y453 HydrophobicContact CD1-CD1 4.22Å; Y424-Y453 HydrophobicContact CD1-CD2 4.3Å; Y424-Y453 HydrophobicContact CD1-CE1 4.21Å; Y424-Y453 HydrophobicContact CD1-CE2 4.31Å; Y424-Y453 HydrophobicContact CD1-CG 4.27Å
425	L	97.4	Very high	96.7	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	27%	0.271	C	S	.	.			trans	-84.3	148.6	178.3	-63.5	-174.5	0	0	0	111.5	V406 I413 V423 A429 C432 I444 L445 I446 P447	V406-L425 HydrophobicContact CG1-CD2 4Å; I413-L425 HydrophobicContact CD1-CD2 3.96Å; V423-L425 HydrophobicContact CG1-CD2 3.74Å; V423-L425 HydrophobicContact CG1-CG 4.32Å; L425-A429 HydrophobicContact CD2-CB 4.38Å; L425-C432 HydrophobicContact CD2-CB 4.41Å; L425-I444 HydrophobicContact CD1-CG2 3.81Å; L425-I444 HydrophobicContact CG-CG2 4.06Å; L425-L445 PolarHBondContact N-O 3.4Å; L425-I446 HydrophobicContact CD1-CD1 3.76Å; L425-I446 HydrophobicContact CG-CD1 4.46Å; L425-P447 WeakPolarHBondContact O-CD 3.45Å
426	S	96.4	Very high	96.6	Very high	12 Å²	12	53.7 Å²	53.7	8%	0.084	29%	0.286	C	S	.	.			trans	-83.3	165.5	168.2	82.1	0	0	0	0	110.6	V406 L407 G408 A428 A429	V406-S426 WeakPolarHBondContact O-CB 3.46Å; V406-S426 PolarHBondContact O-N 3.47Å; L407-S426 WeakPolarHBondContact O-CB 3.41Å; G408-S426 PolarHBondContact O-OG 2.88Å; S426-A428 PolarHBondContact O-N 2.97Å; S426-A428 VanDerWaalsContact O-N 3.14Å; S426-A428 PolarHBondContact OG-N 3.28Å; S426-A429 PolarHBondContact O-N 3.25Å; S426-A429 VanDerWaalsContact O-N 3.09Å; S426-A429 PolarHBondContact OG-N 3.18Å
427	K	95.1	Very high	96.3	Very high	131 Å²	131	53.4 Å²	53.4	57%	0.57	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.2	169.3	-65.8	177.7	-175.5	168.5	0	112.3	P447 D450	K427-P447 HydrophobicContact CG-CB 4.27Å; K427-P447 HydrophobicContact CG-CG 3.96Å; K427-D450 IonicContact NZ-OD1 3.02Å; K427-D450 PolarHBondContact NZ-OD1 2.66Å
428	A	95.7	Very high	96.2	Very high	60 Å²	60	55.8 Å²	55.8	50%	0.496	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-13.9	179.9	0	0	0	0	0	113.7	V409 S426	V409-A428 HydrophobicContact CG2-CB 3.84Å; S426-A428 PolarHBondContact O-N 2.97Å; S426-A428 VanDerWaalsContact O-N 3.14Å; S426-A428 PolarHBondContact OG-N 3.28Å
429	A	95.8	Very high	96.1	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.017	31%	0.307	C	S	.	.			trans	-105.2	16.4	-177.6	0	0	0	0	0	113.6	V406 V410 L425 S426 N431 C432	V406-A429 HydrophobicContact CG1-CB 3.75Å; V410-A429 HydrophobicContact CG1-CB 4.12Å; L425-A429 HydrophobicContact CD2-CB 4.38Å; S426-A429 PolarHBondContact O-N 3.25Å; S426-A429 VanDerWaalsContact O-N 3.09Å; S426-A429 PolarHBondContact OG-N 3.18Å; A429-N431 PolarHBondContact O-N 3.36Å; A429-C432 WeakPolarHBondContact O-CB 3.28Å; A429-C432 PolarHBondContact O-N 2.95Å
430	L	95.6	Very high	95.9	Very high	92 Å²	92	55.1 Å²	55.1	48%	0.482	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.1	-178.3	-65.4	178.7	0	0	0	114	C432 I446 P447	L430-C432 VanDerWaalsContact C-N 3.26Å; L430-C432 PolarHBondContact O-N 3.21Å; L430-I446 HydrophobicContact CD2-CD1 4.39Å; L430-I446 HydrophobicContact CD2-CG2 3.86Å; L430-P447 HydrophobicContact CD2-CG 4.38Å
431	N	94.1	Very high	95.9	Very high	156 Å²	156	59.9 Å²	59.9	83%	0.834	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	16.9	174.9	-60.9	-32.4	0	0	0	112.5	A429	A429-N431 PolarHBondContact O-N 3.36Å
