A0A077ZIR4_TRITR Loading...

Helix-turn-helix domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZIR4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 258 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	74.8	Confident	79.2	Confident	137 Å²	137	83.9 Å²	83.9	68%	0.675	45%	0.454	S	S	*	.				0	-66.2	0	-66.2	178.1	76.5	0	0	109.9	D3 R4 A5 I21	M1-D3 PolarHBondContact O-N 2.91Å; M1-R4 WeakPolarHBondContact O-CB 3.33Å; M1-R4 PolarHBondContact O-N 3.32Å; M1-A5 PolarHBondContact O-N 2.73Å; M1-I21 HydrophobicContact CB-CD1 4.36Å; M1-I21 HydrophobicContact CB-CG2 4.2Å; M1-I21 HydrophobicContact CE-CG1 4.29Å; M1-I21 HydrophobicContact CE-CG2 4.29Å
2	V	78.8	Confident	79.7	Confident	16 Å²	16	90.4 Å²	90.4	10%	0.097	48%	0.479	C	S	.	.	H	α-helix	trans	-53.8	-50.9	179.4	-178.6	0	0	0	0	113.3	R4 A5 I6 L18 I21 I39 R42	V2-R4 PolarHBondContact O-N 3.45Å; V2-A5 WeakPolarHBondContact O-CB 3.42Å; V2-A5 PolarHBondContact O-N 3.48Å; V2-A5 VanDerWaalsContact O-N 3.12Å; V2-I6 HydrophobicContact CG1-CD1 3.87Å; V2-I6 HydrophobicContact CG1-CG1 4.49Å; V2-I6 WeakPolarHBondContact O-CG1 3.28Å; V2-I6 PolarHBondContact O-N 3.32Å; V2-L18 HydrophobicContact CG1-CD2 3.88Å; V2-L18 HydrophobicContact CG2-CD2 4.49Å; V2-I21 HydrophobicContact CG2-CG2 4.31Å; V2-I39 HydrophobicContact CG2-CG1 3.98Å; V2-R42 HydrophobicContact CG1-CB 3.74Å; V2-R42 HydrophobicContact CG1-CG 4.19Å
3	D	77.8	Confident	80.3	Confident	79 Å²	79	93.4 Å²	93.4	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-60.7	-33.1	178.3	-56	-34.3	0	0	0	113	M1 A7 R42	M1-D3 PolarHBondContact O-N 2.91Å; D3-A7 VanDerWaalsContact O-CB 3.28Å; D3-A7 WeakPolarHBondContact O-CB 3.28Å; D3-A7 PolarHBondContact O-N 2.79Å; D3-R42 IonicContact OD1-CZ 3.51Å; D3-R42 IonicContact OD1-NE 2.71Å; D3-R42 IonicContact OD1-NH1 2.67Å; D3-R42 PolarHBondContact OD1-NH1 3.34Å; D3-R42 IonicContact OD2-CZ 3.54Å; D3-R42 IonicContact OD2-NH1 3.85Å; D3-R42 PolarHBondContact OD2-NH1 3.02Å; D3-R42 IonicContact OD2-NH2 3.54Å
4	R	75.5	Confident	80.8	Confident	183 Å²	183	88.9 Å²	88.9	69%	0.691	46%	0.463	S	S	*	.	H	α-helix	trans	-72.4	-38.8	177.7	-175.2	177.5	174.9	136.5	-1.2	111.1	M1 V2 A7 I8	M1-R4 WeakPolarHBondContact O-CB 3.33Å; M1-R4 PolarHBondContact O-N 3.32Å; V2-R4 PolarHBondContact O-N 3.45Å; R4-A7 PolarHBondContact O-N 3.43Å; R4-I8 HydrophobicContact CG-CD1 3.51Å; R4-I8 HydrophobicContact CG-CG1 4.3Å; R4-I8 WeakPolarHBondContact O-CB 3.36Å; R4-I8 WeakPolarHBondContact O-CG1 3.37Å; R4-I8 PolarHBondContact O-N 3.31Å; R4-I8 VanDerWaalsContact O-N 3.08Å
5	A	79.4	Confident	81.3	Confident	5 Å²	5	89.7 Å²	89.7	4%	0.041	47%	0.468	C	S	.	.	H	α-helix	trans	-63.8	-45.5	173.4	0	0	0	0	0	110.7	M1 V2 A7 I8 C9 L14 E17 L18 I21	M1-A5 PolarHBondContact O-N 2.73Å; V2-A5 WeakPolarHBondContact O-CB 3.42Å; V2-A5 PolarHBondContact O-N 3.48Å; V2-A5 VanDerWaalsContact O-N 3.12Å; A5-A7 VanDerWaalsContact C-N 3.29Å; A5-A7 PolarHBondContact O-N 2.97Å; A5-I8 PolarHBondContact O-N 2.99Å; A5-C9 WeakPolarHBondContact O-CB 3.29Å; A5-C9 PolarHBondContact O-N 2.83Å; A5-L14 HydrophobicContact CB-CD1 4.25Å; A5-E17 HydrophobicContact CB-CG 3.91Å; A5-L18 HydrophobicContact CB-CD2 4.41Å; A5-I21 HydrophobicContact CB-CD1 3.76Å
6	I	80.7	Confident	81.7	Confident	68 Å²	68	87.9 Å²	87.9	35%	0.349	47%	0.466	S	S	.	.	H	α-helix	trans	-60.2	-39	176.3	-65.3	167.9	0	0	0	111.7	V2 L14 R42 L43	V2-I6 HydrophobicContact CG1-CD1 3.87Å; V2-I6 HydrophobicContact CG1-CG1 4.49Å; V2-I6 WeakPolarHBondContact O-CG1 3.28Å; V2-I6 PolarHBondContact O-N 3.32Å; I6-L14 HydrophobicContact CG1-CD1 4.3Å; I6-R42 HydrophobicContact CD1-CB 4.29Å; I6-L43 HydrophobicContact CD1-CD2 4.4Å
7	A	79.8	Confident	82.1	Confident	82 Å²	82	87.2 Å²	87.2	68%	0.678	46%	0.459	S	S	*	.	H	α-helix	trans	-80.4	-23.5	-176	0	0	0	0	0	114.9	D3 R4 A5	D3-A7 VanDerWaalsContact O-CB 3.28Å; D3-A7 WeakPolarHBondContact O-CB 3.28Å; D3-A7 PolarHBondContact O-N 2.79Å; R4-A7 PolarHBondContact O-N 3.43Å; A5-A7 VanDerWaalsContact C-N 3.29Å; A5-A7 PolarHBondContact O-N 2.97Å
8	I	78.6	Confident	82.5	Confident	117 Å²	117	82.8 Å²	82.8	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-119.3	-31.6	-168.8	-56.2	179.8	0	0	0	112.5	R4 A5	R4-I8 HydrophobicContact CG-CD1 3.51Å; R4-I8 HydrophobicContact CG-CG1 4.3Å; R4-I8 WeakPolarHBondContact O-CB 3.36Å; R4-I8 WeakPolarHBondContact O-CG1 3.37Å; R4-I8 PolarHBondContact O-N 3.31Å; R4-I8 VanDerWaalsContact O-N 3.08Å; A5-I8 PolarHBondContact O-N 2.99Å
9	C	79.7	Confident	82.8	Confident	40 Å²	40	87.6 Å²	87.6	27%	0.27	45%	0.447	S	S	.	.	S	Bend	trans	-77.6	140.7	-176.2	-66.8	0	0	0	0	111.6	A5 L14	A5-C9 WeakPolarHBondContact O-CB 3.29Å; A5-C9 PolarHBondContact O-N 2.83Å; C9-L14 HydrophobicContact CB-CD1 4.28Å
10	D	82.8	Confident	83	Confident	88 Å²	88	89.1 Å²	89.1	47%	0.471	45%	0.452	S	S	.	.			trans	-58.8	138.1	167.2	-175.1	-58.4	0	0	0	110.1	E12 F13 L14	D10-E12 PolarHBondContact O-N 3.37Å; D10-E12 VanDerWaalsContact O-N 3.12Å; D10-E12 PolarHBondContact OD1-N 2.94Å; D10-F13 HydrophobicContact CB-CD2 4.05Å; D10-F13 CarbonylContact O-C 3.6Å; D10-F13 PolarHBondContact O-N 3.2Å; D10-L14 PolarHBondContact O-N 2.98Å
11	P	83.7	Confident	83.2	Confident	108 Å²	108	85 Å²	85	70%	0.701	43%	0.431	S	S	*	.	H	α-helix	trans	-49.8	-33.7	179	-28.1	34.6	0	0	0	115	F13	P11-F13 VanDerWaalsContact C-N 3.31Å; P11-F13 PolarHBondContact O-N 3.02Å
12	E	85	Confident	83.9	Confident	162 Å²	162	79.1 Å²	79.1	76%	0.757	40%	0.404	S	S	*	.	H	α-helix	trans	-66.2	-34.2	178.6	-66.9	-170.8	170.5	0	0	112.2	D10	D10-E12 PolarHBondContact O-N 3.37Å; D10-E12 VanDerWaalsContact O-N 3.12Å; D10-E12 PolarHBondContact OD1-N 2.94Å
13	F	87.7	Confident	84.2	Confident	129 Å²	129	81.5 Å²	81.5	57%	0.566	42%	0.419	S	S	*	.	H	α-helix	trans	-99.5	-7.4	-177.4	-61.9	-84.9	0	0	0	113.4	D10 P11 N15 S16 E17	D10-F13 HydrophobicContact CB-CD2 4.05Å; D10-F13 CarbonylContact O-C 3.6Å; D10-F13 PolarHBondContact O-N 3.2Å; P11-F13 VanDerWaalsContact C-N 3.31Å; P11-F13 PolarHBondContact O-N 3.02Å; F13-N15 VanDerWaalsContact C-N 3.29Å; F13-N15 PolarHBondContact O-N 2.71Å; F13-S16 PolarHBondContact O-N 2.91Å; F13-S16 PolarHBondContact O-OG 3.08Å; F13-E17 PolarHBondContact O-N 3.42Å
14	L	87.3	Confident	84.3	Confident	31 Å²	31	79.9 Å²	79.9	16%	0.162	41%	0.412	C	S	.	.	H	α-helix	trans	-58.8	-41.3	-178.2	-178.9	61.9	0	0	0	112.1	A5 I6 C9 D10 E17 L18	A5-L14 HydrophobicContact CB-CD1 4.25Å; I6-L14 HydrophobicContact CG1-CD1 4.3Å; C9-L14 HydrophobicContact CB-CD1 4.28Å; D10-L14 PolarHBondContact O-N 2.98Å; L14-E17 PolarHBondContact O-N 3.46Å; L14-L18 HydrophobicContact CD1-CD1 4.15Å; L14-L18 HydrophobicContact CD1-CG 4.14Å; L14-L18 HydrophobicContact CG-CD1 4.01Å; L14-L18 HydrophobicContact CG-CG 4.4Å; L14-L18 WeakPolarHBondContact O-CB 3.27Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.22Å; L14-L18 PolarHBondContact O-N 2.67Å
15	N	88	Confident	84.6	Confident	100 Å²	100	73 Å²	73	54%	0.535	39%	0.389	S	S	.	.	H	α-helix	trans	-67.8	-35.7	-179.4	-78.3	-45.3	0	0	0	113.3	F13 R19	F13-N15 VanDerWaalsContact C-N 3.29Å; F13-N15 PolarHBondContact O-N 2.71Å; N15-R19 WeakPolarHBondContact O-CG 3.37Å; N15-R19 PolarHBondContact O-N 2.9Å
16	S	88.1	Confident	84.7	Confident	62 Å²	62	75.8 Å²	75.8	43%	0.434	40%	0.401	S	S	.	.	H	α-helix	trans	-72.2	-39.9	175.7	54.2	0	0	0	0	110.9	F13 R19 H20	F13-S16 PolarHBondContact O-N 2.91Å; F13-S16 PolarHBondContact O-OG 3.08Å; S16-R19 WeakPolarHBondContact O-CB 3.28Å; S16-R19 PolarHBondContact O-N 3.42Å; S16-H20 PolarHBondContact O-N 3Å
17	E	88.5	Confident	84.4	Confident	75 Å²	75	80.9 Å²	80.9	35%	0.35	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-44.2	176.5	-171.8	64.8	-168.8	0	0	111.9	A5 F13 L14 R19 H20 I21	A5-E17 HydrophobicContact CB-CG 3.91Å; F13-E17 PolarHBondContact O-N 3.42Å; L14-E17 PolarHBondContact O-N 3.46Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.82Å; E17-H20 WeakPolarHBondContact O-CB 3.43Å; E17-H20 PolarHBondContact O-N 3.34Å; E17-H20 VanDerWaalsContact O-N 3.13Å; E17-I21 HydrophobicContact CG-CD1 4.11Å; E17-I21 VanDerWaalsContact O-CG1 3.31Å; E17-I21 WeakPolarHBondContact O-CG1 3.3Å; E17-I21 PolarHBondContact O-N 3.43Å
18	L	89.3	Confident	84.1	Confident	9 Å²	9	82.4 Å²	82.4	5%	0.047	42%	0.417	C	S	.	.	H	α-helix	trans	-63.3	-36.5	176.5	-70.4	175.4	0	0	0	112.4	V2 A5 L14 I21 A22 I39 L43	V2-L18 HydrophobicContact CG1-CD2 3.88Å; V2-L18 HydrophobicContact CG2-CD2 4.49Å; A5-L18 HydrophobicContact CB-CD2 4.41Å; L14-L18 HydrophobicContact CD1-CD1 4.15Å; L14-L18 HydrophobicContact CD1-CG 4.14Å; L14-L18 HydrophobicContact CG-CD1 4.01Å; L14-L18 HydrophobicContact CG-CG 4.4Å; L14-L18 WeakPolarHBondContact O-CB 3.27Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.22Å; L14-L18 PolarHBondContact O-N 2.67Å; L18-I21 HydrophobicContact CD2-CD1 4.5Å; L18-A22 WeakPolarHBondContact O-CB 3.39Å; L18-A22 PolarHBondContact O-N 3.11Å; L18-I39 HydrophobicContact CD1-CG2 4.27Å; L18-I39 HydrophobicContact CD2-CG2 4.32Å; L18-L43 HydrophobicContact CD1-CD1 3.93Å; L18-L43 HydrophobicContact CD1-CD2 3.84Å; L18-L43 HydrophobicContact CD1-CG 4.17Å
19	R	88.6	Confident	83.6	Confident	173 Å²	173	79.9 Å²	79.9	65%	0.653	42%	0.42	S	S	*	.	H	α-helix	trans	-63.7	-44.3	171.2	-77	-176.1	-175.9	109.8	-4.2	111.4	N15 S16 E17 A22 T23	N15-R19 WeakPolarHBondContact O-CG 3.37Å; N15-R19 PolarHBondContact O-N 2.9Å; S16-R19 WeakPolarHBondContact O-CB 3.28Å; S16-R19 PolarHBondContact O-N 3.42Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.82Å; R19-A22 WeakPolarHBondContact O-CB 3.38Å; R19-A22 PolarHBondContact O-N 3.39Å; R19-T23 PolarHBondContact O-N 3.31Å; R19-T23 PolarHBondContact O-OG1 3.5Å; R19-T23 VanDerWaalsContact O-OG1 3.1Å
20	H	86.8	Confident	83.1	Confident	117 Å²	117	82.5 Å²	82.5	54%	0.542	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-44.7	177.8	-176	69.7	0	0	0	112.1	S16 E17 A22 T23 T24	S16-H20 PolarHBondContact O-N 3Å; E17-H20 WeakPolarHBondContact O-CB 3.43Å; E17-H20 PolarHBondContact O-N 3.34Å; E17-H20 VanDerWaalsContact O-N 3.13Å; H20-A22 VanDerWaalsContact C-N 3.33Å; H20-A22 PolarHBondContact O-N 3.04Å; H20-T23 PolarHBondContact O-N 3.29Å; H20-T24 WeakPolarHBondContact O-CB 3.4Å; H20-T24 PolarHBondContact O-N 3.31Å; H20-T24 PolarHBondContact O-OG1 2.99Å
21	I	87	Confident	82.7	Confident	4 Å²	4	82 Å²	82	2%	0.021	43%	0.427	C	S	.	.	H	α-helix	trans	-58.6	-46	173.6	-68.2	169.2	0	0	0	110.3	M1 V2 A5 E17 L18 T24 L25	M1-I21 HydrophobicContact CB-CD1 4.36Å; M1-I21 HydrophobicContact CB-CG2 4.2Å; M1-I21 HydrophobicContact CE-CG1 4.29Å; M1-I21 HydrophobicContact CE-CG2 4.29Å; V2-I21 HydrophobicContact CG2-CG2 4.31Å; A5-I21 HydrophobicContact CB-CD1 3.76Å; E17-I21 HydrophobicContact CG-CD1 4.11Å; E17-I21 VanDerWaalsContact O-CG1 3.31Å; E17-I21 WeakPolarHBondContact O-CG1 3.3Å; E17-I21 PolarHBondContact O-N 3.43Å; L18-I21 HydrophobicContact CD2-CD1 4.5Å; I21-T24 PolarHBondContact O-N 3.07Å; I21-L25 HydrophobicContact CG2-CD1 3.97Å; I21-L25 WeakPolarHBondContact O-CG 3.33Å; I21-L25 PolarHBondContact O-N 3.46Å
22	A	89	Confident	82.5	Confident	13 Å²	13	83.6 Å²	83.6	11%	0.107	42%	0.423	C	S	.	.	H	α-helix	trans	-60.7	-51.1	179.9	0	0	0	0	0	112	L18 R19 H20 T24 L25 E26 V35 I39	L18-A22 WeakPolarHBondContact O-CB 3.39Å; L18-A22 PolarHBondContact O-N 3.11Å; R19-A22 WeakPolarHBondContact O-CB 3.38Å; R19-A22 PolarHBondContact O-N 3.39Å; H20-A22 VanDerWaalsContact C-N 3.33Å; H20-A22 PolarHBondContact O-N 3.04Å; A22-T24 VanDerWaalsContact C-N 3.29Å; A22-T24 PolarHBondContact O-N 3.34Å; A22-L25 PolarHBondContact O-N 2.95Å; A22-E26 WeakPolarHBondContact O-CG 3.32Å; A22-E26 PolarHBondContact O-N 3.09Å; A22-V35 HydrophobicContact CB-CG1 3.66Å; A22-I39 HydrophobicContact CB-CD1 3.79Å
23	T	84	Confident	82.2	Confident	66 Å²	66	81.2 Å²	81.2	41%	0.405	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-37.3	178	-54.3	0	0	0	0	112.2	R19 H20 E26 K27	R19-T23 PolarHBondContact O-N 3.31Å; R19-T23 PolarHBondContact O-OG1 3.5Å; R19-T23 VanDerWaalsContact O-OG1 3.1Å; H20-T23 PolarHBondContact O-N 3.29Å; T23-E26 PolarHBondContact O-N 2.94Å; T23-K27 HydrophobicContact CG2-CD 4.48Å; T23-K27 WeakPolarHBondContact O-CB 3.33Å; T23-K27 WeakPolarHBondContact O-CG 3.23Å; T23-K27 PolarHBondContact O-N 3.05Å
24	T	81.7	Confident	81.8	Confident	45 Å²	45	78.1 Å²	78.1	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-65.3	-41.4	177.4	-61.2	0	0	0	0	111.4	H20 I21 A22 N28	H20-T24 WeakPolarHBondContact O-CB 3.4Å; H20-T24 PolarHBondContact O-N 3.31Å; H20-T24 PolarHBondContact O-OG1 2.99Å; I21-T24 PolarHBondContact O-N 3.07Å; A22-T24 VanDerWaalsContact C-N 3.29Å; A22-T24 PolarHBondContact O-N 3.34Å; T24-N28 WeakPolarHBondContact O-CB 3.42Å; T24-N28 PolarHBondContact O-N 3.23Å; T24-N28 VanDerWaalsContact O-N 3.12Å; T24-N28 PolarHBondContact O-ND2 3.41Å
25	L	81.8	Confident	81.4	Confident	38 Å²	38	76.8 Å²	76.8	20%	0.199	40%	0.399	C	S	.	.	H	α-helix	trans	-67.5	-44.1	175	-68.6	172	0	0	0	111.1	I21 A22 K27 N28 G29 Y30 V35	I21-L25 HydrophobicContact CG2-CD1 3.97Å; I21-L25 WeakPolarHBondContact O-CG 3.33Å; I21-L25 PolarHBondContact O-N 3.46Å; A22-L25 PolarHBondContact O-N 2.95Å; L25-K27 VanDerWaalsContact C-N 3.35Å; L25-K27 PolarHBondContact O-N 3.07Å; L25-N28 CarbonylContact O-C 2.87Å; L25-N28 WeakPolarHBondContact O-CA 3.42Å; L25-N28 PolarHBondContact O-N 3.37Å; L25-N28 VanDerWaalsContact O-N 3.07Å; L25-G29 PolarHBondContact O-N 3.41Å; L25-Y30 HydrophobicContact CB-CD2 4.18Å; L25-Y30 HydrophobicContact CB-CG 4.39Å; L25-Y30 HydrophobicContact CD2-CD2 3.99Å; L25-Y30 HydrophobicContact CD2-CE2 4.05Å; L25-Y30 WeakPolarHBondContact O-CB 3.34Å; L25-Y30 VanDerWaalsContact O-CD2 3.23Å; L25-Y30 WeakPolarHBondContact O-CD2 3.35Å; L25-Y30 PolarHBondContact O-N 3.12Å; L25-Y30 VanDerWaalsContact O-N 3.08Å; L25-V35 HydrophobicContact CB-CG1 4.41Å; L25-V35 HydrophobicContact CB-CG2 3.77Å; L25-V35 HydrophobicContact CD1-CG1 4.26Å; L25-V35 HydrophobicContact CD1-CG2 4.34Å
26	E	81.4	Confident	81.2	Confident	64 Å²	64	74.9 Å²	74.9	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-59.5	-43.7	176.5	-71.3	173.6	-162	0	0	112.1	A22 T23 N28 G29 K32 V35	A22-E26 WeakPolarHBondContact O-CG 3.32Å; A22-E26 PolarHBondContact O-N 3.09Å; T23-E26 PolarHBondContact O-N 2.94Å; E26-N28 VanDerWaalsContact C-N 3.26Å; E26-N28 PolarHBondContact O-N 3.05Å; E26-G29 PolarHBondContact O-N 3.4Å; E26-K32 HydrophobicContact CG-CB 4.5Å; E26-K32 WeakPolarHBondContact OE1-CG 3.23Å; E26-V35 HydrophobicContact CG-CG2 4.44Å
27	K	73.4	Confident	80.7	Confident	176 Å²	176	75.1 Å²	75.1	77%	0.765	40%	0.395	S	S	*	.	H	α-helix	trans	-62.5	-30.8	174.3	-77.4	-176.7	178.6	-177.8	0	113.4	T23 L25 G29	T23-K27 HydrophobicContact CG2-CD 4.48Å; T23-K27 WeakPolarHBondContact O-CB 3.33Å; T23-K27 WeakPolarHBondContact O-CG 3.23Å; T23-K27 PolarHBondContact O-N 3.05Å; L25-K27 VanDerWaalsContact C-N 3.35Å; L25-K27 PolarHBondContact O-N 3.07Å; K27-G29 PolarHBondContact O-N 2.94Å
28	N	74.1	Confident	80.4	Confident	113 Å²	113	73.1 Å²	73.1	60%	0.604	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	8.8	174.1	-73	-40.3	0	0	0	113.1	T24 L25 E26 Y30	T24-N28 WeakPolarHBondContact O-CB 3.42Å; T24-N28 PolarHBondContact O-N 3.23Å; T24-N28 VanDerWaalsContact O-N 3.12Å; T24-N28 PolarHBondContact O-ND2 3.41Å; L25-N28 CarbonylContact O-C 2.87Å; L25-N28 WeakPolarHBondContact O-CA 3.42Å; L25-N28 PolarHBondContact O-N 3.37Å; L25-N28 VanDerWaalsContact O-N 3.07Å; E26-N28 VanDerWaalsContact C-N 3.26Å; E26-N28 PolarHBondContact O-N 3.05Å; N28-Y30 HydrophobicContact CB-CD2 4.01Å; N28-Y30 HydrophobicContact CB-CE2 4.05Å
29	G	68.5	Low	80.2	Confident	64 Å²	64	73.7 Å²	73.7	66%	0.66	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	10.8	174.2	0	0	0	0	0	114.9	L25 E26 K27	L25-G29 PolarHBondContact O-N 3.41Å; E26-G29 PolarHBondContact O-N 3.4Å; K27-G29 PolarHBondContact O-N 2.94Å
30	Y	69.5	Low	79.9	Confident	95 Å²	95	68.1 Å²	68.1	37%	0.373	38%	0.382	S	S	.	.			trans	-77.3	135.5	175.4	-68.2	-92.5	0	0	0	110.6	L25 N28 K32 F34	L25-Y30 HydrophobicContact CB-CD2 4.18Å; L25-Y30 HydrophobicContact CB-CG 4.39Å; L25-Y30 HydrophobicContact CD2-CD2 3.99Å; L25-Y30 HydrophobicContact CD2-CE2 4.05Å; L25-Y30 WeakPolarHBondContact O-CB 3.34Å; L25-Y30 VanDerWaalsContact O-CD2 3.23Å; L25-Y30 WeakPolarHBondContact O-CD2 3.35Å; L25-Y30 PolarHBondContact O-N 3.12Å; L25-Y30 VanDerWaalsContact O-N 3.08Å; N28-Y30 HydrophobicContact CB-CD2 4.01Å; N28-Y30 HydrophobicContact CB-CE2 4.05Å; Y30-K32 PolarHBondContact O-N 2.9Å; Y30-F34 HydrophobicContact CD1-CD1 4.26Å; Y30-F34 HydrophobicContact CD1-CE1 4.13Å