432	C	96.5	Very high	95.8	Very high	13 Å²	13	60.1 Å²	60.1	9%	0.088	33%	0.325	C	S	.	.			trans	-72.6	127.9	177.9	-179.9	0	0	0	0	110.6	V410 P411 L425 A429 L430	V410-C432 HydrophobicContact CG1-CB 4.38Å; V410-C432 WeakPolarHBondContact O-CB 3.45Å; P411-C432 WeakPolarHBondContact O-CA 3.27Å; L425-C432 HydrophobicContact CD2-CB 4.41Å; A429-C432 WeakPolarHBondContact O-CB 3.28Å; A429-C432 PolarHBondContact O-N 2.95Å; L430-C432 VanDerWaalsContact C-N 3.26Å; L430-C432 PolarHBondContact O-N 3.21Å
433	D	97.6	Very high	95.7	Very high	107 Å²	107	59.2 Å²	59.2	57%	0.572	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.8	169.9	-70.4	-35.7	0	0	0	110	P411 T412 I413	P411-D433 PolarHBondContact O-N 3.22Å; T412-D433 CarbonylContact C-O 3.6Å; T412-D433 WeakPolarHBondContact CA-O 3.43Å; T412-D433 HydrophobicContact CG2-CB 4.29Å; I413-D433 PolarHBondContact N-O 2.88Å
434	I	96.6	Very high	95.7	Very high	52 Å²	52	60 Å²	60	27%	0.267	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.6	172.4	-53	-58.2	0	0	0	108.3	I413 I415 I444	I413-I434 HydrophobicContact CB-CD1 3.84Å; I413-I434 HydrophobicContact CD1-CD1 4.1Å; I413-I434 HydrophobicContact CG1-CD1 4.44Å; I413-I434 HydrophobicContact CG2-CD1 4.49Å; I413-I434 WeakPolarHBondContact O-CA 3.33Å; I415-I434 HydrophobicContact CD1-CG2 4.43Å; I434-I444 HydrophobicContact CD1-CD1 4.13Å; I434-I444 HydrophobicContact CG1-CD1 4Å; I434-I444 HydrophobicContact CG1-CG1 4.31Å; I434-I444 HydrophobicContact CG2-CD1 4.08Å
435	V	96.8	Very high	95.6	Very high	80 Å²	80	58.1 Å²	58.1	49%	0.485	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.1	177.5	-177	0	0	0	0	108.5	T412 I413 S414 I415	T412-V435 HydrophobicContact CG2-CG2 4.24Å; I413-V435 PolarHBondContact O-N 3.01Å; S414-V435 CarbonylContact C-O 3.59Å; S414-V435 VanDerWaalsContact CA-O 3.22Å; S414-V435 WeakPolarHBondContact CA-O 3.35Å; I415-V435 PolarHBondContact N-O 3.39Å
436	S	95.4	Very high	95.6	Very high	45 Å²	45	59.8 Å²	59.8	32%	0.315	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.8	-179.4	60.1	0	0	0	0	112.7	I415 M442	I415-S436 VanDerWaalsContact O-CA 3.27Å; I415-S436 WeakPolarHBondContact O-CA 3.26Å; S436-M442 VanDerWaalsContact CB-SD 3.6Å
437	A	91.9	Very high	95.5	Very high	48 Å²	48	60.3 Å²	60.3	40%	0.397	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	131.3	175	0	0	0	0	0	111.4	I415 N416 K417 S439	I415-A437 PolarHBondContact O-N 2.95Å; N416-A437 CarbonylContact C-O 3.48Å; N416-A437 VanDerWaalsContact CA-O 3.27Å; N416-A437 WeakPolarHBondContact CA-O 3.49Å; N416-A437 PolarHBondContact OD1-O 3.35Å; N416-A437 VanDerWaalsContact OD1-O 3.12Å; K417-A437 PolarHBondContact N-O 3.16Å; A437-S439 PolarHBondContact O-N 3.2Å; A437-S439 VanDerWaalsContact O-N 3.12Å; A437-S439 PolarHBondContact O-OG 3.02Å; A437-S439 VanDerWaalsContact O-OG 3.09Å
438	K	92.4	Very high	95.3	Very high	177 Å²	177	57 Å²	57	77%	0.77	33%	0.327	S	S	*	.	S	Bend	trans	52.2	33.2	179.2	-58.3	-173.4	175	-175.7	0	113.5	K417	K417-K438 VanDerWaalsContact CA-O 3.25Å; K417-K438 WeakPolarHBondContact CA-O 3.26Å