31	P	72.8	Confident	79.6	Confident	79 Å²	79	69.8 Å²	69.8	51%	0.513	38%	0.383	S	S	.	.			trans	-60.4	136	178.7	-23.1	32.6	0	0	0	112.5	T33 F34 V35	P31-T33 VanDerWaalsContact C-N 3.3Å; P31-T33 PolarHBondContact O-N 2.95Å; P31-F34 HydrophobicContact CB-CB 4.16Å; P31-F34 WeakPolarHBondContact O-CB 3.02Å; P31-F34 PolarHBondContact O-N 2.97Å; P31-F34 VanDerWaalsContact O-N 3.07Å; P31-V35 WeakPolarHBondContact O-CG2 3.49Å; P31-V35 PolarHBondContact O-N 3.34Å; P31-V35 VanDerWaalsContact O-N 3.08Å
32	K	80.1	Confident	79.3	Confident	141 Å²	141	74.4 Å²	74.4	61%	0.613	40%	0.4	S	S	*	.	H	α-helix	trans	-54.1	-43.7	179.6	-176.5	165.8	-169.5	179.9	0	113.1	E26 Y30 F34 V35 S36	E26-K32 HydrophobicContact CG-CB 4.5Å; E26-K32 WeakPolarHBondContact OE1-CG 3.23Å; Y30-K32 PolarHBondContact O-N 2.9Å; K32-F34 VanDerWaalsContact C-N 3.33Å; K32-F34 PolarHBondContact O-N 3.12Å; K32-V35 PolarHBondContact O-N 3.3Å; K32-S36 PolarHBondContact O-N 2.85Å; K32-S36 PolarHBondContact O-OG 2.98Å; K32-S36 VanDerWaalsContact O-OG 3.08Å
33	T	78.3	Confident	78.9	Confident	112 Å²	112	77.2 Å²	77.2	69%	0.687	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-40	177.9	51.5	0	0	0	0	112.7	P31 S37	P31-T33 VanDerWaalsContact C-N 3.3Å; P31-T33 PolarHBondContact O-N 2.95Å; T33-S37 VanDerWaalsContact O-CB 3.28Å; T33-S37 WeakPolarHBondContact O-CB 3.16Å; T33-S37 PolarHBondContact O-N 3.29Å; T33-S37 PolarHBondContact O-OG 3.01Å
34	F	79.3	Confident	78.6	Confident	64 Å²	64	79.9 Å²	79.9	28%	0.281	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-45.4	177	173.4	-102.5	0	0	0	111.8	Y30 P31 K32 S37 T38 E70	Y30-F34 HydrophobicContact CD1-CD1 4.26Å; Y30-F34 HydrophobicContact CD1-CE1 4.13Å; P31-F34 HydrophobicContact CB-CB 4.16Å; P31-F34 WeakPolarHBondContact O-CB 3.02Å; P31-F34 PolarHBondContact O-N 2.97Å; P31-F34 VanDerWaalsContact O-N 3.07Å; K32-F34 VanDerWaalsContact C-N 3.33Å; K32-F34 PolarHBondContact O-N 3.12Å; F34-S37 PolarHBondContact O-OG 3.47Å; F34-T38 VanDerWaalsContact O-CB 3.28Å; F34-T38 WeakPolarHBondContact O-CB 3.33Å; F34-T38 PolarHBondContact O-N 2.83Å; F34-T38 PolarHBondContact O-OG1 2.92Å; F34-E70 HydrophobicContact CD2-CG 4.45Å; F34-E70 WeakPolarHBondContact CD2-OE1 3.05Å; F34-E70 HydrophobicContact CE2-CG 4.3Å; F34-E70 VanDerWaalsContact CE2-OE1 3.26Å; F34-E70 WeakPolarHBondContact CE2-OE1 3.38Å
35	V	79.5	Confident	77.8	Confident	2 Å²	2	82.6 Å²	82.6	1%	0.012	44%	0.443	C	S	.	.	H	α-helix	trans	-63.4	-50.8	179	175.5	0	0	0	0	110.3	A22 L25 E26 P31 K32 S37 T38 I39	A22-V35 HydrophobicContact CB-CG1 3.66Å; L25-V35 HydrophobicContact CB-CG1 4.41Å; L25-V35 HydrophobicContact CB-CG2 3.77Å; L25-V35 HydrophobicContact CD1-CG1 4.26Å; L25-V35 HydrophobicContact CD1-CG2 4.34Å; E26-V35 HydrophobicContact CG-CG2 4.44Å; P31-V35 WeakPolarHBondContact O-CG2 3.49Å; P31-V35 PolarHBondContact O-N 3.34Å; P31-V35 VanDerWaalsContact O-N 3.08Å; K32-V35 PolarHBondContact O-N 3.3Å; V35-S37 PolarHBondContact O-N 3.22Å; V35-T38 PolarHBondContact O-N 3.29Å; V35-I39 HydrophobicContact CG1-CD1 3.97Å; V35-I39 WeakPolarHBondContact O-CG1 3.47Å; V35-I39 PolarHBondContact O-N 3.02Å
36	S	83.1	Confident	76.4	Confident	61 Å²	61	87.1 Å²	87.1	43%	0.427	47%	0.473	S	S	.	.	H	α-helix	trans	-62.1	-45.7	-179.9	-56	0	0	0	0	112.8	K32 T38 I39 A40	K32-S36 PolarHBondContact O-N 2.85Å; K32-S36 PolarHBondContact O-OG 2.98Å; K32-S36 VanDerWaalsContact O-OG 3.08Å; S36-T38 VanDerWaalsContact C-N 3.32Å; S36-T38 PolarHBondContact O-N 3.41Å; S36-I39 PolarHBondContact O-N 2.84Å; S36-A40 WeakPolarHBondContact O-CB 3.45Å; S36-A40 PolarHBondContact O-N 3.04Å
37	S	79	Confident	74.5	Confident	66 Å²	66	90.7 Å²	90.7	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-37.2	178.5	58.9	0	0	0	0	112.4	T33 F34 V35 R41	T33-S37 VanDerWaalsContact O-CB 3.28Å; T33-S37 WeakPolarHBondContact O-CB 3.16Å; T33-S37 PolarHBondContact O-N 3.29Å; T33-S37 PolarHBondContact O-OG 3.01Å; F34-S37 PolarHBondContact O-OG 3.47Å; V35-S37 PolarHBondContact O-N 3.22Å; S37-R41 WeakPolarHBondContact O-CB 3.28Å; S37-R41 PolarHBondContact O-N 3.25Å; S37-R41 VanDerWaalsContact O-N 3.07Å
38	T	81.2	Confident	73.2	Confident	34 Å²	34	86.4 Å²	86.4	21%	0.209	49%	0.486	C	S	.	.	H	α-helix	trans	-66.3	-44.2	176.2	-63	0	0	0	0	111.6	F34 V35 S36 R42	F34-T38 VanDerWaalsContact O-CB 3.28Å; F34-T38 WeakPolarHBondContact O-CB 3.33Å; F34-T38 PolarHBondContact O-N 2.83Å; F34-T38 PolarHBondContact O-OG1 2.92Å; V35-T38 PolarHBondContact O-N 3.29Å; S36-T38 VanDerWaalsContact C-N 3.32Å; S36-T38 PolarHBondContact O-N 3.41Å; T38-R42 VanDerWaalsContact O-CG 3.3Å; T38-R42 WeakPolarHBondContact O-CG 3.36Å; T38-R42 PolarHBondContact O-N 3.13Å
39	I	85.1	Confident	71.5	Confident	21 Å²	21	86.4 Å²	86.4	11%	0.108	50%	0.495	C	S	.	.	H	α-helix	trans	-64.2	-48	177.7	-66.3	172.6	0	0	0	110.6	V2 L18 A22 V35 S36 R41 R42 L43	V2-I39 HydrophobicContact CG2-CG1 3.98Å; L18-I39 HydrophobicContact CD1-CG2 4.27Å; L18-I39 HydrophobicContact CD2-CG2 4.32Å; A22-I39 HydrophobicContact CB-CD1 3.79Å; V35-I39 HydrophobicContact CG1-CD1 3.97Å; V35-I39 WeakPolarHBondContact O-CG1 3.47Å; V35-I39 PolarHBondContact O-N 3.02Å; S36-I39 PolarHBondContact O-N 2.84Å; I39-R41 VanDerWaalsContact C-N 3.34Å; I39-R41 PolarHBondContact O-N 2.94Å; I39-R42 PolarHBondContact O-N 3.02Å; I39-L43 HydrophobicContact CG2-CD1 3.95Å; I39-L43 HydrophobicContact CG2-CG 4.4Å; I39-L43 PolarHBondContact O-N 3.44Å
40	A	83.6	Confident	70	Confident	55 Å²	55	86.5 Å²	86.5	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-58.4	-44	-179.8	0	0	0	0	0	112.5	S36 R42 L43 N44	S36-A40 WeakPolarHBondContact O-CB 3.45Å; S36-A40 PolarHBondContact O-N 3.04Å; A40-R42 PolarHBondContact O-N 2.81Å; A40-L43 PolarHBondContact O-N 3.32Å; A40-N44 PolarHBondContact O-N 3.02Å
41	R	79.6	Confident	68.7	Low	152 Å²	152	86.4 Å²	86.4	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-64	-27.8	177.6	-175.4	177.4	62.5	90.7	-3	113.3	S37 I39	S37-R41 WeakPolarHBondContact O-CB 3.28Å; S37-R41 PolarHBondContact O-N 3.25Å; S37-R41 VanDerWaalsContact O-N 3.07Å; I39-R41 VanDerWaalsContact C-N 3.34Å; I39-R41 PolarHBondContact O-N 2.94Å
42	R	80.6	Confident	66.9	Low	101 Å²	101	90.6 Å²	90.6	38%	0.381	51%	0.508	S	S	.	.	H	α-helix	trans	-86.3	-30.1	179	-67	-60.5	-172.5	125.3	5.7	112.7	V2 D3 I6 T38 I39 A40	V2-R42 HydrophobicContact CG1-CB 3.74Å; V2-R42 HydrophobicContact CG1-CG 4.19Å; D3-R42 IonicContact OD1-CZ 3.51Å; D3-R42 IonicContact OD1-NE 2.71Å; D3-R42 IonicContact OD1-NH1 2.67Å; D3-R42 PolarHBondContact OD1-NH1 3.34Å; D3-R42 IonicContact OD2-CZ 3.54Å; D3-R42 IonicContact OD2-NH1 3.85Å; D3-R42 PolarHBondContact OD2-NH1 3.02Å; D3-R42 IonicContact OD2-NH2 3.54Å; I6-R42 HydrophobicContact CD1-CB 4.29Å; T38-R42 VanDerWaalsContact O-CG 3.3Å; T38-R42 WeakPolarHBondContact O-CG 3.36Å; T38-R42 PolarHBondContact O-N 3.13Å; I39-R42 PolarHBondContact O-N 3.02Å; A40-R42 PolarHBondContact O-N 2.81Å
43	L	79.8	Confident	65	Low	72 Å²	72	92.1 Å²	92.1	38%	0.377	52%	0.517	S	S	.	.	H	α-helix	trans	-72.9	-42.6	173.8	-77.2	174	0	0	0	112.4	I6 L18 I39 A40 P45	I6-L43 HydrophobicContact CD1-CD2 4.4Å; L18-L43 HydrophobicContact CD1-CD1 3.93Å; L18-L43 HydrophobicContact CD1-CD2 3.84Å; L18-L43 HydrophobicContact CD1-CG 4.17Å; I39-L43 HydrophobicContact CG2-CD1 3.95Å; I39-L43 HydrophobicContact CG2-CG 4.4Å; I39-L43 PolarHBondContact O-N 3.44Å; A40-L43 PolarHBondContact O-N 3.32Å; L43-P45 VanDerWaalsContact C-CD 3.49Å; L43-P45 VanDerWaalsContact O-CD 3.28Å; L43-P45 WeakPolarHBondContact O-CD 3.24Å
44	N	77.6	Confident	63.4	Low	122 Å²	122	93 Å²	93	65%	0.652	51%	0.508	S	S	*	.	S	Bend	trans	-117.6	81.2	178.8	-63.3	-40.8	0	0	0	109.5	A40 T46	A40-N44 PolarHBondContact O-N 3.02Å; N44-T46 VanDerWaalsContact C-N 3.34Å; N44-T46 PolarHBondContact O-N 3.01Å
45	P	65	Low	61.9	Low	102 Å²	102	96.1 Å²	96.1	66%	0.662	53%	0.527	S	S	*	.			trans	-68.3	95	168.6	28.2	-31	0	0	0	108.1	L43 D47	L43-P45 VanDerWaalsContact C-CD 3.49Å; L43-P45 VanDerWaalsContact O-CD 3.28Å; L43-P45 WeakPolarHBondContact O-CD 3.24Å; P45-D47 PolarHBondContact O-N 3.5Å
46	T	54.1	Low	60.4	Low	134 Å²	134	106.9 Å²	106.9	82%	0.822	57%	0.568	S	S	*	*			trans	-56.6	137.7	173.8	43.4	0	0	0	0	110.7	N44 S48	N44-T46 VanDerWaalsContact C-N 3.34Å; N44-T46 PolarHBondContact O-N 3.01Å; T46-S48 PolarHBondContact O-N 2.95Å
47	D	40.3	Very low	58.7	Low	139 Å²	139	107 Å²	107	74%	0.743	56%	0.563	S	S	*	*			trans	-39.7	115	-168	-92.2	-48.3	0	0	0	116.2	P45 S49	P45-D47 PolarHBondContact O-N 3.5Å; D47-S49 PolarHBondContact O-N 2.94Å
48	S	45.3	Very low	57.1	Low	86 Å²	86	108.2 Å²	108.2	60%	0.601	57%	0.57	S	S	*	*	S	Bend		34.9	3.5	119.3	64.1	0	0	0	0	123.1	T46	T46-S48 PolarHBondContact O-N 2.95Å
49	S	38.8	Very low	55.6	Low	113 Å²	113	110.1 Å²	110.1	79%	0.79	58%	0.581	S	S	*	*	S	Bend	trans	-105.8	18.8	-176.1	-70.9	0	0	0	0	116.4	D47	D47-S49 PolarHBondContact O-N 2.94Å
50	S	38.5	Very low	53.5	Low	65 Å²	65	112.9 Å²	112.9	46%	0.455	60%	0.596	S	S	.	*	S	Bend	trans	-148.1	31.7	170.3	54	0	0	0	0	114.9	R54	S50-R54 WeakPolarHBondContact O-CD 3.46Å; S50-R54 WeakPolarHBondContact O-CG 3.44Å; S50-R54 PolarHBondContact O-NE 2.87Å; S50-R54 PolarHBondContact OG-NH2 3.37Å
51	N	40.3	Very low	51.7	Low	93 Å²	93	113.6 Å²	113.6	50%	0.497	60%	0.595	S	S	.	*			trans	-85.5	-19	-179.4	-80.2	-27.2	0	0	0	114.8	R54	N51-R54 PolarHBondContact OD1-NH1 3.35Å
52	I	36.8	Very low	50	Low	168 Å²	168	108 Å²	108	86%	0.862	58%	0.576	S	S	*	*	S	Bend	trans	-75.9	-28.4	-172.9	-60.1	177.4	0	0	0	112.6
53	E	39.3	Very low	48.3	Very low	172 Å²	172	105.5 Å²	105.5	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	-87.5	-14.2	178.9	-129.2	177.3	-173.4	0	0	113.8	D55	E53-D55 PolarHBondContact O-N 2.9Å
54	R	44.3	Very low	46.7	Very low	132 Å²	132	107.6 Å²	107.6	50%	0.498	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-75.8	-22.9	-172.5	-69.2	-179.8	-162.3	-178.3	2.7	114.7	S50 N51	S50-R54 WeakPolarHBondContact O-CD 3.46Å; S50-R54 WeakPolarHBondContact O-CG 3.44Å; S50-R54 PolarHBondContact O-NE 2.87Å; S50-R54 PolarHBondContact OG-NH2 3.37Å; N51-R54 PolarHBondContact OD1-NH1 3.35Å
55	D	47.5	Very low	45.4	Very low	128 Å²	128	107.9 Å²	107.9	68%	0.684	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-88.7	-4	-174.9	-91.8	-14.9	0	0	0	114.7	E53 R82	E53-D55 PolarHBondContact O-N 2.9Å; D55-R82 IonicContact OD1-NH1 3.59Å
56	R	47.9	Very low	44.6	Very low	228 Å²	228	109.3 Å²	109.3	86%	0.86	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-100.2	0.4	177.7	-74.7	-173.5	179.9	177.1	0.7	115.3
57	L	48.1	Very low	44.7	Very low	64 Å²	64	106.3 Å²	106.3	34%	0.335	57%	0.571	S	S	.	*	S	Bend	trans	-71.6	131.4	179.7	-62.2	172.7	0	0	0	110.9	V59 G80 R82	L57-V59 PolarHBondContact O-N 3.02Å; L57-G80 VanDerWaalsContact CD2-O 3.29Å; L57-G80 WeakPolarHBondContact CD2-O 3.31Å; L57-R82 HydrophobicContact CB-CB 4.4Å
58	P	44.9	Very low	45.6	Very low	92 Å²	92	103.8 Å²	103.8	60%	0.597	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-57.2	137.6	172.1	21.9	-30.4	0	0	0	110.4	F81 R82	P58-F81 HydrophobicContact CG-CB 4.34Å; P58-F81 WeakPolarHBondContact O-CA 3.37Å; P58-F81 VanDerWaalsContact O-CB 3.28Å; P58-F81 WeakPolarHBondContact O-CB 3.47Å; P58-R82 PolarHBondContact O-N 3.08Å
59	V	49.3	Very low	46.3	Very low	73 Å²	73	100 Å²	100	44%	0.442	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.5	-174.5	167.1	0	0	0	0	110.2	L57 R82 F84	L57-V59 PolarHBondContact O-N 3.02Å; V59-R82 CarbonylContact C-O 3.52Å; V59-R82 WeakPolarHBondContact CA-O 3.39Å; V59-R82 HydrophobicContact CG2-CB 4.45Å; V59-F84 HydrophobicContact CB-CD2 4.35Å; V59-F84 HydrophobicContact CG1-CB 4.43Å; V59-F84 HydrophobicContact CG1-CD2 3.41Å; V59-F84 VanDerWaalsContact CG1-CD2 3.41Å; V59-F84 HydrophobicContact CG1-CE2 3.98Å; V59-F84 HydrophobicContact CG1-CG 4.32Å; V59-F84 HydrophobicContact CG2-CD2 4.07Å; V59-F84 HydrophobicContact CG2-CE2 3.78Å
60	L	42.5	Very low	47.5	Very low	79 Å²	79	100.2 Å²	100.2	41%	0.414	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.9	171.4	-176.7	61.5	0	0	0	109.1	I62 F81 R82 I83 F84	L60-I62 HydrophobicContact CD2-CD1 3.88Å; L60-I62 HydrophobicContact CD2-CG1 4.3Å; L60-I62 HydrophobicContact CG-CD1 4.09Å; L60-I62 HydrophobicContact CG-CG1 3.95Å; L60-F81 HydrophobicContact CB-CD2 3.97Å; L60-F81 HydrophobicContact CB-CE2 4.48Å; L60-F81 HydrophobicContact CD2-CD2 3.94Å; L60-F81 HydrophobicContact CD2-CE2 3.62Å; L60-F81 HydrophobicContact CD2-CZ 4.34Å; L60-R82 PolarHBondContact N-O 3.28Å; L60-I83 HydrophobicContact CB-CG1 4.46Å; L60-I83 VanDerWaalsContact O-CA 3.23Å; L60-I83 WeakPolarHBondContact O-CA 3.08Å; L60-F84 PolarHBondContact O-N 3.13Å
61	T	45.1	Very low	49.1	Very low	71 Å²	71	101 Å²	101	44%	0.436	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.1	177.9	-56.8	0	0	0	0	110	F84 K86 Y168	T61-F84 CarbonylContact C-O 3.45Å; T61-F84 WeakPolarHBondContact CA-O 3.5Å; T61-K86 HydrophobicContact CG2-CB 3.94Å; T61-Y168 PolarHBondContact O-OH 3.33Å; T61-Y168 VanDerWaalsContact O-OH 3.09Å
62	I	43.5	Very low	50.4	Low	35 Å²	35	98.6 Å²	98.6	18%	0.179	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.8	179.2	-53.9	-177.8	0	0	0	109	L60 I83 F84 F85	L60-I62 HydrophobicContact CD2-CD1 3.88Å; L60-I62 HydrophobicContact CD2-CG1 4.3Å; L60-I62 HydrophobicContact CG-CD1 4.09Å; L60-I62 HydrophobicContact CG-CG1 3.95Å; I62-I83 HydrophobicContact CB-CG2 4.13Å; I62-I83 HydrophobicContact CD1-CD1 3.92Å; I62-I83 HydrophobicContact CD1-CG1 4.49Å; I62-I83 HydrophobicContact CD1-CG2 3.89Å; I62-I83 HydrophobicContact CG1-CG2 3.97Å; I62-F84 PolarHBondContact N-O 2.94Å; I62-F85 HydrophobicContact CB-CD1 4.5Å; I62-F85 HydrophobicContact CB-CE1 4.25Å; I62-F85 HydrophobicContact CG2-CE1 4.46Å; I62-F85 VanDerWaalsContact O-CA 3.29Å; I62-F85 WeakPolarHBondContact O-CA 3.35Å; I62-F85 VanDerWaalsContact O-CD1 3.27Å; I62-F85 WeakPolarHBondContact O-CD1 3.28Å
63	P	44.3	Very low	52	Low	48 Å²	48	94 Å²	94	31%	0.312	48%	0.478	S	S	.	.			trans	-60.1	143.1	169.7	-23	32	0	0	0	112.1	Y65 F85 Y168	P63-Y65 HydrophobicContact CB-CE2 4.45Å; P63-Y65 VanDerWaalsContact O-CD2 3.3Å; P63-Y65 WeakPolarHBondContact O-CD2 3.38Å; P63-Y65 PolarHBondContact O-N 2.83Å; P63-F85 WeakPolarHBondContact O-CD1 3.49Å; P63-Y168 VanDerWaalsContact CD-OH 3.26Å; P63-Y168 WeakPolarHBondContact CD-OH 3.47Å; P63-Y168 HydrophobicContact CG-CD2 4.21Å; P63-Y168 HydrophobicContact CG-CE2 3.5Å
64	Y	47.5	Very low	53.7	Low	115 Å²	115	93.1 Å²	93.1	45%	0.451	47%	0.467	S	S	.	.			trans	-70.1	123	177.9	-174	-109.7	0	0	0	110.9	V66 F85	Y64-V66 HydrophobicContact CE1-CG2 4.02Å; Y64-F85 HydrophobicContact CD2-CB 4.08Å; Y64-F85 HydrophobicContact CD2-CD1 4.17Å; Y64-F85 HydrophobicContact CD2-CD2 4.09Å; Y64-F85 AromaticContact CD2-CG 3.84Å; Y64-F85 HydrophobicContact CD2-CG 3.84Å; Y64-F85 HydrophobicContact CG-CB 4.49Å
65	Y	49.1	Very low	55	Low	128 Å²	128	89.1 Å²	89.1	50%	0.502	46%	0.456	S	S	.	.			trans	-108	127.2	165.2	-64.1	-89.1	0	0	0	108.3	P63 G67 L68	P63-Y65 HydrophobicContact CB-CE2 4.45Å; P63-Y65 VanDerWaalsContact O-CD2 3.3Å; P63-Y65 WeakPolarHBondContact O-CD2 3.38Å; P63-Y65 PolarHBondContact O-N 2.83Å; Y65-G67 PolarHBondContact O-N 3.19Å; Y65-L68 HydrophobicContact CG-CD1 4.41Å; Y65-L68 PolarHBondContact O-N 2.98Å
66	V	49.2	Very low	55.9	Low	132 Å²	132	83 Å²	83	80%	0.8	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	125.3	174.9	-178.5	0	0	0	0	108.5	Y64 L68	Y64-V66 HydrophobicContact CE1-CG2 4.02Å; V66-L68 PolarHBondContact O-N 3.29Å
67	G	56.7	Low	57.1	Low	71 Å²	71	81.1 Å²	81.1	73%	0.732	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-19	178.6	0	0	0	0	0	116.8	Y65	Y65-G67 PolarHBondContact O-N 3.19Å
68	L	57.8	Low	58.3	Low	87 Å²	87	83.9 Å²	83.9	46%	0.455	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-10.8	178.6	-66.8	173.1	0	0	0	113.7	Y65 V66 E70 H71 L72	Y65-L68 HydrophobicContact CG-CD1 4.41Å; Y65-L68 PolarHBondContact O-N 2.98Å; V66-L68 PolarHBondContact O-N 3.29Å; L68-E70 PolarHBondContact O-N 3.07Å; L68-H71 PolarHBondContact O-N 3.16Å; L68-L72 HydrophobicContact CB-CD1 4.14Å; L68-L72 HydrophobicContact CB-CG 4.48Å; L68-L72 WeakPolarHBondContact O-CB 3.38Å; L68-L72 WeakPolarHBondContact O-CG 3.3Å; L68-L72 PolarHBondContact O-N 2.9Å
69	G	59.8	Low	59.6	Low	5 Å²	5	87 Å²	87	5%	0.052	43%	0.428	C	S	.	.	H	α-helix	trans	-56.4	-47.7	-171.6	0	0	0	0	0	114.4	Q73 F85	G69-Q73 WeakPolarHBondContact O-CB 3.49Å; G69-Q73 WeakPolarHBondContact O-CG 3.29Å; G69-Q73 PolarHBondContact O-N 3.42Å; G69-F85 VanDerWaalsContact CA-CZ 3.49Å; G69-F85 WeakPolarHBondContact O-CE2 3.39Å
70	E	65.7	Low	60.4	Low	119 Å²	119	85.1 Å²	85.1	56%	0.556	42%	0.423	S	S	*	.	H	α-helix	trans	-71.2	-41.8	-179.1	-65.7	-162.7	131	0	0	112.7	F34 L68 L72 Q73 R74	F34-E70 HydrophobicContact CD2-CG 4.45Å; F34-E70 WeakPolarHBondContact CD2-OE1 3.05Å; F34-E70 HydrophobicContact CE2-CG 4.3Å; F34-E70 VanDerWaalsContact CE2-OE1 3.26Å; F34-E70 WeakPolarHBondContact CE2-OE1 3.38Å; L68-E70 PolarHBondContact O-N 3.07Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.33Å; E70-Q73 PolarHBondContact O-N 3.21Å; E70-R74 WeakPolarHBondContact O-CB 3.43Å; E70-R74 PolarHBondContact O-N 2.86Å
71	H	71	Confident	61.4	Low	82 Å²	82	84.1 Å²	84.1	38%	0.38	42%	0.416	S	S	.	.	H	α-helix	trans	-61.1	-45.3	178.8	178.1	55.2	0	0	0	111.2	L68 R74 L75	L68-H71 PolarHBondContact O-N 3.16Å; H71-R74 PolarHBondContact ND1-NH2 3.38Å; H71-R74 VanDerWaalsContact ND1-NH2 3.13Å; H71-R74 PolarHBondContact O-N 3Å; H71-L75 WeakPolarHBondContact NE2-CD1 3.27Å; H71-L75 WeakPolarHBondContact O-CG 3.29Å; H71-L75 PolarHBondContact O-N 3.39Å
72	L	67.1	Low	62.1	Low	41 Å²	41	85.3 Å²	85.3	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-64.8	-44.8	175.8	-70.2	174.4	0	0	0	111.3	L68 E70 R74 L75 G76 I83 F85	L68-L72 HydrophobicContact CB-CD1 4.14Å; L68-L72 HydrophobicContact CB-CG 4.48Å; L68-L72 WeakPolarHBondContact O-CB 3.38Å; L68-L72 WeakPolarHBondContact O-CG 3.3Å; L68-L72 PolarHBondContact O-N 2.9Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.33Å; L72-R74 VanDerWaalsContact C-N 3.27Å; L72-R74 PolarHBondContact O-N 3.44Å; L72-L75 HydrophobicContact CD2-CD1 4.49Å; L72-L75 PolarHBondContact O-N 2.84Å; L72-G76 PolarHBondContact O-N 3.2Å; L72-I83 HydrophobicContact CB-CD1 3.97Å; L72-I83 WeakPolarHBondContact O-CD1 3.49Å; L72-F85 HydrophobicContact CB-CZ 4.13Å; L72-F85 HydrophobicContact CD1-CE1 4.29Å; L72-F85 HydrophobicContact CD1-CZ 4.3Å
73	Q	72.4	Confident	62.7	Low	72 Å²	72	84.2 Å²	84.2	34%	0.336	41%	0.407	S	S	.	.	H	α-helix	trans	-59	-39	175.1	-79	178	58.8	0	0	112.5	G69 E70 G76 R77 I83 F85	G69-Q73 WeakPolarHBondContact O-CB 3.49Å; G69-Q73 WeakPolarHBondContact O-CG 3.29Å; G69-Q73 PolarHBondContact O-N 3.42Å; E70-Q73 PolarHBondContact O-N 3.21Å; Q73-G76 PolarHBondContact O-N 3.35Å; Q73-R77 WeakPolarHBondContact O-CG 3.48Å; Q73-R77 PolarHBondContact O-N 3.36Å; Q73-I83 HydrophobicContact CG-CB 4.46Å; Q73-F85 HydrophobicContact CG-CE2 3.85Å
74	R	73.2	Confident	63.2	Low	153 Å²	153	86.5 Å²	86.5	58%	0.577	41%	0.412	S	S	*	.	H	α-helix	trans	-64.2	-46.3	175.5	179.3	171.2	59.2	108.2	-6	111.5	E70 H71 L72 G76 R77 Q78	E70-R74 WeakPolarHBondContact O-CB 3.43Å; E70-R74 PolarHBondContact O-N 2.86Å; H71-R74 PolarHBondContact ND1-NH2 3.38Å; H71-R74 VanDerWaalsContact ND1-NH2 3.13Å; H71-R74 PolarHBondContact O-N 3Å; L72-R74 VanDerWaalsContact C-N 3.27Å; L72-R74 PolarHBondContact O-N 3.44Å; R74-G76 VanDerWaalsContact C-N 3.34Å; R74-G76 PolarHBondContact O-N 2.93Å; R74-R77 PolarHBondContact O-N 3.36Å; R74-Q78 PolarHBondContact O-N 3.46Å
75	L	71.8	Confident	63.4	Low	49 Å²	49	83.2 Å²	83.2	26%	0.257	40%	0.4	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174.5	-75.5	171.8	0	0	0	111.6	H71 L72 R77 Q78 Y79	H71-L75 WeakPolarHBondContact NE2-CD1 3.27Å; H71-L75 WeakPolarHBondContact O-CG 3.29Å; H71-L75 PolarHBondContact O-N 3.39Å; L72-L75 HydrophobicContact CD2-CD1 4.49Å; L72-L75 PolarHBondContact O-N 2.84Å; L75-R77 VanDerWaalsContact C-N 3.32Å; L75-R77 PolarHBondContact O-N 2.82Å; L75-Q78 WeakPolarHBondContact O-CB 3.26Å; L75-Q78 PolarHBondContact O-N 3.46Å; L75-Q78 VanDerWaalsContact O-N 3.11Å; L75-Y79 HydrophobicContact CD2-CE2 4.09Å; L75-Y79 VanDerWaalsContact O-CD2 3.22Å; L75-Y79 WeakPolarHBondContact O-CD2 3.3Å; L75-Y79 PolarHBondContact O-N 3.22Å
76	G	67.2	Low	63.2	Low	0 Å²	0	83.8 Å²	83.8	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-57.8	-46.4	176.7	0	0	0	0	0	112	L72 Q73 R74 Q78 Y79 G80 F81	L72-G76 PolarHBondContact O-N 3.2Å; Q73-G76 PolarHBondContact O-N 3.35Å; R74-G76 VanDerWaalsContact C-N 3.34Å; R74-G76 PolarHBondContact O-N 2.93Å; G76-Q78 VanDerWaalsContact C-N 3.33Å; G76-Q78 PolarHBondContact O-N 3.38Å; G76-Y79 CarbonylContact O-C 3.56Å; G76-Y79 PolarHBondContact O-N 2.94Å; G76-G80 PolarHBondContact O-N 3.39Å; G76-F81 CarbonylContact C-O 3.46Å; G76-F81 VanDerWaalsContact CA-CD2 3.48Å; G76-F81 VanDerWaalsContact CA-O 3.27Å; G76-F81 WeakPolarHBondContact CA-O 3.26Å; G76-F81 PolarHBondContact O-N 3.29Å
77	R	72.3	Confident	62.9	Low	187 Å²	187	82.8 Å²	82.8	71%	0.706	40%	0.404	S	S	*	.	H	α-helix	trans	-61	-41.2	174.8	-68.8	178.9	-164.5	-161	6.3	112.4	Q73 R74 L75 Y79 G80 F81	Q73-R77 WeakPolarHBondContact O-CG 3.48Å; Q73-R77 PolarHBondContact O-N 3.36Å; R74-R77 PolarHBondContact O-N 3.36Å; L75-R77 VanDerWaalsContact C-N 3.32Å; L75-R77 PolarHBondContact O-N 2.82Å; R77-Y79 VanDerWaalsContact C-N 3.26Å; R77-Y79 PolarHBondContact O-N 2.86Å; R77-G80 PolarHBondContact O-N 3.22Å; R77-F81 PolarHBondContact N-O 3.13Å
78	Q	74.6	Confident	62.5	Low	123 Å²	123	80.3 Å²	80.3	58%	0.575	38%	0.375	S	S	*	.	H	α-helix	trans	-60.6	-35.3	177.4	179.8	-179.5	-19.5	0	0	112.4	R74 L75 G76	R74-Q78 PolarHBondContact O-N 3.46Å; L75-Q78 WeakPolarHBondContact O-CB 3.26Å; L75-Q78 PolarHBondContact O-N 3.46Å; L75-Q78 VanDerWaalsContact O-N 3.11Å; G76-Q78 VanDerWaalsContact C-N 3.33Å; G76-Q78 PolarHBondContact O-N 3.38Å
79	Y	71.2	Confident	62	Low	158 Å²	158	82 Å²	82	62%	0.62	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	14	-179.2	-68.4	-73.4	0	0	0	113.8	L75 G76 R77 F81	L75-Y79 HydrophobicContact CD2-CE2 4.09Å; L75-Y79 VanDerWaalsContact O-CD2 3.22Å; L75-Y79 WeakPolarHBondContact O-CD2 3.3Å; L75-Y79 PolarHBondContact O-N 3.22Å; G76-Y79 CarbonylContact O-C 3.56Å; G76-Y79 PolarHBondContact O-N 2.94Å; R77-Y79 VanDerWaalsContact C-N 3.26Å; R77-Y79 PolarHBondContact O-N 2.86Å; Y79-F81 HydrophobicContact CG-CE1 4.29Å; Y79-F81 WeakPolarHBondContact O-CD1 3.36Å
80	G	65.9	Low	61.6	Low	32 Å²	32	85 Å²	85	33%	0.33	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	29.4	173.1	0	0	0	0	0	115.9	L57 G76 R77	L57-G80 VanDerWaalsContact CD2-O 3.29Å; L57-G80 WeakPolarHBondContact CD2-O 3.31Å; G76-G80 PolarHBondContact O-N 3.39Å; R77-G80 PolarHBondContact O-N 3.22Å
81	F	63.2	Low	61.4	Low	59 Å²	59	85.9 Å²	85.9	26%	0.259	41%	0.414	S	S	.	.			trans	-135.1	150	172.7	53.2	-95.5	0	0	0	113.3	P58 L60 G76 R77 Y79 I83	P58-F81 HydrophobicContact CG-CB 4.34Å; P58-F81 WeakPolarHBondContact O-CA 3.37Å; P58-F81 VanDerWaalsContact O-CB 3.28Å; P58-F81 WeakPolarHBondContact O-CB 3.47Å; L60-F81 HydrophobicContact CB-CD2 3.97Å; L60-F81 HydrophobicContact CB-CE2 4.48Å; L60-F81 HydrophobicContact CD2-CD2 3.94Å; L60-F81 HydrophobicContact CD2-CE2 3.62Å; L60-F81 HydrophobicContact CD2-CZ 4.34Å; G76-F81 CarbonylContact C-O 3.46Å; G76-F81 VanDerWaalsContact CA-CD2 3.48Å; G76-F81 VanDerWaalsContact CA-O 3.27Å; G76-F81 WeakPolarHBondContact CA-O 3.26Å; G76-F81 PolarHBondContact O-N 3.29Å; R77-F81 PolarHBondContact N-O 3.13Å; Y79-F81 HydrophobicContact CG-CE1 4.29Å; Y79-F81 WeakPolarHBondContact O-CD1 3.36Å; F81-I83 HydrophobicContact CD2-CD1 4.33Å; F81-I83 HydrophobicContact CD2-CG1 3.85Å; F81-I83 HydrophobicContact CE2-CD1 3.83Å; F81-I83 HydrophobicContact CE2-CG1 3.87Å
82	R	60.9	Low	61.3	Low	95 Å²	95	88.9 Å²	88.9	36%	0.358	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.9	-179.5	-166.9	165.5	68	172.6	8.6	109.9	D55 L57 P58 V59 L60 F84	D55-R82 IonicContact OD1-NH1 3.59Å; L57-R82 HydrophobicContact CB-CB 4.4Å; P58-R82 PolarHBondContact O-N 3.08Å; V59-R82 CarbonylContact C-O 3.52Å; V59-R82 WeakPolarHBondContact CA-O 3.39Å; V59-R82 HydrophobicContact CG2-CB 4.45Å; L60-R82 PolarHBondContact N-O 3.28Å; R82-F84 HydrophobicContact CG-CD2 4.28Å; R82-F84 HydrophobicContact CG-CE2 3.91Å
83	I	56.2	Low	61.8	Low	13 Å²	13	87.1 Å²	87.1	7%	0.067	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	117.8	178.2	-57.4	-174.1	0	0	0	110.6	L60 I62 L72 Q73 F81 F85	L60-I83 HydrophobicContact CB-CG1 4.46Å; L60-I83 VanDerWaalsContact O-CA 3.23Å; L60-I83 WeakPolarHBondContact O-CA 3.08Å; I62-I83 HydrophobicContact CB-CG2 4.13Å; I62-I83 HydrophobicContact CD1-CD1 3.92Å; I62-I83 HydrophobicContact CD1-CG1 4.49Å; I62-I83 HydrophobicContact CD1-CG2 3.89Å; I62-I83 HydrophobicContact CG1-CG2 3.97Å; L72-I83 HydrophobicContact CB-CD1 3.97Å; L72-I83 WeakPolarHBondContact O-CD1 3.49Å; Q73-I83 HydrophobicContact CG-CB 4.46Å; F81-I83 HydrophobicContact CD2-CD1 4.33Å; F81-I83 HydrophobicContact CD2-CG1 3.85Å; F81-I83 HydrophobicContact CE2-CD1 3.83Å; F81-I83 HydrophobicContact CE2-CG1 3.87Å; I83-F85 HydrophobicContact CG2-CE1 4.07Å; I83-F85 HydrophobicContact CG2-CE2 4.24Å; I83-F85 HydrophobicContact CG2-CZ 3.84Å
84	F	54.6	Low	62.3	Low	95 Å²	95	88 Å²	88	42%	0.417	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.2	170.6	-80.7	-92.2	0	0	0	111.2	V59 L60 T61 I62 R82	V59-F84 HydrophobicContact CB-CD2 4.35Å; V59-F84 HydrophobicContact CG1-CB 4.43Å; V59-F84 HydrophobicContact CG1-CD2 3.41Å; V59-F84 VanDerWaalsContact CG1-CD2 3.41Å; V59-F84 HydrophobicContact CG1-CE2 3.98Å; V59-F84 HydrophobicContact CG1-CG 4.32Å; V59-F84 HydrophobicContact CG2-CD2 4.07Å; V59-F84 HydrophobicContact CG2-CE2 3.78Å; L60-F84 PolarHBondContact O-N 3.13Å; T61-F84 CarbonylContact C-O 3.45Å; T61-F84 WeakPolarHBondContact CA-O 3.5Å; I62-F84 PolarHBondContact N-O 2.94Å; R82-F84 HydrophobicContact CG-CD2 4.28Å; R82-F84 HydrophobicContact CG-CE2 3.91Å
85	F	52.5	Low	62.7	Low	46 Å²	46	83.9 Å²	83.9	20%	0.202	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.3	172	-63	-70.4	0	0	0	110.5	I62 P63 Y64 G69 L72 Q73 I83	I62-F85 HydrophobicContact CB-CD1 4.5Å; I62-F85 HydrophobicContact CB-CE1 4.25Å; I62-F85 HydrophobicContact CG2-CE1 4.46Å; I62-F85 VanDerWaalsContact O-CA 3.29Å; I62-F85 WeakPolarHBondContact O-CA 3.35Å; I62-F85 VanDerWaalsContact O-CD1 3.27Å; I62-F85 WeakPolarHBondContact O-CD1 3.28Å; P63-F85 WeakPolarHBondContact O-CD1 3.49Å; Y64-F85 HydrophobicContact CD2-CB 4.08Å; Y64-F85 HydrophobicContact CD2-CD1 4.17Å; Y64-F85 HydrophobicContact CD2-CD2 4.09Å; Y64-F85 AromaticContact CD2-CG 3.84Å; Y64-F85 HydrophobicContact CD2-CG 3.84Å; Y64-F85 HydrophobicContact CG-CB 4.49Å; G69-F85 VanDerWaalsContact CA-CZ 3.49Å; G69-F85 WeakPolarHBondContact O-CE2 3.39Å; L72-F85 HydrophobicContact CB-CZ 4.13Å; L72-F85 HydrophobicContact CD1-CE1 4.29Å; L72-F85 HydrophobicContact CD1-CZ 4.3Å; Q73-F85 HydrophobicContact CG-CE2 3.85Å; I83-F85 HydrophobicContact CG2-CE1 4.07Å; I83-F85 HydrophobicContact CG2-CE2 4.24Å; I83-F85 HydrophobicContact CG2-CZ 3.84Å
86	K	43.2	Very low	63.3	Low	140 Å²	140	84.1 Å²	84.1	61%	0.609	42%	0.418	S	S	*	.			trans	-94	115.5	172.7	-165.8	173.2	-174.7	172.2	0	109.3	T61 S88	T61-K86 HydrophobicContact CG2-CB 3.94Å; K86-S88 PolarHBondContact O-N 3.07Å
87	S	43	Very low	64.2	Low	111 Å²	111	84.9 Å²	84.9	78%	0.776	42%	0.421	S	S	*	.			trans	-69	81	156.9	48.1	0	0	0	0	107.7	P89	S87-P89 WeakPolarHBondContact O-CD 3.21Å
88	S	49.6	Very low	65.1	Low	20 Å²	20	81 Å²	81	14%	0.14	41%	0.407	C	S	.	.			trans	-77.7	120.7	174.3	-167.2	0	0	0	0	108.4	K86 N90 L91	K86-S88 PolarHBondContact O-N 3.07Å; S88-N90 PolarHBondContact O-N 2.93Å; S88-N90 PolarHBondContact OG-N 3.39Å; S88-L91 WeakPolarHBondContact O-CD1 3.34Å
89	P	46.3	Very low	65.8	Low	123 Å²	123	77.2 Å²	77.2	80%	0.799	40%	0.4	S	S	*	.	S	Bend	trans	-63.4	-5.9	169.4	23.8	-31.4	0	0	0	112.8	S87 L91	S87-P89 WeakPolarHBondContact O-CD 3.21Å; P89-L91 PolarHBondContact O-N 3.08Å
90	N	52.4	Low	66.7	Low	67 Å²	67	72.3 Å²	72.3	36%	0.358	38%	0.384	S	S	.	.			trans	-97.5	59	179.4	-66.4	-50.8	0	0	0	112.6	S88 R92 K97 V169	S88-N90 PolarHBondContact O-N 2.93Å; S88-N90 PolarHBondContact OG-N 3.39Å; N90-R92 PolarHBondContact O-N 3.28Å; N90-R92 VanDerWaalsContact O-N 3.14Å; N90-K97 PolarHBondContact OD1-NZ 3.08Å; N90-V169 WeakPolarHBondContact O-CG2 3.27Å
91	L	61.2	Low	68	Low	138 Å²	138	70.8 Å²	70.8	72%	0.723	37%	0.369	S	S	*	.			trans	-68.9	-3.1	176.3	-100.7	70.4	0	0	0	114.6	S88 P89	S88-L91 WeakPolarHBondContact O-CD1 3.34Å; P89-L91 PolarHBondContact O-N 3.08Å
92	R	69.4	Low	69.5	Low	145 Å²	145	69.5 Å²	69.5	55%	0.547	37%	0.365	S	S	.	.	S	Bend	trans	-122	137.1	-174.3	-63.1	-174.4	-179.7	110.1	-2.5	111.4	N90 V96 K97 Y167	N90-R92 PolarHBondContact O-N 3.28Å; N90-R92 VanDerWaalsContact O-N 3.14Å; R92-V96 HydrophobicContact CB-CB 4.39Å; R92-V96 HydrophobicContact CB-CG1 4.35Å; R92-V96 HydrophobicContact CG-CG1 4.45Å; R92-K97 HydrophobicContact CB-CG 4.24Å; R92-Y167 VanDerWaalsContact C-CE1 3.48Å
93	S	76.6	Confident	71	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.021	36%	0.363	C	S	.	.			trans	-55.9	150	169.6	-179.1	0	0	0	0	111.6	S95 V96 K97 Y167 F188	S93-S95 PolarHBondContact O-N 3.08Å; S93-S95 PolarHBondContact OG-N 3.18Å; S93-V96 PolarHBondContact O-N 3.01Å; S93-V96 VanDerWaalsContact O-N 3.08Å; S93-K97 PolarHBondContact O-N 3.05Å; S93-Y167 VanDerWaalsContact CB-CD2 3.48Å; S93-F188 WeakPolarHBondContact OG-CD2 3.11Å; S93-F188 WeakPolarHBondContact OG-CE2 3.44Å
94	L	82.7	Confident	72.9	Confident	91 Å²	91	68.4 Å²	68.4	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-54.7	-34.3	172.1	-68	177.3	0	0	0	112.7	K97 R98 F137	L94-K97 PolarHBondContact O-N 3.3Å; L94-R98 WeakPolarHBondContact O-CB 3.37Å; L94-R98 PolarHBondContact O-N 2.92Å; L94-F137 HydrophobicContact CD2-CE2 4.26Å
95	S	82.5	Confident	74.8	Confident	66 Å²	66	63.9 Å²	63.9	46%	0.462	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-42.9	177	-58.2	0	0	0	0	111.9	S93 R98 G99	S93-S95 PolarHBondContact O-N 3.08Å; S93-S95 PolarHBondContact OG-N 3.18Å; S95-R98 PolarHBondContact O-N 2.69Å; S95-G99 PolarHBondContact O-N 3.28Å
96	V	83.3	Confident	76.7	Confident	55 Å²	55	64 Å²	64	33%	0.333	36%	0.356	S	S	.	.	H	α-helix	trans	-67.2	-44.7	177.4	177.3	0	0	0	0	110.3	R92 S93 R98 G99 I100	R92-V96 HydrophobicContact CB-CB 4.39Å; R92-V96 HydrophobicContact CB-CG1 4.35Å; R92-V96 HydrophobicContact CG-CG1 4.45Å; S93-V96 PolarHBondContact O-N 3.01Å; S93-V96 VanDerWaalsContact O-N 3.08Å; V96-R98 VanDerWaalsContact C-N 3.29Å; V96-R98 PolarHBondContact O-N 3.14Å; V96-G99 PolarHBondContact O-N 2.67Å; V96-G99 VanDerWaalsContact O-N 3.17Å; V96-I100 HydrophobicContact CG1-CD1 4.31Å; V96-I100 WeakPolarHBondContact O-CG1 3.41Å; V96-I100 PolarHBondContact O-N 3.39Å
97	K	86.7	Confident	79.2	Confident	15 Å²	15	64.2 Å²	64.2	7%	0.065	35%	0.353	C	S	.	.	H	α-helix	trans	-56.1	-45.2	174.8	-73.1	-172.8	177.9	-167.5	0	111.4	N90 R92 S93 L94 G99 I100 V101 Y133 F137	N90-K97 PolarHBondContact OD1-NZ 3.08Å; R92-K97 HydrophobicContact CB-CG 4.24Å; S93-K97 PolarHBondContact O-N 3.05Å; L94-K97 PolarHBondContact O-N 3.3Å; K97-G99 VanDerWaalsContact C-N 3.34Å; K97-G99 PolarHBondContact O-N 2.77Å; K97-I100 PolarHBondContact O-N 3.14Å; K97-V101 WeakPolarHBondContact O-CG2 3.35Å; K97-V101 PolarHBondContact O-N 3.45Å; K97-V101 VanDerWaalsContact O-N 3.11Å; K97-Y133 HydrophobicContact CB-CD1 4.23Å; K97-Y133 HydrophobicContact CB-CE1 3.55Å; K97-Y133 HydrophobicContact CD-CD1 4.22Å; K97-Y133 HydrophobicContact CD-CE1 3.92Å; K97-Y133 HydrophobicContact CG-CD1 4.36Å; K97-Y133 HydrophobicContact CG-CE1 3.6Å; K97-F137 HydrophobicContact CB-CE1 3.91Å; K97-F137 HydrophobicContact CB-CZ 3.91Å
98	R	90.5	Very high	81.6	Confident	107 Å²	107	59.1 Å²	59.1	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177.9	-172.4	-179.7	-65.9	157.7	2.2	111.5	L94 S95 V96 I100 V101 T102 F137 T141 R144	L94-R98 WeakPolarHBondContact O-CB 3.37Å; L94-R98 PolarHBondContact O-N 2.92Å; S95-R98 PolarHBondContact O-N 2.69Å; V96-R98 VanDerWaalsContact C-N 3.29Å; V96-R98 PolarHBondContact O-N 3.14Å; R98-I100 VanDerWaalsContact C-N 3.32Å; R98-I100 PolarHBondContact O-N 3.3Å; R98-V101 PolarHBondContact O-N 3.21Å; R98-T102 WeakPolarHBondContact O-CB 3.31Å; R98-T102 PolarHBondContact O-N 3.42Å; R98-T102 PolarHBondContact O-OG1 3.07Å; R98-F137 HydrophobicContact CB-CE2 4.5Å; R98-F137 HydrophobicContact CB-CZ 3.86Å; R98-T141 HydrophobicContact CG-CG2 3.91Å; R98-R144 VanDerWaalsContact CD-NH2 3.34Å
99	G	89.7	Confident	83.7	Confident	43 Å²	43	62 Å²	62	44%	0.443	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-41	175.6	0	0	0	0	0	112.6	S95 V96 K97 T102 G103	S95-G99 PolarHBondContact O-N 3.28Å; V96-G99 PolarHBondContact O-N 2.67Å; V96-G99 VanDerWaalsContact O-N 3.17Å; K97-G99 VanDerWaalsContact C-N 3.34Å; K97-G99 PolarHBondContact O-N 2.77Å; G99-T102 PolarHBondContact O-N 2.9Å; G99-G103 PolarHBondContact O-N 2.83Å