439	S	95.1	Very high	94.7	Very high	17 Å²	17	55.4 Å²	55.4	12%	0.119	32%	0.317	C	S	.	.			trans	-120.1	152.9	-176.2	-61.3	0	0	0	0	110.1	I415 N416 K417 T418 A437 M442	I415-S439 VanDerWaalsContact C-OG 3.3Å; I415-S439 PolarHBondContact O-OG 3.34Å; N416-S439 WeakPolarHBondContact CA-OG 3.45Å; K417-S439 PolarHBondContact N-OG 3.33Å; K417-S439 VanDerWaalsContact N-OG 3.09Å; T418-S439 PolarHBondContact N-OG 2.92Å; T418-S439 VanDerWaalsContact N-OG 3.13Å; T418-S439 CarbonylContact O-C 3.5Å; T418-S439 WeakPolarHBondContact O-CA 3.38Å; T418-S439 WeakPolarHBondContact O-CB 3.5Å; A437-S439 PolarHBondContact O-N 3.2Å; A437-S439 VanDerWaalsContact O-N 3.12Å; A437-S439 PolarHBondContact O-OG 3.02Å; A437-S439 VanDerWaalsContact O-OG 3.09Å; S439-M442 WeakPolarHBondContact CB-SD 3.4Å
440	S	94.4	Very high	93.6	Very high	41 Å²	41	61.8 Å²	61.8	29%	0.287	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	164	-178	62.3	0	0	0	0	112.2	T418 E419 G420 E460	T418-S440 PolarHBondContact O-N 3.33Å; E419-S440 CarbonylContact C-O 3.58Å; E419-S440 WeakPolarHBondContact CA-O 3.47Å; G420-S440 PolarHBondContact N-O 3.23Å; S440-E460 VanDerWaalsContact C-OE1 3.32Å; S440-E460 VanDerWaalsContact CA-CD 3.46Å; S440-E460 WeakPolarHBondContact CA-OE1 3.33Å; S440-E460 VanDerWaalsContact CA-OE2 3.28Å; S440-E460 WeakPolarHBondContact CA-OE2 3.46Å; S440-E460 VanDerWaalsContact CB-OE2 3.31Å; S440-E460 WeakPolarHBondContact CB-OE2 3.44Å
441	E	94.4	Very high	92.7	Very high	113 Å²	113	64.5 Å²	64.5	53%	0.528	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.5	48.5	-176.6	-59.1	170.1	-123.4	0	0	112.6	G420 C421 E460	G420-E441 WeakPolarHBondContact CA-O 3.5Å; C421-E441 PolarHBondContact N-O 2.93Å; E441-E460 WeakPolarHBondContact CA-OE1 3.31Å; E441-E460 VanDerWaalsContact N-CD 3.33Å; E441-E460 PolarHBondContact N-OE1 3.23Å; E441-E460 PolarHBondContact N-OE2 2.91Å
442	M	96.3	Very high	92.5	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.02	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.4	-178.2	-65.4	178.4	-61	0	0	112	I415 C421 S436 S439 V458 E460	I415-M442 HydrophobicContact CB-SD 3.94Å; I415-M442 HydrophobicContact CD1-CG 4.41Å; I415-M442 HydrophobicContact CD1-SD 4.02Å; I415-M442 HydrophobicContact CG2-CG 4.31Å; I415-M442 HydrophobicContact CG2-SD 3.71Å; C421-M442 HydrophobicContact CB-CG 4.33Å; C421-M442 WeakPolarHBondContact O-CA 3.32Å; S436-M442 VanDerWaalsContact CB-SD 3.6Å; S439-M442 WeakPolarHBondContact CB-SD 3.4Å; M442-V458 HydrophobicContact CB-CB 3.94Å; M442-V458 HydrophobicContact CB-CG2 3.97Å; M442-V458 HydrophobicContact CE-CB 4.1Å; M442-V458 HydrophobicContact CE-CG1 3.97Å; M442-V458 PolarHBondContact O-N 2.85Å; M442-E460 HydrophobicContact CE-CG 4.21Å; M442-E460 PolarHBondContact N-OE1 3Å; M442-E460 VanDerWaalsContact N-OE1 3.14Å
443	N	96.2	Very high	92.4	Very high	36 Å²	36	66 Å²	66	19%	0.193	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.3	177.3	-69	-73.2	0	0	0	111.2	C421 Q422 V423 E455 F456 P457	C421-N443 PolarHBondContact O-N 2.76Å; Q422-N443 WeakPolarHBondContact CA-O 3.32Å; V423-N443 PolarHBondContact N-O 2.92Å; N443-E455 HydrophobicContact CB-CG 3.76Å; N443-E455 VanDerWaalsContact CB-OE1 3.29Å; N443-E455 WeakPolarHBondContact CB-OE1 3.33Å; N443-E455 PolarHBondContact ND2-OE1 3.1Å; N443-F456 WeakPolarHBondContact CA-O 3.47Å; N443-P457 WeakPolarHBondContact OD1-CA 3.47Å