100	I	91.1	Very high	85.9	Confident	55 Å²	55	60.2 Å²	60.2	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-49.3	175.5	-65.5	165.3	0	0	0	110.9	V96 K97 R98 T102 G103 M104 Y133	V96-I100 HydrophobicContact CG1-CD1 4.31Å; V96-I100 WeakPolarHBondContact O-CG1 3.41Å; V96-I100 PolarHBondContact O-N 3.39Å; K97-I100 PolarHBondContact O-N 3.14Å; R98-I100 VanDerWaalsContact C-N 3.32Å; R98-I100 PolarHBondContact O-N 3.3Å; I100-T102 VanDerWaalsContact C-N 3.34Å; I100-T102 PolarHBondContact O-N 3.36Å; I100-G103 PolarHBondContact O-N 3.02Å; I100-M104 HydrophobicContact CG2-CE 4.15Å; I100-M104 HydrophobicContact CG2-SD 4.18Å; I100-M104 WeakPolarHBondContact O-CG 3.12Å; I100-M104 PolarHBondContact O-N 3.47Å; I100-Y133 WeakPolarHBondContact CD1-OH 3.39Å
101	V	93.1	Very high	87.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-46.7	178.1	-176	0	0	0	0	110.5	K97 R98 G103 M104 V105 L128 Y133 F137 T141 I142	K97-V101 WeakPolarHBondContact O-CG2 3.35Å; K97-V101 PolarHBondContact O-N 3.45Å; K97-V101 VanDerWaalsContact O-N 3.11Å; R98-V101 PolarHBondContact O-N 3.21Å; V101-G103 PolarHBondContact O-N 3.24Å; V101-M104 PolarHBondContact O-N 3.08Å; V101-V105 HydrophobicContact CG1-CG2 4.41Å; V101-V105 WeakPolarHBondContact O-CG2 3.49Å; V101-V105 PolarHBondContact O-N 2.99Å; V101-L128 HydrophobicContact CB-CD1 4.29Å; V101-L128 HydrophobicContact CG1-CD1 4.1Å; V101-L128 HydrophobicContact CG2-CD1 3.69Å; V101-Y133 HydrophobicContact CG2-CD1 4.38Å; V101-Y133 HydrophobicContact CG2-CE1 4.43Å; V101-F137 HydrophobicContact CG2-CE1 4.19Å; V101-T141 HydrophobicContact CB-CG2 3.78Å; V101-T141 HydrophobicContact CG1-CG2 3.66Å; V101-I142 HydrophobicContact CG1-CG1 3.97Å
102	T	93.6	Very high	89.4	Confident	31 Å²	31	58.6 Å²	58.6	19%	0.19	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-46.7	-179.4	-50.4	0	0	0	0	110.9	R98 G99 I100 M104 V105 D106 R145	R98-T102 WeakPolarHBondContact O-CB 3.31Å; R98-T102 PolarHBondContact O-N 3.42Å; R98-T102 PolarHBondContact O-OG1 3.07Å; G99-T102 PolarHBondContact O-N 2.9Å; I100-T102 VanDerWaalsContact C-N 3.34Å; I100-T102 PolarHBondContact O-N 3.36Å; T102-M104 VanDerWaalsContact C-N 3.29Å; T102-M104 PolarHBondContact O-N 3.2Å; T102-V105 PolarHBondContact O-N 2.78Å; T102-D106 WeakPolarHBondContact O-CB 3.21Å; T102-D106 PolarHBondContact O-N 3.45Å; T102-R145 HydrophobicContact CG2-CG 4.19Å
103	G	93.9	Very high	90.5	Very high	31 Å²	31	56.5 Å²	56.5	32%	0.32	32%	0.319	S	S	.	.	H	α-helix	trans	-68.9	-22.3	178	0	0	0	0	0	114.4	G99 I100 V101 R107	G99-G103 PolarHBondContact O-N 2.83Å; I100-G103 PolarHBondContact O-N 3.02Å; V101-G103 PolarHBondContact O-N 3.24Å; G103-R107 VanDerWaalsContact O-CG 3.26Å; G103-R107 WeakPolarHBondContact O-CG 3.42Å; G103-R107 PolarHBondContact O-N 2.94Å; G103-R107 PolarHBondContact O-NE 3.4Å; G103-R107 VanDerWaalsContact O-NE 3.1Å
104	M	94.8	Very high	91.2	Very high	54 Å²	54	61.6 Å²	61.6	27%	0.266	35%	0.352	S	S	.	.	H	α-helix	trans	-73.6	-46.7	168.8	-75.7	175.4	166.7	0	0	111	I100 V101 T102 R107 A108 I124 L128	I100-M104 HydrophobicContact CG2-CE 4.15Å; I100-M104 HydrophobicContact CG2-SD 4.18Å; I100-M104 WeakPolarHBondContact O-CG 3.12Å; I100-M104 PolarHBondContact O-N 3.47Å; V101-M104 PolarHBondContact O-N 3.08Å; T102-M104 VanDerWaalsContact C-N 3.29Å; T102-M104 PolarHBondContact O-N 3.2Å; M104-R107 PolarHBondContact O-N 3.1Å; M104-A108 PolarHBondContact O-N 3.27Å; M104-I124 HydrophobicContact CB-CD1 4.19Å; M104-I124 HydrophobicContact CB-CG1 4.49Å; M104-I124 HydrophobicContact CB-CG2 3.94Å; M104-I124 HydrophobicContact SD-CG2 4.13Å; M104-L128 HydrophobicContact SD-CD1 4.27Å; M104-L128 HydrophobicContact SD-CD2 4.07Å; M104-L128 HydrophobicContact SD-CG 4.29Å
105	V	94.4	Very high	91.7	Very high	0 Å²	0	65 Å²	65	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178	174.2	0	0	0	0	111.3	V101 T102 R107 A108 I109 L121 I142 R145	V101-V105 HydrophobicContact CG1-CG2 4.41Å; V101-V105 WeakPolarHBondContact O-CG2 3.49Å; V101-V105 PolarHBondContact O-N 2.99Å; T102-V105 PolarHBondContact O-N 2.78Å; V105-R107 VanDerWaalsContact C-N 3.29Å; V105-R107 PolarHBondContact O-N 3.35Å; V105-A108 WeakPolarHBondContact O-CB 3.11Å; V105-A108 PolarHBondContact O-N 3.34Å; V105-A108 VanDerWaalsContact O-N 3.13Å; V105-I109 HydrophobicContact CG1-CD1 3.74Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 WeakPolarHBondContact O-CG1 3.33Å; V105-I109 PolarHBondContact O-N 2.94Å; V105-L121 HydrophobicContact CB-CD2 4.47Å; V105-L121 HydrophobicContact CG1-CD2 4.09Å; V105-L121 HydrophobicContact CG2-CD2 4.14Å; V105-I142 HydrophobicContact CG2-CB 4.34Å; V105-I142 HydrophobicContact CG2-CG1 3.75Å; V105-I142 HydrophobicContact CG2-CG2 4.31Å; V105-R145 HydrophobicContact CB-CG 4.35Å; V105-R145 HydrophobicContact CG1-CB 4.04Å; V105-R145 HydrophobicContact CG1-CG 3.78Å
106	D	93.9	Very high	92.2	Very high	50 Å²	50	67.5 Å²	67.5	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-39	179.7	-70.2	-3.9	0	0	0	111.9	T102 A110 R145	T102-D106 WeakPolarHBondContact O-CB 3.21Å; T102-D106 PolarHBondContact O-N 3.45Å; D106-A110 VanDerWaalsContact O-CB 3.26Å; D106-A110 WeakPolarHBondContact O-CB 2.92Å; D106-A110 PolarHBondContact O-N 3.36Å; D106-R145 VanDerWaalsContact CG-NH2 3.26Å; D106-R145 WeakPolarHBondContact OD1-CG 3.38Å; D106-R145 IonicContact OD1-CZ 2.86Å; D106-R145 VanDerWaalsContact OD1-CZ 3.3Å; D106-R145 IonicContact OD1-NE 2.76Å; D106-R145 PolarHBondContact OD1-NE 2.96Å; D106-R145 IonicContact OD1-NH2 3.78Å; D106-R145 PolarHBondContact OD1-NH2 3.03Å; D106-R145 VanDerWaalsContact OD1-NH2 3.14Å; D106-R145 IonicContact OD2-CZ 3.85Å; D106-R145 IonicContact OD2-NE 3.96Å; D106-R145 PolarHBondContact OD2-NE 3.17Å; D106-R145 IonicContact OD2-NH2 3.29Å; D106-R145 PolarHBondContact OD2-NH2 3.37Å
107	R	95	Very high	92.6	Very high	144 Å²	144	66.7 Å²	66.7	54%	0.543	36%	0.362	S	S	.	.	H	α-helix	trans	-68.6	-39.6	174.5	-74.4	-175	-58.6	132.3	3.3	112	G103 M104 V105 I109 A110 I111	G103-R107 VanDerWaalsContact O-CG 3.26Å; G103-R107 WeakPolarHBondContact O-CG 3.42Å; G103-R107 PolarHBondContact O-N 2.94Å; G103-R107 PolarHBondContact O-NE 3.4Å; G103-R107 VanDerWaalsContact O-NE 3.1Å; M104-R107 PolarHBondContact O-N 3.1Å; V105-R107 VanDerWaalsContact C-N 3.29Å; V105-R107 PolarHBondContact O-N 3.35Å; R107-I109 VanDerWaalsContact C-N 3.35Å; R107-A110 PolarHBondContact O-N 3.08Å; R107-I111 HydrophobicContact CB-CD1 4.39Å; R107-I111 WeakPolarHBondContact O-CB 3.23Å; R107-I111 WeakPolarHBondContact O-CG1 3.39Å; R107-I111 PolarHBondContact O-N 3.47Å
108	A	94.1	Very high	93	Very high	4 Å²	4	71.9 Å²	71.9	3%	0.033	39%	0.39	C	S	.	.	H	α-helix	trans	-61.5	-45.3	175.4	0	0	0	0	0	110.9	M104 V105 A110 C112 L117 E120 L121 I124	M104-A108 PolarHBondContact O-N 3.27Å; V105-A108 WeakPolarHBondContact O-CB 3.11Å; V105-A108 PolarHBondContact O-N 3.34Å; V105-A108 VanDerWaalsContact O-N 3.13Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.93Å; A108-C112 WeakPolarHBondContact O-CB 3.5Å; A108-C112 PolarHBondContact O-N 3.21Å; A108-L117 HydrophobicContact CB-CD1 4.09Å; A108-E120 HydrophobicContact CB-CG 3.74Å; A108-L121 HydrophobicContact CB-CD2 4.35Å; A108-I124 HydrophobicContact CB-CD1 3.85Å
109	I	92.3	Very high	93.2	Very high	81 Å²	81	70.1 Å²	70.1	42%	0.415	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-39.4	176.7	-64.7	165.8	0	0	0	111.4	V105 R107 L117 L146	V105-I109 HydrophobicContact CG1-CD1 3.74Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 WeakPolarHBondContact O-CG1 3.33Å; V105-I109 PolarHBondContact O-N 2.94Å; R107-I109 VanDerWaalsContact C-N 3.35Å; I109-L117 HydrophobicContact CG1-CD1 4.37Å; I109-L146 HydrophobicContact CD1-CD2 4.08Å; I109-L146 HydrophobicContact CG1-CD2 4.44Å
110	A	93.2	Very high	93.4	Very high	84 Å²	84	71.3 Å²	71.3	69%	0.694	39%	0.388	S	S	*	.	H	α-helix	trans	-77.8	-25.9	-176	0	0	0	0	0	114.3	D106 R107 A108	D106-A110 VanDerWaalsContact O-CB 3.26Å; D106-A110 WeakPolarHBondContact O-CB 2.92Å; D106-A110 PolarHBondContact O-N 3.36Å; R107-A110 PolarHBondContact O-N 3.08Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.93Å
111	I	94.2	Very high	93.6	Very high	135 Å²	135	69.3 Å²	69.3	69%	0.692	38%	0.378	S	S	*	.	H	α-helix	trans	-113.6	-35.5	-170.1	-58.8	170.8	0	0	0	112.4	R107	R107-I111 HydrophobicContact CB-CD1 4.39Å; R107-I111 WeakPolarHBondContact O-CB 3.23Å; R107-I111 WeakPolarHBondContact O-CG1 3.39Å; R107-I111 PolarHBondContact O-N 3.47Å
112	C	92	Very high	93.7	Very high	37 Å²	37	75.2 Å²	75.2	25%	0.25	41%	0.405	C	S	.	.	S	Bend	trans	-80.7	141.2	-173.5	-62.9	0	0	0	0	112.2	A108 L117	A108-C112 WeakPolarHBondContact O-CB 3.5Å; A108-C112 PolarHBondContact O-N 3.21Å; C112-L117 HydrophobicContact CB-CD1 4.36Å
113	D	93.2	Very high	93.8	Very high	101 Å²	101	79 Å²	79	54%	0.54	42%	0.421	S	S	.	.			trans	-62.6	147.3	167.8	-58.2	-59.4	0	0	0	110.5	E115 F116 L117	D113-E115 PolarHBondContact O-N 3.4Å; D113-F116 HydrophobicContact CB-CD2 4.14Å; D113-F116 PolarHBondContact O-N 3.41Å; D113-L117 PolarHBondContact O-N 3.35Å
114	P	90.7	Very high	93.9	Very high	109 Å²	109	78 Å²	78	71%	0.708	41%	0.408	S	S	*	.	H	α-helix	trans	-53.5	-31.2	-178.4	-28	35.3	0	0	0	114.2
115	E	92.7	Very high	93.9	Very high	163 Å²	163	76 Å²	76	76%	0.762	40%	0.4	S	S	*	.	H	α-helix	trans	-66.5	-35.7	178.5	-62	177	178.3	0	0	112.6	D113	D113-E115 PolarHBondContact O-N 3.4Å
116	F	92.9	Very high	93.9	Very high	118 Å²	118	79.3 Å²	79.3	52%	0.518	42%	0.416	S	S	.	.	H	α-helix	trans	-100.7	-6.3	-176.9	-59.2	-65.5	0	0	0	113.8	D113 N118 S119 E120	D113-F116 HydrophobicContact CB-CD2 4.14Å; D113-F116 PolarHBondContact O-N 3.41Å; F116-N118 PolarHBondContact O-N 3.3Å; F116-S119 WeakPolarHBondContact CA-OG 3.32Å; F116-S119 PolarHBondContact O-N 3.37Å; F116-S119 PolarHBondContact O-OG 2.86Å; F116-E120 PolarHBondContact O-N 3.14Å
117	L	93.4	Very high	93.8	Very high	38 Å²	38	79.3 Å²	79.3	20%	0.199	42%	0.418	C	S	.	.	H	α-helix	trans	-59.1	-44.6	-177.5	-179	61	0	0	0	112.3	A108 I109 C112 D113 S119 E120 L121	A108-L117 HydrophobicContact CB-CD1 4.09Å; I109-L117 HydrophobicContact CG1-CD1 4.37Å; C112-L117 HydrophobicContact CB-CD1 4.36Å; D113-L117 PolarHBondContact O-N 3.35Å; L117-S119 PolarHBondContact O-N 2.79Å; L117-E120 PolarHBondContact O-N 3.36Å; L117-L121 HydrophobicContact CD1-CD1 4.24Å; L117-L121 HydrophobicContact CD1-CG 4.19Å; L117-L121 HydrophobicContact CG-CD1 4.05Å; L117-L121 HydrophobicContact CG-CG 4.43Å; L117-L121 VanDerWaalsContact O-CG 3.25Å; L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 2.69Å
118	N	94	Very high	93.7	Very high	125 Å²	125	72.7 Å²	72.7	67%	0.668	39%	0.393	S	S	*	.	H	α-helix	trans	-65	-40.1	179.8	-75.2	-43.7	0	0	0	112.4	F116 H122	F116-N118 PolarHBondContact O-N 3.3Å; N118-H122 WeakPolarHBondContact O-CB 3.29Å; N118-H122 PolarHBondContact O-N 3.05Å
119	S	94.2	Very high	93.5	Very high	69 Å²	69	75 Å²	75	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-39.6	174.5	41.6	0	0	0	0	112	F116 L117 H122 H123	F116-S119 WeakPolarHBondContact CA-OG 3.32Å; F116-S119 PolarHBondContact O-N 3.37Å; F116-S119 PolarHBondContact O-OG 2.86Å; L117-S119 PolarHBondContact O-N 2.79Å; S119-H122 PolarHBondContact O-N 3.29Å; S119-H123 WeakPolarHBondContact O-CB 3.39Å; S119-H123 PolarHBondContact O-N 3.08Å
120	E	95.4	Very high	93.4	Very high	68 Å²	68	79.3 Å²	79.3	32%	0.318	42%	0.419	S	S	.	.	H	α-helix	trans	-67.1	-44.1	177.5	178.8	61.8	-171.2	0	0	111.6	A108 F116 L117 H122 H123 I124	A108-E120 HydrophobicContact CB-CG 3.74Å; F116-E120 PolarHBondContact O-N 3.14Å; L117-E120 PolarHBondContact O-N 3.36Å; E120-H122 VanDerWaalsContact C-N 3.29Å; E120-H122 PolarHBondContact O-N 3.17Å; E120-H123 WeakPolarHBondContact O-CB 3.5Å; E120-H123 PolarHBondContact O-N 2.94Å; E120-H123 VanDerWaalsContact O-N 3.11Å; E120-I124 HydrophobicContact CG-CD1 3.93Å; E120-I124 HydrophobicContact CG-CG1 4.47Å; E120-I124 WeakPolarHBondContact O-CG1 3.35Å; E120-I124 PolarHBondContact O-N 3.28Å
121	L	94.7	Very high	93.1	Very high	13 Å²	13	80.8 Å²	80.8	7%	0.068	42%	0.415	C	S	.	.	H	α-helix	trans	-61.6	-39	176.3	-68.9	172.3	0	0	0	111.9	V105 A108 L117 A125 I142 L146	V105-L121 HydrophobicContact CB-CD2 4.47Å; V105-L121 HydrophobicContact CG1-CD2 4.09Å; V105-L121 HydrophobicContact CG2-CD2 4.14Å; A108-L121 HydrophobicContact CB-CD2 4.35Å; L117-L121 HydrophobicContact CD1-CD1 4.24Å; L117-L121 HydrophobicContact CD1-CG 4.19Å; L117-L121 HydrophobicContact CG-CD1 4.05Å; L117-L121 HydrophobicContact CG-CG 4.43Å; L117-L121 VanDerWaalsContact O-CG 3.25Å; L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 2.69Å; L121-A125 WeakPolarHBondContact O-CB 3.25Å; L121-A125 PolarHBondContact O-N 2.76Å; L121-I142 HydrophobicContact CD2-CG2 4.25Å; L121-L146 HydrophobicContact CD1-CD1 4Å; L121-L146 HydrophobicContact CD1-CD2 4.02Å
122	H	95.1	Very high	92.6	Very high	125 Å²	125	76.9 Å²	76.9	58%	0.579	41%	0.409	S	S	*	.	H	α-helix	trans	-64.3	-43.2	173.1	-173.7	75.8	0	0	0	111.6	N118 S119 E120 A125 M126	N118-H122 WeakPolarHBondContact O-CB 3.29Å; N118-H122 PolarHBondContact O-N 3.05Å; S119-H122 PolarHBondContact O-N 3.29Å; E120-H122 VanDerWaalsContact C-N 3.29Å; E120-H122 PolarHBondContact O-N 3.17Å; H122-A125 PolarHBondContact O-N 2.84Å; H122-M126 WeakPolarHBondContact O-CB 3.36Å; H122-M126 WeakPolarHBondContact O-CG 3.32Å; H122-M126 PolarHBondContact O-N 3.31Å
123	H	95.8	Very high	92.4	Very high	110 Å²	110	76.3 Å²	76.3	51%	0.509	40%	0.401	S	S	.	.	H	α-helix	trans	-60.9	-44.8	176.5	-177.1	72.3	0	0	0	112.2	S119 E120 A125 M126 T127	S119-H123 WeakPolarHBondContact O-CB 3.39Å; S119-H123 PolarHBondContact O-N 3.08Å; E120-H123 WeakPolarHBondContact O-CB 3.5Å; E120-H123 PolarHBondContact O-N 2.94Å; E120-H123 VanDerWaalsContact O-N 3.11Å; H123-A125 PolarHBondContact O-N 2.77Å; H123-M126 PolarHBondContact O-N 3.15Å; H123-T127 VanDerWaalsContact O-CB 3.26Å; H123-T127 WeakPolarHBondContact O-CB 3.36Å; H123-T127 PolarHBondContact O-N 3.25Å; H123-T127 PolarHBondContact O-OG1 3.5Å
124	I	94.7	Very high	92.3	Very high	10 Å²	10	74.5 Å²	74.5	5%	0.051	40%	0.395	C	S	.	.	H	α-helix	trans	-59.2	-47.6	174.9	-70.3	164.9	0	0	0	110.4	M104 A108 E120 T127 L128	M104-I124 HydrophobicContact CB-CD1 4.19Å; M104-I124 HydrophobicContact CB-CG1 4.49Å; M104-I124 HydrophobicContact CB-CG2 3.94Å; M104-I124 HydrophobicContact SD-CG2 4.13Å; A108-I124 HydrophobicContact CB-CD1 3.85Å; E120-I124 HydrophobicContact CG-CD1 3.93Å; E120-I124 HydrophobicContact CG-CG1 4.47Å; E120-I124 WeakPolarHBondContact O-CG1 3.35Å; E120-I124 PolarHBondContact O-N 3.28Å; I124-T127 PolarHBondContact O-N 3.45Å; I124-L128 HydrophobicContact CG2-CD1 3.76Å; I124-L128 HydrophobicContact CG2-CG 4.47Å; I124-L128 WeakPolarHBondContact O-CB 3.48Å; I124-L128 VanDerWaalsContact O-CG 3.32Å; I124-L128 WeakPolarHBondContact O-CG 3.1Å; I124-L128 PolarHBondContact O-N 3.27Å
125	A	95.1	Very high	92.3	Very high	13 Å²	13	75.7 Å²	75.7	11%	0.107	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-51.1	180	0	0	0	0	0	111.7	L121 H122 H123 T127 L128 E129 V138 I142	L121-A125 WeakPolarHBondContact O-CB 3.25Å; L121-A125 PolarHBondContact O-N 2.76Å; H122-A125 PolarHBondContact O-N 2.84Å; H123-A125 PolarHBondContact O-N 2.77Å; A125-T127 VanDerWaalsContact C-N 3.31Å; A125-T127 PolarHBondContact O-N 2.94Å; A125-L128 PolarHBondContact O-N 2.98Å; A125-E129 WeakPolarHBondContact O-CG 3.23Å; A125-E129 PolarHBondContact O-N 3.08Å; A125-V138 HydrophobicContact CB-CG1 4.13Å; A125-I142 HydrophobicContact CB-CD1 3.96Å
126	M	94.8	Very high	92.2	Very high	69 Å²	69	73.2 Å²	73.2	34%	0.34	39%	0.385	S	S	.	.	H	α-helix	trans	-60.2	-39.6	178	-74	-59.6	-58.6	0	0	112.5	H122 H123 K130	H122-M126 WeakPolarHBondContact O-CB 3.36Å; H122-M126 WeakPolarHBondContact O-CG 3.32Å; H122-M126 PolarHBondContact O-N 3.31Å; H123-M126 PolarHBondContact O-N 3.15Å; M126-K130 WeakPolarHBondContact O-CB 3.33Å; M126-K130 WeakPolarHBondContact O-CG 3.36Å; M126-K130 PolarHBondContact O-N 3.36Å
127	T	92.6	Very high	92.1	Very high	50 Å²	50	68.7 Å²	68.7	31%	0.307	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-41.9	178.5	-62.8	0	0	0	0	111.5	H123 I124 A125 K130 N131	H123-T127 VanDerWaalsContact O-CB 3.26Å; H123-T127 WeakPolarHBondContact O-CB 3.36Å; H123-T127 PolarHBondContact O-N 3.25Å; H123-T127 PolarHBondContact O-OG1 3.5Å; I124-T127 PolarHBondContact O-N 3.45Å; A125-T127 VanDerWaalsContact C-N 3.31Å; A125-T127 PolarHBondContact O-N 2.94Å; T127-K130 PolarHBondContact O-N 3.39Å; T127-N131 WeakPolarHBondContact O-CB 3.49Å; T127-N131 VanDerWaalsContact O-CG 3.3Å; T127-N131 PolarHBondContact O-N 3.36Å; T127-N131 PolarHBondContact O-ND2 2.98Å
128	L	91.8	Very high	92.1	Very high	4 Å²	4	66.9 Å²	66.9	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-39.9	176.9	-72	167.9	0	0	0	112.1	V101 M104 I124 A125 N131 G132 Y133 V138	V101-L128 HydrophobicContact CB-CD1 4.29Å; V101-L128 HydrophobicContact CG1-CD1 4.1Å; V101-L128 HydrophobicContact CG2-CD1 3.69Å; M104-L128 HydrophobicContact SD-CD1 4.27Å; M104-L128 HydrophobicContact SD-CD2 4.07Å; M104-L128 HydrophobicContact SD-CG 4.29Å; I124-L128 HydrophobicContact CG2-CD1 3.76Å; I124-L128 HydrophobicContact CG2-CG 4.47Å; I124-L128 WeakPolarHBondContact O-CB 3.48Å; I124-L128 VanDerWaalsContact O-CG 3.32Å; I124-L128 WeakPolarHBondContact O-CG 3.1Å; I124-L128 PolarHBondContact O-N 3.27Å; A125-L128 PolarHBondContact O-N 2.98Å; L128-N131 CarbonylContact O-C 3.58Å; L128-N131 WeakPolarHBondContact O-CA 3.46Å; L128-N131 WeakPolarHBondContact O-CB 3.33Å; L128-N131 PolarHBondContact O-N 2.89Å; L128-N131 VanDerWaalsContact O-N 3.15Å; L128-G132 PolarHBondContact O-N 3.45Å; L128-Y133 HydrophobicContact CB-CG 4.28Å; L128-Y133 HydrophobicContact CD2-CD1 4.3Å; L128-Y133 HydrophobicContact CD2-CD2 4.16Å; L128-Y133 HydrophobicContact CD2-CE1 4.26Å; L128-Y133 HydrophobicContact CD2-CE2 4.14Å; L128-Y133 HydrophobicContact CD2-CG 4.26Å; L128-Y133 VanDerWaalsContact O-CB 3.32Å; L128-Y133 WeakPolarHBondContact O-CB 3.48Å; L128-Y133 WeakPolarHBondContact O-CD2 3.48Å; L128-Y133 PolarHBondContact O-N 3.39Å; L128-V138 HydrophobicContact CB-CG1 4.28Å; L128-V138 HydrophobicContact CB-CG2 3.93Å; L128-V138 HydrophobicContact CD1-CG1 3.88Å; L128-V138 HydrophobicContact CD1-CG2 4.33Å
129	E	91.4	Very high	92.1	Very high	52 Å²	52	63.6 Å²	63.6	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-46.9	174.2	-74.4	179.5	-153.3	0	0	111.5	A125 N131 G132 K135	A125-E129 WeakPolarHBondContact O-CG 3.23Å; A125-E129 PolarHBondContact O-N 3.08Å; E129-N131 PolarHBondContact O-N 3.08Å; E129-G132 WeakPolarHBondContact O-CA 3.45Å; E129-G132 PolarHBondContact O-N 2.98Å; E129-K135 HydrophobicContact CG-CB 4.22Å; E129-K135 VanDerWaalsContact OE1-CG 3.27Å; E129-K135 WeakPolarHBondContact OE1-CG 3.44Å
130	K	88.7	Confident	92	Very high	172 Å²	172	63.1 Å²	63.1	75%	0.748	34%	0.34	S	S	*	.	H	α-helix	trans	-59.6	-31.4	173.6	-76.1	175.9	177.8	179.8	0	112.8	M126 T127 G132	M126-K130 WeakPolarHBondContact O-CB 3.33Å; M126-K130 WeakPolarHBondContact O-CG 3.36Å; M126-K130 PolarHBondContact O-N 3.36Å; T127-K130 PolarHBondContact O-N 3.39Å; K130-G132 PolarHBondContact O-N 3.22Å
131	N	87.8	Confident	91.9	Very high	115 Å²	115	60 Å²	60	62%	0.615	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	8.2	173.7	-73.2	-45.6	0	0	0	113.8	T127 L128 E129 Y133	T127-N131 WeakPolarHBondContact O-CB 3.49Å; T127-N131 VanDerWaalsContact O-CG 3.3Å; T127-N131 PolarHBondContact O-N 3.36Å; T127-N131 PolarHBondContact O-ND2 2.98Å; L128-N131 CarbonylContact O-C 3.58Å; L128-N131 WeakPolarHBondContact O-CA 3.46Å; L128-N131 WeakPolarHBondContact O-CB 3.33Å; L128-N131 PolarHBondContact O-N 2.89Å; L128-N131 VanDerWaalsContact O-N 3.15Å; E129-N131 PolarHBondContact O-N 3.08Å; N131-Y133 HydrophobicContact CB-CD2 4.27Å; N131-Y133 HydrophobicContact CB-CE2 4.48Å
132	G	84.1	Confident	91.8	Very high	53 Å²	53	60 Å²	60	55%	0.546	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	16.5	175.1	0	0	0	0	0	114.8	L128 E129 K130	L128-G132 PolarHBondContact O-N 3.45Å; E129-G132 WeakPolarHBondContact O-CA 3.45Å; E129-G132 PolarHBondContact O-N 2.98Å; K130-G132 PolarHBondContact O-N 3.22Å
133	Y	88	Confident	91.7	Very high	26 Å²	26	56.5 Å²	56.5	10%	0.102	32%	0.317	C	S	.	.			trans	-74.9	139.3	170.2	-74.5	-121.2	0	0	0	109.5	K97 I100 V101 L128 N131 K135 F137 V138	K97-Y133 HydrophobicContact CB-CD1 4.23Å; K97-Y133 HydrophobicContact CB-CE1 3.55Å; K97-Y133 HydrophobicContact CD-CD1 4.22Å; K97-Y133 HydrophobicContact CD-CE1 3.92Å; K97-Y133 HydrophobicContact CG-CD1 4.36Å; K97-Y133 HydrophobicContact CG-CE1 3.6Å; I100-Y133 WeakPolarHBondContact CD1-OH 3.39Å; V101-Y133 HydrophobicContact CG2-CD1 4.38Å; V101-Y133 HydrophobicContact CG2-CE1 4.43Å; L128-Y133 HydrophobicContact CB-CG 4.28Å; L128-Y133 HydrophobicContact CD2-CD1 4.3Å; L128-Y133 HydrophobicContact CD2-CD2 4.16Å; L128-Y133 HydrophobicContact CD2-CE1 4.26Å; L128-Y133 HydrophobicContact CD2-CE2 4.14Å; L128-Y133 HydrophobicContact CD2-CG 4.26Å; L128-Y133 VanDerWaalsContact O-CB 3.32Å; L128-Y133 WeakPolarHBondContact O-CB 3.48Å; L128-Y133 WeakPolarHBondContact O-CD2 3.48Å; L128-Y133 PolarHBondContact O-N 3.39Å; N131-Y133 HydrophobicContact CB-CD2 4.27Å; N131-Y133 HydrophobicContact CB-CE2 4.48Å; Y133-K135 PolarHBondContact O-N 2.87Å; Y133-F137 HydrophobicContact CD1-CD1 4.38Å; Y133-F137 HydrophobicContact CD1-CE1 4.24Å; Y133-V138 HydrophobicContact CD1-CG2 4.46Å; Y133-V138 HydrophobicContact CG-CG2 4.42Å
134	P	89.2	Confident	91.4	Very high	63 Å²	63	56.5 Å²	56.5	41%	0.409	31%	0.313	S	S	.	.			trans	-62.6	128.2	176.6	-19.5	30.8	0	0	0	110.9	T136 F137 V138	P134-T136 VanDerWaalsContact C-N 3.34Å; P134-T136 PolarHBondContact O-N 3.35Å; P134-F137 HydrophobicContact CB-CB 3.96Å; P134-F137 HydrophobicContact CG-CB 4.29Å; P134-F137 WeakPolarHBondContact O-CB 3.5Å; P134-F137 PolarHBondContact O-N 2.97Å; P134-V138 PolarHBondContact O-N 3.35Å
135	K	90.7	Very high	91.1	Very high	133 Å²	133	60.9 Å²	60.9	58%	0.578	33%	0.329	S	S	*	.	H	α-helix	trans	-49.9	-51	179.9	177.8	160.7	-166.1	174.4	0	112.9	E129 Y133 F137 V138 S139	E129-K135 HydrophobicContact CG-CB 4.22Å; E129-K135 VanDerWaalsContact OE1-CG 3.27Å; E129-K135 WeakPolarHBondContact OE1-CG 3.44Å; Y133-K135 PolarHBondContact O-N 2.87Å; K135-F137 VanDerWaalsContact C-N 3.28Å; K135-F137 PolarHBondContact O-N 2.84Å; K135-V138 PolarHBondContact O-N 3.38Å; K135-V138 VanDerWaalsContact O-N 3.14Å; K135-S139 PolarHBondContact O-N 3.42Å; K135-S139 PolarHBondContact O-OG 3.01Å; K135-S139 VanDerWaalsContact O-OG 3.08Å
136	T	92.7	Very high	90.7	Very high	111 Å²	111	63.7 Å²	63.7	68%	0.681	34%	0.342	S	S	*	.	H	α-helix	trans	-59.3	-37	178.4	54.1	0	0	0	0	113.1	P134 S140	P134-T136 VanDerWaalsContact C-N 3.34Å; P134-T136 PolarHBondContact O-N 3.35Å; T136-S140 WeakPolarHBondContact O-CB 3.45Å; T136-S140 PolarHBondContact O-N 2.91Å; T136-S140 PolarHBondContact O-OG 2.91Å
137	F	90.7	Very high	90.3	Very high	24 Å²	24	66.2 Å²	66.2	11%	0.105	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-41.3	177.3	172.9	-92	0	0	0	112	L94 K97 R98 V101 Y133 P134 K135 S140 T141	L94-F137 HydrophobicContact CD2-CE2 4.26Å; K97-F137 HydrophobicContact CB-CE1 3.91Å; K97-F137 HydrophobicContact CB-CZ 3.91Å; R98-F137 HydrophobicContact CB-CE2 4.5Å; R98-F137 HydrophobicContact CB-CZ 3.86Å; V101-F137 HydrophobicContact CG2-CE1 4.19Å; Y133-F137 HydrophobicContact CD1-CD1 4.38Å; Y133-F137 HydrophobicContact CD1-CE1 4.24Å; P134-F137 HydrophobicContact CB-CB 3.96Å; P134-F137 HydrophobicContact CG-CB 4.29Å; P134-F137 WeakPolarHBondContact O-CB 3.5Å; P134-F137 PolarHBondContact O-N 2.97Å; K135-F137 VanDerWaalsContact C-N 3.28Å; K135-F137 PolarHBondContact O-N 2.84Å; F137-S140 PolarHBondContact O-OG 3.3Å; F137-T141 VanDerWaalsContact O-CB 3.25Å; F137-T141 WeakPolarHBondContact O-CB 3.49Å; F137-T141 PolarHBondContact O-N 3.26Å; F137-T141 VanDerWaalsContact O-N 3.14Å; F137-T141 PolarHBondContact O-OG1 3.11Å
138	V	92.9	Very high	89.5	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-67.7	-55.2	178.4	177.9	0	0	0	0	109.8	A125 L128 Y133 P134 K135 S140 T141 I142	A125-V138 HydrophobicContact CB-CG1 4.13Å; L128-V138 HydrophobicContact CB-CG1 4.28Å; L128-V138 HydrophobicContact CB-CG2 3.93Å; L128-V138 HydrophobicContact CD1-CG1 3.88Å; L128-V138 HydrophobicContact CD1-CG2 4.33Å; Y133-V138 HydrophobicContact CD1-CG2 4.46Å; Y133-V138 HydrophobicContact CG-CG2 4.42Å; P134-V138 PolarHBondContact O-N 3.35Å; K135-V138 PolarHBondContact O-N 3.38Å; K135-V138 VanDerWaalsContact O-N 3.14Å; V138-S140 PolarHBondContact O-N 3.12Å; V138-T141 PolarHBondContact O-N 3.05Å; V138-T141 VanDerWaalsContact O-N 3.08Å; V138-I142 HydrophobicContact CG1-CD1 3.71Å; V138-I142 HydrophobicContact CG1-CG1 4.38Å; V138-I142 WeakPolarHBondContact O-CG1 3.5Å; V138-I142 PolarHBondContact O-N 2.97Å
139	S	93.3	Very high	88.5	Confident	56 Å²	56	73 Å²	73	39%	0.392	40%	0.4	S	S	.	.	H	α-helix	trans	-57.5	-45.9	-179.1	-51.5	0	0	0	0	112.3	K135 T141 I142 A143	K135-S139 PolarHBondContact O-N 3.42Å; K135-S139 PolarHBondContact O-OG 3.01Å; K135-S139 VanDerWaalsContact O-OG 3.08Å; S139-T141 VanDerWaalsContact C-N 3.32Å; S139-T141 PolarHBondContact O-N 3.32Å; S139-I142 PolarHBondContact O-N 2.97Å; S139-A143 WeakPolarHBondContact O-CB 3.33Å; S139-A143 PolarHBondContact O-N 3.34Å
140	S	93.2	Very high	86.8	Confident	59 Å²	59	77.8 Å²	77.8	41%	0.413	43%	0.427	S	S	.	.	H	α-helix	trans	-66.4	-31.8	178.1	60.5	0	0	0	0	113.2	T136 F137 V138 R144	T136-S140 WeakPolarHBondContact O-CB 3.45Å; T136-S140 PolarHBondContact O-N 2.91Å; T136-S140 PolarHBondContact O-OG 2.91Å; F137-S140 PolarHBondContact O-OG 3.3Å; V138-S140 PolarHBondContact O-N 3.12Å; S140-R144 VanDerWaalsContact O-CB 3.29Å; S140-R144 WeakPolarHBondContact O-CB 3.44Å; S140-R144 PolarHBondContact O-N 2.68Å; S140-R144 VanDerWaalsContact O-N 3.08Å
141	T	92.1	Very high	85.3	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.006	42%	0.421	C	S	.	.	H	α-helix	trans	-74.3	-39.8	177.4	-64.1	0	0	0	0	111.6	R98 V101 F137 V138 S139 R144 R145	R98-T141 HydrophobicContact CG-CG2 3.91Å; V101-T141 HydrophobicContact CB-CG2 3.78Å; V101-T141 HydrophobicContact CG1-CG2 3.66Å; F137-T141 VanDerWaalsContact O-CB 3.25Å; F137-T141 WeakPolarHBondContact O-CB 3.49Å; F137-T141 PolarHBondContact O-N 3.26Å; F137-T141 VanDerWaalsContact O-N 3.14Å; F137-T141 PolarHBondContact O-OG1 3.11Å; V138-T141 PolarHBondContact O-N 3.05Å; V138-T141 VanDerWaalsContact O-N 3.08Å; S139-T141 VanDerWaalsContact C-N 3.32Å; S139-T141 PolarHBondContact O-N 3.32Å; T141-R144 PolarHBondContact OG1-NH2 3.03Å; T141-R145 WeakPolarHBondContact O-CB 3.47Å; T141-R145 PolarHBondContact O-N 3.41Å
142	I	92.9	Very high	83.5	Confident	15 Å²	15	73.8 Å²	73.8	8%	0.077	43%	0.43	C	S	.	.	H	α-helix	trans	-62.9	-51.3	173.7	-63.9	170.5	0	0	0	109.8	V101 V105 L121 A125 V138 S139 R144 R145 L146	V101-I142 HydrophobicContact CG1-CG1 3.97Å; V105-I142 HydrophobicContact CG2-CB 4.34Å; V105-I142 HydrophobicContact CG2-CG1 3.75Å; V105-I142 HydrophobicContact CG2-CG2 4.31Å; L121-I142 HydrophobicContact CD2-CG2 4.25Å; A125-I142 HydrophobicContact CB-CD1 3.96Å; V138-I142 HydrophobicContact CG1-CD1 3.71Å; V138-I142 HydrophobicContact CG1-CG1 4.38Å; V138-I142 WeakPolarHBondContact O-CG1 3.5Å; V138-I142 PolarHBondContact O-N 2.97Å; S139-I142 PolarHBondContact O-N 2.97Å; I142-R144 PolarHBondContact O-N 2.88Å; I142-R145 WeakPolarHBondContact O-CA 3.38Å; I142-R145 PolarHBondContact O-N 2.98Å; I142-L146 HydrophobicContact CG2-CD1 3.95Å; I142-L146 HydrophobicContact CG2-CG 4.35Å; I142-L146 WeakPolarHBondContact O-CG 3.38Å; I142-L146 PolarHBondContact O-N 3.4Å
143	A	92.4	Very high	82.1	Confident	50 Å²	50	74.3 Å²	74.3	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-58.9	-43.7	-179.1	0	0	0	0	0	112.8	S139 R145 L146 N147	S139-A143 WeakPolarHBondContact O-CB 3.33Å; S139-A143 PolarHBondContact O-N 3.34Å; A143-R145 PolarHBondContact O-N 3.32Å; A143-L146 PolarHBondContact O-N 3.47Å; A143-N147 PolarHBondContact O-N 2.94Å
144	R	89.9	Confident	80.4	Confident	110 Å²	110	80.6 Å²	80.6	42%	0.415	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-29.4	175.1	-176.4	178.9	63	-108.6	-12.6	112.4	R98 S140 T141 I142 N147	R98-R144 VanDerWaalsContact CD-NH2 3.34Å; S140-R144 VanDerWaalsContact O-CB 3.29Å; S140-R144 WeakPolarHBondContact O-CB 3.44Å; S140-R144 PolarHBondContact O-N 2.68Å; S140-R144 VanDerWaalsContact O-N 3.08Å; T141-R144 PolarHBondContact OG1-NH2 3.03Å; I142-R144 PolarHBondContact O-N 2.88Å; R144-N147 CarbonylContact O-C 3.49Å; R144-N147 VanDerWaalsContact O-O 3.06Å
145	R	89.3	Confident	79	Confident	103 Å²	103	81.3 Å²	81.3	39%	0.389	46%	0.461	S	S	.	.	H	α-helix	trans	-81.5	-35.6	-179.3	-169.1	51.6	168.7	154	2.3	112.5	T102 V105 D106 T141 I142 A143	T102-R145 HydrophobicContact CG2-CG 4.19Å; V105-R145 HydrophobicContact CB-CG 4.35Å; V105-R145 HydrophobicContact CG1-CB 4.04Å; V105-R145 HydrophobicContact CG1-CG 3.78Å; D106-R145 VanDerWaalsContact CG-NH2 3.26Å; D106-R145 WeakPolarHBondContact OD1-CG 3.38Å; D106-R145 IonicContact OD1-CZ 2.86Å; D106-R145 VanDerWaalsContact OD1-CZ 3.3Å; D106-R145 IonicContact OD1-NE 2.76Å; D106-R145 PolarHBondContact OD1-NE 2.96Å; D106-R145 IonicContact OD1-NH2 3.78Å; D106-R145 PolarHBondContact OD1-NH2 3.03Å; D106-R145 VanDerWaalsContact OD1-NH2 3.14Å; D106-R145 IonicContact OD2-CZ 3.85Å; D106-R145 IonicContact OD2-NE 3.96Å; D106-R145 PolarHBondContact OD2-NE 3.17Å; D106-R145 IonicContact OD2-NH2 3.29Å; D106-R145 PolarHBondContact OD2-NH2 3.37Å; T141-R145 WeakPolarHBondContact O-CB 3.47Å; T141-R145 PolarHBondContact O-N 3.41Å; I142-R145 WeakPolarHBondContact O-CA 3.38Å; I142-R145 PolarHBondContact O-N 2.98Å; A143-R145 PolarHBondContact O-N 3.32Å
146	L	86.8	Confident	77.7	Confident	72 Å²	72	81 Å²	81	38%	0.377	46%	0.462	S	S	.	.	H	α-helix	trans	-69.6	-35.9	174.2	-65.1	173.6	0	0	0	112.3	I109 L121 I142 A143 P148	I109-L146 HydrophobicContact CD1-CD2 4.08Å; I109-L146 HydrophobicContact CG1-CD2 4.44Å; L121-L146 HydrophobicContact CD1-CD1 4Å; L121-L146 HydrophobicContact CD1-CD2 4.02Å; I142-L146 HydrophobicContact CG2-CD1 3.95Å; I142-L146 HydrophobicContact CG2-CG 4.35Å; I142-L146 WeakPolarHBondContact O-CG 3.38Å; I142-L146 PolarHBondContact O-N 3.4Å; A143-L146 PolarHBondContact O-N 3.47Å; L146-P148 VanDerWaalsContact C-CD 3.4Å; L146-P148 WeakPolarHBondContact O-CD 3.41Å
147	N	86	Confident	76.3	Confident	121 Å²	121	83.6 Å²	83.6	65%	0.647	46%	0.459	S	S	*	.	S	Bend	trans	-111.7	78.7	174.4	-61.7	-47.8	0	0	0	109.3	A143 R144 T149	A143-N147 PolarHBondContact O-N 2.94Å; R144-N147 CarbonylContact O-C 3.49Å; R144-N147 VanDerWaalsContact O-O 3.06Å; N147-T149 VanDerWaalsContact C-N 3.34Å; N147-T149 PolarHBondContact O-N 3Å
148	P	75.9	Confident	75.3	Confident	87 Å²	87	87.7 Å²	87.7	57%	0.565	48%	0.482	S	S	*	.			trans	-63.7	101.2	170.1	26.7	-29.8	0	0	0	107.5	L146 D150	L146-P148 VanDerWaalsContact C-CD 3.4Å; L146-P148 WeakPolarHBondContact O-CD 3.41Å; P148-D150 PolarHBondContact O-N 3.5Å
149	T	71	Confident	74.6	Confident	111 Å²	111	96.7 Å²	96.7	68%	0.681	52%	0.516	S	S	*	.			trans	-59.9	126.5	158	36	0	0	0	0	106.6	N147 S151	N147-T149 VanDerWaalsContact C-N 3.34Å; N147-T149 PolarHBondContact O-N 3Å; T149-S151 PolarHBondContact O-N 3.28Å
150	D	56.2	Low	74.2	Confident	152 Å²	152	97 Å²	97	81%	0.813	51%	0.512	S	S	*	.			trans	-62.2	67.6	170.5	-82	-35.2	0	0	0	110.4	P148 S152	P148-D150 PolarHBondContact O-N 3.5Å; D150-S152 PolarHBondContact O-N 2.7Å; D150-S152 VanDerWaalsContact O-N 3.11Å
151	S	56.1	Low	73.9	Confident	89 Å²	89	98.5 Å²	98.5	62%	0.622	52%	0.521	S	S	*	.			trans	-84.7	56.4	161.9	55.1	0	0	0	0	108.2	T149 S153	T149-S151 PolarHBondContact O-N 3.28Å; S151-S153 PolarHBondContact O-N 3.42Å
152	S	50.8	Low	73.7	Confident	113 Å²	113	102.4 Å²	102.4	79%	0.79	55%	0.545	S	S	*	.			trans	-74.6	45.8	154.7	-66.7	0	0	0	0	108.8	D150 N154	D150-S152 PolarHBondContact O-N 2.7Å; D150-S152 VanDerWaalsContact O-N 3.11Å; S152-N154 PolarHBondContact O-N 3.46Å
153	S	53.5	Low	73.3	Confident	64 Å²	64	105.8 Å²	105.8	45%	0.448	56%	0.563	S	S	.	*			trans	-79.4	107	165.8	62.1	0	0	0	0	105.5	S151 N155	S151-S153 PolarHBondContact O-N 3.42Å; S153-N155 PolarHBondContact O-N 3.48Å; S153-N155 PolarHBondContact O-ND2 2.86Å; S153-N155 PolarHBondContact OG-ND2 3.2Å
154	N	52.4	Low	72.9	Confident	159 Å²	159	107.4 Å²	107.4	85%	0.85	57%	0.567	S	S	*	*			trans	-48.8	84.3	167.4	-147.4	7.1	0	0	0	108.1	S152 E156	S152-N154 PolarHBondContact O-N 3.46Å; N154-E156 PolarHBondContact O-N 3.32Å
155	N	60	Low	72.4	Confident	77 Å²	77	103.6 Å²	103.6	41%	0.412	56%	0.556	S	S	.	*			trans	-79.3	122.5	-169.1	-90.6	-53.9	0	0	0	105.9	S153 R157 D158	S153-N155 PolarHBondContact O-N 3.48Å; S153-N155 PolarHBondContact O-ND2 2.86Å; S153-N155 PolarHBondContact OG-ND2 3.2Å; N155-R157 HydrophobicContact CB-CB 4.08Å; N155-R157 HydrophobicContact CB-CG 4.36Å; N155-R157 PolarHBondContact O-N 2.85Å; N155-D158 PolarHBondContact O-N 2.95Å