444	I	97.4	Very high	92.3	Very high	17 Å²	17	67.8 Å²	67.8	9%	0.087	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.5	174.4	-47.5	-55.7	0	0	0	108.3	V423 L425 I434 I446 F456 V458	V423-I444 HydrophobicContact CB-CD1 3.76Å; V423-I444 HydrophobicContact CG1-CD1 4.41Å; V423-I444 HydrophobicContact CG2-CD1 4.02Å; L425-I444 HydrophobicContact CD1-CG2 3.81Å; L425-I444 HydrophobicContact CG-CG2 4.06Å; I434-I444 HydrophobicContact CD1-CD1 4.13Å; I434-I444 HydrophobicContact CG1-CD1 4Å; I434-I444 HydrophobicContact CG1-CG1 4.31Å; I434-I444 HydrophobicContact CG2-CD1 4.08Å; I444-I446 HydrophobicContact CG2-CD1 3.78Å; I444-F456 PolarHBondContact N-O 3.47Å; I444-F456 PolarHBondContact O-N 2.9Å; I444-V458 HydrophobicContact CD1-CG2 3.94Å; I444-V458 HydrophobicContact CG1-CG2 3.65Å
445	L	97.4	Very high	92.2	Very high	13 Å²	13	70.2 Å²	70.2	7%	0.068	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.5	-178.6	-66.1	101.7	0	0	0	109	Q422 V423 Y424 L425 Y453 R454 E455	Q422-L445 HydrophobicContact CB-CD1 3.83Å; Q422-L445 HydrophobicContact CG-CD1 4.3Å; V423-L445 PolarHBondContact O-N 2.92Å; Y424-L445 HydrophobicContact CD1-CB 3.91Å; Y424-L445 HydrophobicContact CD1-CD1 4.3Å; Y424-L445 HydrophobicContact CD1-CD2 4.03Å; Y424-L445 HydrophobicContact CD1-CG 4.29Å; Y424-L445 HydrophobicContact CD2-CD1 4.15Å; Y424-L445 HydrophobicContact CE1-CB 4.31Å; Y424-L445 HydrophobicContact CE1-CD1 4.16Å; Y424-L445 HydrophobicContact CE1-CD2 3.54Å; Y424-L445 HydrophobicContact CE1-CG 4.2Å; Y424-L445 HydrophobicContact CE2-CD1 3.95Å; Y424-L445 HydrophobicContact CG-CB 4.22Å; Y424-L445 HydrophobicContact CG-CD1 4.29Å; L425-L445 PolarHBondContact N-O 3.4Å; L445-Y453 HydrophobicContact CB-CD1 3.87Å; L445-Y453 HydrophobicContact CB-CG 4.2Å; L445-R454 WeakPolarHBondContact CA-O 3.2Å; L445-E455 HydrophobicContact CD2-CB 4.4Å; L445-E455 HydrophobicContact CD2-CG 4.48Å; L445-E455 HydrophobicContact CG-CB 4.43Å; L445-E455 HydrophobicContact CG-CG 4.3Å
446	I	96.4	Very high	92.1	Very high	40 Å²	40	70.9 Å²	70.9	21%	0.205	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.1	-177.2	-55.2	-60.6	0	0	0	109.2	L425 L430 I444 A448 Y453 R454 F456	L425-I446 HydrophobicContact CD1-CD1 3.76Å; L425-I446 HydrophobicContact CG-CD1 4.46Å; L430-I446 HydrophobicContact CD2-CD1 4.39Å; L430-I446 HydrophobicContact CD2-CG2 3.86Å; I444-I446 HydrophobicContact CG2-CD1 3.78Å; I446-A448 PolarHBondContact O-N 3.45Å; I446-Y453 WeakPolarHBondContact O-CA 3.43Å; I446-R454 PolarHBondContact N-O 3.06Å; I446-R454 PolarHBondContact O-N 3.27Å; I446-F456 HydrophobicContact CB-CD2 4.21Å; I446-F456 HydrophobicContact CB-CE2 3.93Å; I446-F456 HydrophobicContact CG1-CD2 3.63Å; I446-F456 HydrophobicContact CG1-CE2 3.76Å
447	P	94.4	Very high	92	Very high	23 Å²	23	71.5 Å²	71.5	15%	0.149	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.8	-179.3	24.9	-32.8	0	0	0	110.9	L425 K427 L430 Y453	L425-P447 WeakPolarHBondContact O-CD 3.45Å; K427-P447 HydrophobicContact CG-CB 4.27Å; K427-P447 HydrophobicContact CG-CG 3.96Å; L430-P447 HydrophobicContact CD2-CG 4.38Å; P447-Y453 HydrophobicContact CB-CD1 4.48Å; P447-Y453 HydrophobicContact CB-CE1 4.24Å
448	A	90.2	Very high	92.1	Very high	60 Å²	60	70.4 Å²	70.4	50%	0.496	36%	0.364	S	S	.	.	S	Bend	trans	-113.5	-5.2	177.6	0	0	0	0	0	113.2	I446 D452 R454	I446-A448 PolarHBondContact O-N 3.45Å; A448-D452 PolarHBondContact N-O 3.43Å; A448-R454 HydrophobicContact CB-CG 3.91Å