156	E	63.4	Low	71.9	Confident	128 Å²	128	103.3 Å²	103.3	60%	0.598	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-42.9	-22	165.7	-76.2	-68.6	145.7	0	0	112.9	N154 D158 R159	N154-E156 PolarHBondContact O-N 3.32Å; E156-D158 VanDerWaalsContact C-N 3.26Å; E156-D158 PolarHBondContact O-N 3.11Å; E156-R159 PolarHBondContact O-N 2.99Å; E156-R159 IonicContact OE1-CZ 2.72Å; E156-R159 IonicContact OE1-NH1 3.81Å; E156-R159 PolarHBondContact OE1-NH1 3.41Å; E156-R159 IonicContact OE2-NH1 3.91Å; E156-R159 PolarHBondContact OE2-NH1 3.35Å
157	R	64.1	Low	71.5	Confident	164 Å²	164	102 Å²	102	62%	0.619	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-59.4	-24.6	172	-60.1	-174.9	177.1	175.2	2.1	115.4	N155 R159 L160 R185	N155-R157 HydrophobicContact CB-CB 4.08Å; N155-R157 HydrophobicContact CB-CG 4.36Å; N155-R157 PolarHBondContact O-N 2.85Å; R157-R159 PolarHBondContact O-N 3.06Å; R157-L160 HydrophobicContact CB-CD1 4.3Å; R157-L160 HydrophobicContact CG-CD1 4.4Å; R157-L160 PolarHBondContact O-N 2.81Å; R157-R185 WeakPolarHBondContact O-CD 3.32Å; R157-R185 PolarHBondContact O-NH1 3.47Å; R157-R185 VanDerWaalsContact O-NH1 3.08Å
158	D	68.7	Low	70.9	Confident	111 Å²	111	100 Å²	100	59%	0.594	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-75	-14.7	177.6	-69.4	-31.8	0	0	0	112.7	N155 E156 R185	N155-D158 PolarHBondContact O-N 2.95Å; E156-D158 VanDerWaalsContact C-N 3.26Å; E156-D158 PolarHBondContact O-N 3.11Å; D158-R185 IonicContact OD1-CZ 3.89Å; D158-R185 IonicContact OD1-NH1 2.76Å; D158-R185 PolarHBondContact OD1-NH1 2.89Å; D158-R185 IonicContact OD1-NH2 3.72Å
159	R	79.7	Confident	70.8	Confident	189 Å²	189	99.2 Å²	99.2	71%	0.713	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-87.6	-8.9	173.4	-62.4	176.5	176.4	160.9	-3.4	114	E156 R157	E156-R159 PolarHBondContact O-N 2.99Å; E156-R159 IonicContact OE1-CZ 2.72Å; E156-R159 IonicContact OE1-NH1 3.81Å; E156-R159 PolarHBondContact OE1-NH1 3.41Å; E156-R159 IonicContact OE2-NH1 3.91Å; E156-R159 PolarHBondContact OE2-NH1 3.35Å; R157-R159 PolarHBondContact O-N 3.06Å
160	L	82.9	Confident	71.1	Confident	61 Å²	61	96.2 Å²	96.2	32%	0.319	53%	0.526	S	S	.	.	S	Bend	trans	-73.8	141.7	-177.2	-63.1	171.8	0	0	0	111.1	R157 V162 G183 R185	R157-L160 HydrophobicContact CB-CD1 4.3Å; R157-L160 HydrophobicContact CG-CD1 4.4Å; R157-L160 PolarHBondContact O-N 2.81Å; L160-V162 PolarHBondContact O-N 2.91Å; L160-G183 WeakPolarHBondContact CD2-O 3.41Å; L160-R185 HydrophobicContact CB-CG 4.2Å; L160-R185 HydrophobicContact CD1-CG 4.27Å
161	P	88.4	Confident	72.4	Confident	91 Å²	91	93.1 Å²	93.1	59%	0.591	51%	0.51	S	S	*	.			trans	-51.8	138.2	170.8	-26.2	33.9	0	0	0	111.9	F184 R185	P161-F184 HydrophobicContact CB-CB 4.38Å; P161-F184 CarbonylContact O-C 3.37Å; P161-F184 WeakPolarHBondContact O-CA 3.45Å; P161-F184 WeakPolarHBondContact O-CB 3.33Å; P161-R185 PolarHBondContact O-N 2.72Å
162	V	87.3	Confident	73.7	Confident	84 Å²	84	89 Å²	89	51%	0.509	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.4	-177.6	176.6	0	0	0	0	110.4	L160 R185 F187	L160-V162 PolarHBondContact O-N 2.91Å; V162-R185 HydrophobicContact CG2-CB 4.25Å; V162-F187 HydrophobicContact CG1-CD2 3.37Å; V162-F187 HydrophobicContact CG1-CE2 3.72Å; V162-F187 HydrophobicContact CG1-CG 4.41Å; V162-F187 HydrophobicContact CG2-CE2 4.19Å
163	L	84.8	Confident	75.4	Confident	86 Å²	86	86.8 Å²	86.8	45%	0.45	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.7	171.7	-175.4	64.2	0	0	0	110.2	V165 F184 R185 I186 F187	L163-V165 HydrophobicContact CD1-CG1 4.49Å; L163-V165 HydrophobicContact CD2-CG1 4.06Å; L163-V165 HydrophobicContact CG-CG1 3.9Å; L163-F184 HydrophobicContact CB-CD2 4.34Å; L163-F184 HydrophobicContact CD2-CE2 4.24Å; L163-R185 PolarHBondContact N-O 3.49Å; L163-I186 VanDerWaalsContact O-CA 3.31Å; L163-I186 WeakPolarHBondContact O-CA 3.26Å; L163-F187 PolarHBondContact O-N 3.25Å
164	T	82.7	Confident	77	Confident	84 Å²	84	87.6 Å²	87.6	52%	0.515	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.4	177.4	-63	0	0	0	0	110.4	F187 K189	T164-F187 WeakPolarHBondContact CA-O 3.23Å; T164-K189 HydrophobicContact CG2-CB 3.89Å
165	V	81.3	Confident	78.6	Confident	29 Å²	29	82.4 Å²	82.4	18%	0.176	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	157.4	-177.3	-58.1	0	0	0	0	111.8	L163 L175 I186 F187 F188 K189	L163-V165 HydrophobicContact CD1-CG1 4.49Å; L163-V165 HydrophobicContact CD2-CG1 4.06Å; L163-V165 HydrophobicContact CG-CG1 3.9Å; V165-L175 HydrophobicContact CG2-CD1 4.31Å; V165-I186 HydrophobicContact CG2-CG2 3.73Å; V165-F187 PolarHBondContact N-O 3.11Å; V165-F188 HydrophobicContact CG2-CD1 3.92Å; V165-F188 HydrophobicContact CG2-CE1 4Å; V165-F188 CarbonylContact O-C 3.56Å; V165-F188 VanDerWaalsContact O-CA 3.23Å; V165-F188 WeakPolarHBondContact O-CA 3.5Å; V165-K189 PolarHBondContact O-N 3.34Å
166	P	78.7	Confident	79.9	Confident	98 Å²	98	81 Å²	81	64%	0.636	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.8	138.6	169.4	-22.9	34.3	0	0	0	111.7	Y168	P166-Y168 PolarHBondContact O-N 3.02Å
167	Y	77.9	Confident	81.1	Confident	44 Å²	44	82.3 Å²	82.3	17%	0.173	42%	0.417	C	S	.	.			trans	-69.9	130.7	172.4	179	-109.9	0	0	0	111	R92 S93 V169 E173 F188 K189	R92-Y167 VanDerWaalsContact C-CE1 3.48Å; S93-Y167 VanDerWaalsContact CB-CD2 3.48Å; Y167-V169 HydrophobicContact CE1-CG2 3.85Å; Y167-E173 WeakPolarHBondContact CE2-OE1 3.26Å; Y167-E173 PolarHBondContact OH-OE1 2.9Å; Y167-F188 HydrophobicContact CD2-CD1 4.01Å; Y167-F188 AromaticContact CD2-CD2 3.89Å; Y167-F188 HydrophobicContact CD2-CD2 3.89Å; Y167-F188 HydrophobicContact CD2-CE1 4.1Å; Y167-F188 AromaticContact CD2-CE2 3.9Å; Y167-F188 HydrophobicContact CD2-CE2 3.9Å; Y167-F188 AromaticContact CD2-CG 3.91Å; Y167-F188 HydrophobicContact CD2-CG 3.91Å; Y167-F188 HydrophobicContact CD2-CZ 4.03Å; Y167-F188 HydrophobicContact CE2-CE2 4.36Å; Y167-F188 HydrophobicContact CG-CG 4.4Å; Y167-K189 PolarHBondContact N-O 2.84Å
168	Y	72.9	Confident	82.3	Confident	79 Å²	79	76.8 Å²	76.8	31%	0.31	40%	0.399	S	S	.	.			trans	-133.3	134.4	170	-176.5	-83.3	0	0	0	109.3	T61 P63 P166 G170 L171 G172	T61-Y168 PolarHBondContact O-OH 3.33Å; T61-Y168 VanDerWaalsContact O-OH 3.09Å; P63-Y168 VanDerWaalsContact CD-OH 3.26Å; P63-Y168 WeakPolarHBondContact CD-OH 3.47Å; P63-Y168 HydrophobicContact CG-CD2 4.21Å; P63-Y168 HydrophobicContact CG-CE2 3.5Å; P166-Y168 PolarHBondContact O-N 3.02Å; Y168-G170 PolarHBondContact O-N 3.48Å; Y168-L171 HydrophobicContact CD1-CB 3.5Å; Y168-L171 HydrophobicContact CE1-CB 4.29Å; Y168-L171 HydrophobicContact CG-CB 4.22Å; Y168-L171 PolarHBondContact O-N 3.35Å; Y168-G172 PolarHBondContact O-N 3.24Å
169	V	74.5	Confident	83.2	Confident	71 Å²	71	71.5 Å²	71.5	43%	0.43	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	125.5	-175.8	179.4	0	0	0	0	110.4	N90 Y167 L171	N90-V169 WeakPolarHBondContact O-CG2 3.27Å; Y167-V169 HydrophobicContact CE1-CG2 3.85Å; V169-L171 PolarHBondContact O-N 3.23Å
170	G	77.8	Confident	83.5	Confident	47 Å²	47	72.3 Å²	72.3	49%	0.485	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-45.1	179.7	0	0	0	0	0	113	Y168 E173 H174	Y168-G170 PolarHBondContact O-N 3.48Å; G170-E173 VanDerWaalsContact CA-OE2 3.3Å; G170-E173 WeakPolarHBondContact CA-OE2 3.45Å; G170-E173 PolarHBondContact N-OE2 3.13Å; G170-H174 PolarHBondContact O-N 3.17Å
171	L	82.4	Confident	83.8	Confident	88 Å²	88	75.7 Å²	75.7	46%	0.461	39%	0.388	S	S	.	.	H	α-helix	trans	-71.9	-40.9	175.2	-175.7	62.8	0	0	0	111.4	Y168 V169 E173 H174 L175	Y168-L171 HydrophobicContact CD1-CB 3.5Å; Y168-L171 HydrophobicContact CE1-CB 4.29Å; Y168-L171 HydrophobicContact CG-CB 4.22Å; Y168-L171 PolarHBondContact O-N 3.35Å; V169-L171 PolarHBondContact O-N 3.23Å; L171-E173 PolarHBondContact O-N 2.67Å; L171-H174 PolarHBondContact O-N 3.26Å; L171-L175 HydrophobicContact CD1-CD1 4.44Å; L171-L175 HydrophobicContact CD1-CG 4.19Å; L171-L175 HydrophobicContact CD2-CD1 4.38Å; L171-L175 HydrophobicContact CG-CD1 3.91Å; L171-L175 HydrophobicContact CG-CG 4.11Å; L171-L175 WeakPolarHBondContact O-CB 3.45Å; L171-L175 VanDerWaalsContact O-CG 3.29Å; L171-L175 WeakPolarHBondContact O-CG 3.16Å; L171-L175 PolarHBondContact O-N 3.47Å
172	G	84	Confident	83.9	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.01	39%	0.39	C	S	.	.	H	α-helix	trans	-59.7	-47.5	-178.3	0	0	0	0	0	112	Y168 H174 L175 Q176 F188	Y168-G172 PolarHBondContact O-N 3.24Å; G172-H174 VanDerWaalsContact C-N 3.3Å; G172-H174 PolarHBondContact O-N 2.94Å; G172-L175 PolarHBondContact O-N 3.26Å; G172-Q176 PolarHBondContact O-N 2.9Å; G172-F188 VanDerWaalsContact CA-CZ 3.46Å; G172-F188 WeakPolarHBondContact O-CZ 3.46Å
173	E	85.3	Confident	83.8	Confident	67 Å²	67	76.3 Å²	76.3	31%	0.313	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-37.7	177.9	-66.8	73.8	-162.8	0	0	111.9	Y167 G170 L171 R177	Y167-E173 WeakPolarHBondContact CE2-OE1 3.26Å; Y167-E173 PolarHBondContact OH-OE1 2.9Å; G170-E173 VanDerWaalsContact CA-OE2 3.3Å; G170-E173 WeakPolarHBondContact CA-OE2 3.45Å; G170-E173 PolarHBondContact N-OE2 3.13Å; L171-E173 PolarHBondContact O-N 2.67Å; E173-R177 PolarHBondContact O-N 2.81Å; E173-R177 VanDerWaalsContact O-N 3.16Å
174	H	86.9	Confident	83.9	Confident	82 Å²	82	75.1 Å²	75.1	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-47.9	175.8	-175	63.2	0	0	0	111.5	G170 L171 G172 Q176 R177 L178	G170-H174 PolarHBondContact O-N 3.17Å; L171-H174 PolarHBondContact O-N 3.26Å; G172-H174 VanDerWaalsContact C-N 3.3Å; G172-H174 PolarHBondContact O-N 2.94Å; H174-Q176 VanDerWaalsContact C-N 3.31Å; H174-Q176 PolarHBondContact O-N 2.91Å; H174-R177 WeakPolarHBondContact O-CB 3.33Å; H174-R177 PolarHBondContact O-N 3.14Å; H174-R177 VanDerWaalsContact O-N 3.07Å; H174-L178 PolarHBondContact O-N 3.48Å
175	L	86.4	Confident	84.1	Confident	50 Å²	50	74.6 Å²	74.6	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-57.3	-45	175.2	-72	176.4	0	0	0	110.9	V165 L171 G172 R177 L178 G179 I186	V165-L175 HydrophobicContact CG2-CD1 4.31Å; L171-L175 HydrophobicContact CD1-CD1 4.44Å; L171-L175 HydrophobicContact CD1-CG 4.19Å; L171-L175 HydrophobicContact CD2-CD1 4.38Å; L171-L175 HydrophobicContact CG-CD1 3.91Å; L171-L175 HydrophobicContact CG-CG 4.11Å; L171-L175 WeakPolarHBondContact O-CB 3.45Å; L171-L175 VanDerWaalsContact O-CG 3.29Å; L171-L175 WeakPolarHBondContact O-CG 3.16Å; L171-L175 PolarHBondContact O-N 3.47Å; G172-L175 PolarHBondContact O-N 3.26Å; L175-R177 PolarHBondContact O-N 3.38Å; L175-L178 PolarHBondContact O-N 2.66Å; L175-G179 PolarHBondContact O-N 2.82Å; L175-I186 HydrophobicContact CB-CD1 3.5Å; L175-I186 VanDerWaalsContact CB-CD1 3.5Å; L175-I186 WeakPolarHBondContact O-CD1 3.34Å
176	Q	87.9	Confident	84.3	Confident	48 Å²	48	74 Å²	74	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-59.4	-36.6	177	-81.7	-171.7	-15.2	0	0	112.9	G172 H174 R180 I186 F188	G172-Q176 PolarHBondContact O-N 2.9Å; H174-Q176 VanDerWaalsContact C-N 3.31Å; H174-Q176 PolarHBondContact O-N 2.91Å; Q176-R180 WeakPolarHBondContact O-CG 3.25Å; Q176-R180 PolarHBondContact O-N 3.13Å; Q176-R180 VanDerWaalsContact O-N 3.13Å; Q176-I186 HydrophobicContact CG-CB 4.1Å; Q176-I186 HydrophobicContact CG-CG2 4.47Å; Q176-F188 HydrophobicContact CG-CE2 4.02Å; Q176-F188 HydrophobicContact CG-CZ 3.77Å
177	R	89.2	Confident	84.7	Confident	155 Å²	155	73.9 Å²	73.9	59%	0.585	35%	0.345	S	S	*	.	H	α-helix	trans	-67.4	-45	176.4	-162.9	-171	-45.2	153.4	8.3	111.2	E173 H174 L175 G179 R180 Q181	E173-R177 PolarHBondContact O-N 2.81Å; E173-R177 VanDerWaalsContact O-N 3.16Å; H174-R177 WeakPolarHBondContact O-CB 3.33Å; H174-R177 PolarHBondContact O-N 3.14Å; H174-R177 VanDerWaalsContact O-N 3.07Å; L175-R177 PolarHBondContact O-N 3.38Å; R177-G179 VanDerWaalsContact C-N 3.35Å; R177-R180 PolarHBondContact O-N 3.21Å; R177-Q181 PolarHBondContact O-N 2.84Å; R177-Q181 VanDerWaalsContact O-N 3.08Å
178	L	88.8	Confident	84.9	Confident	48 Å²	48	73 Å²	73	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-45	174.5	-67.1	174.2	0	0	0	111.1	H174 L175 R180 Q181 Y182	H174-L178 PolarHBondContact O-N 3.48Å; L175-L178 PolarHBondContact O-N 2.66Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 2.98Å; L178-Q181 WeakPolarHBondContact O-CB 3.44Å; L178-Q181 PolarHBondContact O-N 3.11Å; L178-Y182 HydrophobicContact CB-CD2 4.37Å; L178-Y182 HydrophobicContact CD2-CE2 4.03Å; L178-Y182 VanDerWaalsContact O-CD2 3.23Å; L178-Y182 WeakPolarHBondContact O-CD2 3.47Å; L178-Y182 PolarHBondContact O-N 3.34Å
179	G	87	Confident	85.2	Confident	0 Å²	0	76 Å²	76	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-56.5	-44.4	176.3	0	0	0	0	0	112.6	L175 R177 Q181 Y182 G183 F184	L175-G179 PolarHBondContact O-N 2.82Å; R177-G179 VanDerWaalsContact C-N 3.35Å; G179-Q181 VanDerWaalsContact C-N 3.29Å; G179-Q181 PolarHBondContact O-N 3.36Å; G179-Y182 PolarHBondContact O-N 3.1Å; G179-G183 PolarHBondContact O-N 3.19Å; G179-F184 CarbonylContact C-O 3.52Å; G179-F184 VanDerWaalsContact CA-CE2 3.49Å; G179-F184 WeakPolarHBondContact CA-O 3.42Å; G179-F184 PolarHBondContact O-N 2.89Å
180	R	86.3	Confident	85.1	Confident	205 Å²	205	77 Å²	77	77%	0.774	37%	0.368	S	S	*	.	H	α-helix	trans	-61.9	-36.8	175.1	-69.9	176.3	-170	-164.8	4.3	112.9	Q176 R177 L178	Q176-R180 WeakPolarHBondContact O-CG 3.25Å; Q176-R180 PolarHBondContact O-N 3.13Å; Q176-R180 VanDerWaalsContact O-N 3.13Å; R177-R180 PolarHBondContact O-N 3.21Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 2.98Å
181	Q	89.2	Confident	84.7	Confident	132 Å²	132	79.1 Å²	79.1	62%	0.617	38%	0.375	S	S	*	.	H	α-helix	trans	-70.9	-39.3	179.2	-178.5	179.2	-15.4	0	0	112.3	R177 L178 G179	R177-Q181 PolarHBondContact O-N 2.84Å; R177-Q181 VanDerWaalsContact O-N 3.08Å; L178-Q181 WeakPolarHBondContact O-CB 3.44Å; L178-Q181 PolarHBondContact O-N 3.11Å; G179-Q181 VanDerWaalsContact C-N 3.29Å; G179-Q181 PolarHBondContact O-N 3.36Å
182	Y	89.7	Confident	83.9	Confident	158 Å²	158	78.7 Å²	78.7	62%	0.62	38%	0.377	S	S	*	.	H	α-helix	trans	-101.6	9.8	-174.5	-67.9	-72.9	0	0	0	114	L178 G179	L178-Y182 HydrophobicContact CB-CD2 4.37Å; L178-Y182 HydrophobicContact CD2-CE2 4.03Å; L178-Y182 VanDerWaalsContact O-CD2 3.23Å; L178-Y182 WeakPolarHBondContact O-CD2 3.47Å; L178-Y182 PolarHBondContact O-N 3.34Å; G179-Y182 PolarHBondContact O-N 3.1Å
183	G	86.4	Confident	83	Confident	31 Å²	31	83.3 Å²	83.3	32%	0.32	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	33.2	173.2	0	0	0	0	0	115.3	L160 G179	L160-G183 WeakPolarHBondContact CD2-O 3.41Å; G179-G183 PolarHBondContact O-N 3.19Å
184	F	87.6	Confident	82.1	Confident	60 Å²	60	86.3 Å²	86.3	26%	0.263	42%	0.419	S	S	.	.			trans	-133.6	154.1	170.4	63.2	-91.9	0	0	0	112.3	P161 L163 G179 I186	P161-F184 HydrophobicContact CB-CB 4.38Å; P161-F184 CarbonylContact O-C 3.37Å; P161-F184 WeakPolarHBondContact O-CA 3.45Å; P161-F184 WeakPolarHBondContact O-CB 3.33Å; L163-F184 HydrophobicContact CB-CD2 4.34Å; L163-F184 HydrophobicContact CD2-CE2 4.24Å; G179-F184 CarbonylContact C-O 3.52Å; G179-F184 VanDerWaalsContact CA-CE2 3.49Å; G179-F184 WeakPolarHBondContact CA-O 3.42Å; G179-F184 PolarHBondContact O-N 2.89Å; F184-I186 HydrophobicContact CD2-CD1 4.36Å; F184-I186 HydrophobicContact CD2-CG1 3.9Å; F184-I186 HydrophobicContact CE2-CD1 3.7Å; F184-I186 HydrophobicContact CE2-CG1 3.75Å
185	R	86.4	Confident	81.1	Confident	74 Å²	74	90.9 Å²	90.9	28%	0.279	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.8	-179.1	-72	173	62.6	177.9	5.6	110.4	R157 D158 L160 P161 V162 L163 F187	R157-R185 WeakPolarHBondContact O-CD 3.32Å; R157-R185 PolarHBondContact O-NH1 3.47Å; R157-R185 VanDerWaalsContact O-NH1 3.08Å; D158-R185 IonicContact OD1-CZ 3.89Å; D158-R185 IonicContact OD1-NH1 2.76Å; D158-R185 PolarHBondContact OD1-NH1 2.89Å; D158-R185 IonicContact OD1-NH2 3.72Å; L160-R185 HydrophobicContact CB-CG 4.2Å; L160-R185 HydrophobicContact CD1-CG 4.27Å; P161-R185 PolarHBondContact O-N 2.72Å; V162-R185 HydrophobicContact CG2-CB 4.25Å; L163-R185 PolarHBondContact N-O 3.49Å; R185-F187 HydrophobicContact CB-CE2 4.27Å
186	I	85.7	Confident	80.2	Confident	16 Å²	16	91.7 Å²	91.7	8%	0.082	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.8	175.2	-57	-170.3	0	0	0	110.5	L163 V165 L175 Q176 F184 F188	L163-I186 VanDerWaalsContact O-CA 3.31Å; L163-I186 WeakPolarHBondContact O-CA 3.26Å; V165-I186 HydrophobicContact CG2-CG2 3.73Å; L175-I186 HydrophobicContact CB-CD1 3.5Å; L175-I186 VanDerWaalsContact CB-CD1 3.5Å; L175-I186 WeakPolarHBondContact O-CD1 3.34Å; Q176-I186 HydrophobicContact CG-CB 4.1Å; Q176-I186 HydrophobicContact CG-CG2 4.47Å; F184-I186 HydrophobicContact CD2-CD1 4.36Å; F184-I186 HydrophobicContact CD2-CG1 3.9Å; F184-I186 HydrophobicContact CE2-CD1 3.7Å; F184-I186 HydrophobicContact CE2-CG1 3.75Å; I186-F188 HydrophobicContact CG2-CD1 4.4Å; I186-F188 HydrophobicContact CG2-CE1 3.96Å; I186-F188 HydrophobicContact CG2-CZ 4.34Å