449	G	82.9	Confident	92	Very high	27 Å²	27	63.8 Å²	63.8	28%	0.278	34%	0.339	S	S	.	.	S	Bend	trans	-163.3	-157	179.4	0	0	0	0	0	110.6	D452	G449-D452 PolarHBondContact N-O 3.22Å
450	D	73.8	Confident	91.6	Very high	137 Å²	137	67.1 Å²	67.1	73%	0.733	35%	0.353	S	S	*	.	S	Bend	trans	-81.3	-25.6	176.5	-72	-25	0	0	0	113	K427	K427-D450 IonicContact NZ-OD1 3.02Å; K427-D450 PolarHBondContact NZ-OD1 2.66Å
451	D	76.2	Confident	91.2	Very high	148 Å²	148	70.7 Å²	70.7	79%	0.791	37%	0.365	S	S	*	.	S	Bend	trans	-137	7.6	175	-73.3	-49.7	0	0	0	114
452	D	90.1	Very high	91.1	Very high	116 Å²	116	70.4 Å²	70.4	62%	0.62	36%	0.362	S	S	*	.			trans	-103.4	138.6	-179.5	-72.6	-32.9	0	0	0	111.8	A448 G449	A448-D452 PolarHBondContact N-O 3.43Å; G449-D452 PolarHBondContact N-O 3.22Å
453	Y	94.7	Very high	90.9	Very high	84 Å²	84	75.4 Å²	75.4	33%	0.329	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.1	174.8	-68.2	-94.3	0	0	0	111.2	Y424 L445 I446 P447	Y424-Y453 HydrophobicContact CD1-CD1 4.22Å; Y424-Y453 HydrophobicContact CD1-CD2 4.3Å; Y424-Y453 HydrophobicContact CD1-CE1 4.21Å; Y424-Y453 HydrophobicContact CD1-CE2 4.31Å; Y424-Y453 HydrophobicContact CD1-CG 4.27Å; L445-Y453 HydrophobicContact CB-CD1 3.87Å; L445-Y453 HydrophobicContact CB-CG 4.2Å; I446-Y453 WeakPolarHBondContact O-CA 3.43Å; P447-Y453 HydrophobicContact CB-CD1 4.48Å; P447-Y453 HydrophobicContact CB-CE1 4.24Å
454	R	95.8	Very high	90.9	Very high	146 Å²	146	77.2 Å²	77.2	55%	0.551	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.9	164.7	-73.7	-175.2	-64.4	169.3	-0.2	108.9	L445 I446 A448 F456	L445-R454 WeakPolarHBondContact CA-O 3.2Å; I446-R454 PolarHBondContact N-O 3.06Å; I446-R454 PolarHBondContact O-N 3.27Å; A448-R454 HydrophobicContact CB-CG 3.91Å; R454-F456 HydrophobicContact CB-CD2 4.43Å; R454-F456 HydrophobicContact CB-CE2 3.59Å; R454-F456 HydrophobicContact CB-CZ 4.1Å; R454-F456 WeakPolarHBondContact O-CD2 3.4Å
455	E	94.6	Very high	90.8	Very high	103 Å²	103	79.7 Å²	79.7	48%	0.481	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.6	-179.2	-170.5	170.5	-161.4	0	0	110.3	N443 L445	N443-E455 HydrophobicContact CB-CG 3.76Å; N443-E455 VanDerWaalsContact CB-OE1 3.29Å; N443-E455 WeakPolarHBondContact CB-OE1 3.33Å; N443-E455 PolarHBondContact ND2-OE1 3.1Å; L445-E455 HydrophobicContact CD2-CB 4.4Å; L445-E455 HydrophobicContact CD2-CG 4.48Å; L445-E455 HydrophobicContact CG-CB 4.43Å; L445-E455 HydrophobicContact CG-CG 4.3Å
456	F	94.8	Very high	90.7	Very high	94 Å²	94	86.6 Å²	86.6	41%	0.412	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.8	177.5	-65.1	-90.3	0	0	0	109.3	N443 I444 I446 R454	N443-F456 WeakPolarHBondContact CA-O 3.47Å; I444-F456 PolarHBondContact N-O 3.47Å; I444-F456 PolarHBondContact O-N 2.9Å; I446-F456 HydrophobicContact CB-CD2 4.21Å; I446-F456 HydrophobicContact CB-CE2 3.93Å; I446-F456 HydrophobicContact CG1-CD2 3.63Å; I446-F456 HydrophobicContact CG1-CE2 3.76Å; R454-F456 HydrophobicContact CB-CD2 4.43Å; R454-F456 HydrophobicContact CB-CE2 3.59Å; R454-F456 HydrophobicContact CB-CZ 4.1Å; R454-F456 WeakPolarHBondContact O-CD2 3.4Å
457	P	93.4	Very high	90.6	Very high	58 Å²	58	88.7 Å²	88.7	38%	0.377	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	141.8	175.7	29.3	-33.7	0	0	0	110.4	N443	N443-P457 WeakPolarHBondContact OD1-CA 3.47Å