187	F	85.8	Confident	79.3	Confident	95 Å²	95	94.7 Å²	94.7	42%	0.417	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	148.9	167.5	-73.3	-97.1	0	0	0	110.3	V162 L163 T164 V165 R185	V162-F187 HydrophobicContact CG1-CD2 3.37Å; V162-F187 HydrophobicContact CG1-CE2 3.72Å; V162-F187 HydrophobicContact CG1-CG 4.41Å; V162-F187 HydrophobicContact CG2-CE2 4.19Å; L163-F187 PolarHBondContact O-N 3.25Å; T164-F187 WeakPolarHBondContact CA-O 3.23Å; V165-F187 PolarHBondContact N-O 3.11Å; R185-F187 HydrophobicContact CB-CE2 4.27Å
188	F	83.8	Confident	78.3	Confident	27 Å²	27	92 Å²	92	12%	0.118	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.6	178.4	-61.7	-62.5	0	0	0	111.6	S93 V165 Y167 G172 Q176 I186	S93-F188 WeakPolarHBondContact OG-CD2 3.11Å; S93-F188 WeakPolarHBondContact OG-CE2 3.44Å; V165-F188 HydrophobicContact CG2-CD1 3.92Å; V165-F188 HydrophobicContact CG2-CE1 4Å; V165-F188 CarbonylContact O-C 3.56Å; V165-F188 VanDerWaalsContact O-CA 3.23Å; V165-F188 WeakPolarHBondContact O-CA 3.5Å; Y167-F188 HydrophobicContact CD2-CD1 4.01Å; Y167-F188 AromaticContact CD2-CD2 3.89Å; Y167-F188 HydrophobicContact CD2-CD2 3.89Å; Y167-F188 HydrophobicContact CD2-CE1 4.1Å; Y167-F188 AromaticContact CD2-CE2 3.9Å; Y167-F188 HydrophobicContact CD2-CE2 3.9Å; Y167-F188 AromaticContact CD2-CG 3.91Å; Y167-F188 HydrophobicContact CD2-CG 3.91Å; Y167-F188 HydrophobicContact CD2-CZ 4.03Å; Y167-F188 HydrophobicContact CE2-CE2 4.36Å; Y167-F188 HydrophobicContact CG-CG 4.4Å; G172-F188 VanDerWaalsContact CA-CZ 3.46Å; G172-F188 WeakPolarHBondContact O-CZ 3.46Å; Q176-F188 HydrophobicContact CG-CE2 4.02Å; Q176-F188 HydrophobicContact CG-CZ 3.77Å; I186-F188 HydrophobicContact CG2-CD1 4.4Å; I186-F188 HydrophobicContact CG2-CE1 3.96Å; I186-F188 HydrophobicContact CG2-CZ 4.34Å
189	K	77.5	Confident	77.1	Confident	141 Å²	141	95.9 Å²	95.9	61%	0.613	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	139.7	165	-160.8	175.2	-179.5	173.1	0	108.9	T164 V165 Y167	T164-K189 HydrophobicContact CG2-CB 3.89Å; V165-K189 PolarHBondContact O-N 3.34Å; Y167-K189 PolarHBondContact N-O 2.84Å
190	S	72.1	Confident	76	Confident	93 Å²	93	102.3 Å²	102.3	65%	0.65	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-63.1	146.7	165.4	53.1	0	0	0	0	109.8
191	S	70.2	Confident	75.3	Confident	90 Å²	90	97.2 Å²	97.2	63%	0.629	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-55	151.7	167.6	56.7	0	0	0	0	110.3	N193	S191-N193 PolarHBondContact O-N 2.88Å
192	P	65.8	Low	74.2	Confident	79 Å²	79	98.3 Å²	98.3	51%	0.513	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-50.4	137.3	169.4	21.5	-32	0	0	0	109.5	S196 L197	P192-S196 WeakPolarHBondContact CB-OG 3.36Å; P192-L197 HydrophobicContact CB-CD2 4.18Å; P192-L197 HydrophobicContact CB-CG 4.21Å; P192-L197 HydrophobicContact CG-CD1 4.32Å; P192-L197 HydrophobicContact CG-CD2 3.85Å; P192-L197 HydrophobicContact CG-CG 4.16Å
193	N	65.5	Low	73.3	Confident	99 Å²	99	98.1 Å²	98.1	53%	0.529	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-67.6	151.6	179	59.5	46.7	0	0	0	109.5	S191 R195 S196 L197	S191-N193 PolarHBondContact O-N 2.88Å; N193-R195 PolarHBondContact O-N 3.04Å; N193-R195 VanDerWaalsContact O-N 3.13Å; N193-R195 WeakPolarHBondContact OD1-CB 3.17Å; N193-S196 PolarHBondContact N-OG 3.09Å; N193-S196 PolarHBondContact O-N 3.05Å; N193-S196 PolarHBondContact O-OG 2.7Å; N193-S196 VanDerWaalsContact OD1-CB 3.23Å; N193-S196 WeakPolarHBondContact OD1-CB 3.4Å; N193-S196 PolarHBondContact OD1-N 2.97Å; N193-S196 PolarHBondContact OD1-OG 3.43Å; N193-L197 PolarHBondContact O-N 2.95Å
194	L	66.4	Low	72.6	Confident	130 Å²	130	105.5 Å²	105.5	68%	0.681	53%	0.528	S	S	*	.	H	α-helix	trans	-54.1	-37.5	-179.3	-177.1	65.1	0	0	0	111.5	S196 L197 V198	L194-S196 VanDerWaalsContact C-N 3.31Å; L194-S196 PolarHBondContact O-N 3.35Å; L194-L197 PolarHBondContact O-N 2.93Å; L194-L197 VanDerWaalsContact O-N 3.11Å; L194-V198 HydrophobicContact CD1-CG2 3.58Å; L194-V198 HydrophobicContact CG-CG2 3.91Å; L194-V198 WeakPolarHBondContact O-CB 3.26Å; L194-V198 WeakPolarHBondContact O-CG2 3.35Å; L194-V198 PolarHBondContact O-N 3.31Å
195	R	65.6	Low	72.1	Confident	178 Å²	178	105.3 Å²	105.3	67%	0.672	53%	0.532	S	S	*	.	H	α-helix	trans	-54.4	-45.1	174.2	-179.4	178	-73.1	138.3	-3.9	111.7	N193 L197 R199	N193-R195 PolarHBondContact O-N 3.04Å; N193-R195 VanDerWaalsContact O-N 3.13Å; N193-R195 WeakPolarHBondContact OD1-CB 3.17Å; R195-L197 VanDerWaalsContact C-N 3.33Å; R195-L197 PolarHBondContact O-N 2.98Å; R195-R199 HydrophobicContact CG-CG 4.15Å; R195-R199 WeakPolarHBondContact O-CB 3.33Å; R195-R199 PolarHBondContact O-N 3.43Å
196	S	66.7	Low	71.8	Confident	67 Å²	67	104.7 Å²	104.7	47%	0.469	54%	0.538	S	S	.	.	H	α-helix	trans	-72.1	-23.5	179.5	66.2	0	0	0	0	114	P192 N193 L194	P192-S196 WeakPolarHBondContact CB-OG 3.36Å; N193-S196 PolarHBondContact N-OG 3.09Å; N193-S196 PolarHBondContact O-N 3.05Å; N193-S196 PolarHBondContact O-OG 2.7Å; N193-S196 VanDerWaalsContact OD1-CB 3.23Å; N193-S196 WeakPolarHBondContact OD1-CB 3.4Å; N193-S196 PolarHBondContact OD1-N 2.97Å; N193-S196 PolarHBondContact OD1-OG 3.43Å; L194-S196 VanDerWaalsContact C-N 3.31Å; L194-S196 PolarHBondContact O-N 3.35Å
197	L	69.5	Low	71.3	Confident	111 Å²	111	110.6 Å²	110.6	58%	0.581	56%	0.563	S	S	*	*	H	α-helix	trans	-82.9	-37.8	175.6	-67.5	172.5	0	0	0	111.9	P192 N193 L194 R195	P192-L197 HydrophobicContact CB-CD2 4.18Å; P192-L197 HydrophobicContact CB-CG 4.21Å; P192-L197 HydrophobicContact CG-CD1 4.32Å; P192-L197 HydrophobicContact CG-CD2 3.85Å; P192-L197 HydrophobicContact CG-CG 4.16Å; N193-L197 PolarHBondContact O-N 2.95Å; L194-L197 PolarHBondContact O-N 2.93Å; L194-L197 VanDerWaalsContact O-N 3.11Å; R195-L197 VanDerWaalsContact C-N 3.33Å; R195-L197 PolarHBondContact O-N 2.98Å
198	V	68.6	Low	70.9	Confident	99 Å²	99	112.3 Å²	112.3	60%	0.6	57%	0.572	S	S	*	*	H	α-helix	trans	-92.3	-32.8	-173.9	179.1	0	0	0	0	112.2	L194 N200	L194-V198 HydrophobicContact CD1-CG2 3.58Å; L194-V198 HydrophobicContact CG-CG2 3.91Å; L194-V198 WeakPolarHBondContact O-CB 3.26Å; L194-V198 WeakPolarHBondContact O-CG2 3.35Å; L194-V198 PolarHBondContact O-N 3.31Å; V198-N200 PolarHBondContact O-N 3.48Å; V198-N200 VanDerWaalsContact O-N 3.09Å
199	R	63.7	Low	70.7	Confident	129 Å²	129	116.7 Å²	116.7	49%	0.487	59%	0.593	S	S	.	*			trans	-72.5	105.9	176	-87.3	-168.7	168.1	-140.7	6.8	110.4	R195 D201	R195-R199 HydrophobicContact CG-CG 4.15Å; R195-R199 WeakPolarHBondContact O-CB 3.33Å; R195-R199 PolarHBondContact O-N 3.43Å; R199-D201 WeakPolarHBondContact CB-OD1 3.16Å; R199-D201 WeakPolarHBondContact CD-OD1 3.16Å; R199-D201 WeakPolarHBondContact CG-OD1 3.13Å; R199-D201 IonicContact CZ-OD1 3.3Å; R199-D201 IonicContact CZ-OD2 3.57Å; R199-D201 IonicContact NE-OD1 3.14Å; R199-D201 IonicContact NE-OD2 2.81Å; R199-D201 PolarHBondContact NE-OD2 2.98Å; R199-D201 IonicContact NH1-OD1 3.48Å; R199-D201 IonicContact NH1-OD2 2.66Å; R199-D201 PolarHBondContact NH1-OD2 3.48Å; R199-D201 IonicContact NH2-OD2 3.11Å
200	N	64.3	Low	70.9	Confident	134 Å²	134	115.9 Å²	115.9	72%	0.717	59%	0.586	S	S	*	*			trans	-100	3.8	158.8	-65.3	-53	0	0	0	112	V198 K202	V198-N200 PolarHBondContact O-N 3.48Å; V198-N200 VanDerWaalsContact O-N 3.09Å; N200-K202 PolarHBondContact O-N 3.02Å
201	D	71.5	Confident	71.5	Confident	98 Å²	98	115.5 Å²	115.5	52%	0.524	58%	0.581	S	S	.	*			trans	-66.6	-21.8	-175.6	68.4	-34.8	0	0	0	113.4	R199	R199-D201 WeakPolarHBondContact CB-OD1 3.16Å; R199-D201 WeakPolarHBondContact CD-OD1 3.16Å; R199-D201 WeakPolarHBondContact CG-OD1 3.13Å; R199-D201 IonicContact CZ-OD1 3.3Å; R199-D201 IonicContact CZ-OD2 3.57Å; R199-D201 IonicContact NE-OD1 3.14Å; R199-D201 IonicContact NE-OD2 2.81Å; R199-D201 PolarHBondContact NE-OD2 2.98Å; R199-D201 IonicContact NH1-OD1 3.48Å; R199-D201 IonicContact NH1-OD2 2.66Å; R199-D201 PolarHBondContact NH1-OD2 3.48Å; R199-D201 IonicContact NH2-OD2 3.11Å
202	K	65.9	Low	72.2	Confident	156 Å²	156	113.4 Å²	113.4	68%	0.678	57%	0.574	S	S	*	*	S	Bend	trans	-87.7	118.4	171.8	-65.5	-167.8	175.3	-166.3	0	109.8	N200 K204	N200-K202 PolarHBondContact O-N 3.02Å; K202-K204 PolarHBondContact O-N 3.11Å; K202-K204 VanDerWaalsContact O-N 3.11Å
203	I	70.7	Confident	73	Confident	153 Å²	153	111 Å²	111	79%	0.785	56%	0.558	S	S	*	*			trans	-56.4	117.1	169.2	-58.7	172.2	0	0	0	107.6	V205	I203-V205 PolarHBondContact O-N 3.28Å
204	K	72.3	Confident	74	Confident	186 Å²	186	111.2 Å²	111.2	81%	0.809	56%	0.562	S	S	*	*			trans	-71.6	98.2	169.8	-70.3	-179.6	-176.8	172.8	0	107.2	K202 P206	K202-K204 PolarHBondContact O-N 3.11Å; K202-K204 VanDerWaalsContact O-N 3.11Å; K204-P206 WeakPolarHBondContact O-CD 3.45Å
205	V	77	Confident	74.9	Confident	57 Å²	57	106.2 Å²	106.2	35%	0.345	54%	0.535	S	S	.	.			trans	-67.6	124.3	173.6	-173.2	0	0	0	0	108	I203 Q209 R210	I203-V205 PolarHBondContact O-N 3.28Å; V205-Q209 HydrophobicContact CG1-CB 3.5Å; V205-Q209 WeakPolarHBondContact CG1-O 3.15Å; V205-R210 HydrophobicContact CB-CG 4.48Å; V205-R210 HydrophobicContact CG1-CG 4.32Å; V205-R210 PolarHBondContact O-NE 3.03Å
206	P	80.5	Confident	75.9	Confident	60 Å²	60	101.6 Å²	101.6	39%	0.39	53%	0.526	S	S	.	.			trans	-50.2	149.5	171.6	-25.1	34.1	0	0	0	110.6	K204 E208 Q209 R210	K204-P206 WeakPolarHBondContact O-CD 3.45Å; P206-E208 WeakPolarHBondContact CB-OE2 3.44Å; P206-E208 PolarHBondContact O-N 3.35Å; P206-E208 VanDerWaalsContact O-N 3.11Å; P206-Q209 PolarHBondContact O-N 2.72Å; P206-R210 WeakPolarHBondContact O-CG 3.48Å; P206-R210 PolarHBondContact O-N 3.49Å
207	F	74.9	Confident	76.8	Confident	140 Å²	140	102 Å²	102	61%	0.614	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-54.9	-36	-175.3	177.9	-98.8	0	0	0	112	Q209 R210	F207-Q209 VanDerWaalsContact C-N 3.27Å; F207-Q209 PolarHBondContact O-N 3.11Å; F207-R210 PolarHBondContact O-N 3.34Å
208	E	76.1	Confident	77.8	Confident	132 Å²	132	102.5 Å²	102.5	62%	0.617	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-68.5	-22.9	-177.3	-53.5	73.2	-156	0	0	113.1	P206	P206-E208 WeakPolarHBondContact CB-OE2 3.44Å; P206-E208 PolarHBondContact O-N 3.35Å; P206-E208 VanDerWaalsContact O-N 3.11Å
209	Q	80.6	Confident	78.6	Confident	118 Å²	118	101.3 Å²	101.3	55%	0.551	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-105.5	6.1	-177.3	-65.9	179.3	7.5	0	0	112.7	V205 P206 F207	V205-Q209 HydrophobicContact CG1-CB 3.5Å; V205-Q209 WeakPolarHBondContact CG1-O 3.15Å; P206-Q209 PolarHBondContact O-N 2.72Å; F207-Q209 VanDerWaalsContact C-N 3.27Å; F207-Q209 PolarHBondContact O-N 3.11Å
210	R	81.5	Confident	79.7	Confident	125 Å²	125	103.5 Å²	103.5	47%	0.472	54%	0.542	S	S	.	.			trans	-72.5	132.1	180	-66.9	-179.7	-175.6	173.6	4.7	110.3	V205 P206 F207 V213	V205-R210 HydrophobicContact CB-CG 4.48Å; V205-R210 HydrophobicContact CG1-CG 4.32Å; V205-R210 PolarHBondContact O-NE 3.03Å; P206-R210 WeakPolarHBondContact O-CG 3.48Å; P206-R210 PolarHBondContact O-N 3.49Å; F207-R210 PolarHBondContact O-N 3.34Å; R210-V213 HydrophobicContact CB-CG1 4.34Å; R210-V213 WeakPolarHBondContact O-CG1 3.35Å
211	P	85.3	Confident	81	Confident	84 Å²	84	101.6 Å²	101.6	55%	0.545	54%	0.538	S	S	.	.	S	Bend	trans	-74.7	164.4	166.9	31.6	-33.4	0	0	0	110.9	G230	P211-G230 WeakPolarHBondContact CB-O 3.47Å
212	G	84.4	Confident	81.8	Confident	46 Å²	46	104.8 Å²	104.8	47%	0.474	56%	0.555	S	S	.	*	S	Bend	trans	76.1	32.2	174.1	0	0	0	0	0	113.5	T229	G212-T229 CarbonylContact C-O 3.51Å; G212-T229 WeakPolarHBondContact CA-O 3.37Å; G212-T229 PolarHBondContact N-O 3.15Å
213	V	83.3	Confident	83	Confident	29 Å²	29	99.8 Å²	99.8	18%	0.176	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.8	-179.2	-63.1	0	0	0	0	111.1	R210 T229 L233	R210-V213 HydrophobicContact CB-CG1 4.34Å; R210-V213 WeakPolarHBondContact O-CG1 3.35Å; V213-T229 HydrophobicContact CG2-CG2 3.66Å; V213-T229 PolarHBondContact N-O 3.18Å; V213-T229 PolarHBondContact O-N 3.19Å; V213-T229 VanDerWaalsContact O-N 3.09Å; V213-L233 HydrophobicContact CG2-CB 4.07Å; V213-L233 HydrophobicContact CG2-CD1 4.4Å
214	V	86	Confident	84	Confident	103 Å²	103	95.9 Å²	95.9	62%	0.624	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.7	168.1	-178.5	0	0	0	0	108	I226 G227 E228	V214-I226 HydrophobicContact CG1-CG2 3.78Å; V214-G227 CarbonylContact C-O 2.93Å; V214-G227 WeakPolarHBondContact CA-O 3.38Å; V214-E228 HydrophobicContact CG2-CB 4.4Å; V214-E228 HydrophobicContact CG2-CG 4.29Å
215	Y	83.8	Confident	84.7	Confident	25 Å²	25	92.2 Å²	92.2	10%	0.098	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	157.7	-178.7	63.9	-82.8	0	0	0	111	I217 Y225 I226 G227 T229 L233 R236 H240	Y215-I217 HydrophobicContact CD2-CD1 4.36Å; Y215-I217 HydrophobicContact CD2-CG1 4.06Å; Y215-I217 HydrophobicContact CE2-CD1 3.92Å; Y215-I217 HydrophobicContact CE2-CG1 4.11Å; Y215-Y225 HydrophobicContact CE2-CD1 4.3Å; Y215-Y225 AromaticContact CE2-CE1 3.99Å; Y215-Y225 HydrophobicContact CE2-CE1 3.99Å; Y215-I226 WeakPolarHBondContact O-CA 3.22Å; Y215-G227 VanDerWaalsContact CD1-O 3.22Å; Y215-G227 WeakPolarHBondContact CD1-O 3.37Å; Y215-G227 WeakPolarHBondContact CE1-O 3.01Å; Y215-G227 PolarHBondContact N-O 3.42Å; Y215-G227 PolarHBondContact O-N 2.88Å; Y215-T229 HydrophobicContact CD1-CG2 4.26Å; Y215-T229 HydrophobicContact CE1-CG2 4.1Å; Y215-L233 HydrophobicContact CD1-CD1 3.88Å; Y215-L233 HydrophobicContact CD2-CD1 4.32Å; Y215-L233 HydrophobicContact CG-CD1 3.67Å; Y215-R236 HydrophobicContact CE1-CG 3.7Å; Y215-R236 WeakPolarHBondContact OH-CG 3.39Å; Y215-R236 PolarHBondContact OH-NE 2.83Å; Y215-H240 AromaticContact CE2-NE2 3.8Å; Y215-H240 AromaticContact CZ-NE2 3.77Å; Y215-H240 PolarHBondContact OH-NE2 2.8Å
216	V	87.7	Confident	85.3	Confident	81 Å²	81	95.1 Å²	95.1	49%	0.491	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.2	176.6	64.5	0	0	0	0	109.9	Y225 I226	V216-Y225 CarbonylContact C-O 3.6Å; V216-Y225 VanDerWaalsContact CA-O 3.27Å; V216-Y225 WeakPolarHBondContact CA-O 3.4Å; V216-I226 HydrophobicContact CB-CG1 4.35Å; V216-I226 HydrophobicContact CG2-CG1 3.99Å
217	I	85.2	Confident	85.6	Confident	75 Å²	75	92.5 Å²	92.5	39%	0.385	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.3	171.3	-57.8	175.1	0	0	0	106.8	Y215 S224 Y225	Y215-I217 HydrophobicContact CD2-CD1 4.36Å; Y215-I217 HydrophobicContact CD2-CG1 4.06Å; Y215-I217 HydrophobicContact CE2-CD1 3.92Å; Y215-I217 HydrophobicContact CE2-CG1 4.11Å; I217-S224 CarbonylContact O-C 3.58Å; I217-S224 WeakPolarHBondContact O-CA 3.27Å; I217-Y225 HydrophobicContact CD1-CD1 4.13Å; I217-Y225 HydrophobicContact CG1-CD1 4.42Å; I217-Y225 PolarHBondContact N-O 2.93Å; I217-Y225 PolarHBondContact O-N 3.32Å
218	N	90.2	Very high	86.3	Confident	123 Å²	123	92.8 Å²	92.8	66%	0.658	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	137.8	176.9	-62.8	-26	0	0	0	109.7
219	C	85.9	Confident	86.7	Confident	73 Å²	73	87 Å²	87	49%	0.493	49%	0.485	S	S	.	.			trans	-104.7	150.2	172.6	-171	0	0	0	0	109.6	C221 N222 A223	C219-C221 PolarHBondContact O-N 2.93Å; C219-C221 VanDerWaalsContact O-N 3.12Å; C219-C221 PolarHBondContact SG-SG 3.12Å; C219-N222 PolarHBondContact O-N 2.8Å; C219-A223 HydrophobicContact CB-CB 4.4Å; C219-A223 WeakPolarHBondContact CB-O 3.36Å; C219-A223 PolarHBondContact N-O 3.09Å
220	D	87.7	Confident	87	Confident	175 Å²	175	84.3 Å²	84.3	94%	0.936	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.4	179.2	-60.5	-32.3	0	0	0	112.8	N222	D220-N222 PolarHBondContact O-N 2.87Å
221	C	89.8	Confident	87.4	Confident	95 Å²	95	82.5 Å²	82.5	64%	0.642	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	19.8	175.9	67.9	0	0	0	0	114.4	C219 A223	C219-C221 PolarHBondContact O-N 2.93Å; C219-C221 VanDerWaalsContact O-N 3.12Å; C219-C221 PolarHBondContact SG-SG 3.12Å; C221-A223 PolarHBondContact O-N 3.39Å; C221-A223 VanDerWaalsContact O-N 3.15Å; C221-A223 VanDerWaalsContact SG-CB 3.58Å
222	N	89.5	Confident	87.3	Confident	164 Å²	164	80 Å²	80	88%	0.877	47%	0.472	S	S	*	.	S	Bend	trans	61.5	16.6	-176.7	-156.8	48.1	0	0	0	113.9	C219 D220	C219-N222 PolarHBondContact O-N 2.8Å; D220-N222 PolarHBondContact O-N 2.87Å