458	V	93.4	Very high	90.6	Very high	25 Å²	25	90.3 Å²	90.3	15%	0.152	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-82.8	129.2	168.4	-177.4	0	0	0	0	107.8	M442 I444 E460	M442-V458 HydrophobicContact CB-CB 3.94Å; M442-V458 HydrophobicContact CB-CG2 3.97Å; M442-V458 HydrophobicContact CE-CB 4.1Å; M442-V458 HydrophobicContact CE-CG1 3.97Å; M442-V458 PolarHBondContact O-N 2.85Å; I444-V458 HydrophobicContact CD1-CG2 3.94Å; I444-V458 HydrophobicContact CG1-CG2 3.65Å; V458-E460 PolarHBondContact O-N 3.28Å
459	P	90.9	Very high	90.9	Very high	38 Å²	38	91.6 Å²	91.6	25%	0.247	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-61.2	132	178.9	-24.8	33.8	0	0	0	112.6	F462 P475 A479	P459-F462 WeakPolarHBondContact O-CZ 3.48Å; P459-P475 HydrophobicContact CB-CB 3.71Å; P459-P475 HydrophobicContact CB-CG 4.23Å; P459-P475 HydrophobicContact CG-CB 3.99Å; P459-P475 HydrophobicContact CG-CG 4.29Å; P459-A479 HydrophobicContact CB-CB 4.26Å
460	E	86.1	Confident	91.4	Very high	86 Å²	86	98 Å²	98	40%	0.402	49%	0.491	S	S	.	.			trans	-113	-16.8	-178.8	-70.3	168.9	-155.9	0	0	112.7	S440 E441 M442 V458	S440-E460 VanDerWaalsContact C-OE1 3.32Å; S440-E460 VanDerWaalsContact CA-CD 3.46Å; S440-E460 WeakPolarHBondContact CA-OE1 3.33Å; S440-E460 VanDerWaalsContact CA-OE2 3.28Å; S440-E460 WeakPolarHBondContact CA-OE2 3.46Å; S440-E460 VanDerWaalsContact CB-OE2 3.31Å; S440-E460 WeakPolarHBondContact CB-OE2 3.44Å; E441-E460 WeakPolarHBondContact CA-OE1 3.31Å; E441-E460 VanDerWaalsContact N-CD 3.33Å; E441-E460 PolarHBondContact N-OE1 3.23Å; E441-E460 PolarHBondContact N-OE2 2.91Å; M442-E460 HydrophobicContact CE-CG 4.21Å; M442-E460 PolarHBondContact N-OE1 3Å; M442-E460 VanDerWaalsContact N-OE1 3.14Å; V458-E460 PolarHBondContact O-N 3.28Å
461	Q	86.1	Confident	92.4	Very high	116 Å²	116	97.2 Å²	97.2	54%	0.542	49%	0.486	S	S	.	.			trans	-105.4	123.7	177	-168.5	-176	42.9	0	0	109.6	T476	Q461-T476 HydrophobicContact CB-CG2 4.31Å; Q461-T476 WeakPolarHBondContact CB-OG1 3.46Å; Q461-T476 HydrophobicContact CG-CG2 3.76Å; Q461-T476 PolarHBondContact O-N 3.26Å; Q461-T476 PolarHBondContact O-OG1 3.3Å; Q461-T476 PolarHBondContact OE1-OG1 3.36Å
462	F	91.5	Very high	93.4	Very high	108 Å²	108	93.1 Å²	93.1	47%	0.474	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.2	-179.4	-58.2	-88.9	0	0	0	110.3	P459 T473 E474 P475	P459-F462 WeakPolarHBondContact O-CZ 3.48Å; F462-T473 HydrophobicContact CB-CG2 3.65Å; F462-T473 HydrophobicContact CD1-CG2 4.2Å; F462-T473 HydrophobicContact CG-CG2 4.2Å; F462-E474 CarbonylContact C-O 3.52Å; F462-E474 VanDerWaalsContact CA-O 3.31Å; F462-E474 WeakPolarHBondContact CA-O 3.4Å; F462-P475 HydrophobicContact CD1-CG 4.28Å; F462-P475 HydrophobicContact CE1-CG 4.11Å
463	K	92.9	Very high	93.5	Very high	108 Å²	108	91.4 Å²	91.4	47%	0.47	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.4	169.7	-178.7	-175.1	168.7	-152.9	0	107.8	V465 T473 E474 T476	K463-V465 HydrophobicContact CD-CG2 4.26Å; K463-V465 HydrophobicContact CG-CG2 3.92Å; K463-T473 WeakPolarHBondContact O-CA 3.39Å; K463-E474 HydrophobicContact CB-CG 4.27Å; K463-E474 PolarHBondContact N-O 2.93Å; K463-E474 IonicContact NZ-OE1 2.68Å; K463-E474 PolarHBondContact NZ-OE1 3.45Å; K463-E474 PolarHBondContact O-N 3.47Å; K463-T476 HydrophobicContact CB-CG2 4.09Å
464	T	95	Very high	93.4	Very high	75 Å²	75	92 Å²	92	46%	0.46	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.9	174.2	-59.2	0	0	0	0	109.1	L471 V472 T473	T464-L471 HydrophobicContact CG2-CB 4Å; T464-L471 HydrophobicContact CG2-CD2 4.05Å; T464-L471 HydrophobicContact CG2-CG 4.43Å; T464-V472 WeakPolarHBondContact CA-O 3.35Å; T464-T473 WeakPolarHBondContact CG2-OG1 3.47Å; T464-T473 WeakPolarHBondContact OG1-CG2 3.29Å; T464-T473 PolarHBondContact OG1-OG1 3.39Å
465	V	96.2	Very high	93.2	Very high	69 Å²	69	88.3 Å²	88.3	42%	0.418	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.7	-178.7	-172.4	0	0	0	0	109.6	K463 V472	K463-V465 HydrophobicContact CD-CG2 4.26Å; K463-V465 HydrophobicContact CG-CG2 3.92Å; V465-V472 PolarHBondContact N-O 3.38Å; V465-V472 PolarHBondContact O-N 3.39Å
466	W	95.9	Very high	92.7	Very high	158 Å²	158	84.8 Å²	84.8	60%	0.598	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.3	167.8	178.2	-104.5	0	0	0	110	G468 S469 R470 L471	W466-G468 VanDerWaalsContact C-N 3.31Å; W466-G468 VanDerWaalsContact NE1-CA 3.27Å; W466-G468 PolarHBondContact O-N 3.04Å; W466-S469 WeakPolarHBondContact CH2-O 3.49Å; W466-R470 VanDerWaalsContact CE3-C 3.48Å; W466-R470 VanDerWaalsContact CZ3-CA 3.49Å; W466-L471 HydrophobicContact CB-CD2 4.42Å; W466-L471 HydrophobicContact CE3-CD2 4.03Å; W466-L471 HydrophobicContact CE3-CG 4.26Å
467	D	93.5	Very high	91.3	Very high	83 Å²	83	90 Å²	90	44%	0.444	47%	0.472	S	S	.	.			trans	-88.1	4.8	-177.1	73.8	5	0	0	0	114.3	S469 R470 V472	D467-S469 WeakPolarHBondContact OD1-CA 3.39Å; D467-S469 PolarHBondContact OD1-N 3.29Å; D467-S469 PolarHBondContact OD1-OG 3.12Å; D467-R470 PolarHBondContact N-O 3.47Å; D467-R470 PolarHBondContact OD1-N 3.01Å; D467-R470 WeakPolarHBondContact OD2-CG 3.5Å; D467-R470 IonicContact OD2-NE 3.33Å; D467-V472 HydrophobicContact CB-CG2 4.08Å; D467-V472 WeakPolarHBondContact OD2-CG2 3.42Å
468	G	94.6	Very high	89.8	Confident	57 Å²	57	94.8 Å²	94.8	59%	0.588	49%	0.492	S	S	*	.	S	Bend	trans	100.9	-17.1	-170.9	0	0	0	0	0	113.6	W466	W466-G468 VanDerWaalsContact C-N 3.31Å; W466-G468 VanDerWaalsContact NE1-CA 3.27Å; W466-G468 PolarHBondContact O-N 3.04Å
469	S	96.2	Very high	87.9	Confident	87 Å²	87	94.8 Å²	94.8	61%	0.608	50%	0.495	S	S	*	.	S	Bend	trans	-134.6	-33.5	-178.1	70.3	0	0	0	0	114.5	W466 D467	W466-S469 WeakPolarHBondContact CH2-O 3.49Å; D467-S469 WeakPolarHBondContact OD1-CA 3.39Å; D467-S469 PolarHBondContact OD1-N 3.29Å; D467-S469 PolarHBondContact OD1-OG 3.12Å
470	R	93.1	Very high	85.7	Confident	163 Å²	163	98 Å²	98	62%	0.615	54%	0.536	S	S	*	.	S	Bend	trans	-150.3	166.6	-178	62.3	-178.3	-179.9	173.2	3.3	111.1	W466 D467 V472	W466-R470 VanDerWaalsContact CE3-C 3.48Å; W466-R470 VanDerWaalsContact CZ3-CA 3.49Å; D467-R470 PolarHBondContact N-O 3.47Å; D467-R470 PolarHBondContact OD1-N 3.01Å; D467-R470 WeakPolarHBondContact OD2-CG 3.5Å; D467-R470 IonicContact OD2-NE 3.33Å; R470-V472 HydrophobicContact CG-CG2 4.19Å
471	L	96.4	Very high	85.7	Confident	120 Å²	120	98.7 Å²	98.7	63%	0.628	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.2	167.3	-64.4	172.4	0	0	0	109.1	T464 W466	T464-L471 HydrophobicContact CG2-CB 4Å; T464-L471 HydrophobicContact CG2-CD2 4.05Å; T464-L471 HydrophobicContact CG2-CG 4.43Å; W466-L471 HydrophobicContact CB-CD2 4.42Å; W466-L471 HydrophobicContact CE3-CD2 4.03Å; W466-L471 HydrophobicContact CE3-CG 4.26Å
472	V	95.3	Very high	85.7	Confident	62 Å²	62	97.7 Å²	97.7	38%	0.376	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.1	172.9	-179.1	0	0	0	0	107.6	T464 V465 D467 R470	T464-V472 WeakPolarHBondContact CA-O 3.35Å; V465-V472 PolarHBondContact N-O 3.38Å; V465-V472 PolarHBondContact O-N 3.39Å; D467-V472 HydrophobicContact CB-CG2 4.08Å; D467-V472 WeakPolarHBondContact OD2-CG2 3.42Å; R470-V472 HydrophobicContact CG-CG2 4.19Å
473	T	93.9	Very high	85.3	Confident	79 Å²	79	97.2 Å²	97.2	49%	0.485	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.5	-177.2	-58.3	0	0	0	0	109.9	F462 K463 T464	F462-T473 HydrophobicContact CB-CG2 3.65Å; F462-T473 HydrophobicContact CD1-CG2 4.2Å; F462-T473 HydrophobicContact CG-CG2 4.2Å; K463-T473 WeakPolarHBondContact O-CA 3.39Å; T464-T473 WeakPolarHBondContact CG2-OG1 3.47Å; T464-T473 WeakPolarHBondContact OG1-CG2 3.29Å; T464-T473 PolarHBondContact OG1-OG1 3.39Å
474	E	92.4	Very high	84.9	Confident	98 Å²	98	96.5 Å²	96.5	46%	0.458	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.3	149.3	177.1	63.6	-171.8	169.1	0	0	110.2	F462 K463	F462-E474 CarbonylContact C-O 3.52Å; F462-E474 VanDerWaalsContact CA-O 3.31Å; F462-E474 WeakPolarHBondContact CA-O 3.4Å; K463-E474 HydrophobicContact CB-CG 4.27Å; K463-E474 PolarHBondContact N-O 2.93Å; K463-E474 IonicContact NZ-OE1 2.68Å; K463-E474 PolarHBondContact NZ-OE1 3.45Å; K463-E474 PolarHBondContact O-N 3.47Å
475	P	90.4	Very high	84.3	Confident	68 Å²	68	97.9 Å²	97.9	44%	0.442	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-56.6	144.4	166.6	-23.6	34.7	0	0	0	111.5	P459 F462	P459-P475 HydrophobicContact CB-CB 3.71Å; P459-P475 HydrophobicContact CB-CG 4.23Å; P459-P475 HydrophobicContact CG-CB 3.99Å; P459-P475 HydrophobicContact CG-CG 4.29Å; F462-P475 HydrophobicContact CD1-CG 4.28Å; F462-P475 HydrophobicContact CE1-CG 4.11Å
476	T	84.6	Confident	83.5	Confident	29 Å²	29	99.8 Å²	99.8	18%	0.178	57%	0.566	C	S	.	*			trans	-72.5	144.1	173.2	58.3	0	0	0	0	111	Q461 K463 I478 A479	Q461-T476 HydrophobicContact CB-CG2 4.31Å; Q461-T476 WeakPolarHBondContact CB-OG1 3.46Å; Q461-T476 HydrophobicContact CG-CG2 3.76Å; Q461-T476 PolarHBondContact O-N 3.26Å; Q461-T476 PolarHBondContact O-OG1 3.3Å; Q461-T476 PolarHBondContact OE1-OG1 3.36Å; K463-T476 HydrophobicContact CB-CG2 4.09Å; T476-I478 PolarHBondContact O-N 2.69Å; T476-A479 PolarHBondContact O-N 3.41Å
477	E	65.9	Low	82.6	Confident	203 Å²	203	95.6 Å²	95.6	95%	0.949	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-12.5	-178.6	-66.2	-179.3	172.5	0	0	114.3
478	I	62.2	Low	81.7	Confident	158 Å²	158	96.6 Å²	96.6	81%	0.81	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-9.5	-178.4	-57.1	169.6	0	0	0	111.3	T476	T476-I478 PolarHBondContact O-N 2.69Å
479	A	51.9	Low	80.7	Confident	25 Å²	25	99.9 Å²	99.9	21%	0.207	57%	0.572	C	S	.	*			trans	-101.6	19.1	-168.4	0	0	0	0	0	115.1	P459 T476	P459-A479 HydrophobicContact CB-CB 4.26Å; T476-A479 PolarHBondContact O-N 3.41Å
480	G	45.6	Very low	79.3	Confident	107 Å²	107	101.1 Å²	101.1	100%	1.103	57%	0.568	S	S	*	*			trans	-136.9	0	-178.7	0	0	0	0	0	113.7

Retrieved 480 of 480 residues in 272.6 ms (Link to these results)

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