223	A	91.4	Very high	87.4	Confident	52 Å²	52	81.8 Å²	81.8	43%	0.43	47%	0.47	S	S	.	.			trans	-95.4	153.7	170.6	0	0	0	0	0	110.2	C219 C221	C219-A223 HydrophobicContact CB-CB 4.4Å; C219-A223 WeakPolarHBondContact CB-O 3.36Å; C219-A223 PolarHBondContact N-O 3.09Å; C221-A223 PolarHBondContact O-N 3.39Å; C221-A223 VanDerWaalsContact O-N 3.15Å; C221-A223 VanDerWaalsContact SG-CB 3.58Å
224	S	90.1	Very high	87.6	Confident	71 Å²	71	86.5 Å²	86.5	50%	0.497	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.4	176.5	62.8	0	0	0	0	110.6	I217	I217-S224 CarbonylContact O-C 3.58Å; I217-S224 WeakPolarHBondContact O-CA 3.27Å
225	Y	88.2	Confident	87.8	Confident	109 Å²	109	84.5 Å²	84.5	43%	0.427	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.1	170.1	172	-98.4	0	0	0	109.5	Y215 V216 I217 H240	Y215-Y225 HydrophobicContact CE2-CD1 4.3Å; Y215-Y225 AromaticContact CE2-CE1 3.99Å; Y215-Y225 HydrophobicContact CE2-CE1 3.99Å; V216-Y225 CarbonylContact C-O 3.6Å; V216-Y225 VanDerWaalsContact CA-O 3.27Å; V216-Y225 WeakPolarHBondContact CA-O 3.4Å; I217-Y225 HydrophobicContact CD1-CD1 4.13Å; I217-Y225 HydrophobicContact CG1-CD1 4.42Å; I217-Y225 PolarHBondContact N-O 2.93Å; I217-Y225 PolarHBondContact O-N 3.32Å; Y225-H240 AromaticContact CE1-CE1 3.97Å; Y225-H240 AromaticContact CE1-NE2 3.9Å
226	I	88.5	Confident	88	Confident	117 Å²	117	86.2 Å²	86.2	60%	0.6	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.4	173.4	-58.8	172.2	0	0	0	107.7	V214 Y215 V216	V214-I226 HydrophobicContact CG1-CG2 3.78Å; Y215-I226 WeakPolarHBondContact O-CA 3.22Å; V216-I226 HydrophobicContact CB-CG1 4.35Å; V216-I226 HydrophobicContact CG2-CG1 3.99Å
227	G	88.5	Confident	88.1	Confident	6 Å²	6	87.7 Å²	87.7	6%	0.062	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.1	178.3	0	0	0	0	0	111.8	V214 Y215	V214-G227 CarbonylContact C-O 2.93Å; V214-G227 WeakPolarHBondContact CA-O 3.38Å; Y215-G227 VanDerWaalsContact CD1-O 3.22Å; Y215-G227 WeakPolarHBondContact CD1-O 3.37Å; Y215-G227 WeakPolarHBondContact CE1-O 3.01Å; Y215-G227 PolarHBondContact N-O 3.42Å; Y215-G227 PolarHBondContact O-N 2.88Å
228	E	89	Confident	88.4	Confident	146 Å²	146	88.6 Å²	88.6	68%	0.682	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	147	165.3	-174.4	179.6	167.9	0	0	108.5	V214	V214-E228 HydrophobicContact CG2-CB 4.4Å; V214-E228 HydrophobicContact CG2-CG 4.29Å
229	T	83.4	Confident	88.5	Confident	10 Å²	10	86.5 Å²	86.5	6%	0.061	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.7	171.6	178.3	0	0	0	0	111.2	G212 V213 Y215 N231 R236	G212-T229 CarbonylContact C-O 3.51Å; G212-T229 WeakPolarHBondContact CA-O 3.37Å; G212-T229 PolarHBondContact N-O 3.15Å; V213-T229 HydrophobicContact CG2-CG2 3.66Å; V213-T229 PolarHBondContact N-O 3.18Å; V213-T229 PolarHBondContact O-N 3.19Å; V213-T229 VanDerWaalsContact O-N 3.09Å; Y215-T229 HydrophobicContact CD1-CG2 4.26Å; Y215-T229 HydrophobicContact CE1-CG2 4.1Å; T229-N231 WeakPolarHBondContact CG2-O 3.35Å; T229-N231 PolarHBondContact OG1-N 3.09Å; T229-R236 HydrophobicContact CG2-CB 3.93Å; T229-R236 HydrophobicContact CG2-CG 4.23Å
230	G	88.7	Confident	88.8	Confident	62 Å²	62	85 Å²	85	64%	0.639	45%	0.453	S	S	*	.	S	Bend	trans	-74.1	-14.4	168.9	0	0	0	0	0	113.5	P211	P211-G230 WeakPolarHBondContact CB-O 3.47Å
231	N	88.1	Confident	89.1	Confident	86 Å²	86	80 Å²	80	46%	0.46	43%	0.426	S	S	.	.	S	Bend	trans	-98.4	-175.7	177.3	-72.5	-24	0	0	0	111.5	T229 D235	T229-N231 WeakPolarHBondContact CG2-O 3.35Å; T229-N231 PolarHBondContact OG1-N 3.09Å; N231-D235 HydrophobicContact CB-CB 4.23Å
232	T	85	Confident	89.3	Confident	33 Å²	33	79.9 Å²	79.9	20%	0.202	42%	0.419	C	S	.	.			trans	-66.6	154.4	171.6	76.6	0	0	0	0	110.9	F234 D235 R236	T232-F234 PolarHBondContact O-N 3.27Å; T232-D235 PolarHBondContact O-N 3.25Å; T232-D235 PolarHBondContact OG1-N 3.44Å; T232-D235 VanDerWaalsContact OG1-N 3.15Å; T232-D235 PolarHBondContact OG1-OD2 3.15Å; T232-R236 PolarHBondContact O-N 3.02Å; T232-R236 VanDerWaalsContact O-N 3.09Å
233	L	85.5	Confident	89.4	Confident	82 Å²	82	75 Å²	75	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-56.9	-36.7	174.8	-175.1	60.3	0	0	0	111.7	V213 Y215 R236 F237	V213-L233 HydrophobicContact CG2-CB 4.07Å; V213-L233 HydrophobicContact CG2-CD1 4.4Å; Y215-L233 HydrophobicContact CD1-CD1 3.88Å; Y215-L233 HydrophobicContact CD2-CD1 4.32Å; Y215-L233 HydrophobicContact CG-CD1 3.67Å; L233-R236 PolarHBondContact O-N 2.66Å; L233-F237 WeakPolarHBondContact O-CB 3.32Å; L233-F237 PolarHBondContact O-N 2.91Å
234	F	88.3	Confident	89.3	Confident	128 Å²	128	76.5 Å²	76.5	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-67.4	-42	-178.8	-172.6	-115.1	0	0	0	112.5	T232 F237 K238	T232-F234 PolarHBondContact O-N 3.27Å; F234-F237 PolarHBondContact O-N 3.49Å; F234-K238 HydrophobicContact CD1-CD 4.46Å; F234-K238 HydrophobicContact CE1-CD 4.3Å; F234-K238 VanDerWaalsContact CE1-NZ 3.25Å; F234-K238 WeakPolarHBondContact O-CG 3.15Å; F234-K238 PolarHBondContact O-N 2.99Å
235	D	89.5	Confident	89.5	Confident	62 Å²	62	79.7 Å²	79.7	33%	0.332	41%	0.406	S	S	.	.	H	α-helix	trans	-65.6	-42.6	175.8	-61.2	-41.3	0	0	0	110.7	N231 T232 F237 K238 E239	N231-D235 HydrophobicContact CB-CB 4.23Å; T232-D235 PolarHBondContact O-N 3.25Å; T232-D235 PolarHBondContact OG1-N 3.44Å; T232-D235 VanDerWaalsContact OG1-N 3.15Å; T232-D235 PolarHBondContact OG1-OD2 3.15Å; D235-F237 VanDerWaalsContact C-N 3.3Å; D235-F237 PolarHBondContact O-N 3.29Å; D235-K238 WeakPolarHBondContact O-CB 3.39Å; D235-K238 PolarHBondContact O-N 3.34Å; D235-K238 VanDerWaalsContact O-N 3.16Å; D235-E239 WeakPolarHBondContact O-CG 3.2Å; D235-E239 PolarHBondContact O-N 3.05Å
236	R	88.6	Confident	89.7	Confident	61 Å²	61	78.4 Å²	78.4	23%	0.23	41%	0.413	C	S	.	.	H	α-helix	trans	-63	-37.5	175.8	-176.1	54.8	-179.4	175	-0.3	112.8	Y215 T229 T232 L233 E239 H240	Y215-R236 HydrophobicContact CE1-CG 3.7Å; Y215-R236 WeakPolarHBondContact OH-CG 3.39Å; Y215-R236 PolarHBondContact OH-NE 2.83Å; T229-R236 HydrophobicContact CG2-CB 3.93Å; T229-R236 HydrophobicContact CG2-CG 4.23Å; T232-R236 PolarHBondContact O-N 3.02Å; T232-R236 VanDerWaalsContact O-N 3.09Å; L233-R236 PolarHBondContact O-N 2.66Å; R236-E239 WeakPolarHBondContact CD-OE2 3.34Å; R236-E239 IonicContact CZ-OE2 3.48Å; R236-E239 IonicContact NE-OE2 3.99Å; R236-E239 IonicContact NH1-OE2 3.76Å; R236-E239 PolarHBondContact NH1-OE2 3.11Å; R236-E239 WeakPolarHBondContact O-CB 3.47Å; R236-E239 PolarHBondContact O-N 3.38Å; R236-H240 PolarHBondContact NE-NE2 2.86Å; R236-H240 PolarHBondContact O-CD2 3.43Å; R236-H240 PolarHBondContact O-N 2.95Å; R236-H240 VanDerWaalsContact O-N 3.11Å
237	F	89.3	Confident	89.9	Confident	111 Å²	111	80 Å²	80	49%	0.487	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175	-177	-99	0	0	0	111.6	L233 F234 D235 E239 H240 M241	L233-F237 WeakPolarHBondContact O-CB 3.32Å; L233-F237 PolarHBondContact O-N 2.91Å; F234-F237 PolarHBondContact O-N 3.49Å; D235-F237 VanDerWaalsContact C-N 3.3Å; D235-F237 PolarHBondContact O-N 3.29Å; F237-E239 VanDerWaalsContact C-N 3.33Å; F237-E239 PolarHBondContact O-N 3.3Å; F237-H240 PolarHBondContact O-N 3.47Å; F237-M241 HydrophobicContact CD1-CG 4.03Å; F237-M241 HydrophobicContact CD2-CE 4.4Å; F237-M241 HydrophobicContact CE1-CE 4.37Å; F237-M241 HydrophobicContact CE1-CG 3.64Å; F237-M241 HydrophobicContact CE1-SD 4.27Å; F237-M241 HydrophobicContact CE2-CE 3.66Å; F237-M241 HydrophobicContact CE2-CG 4.48Å; F237-M241 HydrophobicContact CZ-CE 3.64Å; F237-M241 HydrophobicContact CZ-CG 3.89Å; F237-M241 HydrophobicContact CZ-SD 3.98Å; F237-M241 WeakPolarHBondContact O-CG 3.5Å; F237-M241 PolarHBondContact O-N 3.16Å
238	K	92.1	Very high	90	Very high	95 Å²	95	87.1 Å²	87.1	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-42.3	173.5	-73.1	173.8	178.3	167.7	0	112.2	F234 D235 H240 M241 N242	F234-K238 HydrophobicContact CD1-CD 4.46Å; F234-K238 HydrophobicContact CE1-CD 4.3Å; F234-K238 VanDerWaalsContact CE1-NZ 3.25Å; F234-K238 WeakPolarHBondContact O-CG 3.15Å; F234-K238 PolarHBondContact O-N 2.99Å; D235-K238 WeakPolarHBondContact O-CB 3.39Å; D235-K238 PolarHBondContact O-N 3.34Å; D235-K238 VanDerWaalsContact O-N 3.16Å; K238-H240 PolarHBondContact O-N 3Å; K238-M241 PolarHBondContact O-N 2.76Å; K238-N242 WeakPolarHBondContact O-CB 3.41Å; K238-N242 PolarHBondContact O-N 3.38Å; K238-N242 PolarHBondContact O-ND2 3.35Å
239	E	92.4	Very high	90.1	Very high	79 Å²	79	83 Å²	83	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-57.7	-47.8	175.8	-69.9	168.2	-166.3	0	0	111.3	D235 R236 F237 N242 A243	D235-E239 WeakPolarHBondContact O-CG 3.2Å; D235-E239 PolarHBondContact O-N 3.05Å; R236-E239 WeakPolarHBondContact CD-OE2 3.34Å; R236-E239 IonicContact CZ-OE2 3.48Å; R236-E239 IonicContact NE-OE2 3.99Å; R236-E239 IonicContact NH1-OE2 3.76Å; R236-E239 PolarHBondContact NH1-OE2 3.11Å; R236-E239 WeakPolarHBondContact O-CB 3.47Å; R236-E239 PolarHBondContact O-N 3.38Å; F237-E239 VanDerWaalsContact C-N 3.33Å; F237-E239 PolarHBondContact O-N 3.3Å; E239-N242 PolarHBondContact O-N 3.22Å; E239-A243 WeakPolarHBondContact O-CB 3.36Å; E239-A243 PolarHBondContact O-N 3.43Å
240	H	92	Very high	90.5	Very high	40 Å²	40	85 Å²	85	19%	0.185	44%	0.443	C	S	.	.	H	α-helix	trans	-59.8	-46.7	175.6	-80.9	-57.6	0	0	0	112.2	Y215 Y225 R236 F237 K238 N242 A243 L244	Y215-H240 AromaticContact CE2-NE2 3.8Å; Y215-H240 AromaticContact CZ-NE2 3.77Å; Y215-H240 PolarHBondContact OH-NE2 2.8Å; Y225-H240 AromaticContact CE1-CE1 3.97Å; Y225-H240 AromaticContact CE1-NE2 3.9Å; R236-H240 PolarHBondContact NE-NE2 2.86Å; R236-H240 PolarHBondContact O-CD2 3.43Å; R236-H240 PolarHBondContact O-N 2.95Å; R236-H240 VanDerWaalsContact O-N 3.11Å; F237-H240 PolarHBondContact O-N 3.47Å; K238-H240 PolarHBondContact O-N 3Å; H240-N242 VanDerWaalsContact C-N 3.32Å; H240-N242 PolarHBondContact O-N 3Å; H240-A243 PolarHBondContact O-N 3.46Å; H240-L244 WeakPolarHBondContact O-CG 3.36Å; H240-L244 PolarHBondContact O-N 2.96Å
241	M	93	Very high	90.6	Very high	72 Å²	72	86.1 Å²	86.1	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-63.6	-37.6	178.8	-68.8	-63.6	120.4	0	0	112.4	F237 K238 L244 K245	F237-M241 HydrophobicContact CD1-CG 4.03Å; F237-M241 HydrophobicContact CD2-CE 4.4Å; F237-M241 HydrophobicContact CE1-CE 4.37Å; F237-M241 HydrophobicContact CE1-CG 3.64Å; F237-M241 HydrophobicContact CE1-SD 4.27Å; F237-M241 HydrophobicContact CE2-CE 3.66Å; F237-M241 HydrophobicContact CE2-CG 4.48Å; F237-M241 HydrophobicContact CZ-CE 3.64Å; F237-M241 HydrophobicContact CZ-CG 3.89Å; F237-M241 HydrophobicContact CZ-SD 3.98Å; F237-M241 WeakPolarHBondContact O-CG 3.5Å; F237-M241 PolarHBondContact O-N 3.16Å; K238-M241 PolarHBondContact O-N 2.76Å; M241-L244 HydrophobicContact CE-CD1 3.88Å; M241-L244 PolarHBondContact O-N 3.29Å; M241-L244 HydrophobicContact SD-CD1 4.42Å; M241-K245 WeakPolarHBondContact O-CG 3.46Å; M241-K245 PolarHBondContact O-N 3.42Å
242	N	94.1	Very high	90.8	Very high	92 Å²	92	87 Å²	87	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-67.4	-42.7	176	-71.7	-15.8	0	0	0	111.3	K238 E239 H240 L244 K245 S246	K238-N242 WeakPolarHBondContact O-CB 3.41Å; K238-N242 PolarHBondContact O-N 3.38Å; K238-N242 PolarHBondContact O-ND2 3.35Å; E239-N242 PolarHBondContact O-N 3.22Å; H240-N242 VanDerWaalsContact C-N 3.32Å; H240-N242 PolarHBondContact O-N 3Å; N242-L244 VanDerWaalsContact C-N 3.32Å; N242-L244 PolarHBondContact O-N 2.95Å; N242-K245 PolarHBondContact O-N 3.32Å; N242-S246 PolarHBondContact O-N 2.98Å; N242-S246 PolarHBondContact O-OG 3.39Å
243	A	91.6	Very high	91.1	Very high	61 Å²	61	92 Å²	92	50%	0.504	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.1	0	0	0	0	0	111.9	E239 H240 S246 Y247	E239-A243 WeakPolarHBondContact O-CB 3.36Å; E239-A243 PolarHBondContact O-N 3.43Å; H240-A243 PolarHBondContact O-N 3.46Å; A243-S246 PolarHBondContact O-N 3.22Å; A243-Y247 WeakPolarHBondContact O-CB 3.45Å; A243-Y247 PolarHBondContact O-N 3.2Å
244	L	90.4	Very high	91.3	Very high	84 Å²	84	94.6 Å²	94.6	44%	0.44	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-40.8	175.1	-71	175.2	0	0	0	112.5	H240 M241 N242 Y247 R248	H240-L244 WeakPolarHBondContact O-CG 3.36Å; H240-L244 PolarHBondContact O-N 2.96Å; M241-L244 HydrophobicContact CE-CD1 3.88Å; M241-L244 PolarHBondContact O-N 3.29Å; M241-L244 HydrophobicContact SD-CD1 4.42Å; N242-L244 VanDerWaalsContact C-N 3.32Å; N242-L244 PolarHBondContact O-N 2.95Å; L244-Y247 PolarHBondContact O-N 3.22Å; L244-R248 WeakPolarHBondContact O-CG 3.48Å; L244-R248 PolarHBondContact O-N 2.95Å
245	K	93.3	Very high	91.3	Very high	137 Å²	137	94.1 Å²	94.1	60%	0.596	47%	0.467	S	S	*	.	H	α-helix	trans	-61.9	-47.8	175	-75.6	176.5	179.4	-176.4	0	111.3	M241 N242 Y247 R248 S249	M241-K245 WeakPolarHBondContact O-CG 3.46Å; M241-K245 PolarHBondContact O-N 3.42Å; N242-K245 PolarHBondContact O-N 3.32Å; K245-Y247 VanDerWaalsContact C-N 3.29Å; K245-Y247 PolarHBondContact O-N 3.24Å; K245-R248 PolarHBondContact O-N 3.39Å; K245-S249 PolarHBondContact O-N 2.96Å; K245-S249 PolarHBondContact O-OG 3.1Å
246	S	93.1	Very high	90.9	Very high	83 Å²	83	93.5 Å²	93.5	58%	0.58	48%	0.475	S	S	*	.	H	α-helix	trans	-60	-39.6	177.1	-63.1	0	0	0	0	112.3	N242 A243 A250	N242-S246 PolarHBondContact O-N 2.98Å; N242-S246 PolarHBondContact O-OG 3.39Å; A243-S246 PolarHBondContact O-N 3.22Å; S246-A250 WeakPolarHBondContact O-CB 3.36Å; S246-A250 PolarHBondContact O-N 2.92Å; S246-A250 VanDerWaalsContact O-N 3.1Å
247	Y	91.9	Very high	89.9	Confident	151 Å²	151	96.3 Å²	96.3	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-47.4	175	-179.5	-95.1	0	0	0	112.2	A243 L244 K245 S249 A250 E251	A243-Y247 WeakPolarHBondContact O-CB 3.45Å; A243-Y247 PolarHBondContact O-N 3.2Å; L244-Y247 PolarHBondContact O-N 3.22Å; K245-Y247 VanDerWaalsContact C-N 3.29Å; K245-Y247 PolarHBondContact O-N 3.24Å; Y247-S249 PolarHBondContact O-N 3.48Å; Y247-A250 PolarHBondContact O-N 3.24Å; Y247-E251 WeakPolarHBondContact O-CB 3.47Å; Y247-E251 PolarHBondContact O-N 2.87Å
248	R	90.5	Very high	88.5	Confident	155 Å²	155	103.5 Å²	103.5	59%	0.585	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-43.6	178.5	-72.4	178.3	-172.1	-168.7	1	112.3	L244 K245 A250 E251 E252	L244-R248 WeakPolarHBondContact O-CG 3.48Å; L244-R248 PolarHBondContact O-N 2.95Å; K245-R248 PolarHBondContact O-N 3.39Å; R248-A250 VanDerWaalsContact C-N 3.33Å; R248-A250 PolarHBondContact O-N 3.42Å; R248-E251 WeakPolarHBondContact O-CB 3.47Å; R248-E251 PolarHBondContact O-N 3.46Å; R248-E252 WeakPolarHBondContact O-CG 3.33Å; R248-E252 PolarHBondContact O-N 2.97Å
249	S	91.5	Very high	88.3	Confident	59 Å²	59	104 Å²	104	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-40	176.5	-60.6	0	0	0	0	112.1	K245 Y247 E251 E252 E253	K245-S249 PolarHBondContact O-N 2.96Å; K245-S249 PolarHBondContact O-OG 3.1Å; Y247-S249 PolarHBondContact O-N 3.48Å; S249-E251 VanDerWaalsContact C-N 3.34Å; S249-E252 PolarHBondContact O-N 2.94Å; S249-E253 WeakPolarHBondContact O-CG 3.4Å; S249-E253 PolarHBondContact O-N 3.35Å
250	A	91.8	Very high	88.1	Confident	53 Å²	53	105.3 Å²	105.3	44%	0.438	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-34.4	175	0	0	0	0	0	112.8	S246 Y247 R248 L254	S246-A250 WeakPolarHBondContact O-CB 3.36Å; S246-A250 PolarHBondContact O-N 2.92Å; S246-A250 VanDerWaalsContact O-N 3.1Å; Y247-A250 PolarHBondContact O-N 3.24Å; R248-A250 VanDerWaalsContact C-N 3.33Å; R248-A250 PolarHBondContact O-N 3.42Å; A250-L254 WeakPolarHBondContact O-CB 3.37Å; A250-L254 PolarHBondContact O-N 3.22Å
251	E	91.1	Very high	87.9	Confident	85 Å²	85	108.9 Å²	108.9	40%	0.397	55%	0.552	S	S	.	*	H	α-helix	trans	-68.2	-43.8	174.8	-177.6	175.8	-142.3	0	0	111.6	Y247 R248 S249 L254 H255	Y247-E251 WeakPolarHBondContact O-CB 3.47Å; Y247-E251 PolarHBondContact O-N 2.87Å; R248-E251 WeakPolarHBondContact O-CB 3.47Å; R248-E251 PolarHBondContact O-N 3.46Å; S249-E251 VanDerWaalsContact C-N 3.34Å; E251-L254 PolarHBondContact O-N 3.23Å; E251-H255 PolarHBondContact O-CD2 3.39Å; E251-H255 VanDerWaalsContact O-CD2 3.22Å; E251-H255 PolarHBondContact O-N 3.45Å
252	E	91.4	Very high	87.6	Confident	104 Å²	104	111.1 Å²	111.1	49%	0.486	56%	0.564	S	S	.	*	H	α-helix	trans	-60.1	-44.6	174	-72.9	165.4	178.1	0	0	111.6	R248 S249 L254 H255 G256 I257	R248-E252 WeakPolarHBondContact O-CG 3.33Å; R248-E252 PolarHBondContact O-N 2.97Å; S249-E252 PolarHBondContact O-N 2.94Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.05Å; E252-H255 PolarHBondContact O-N 3.45Å; E252-G256 PolarHBondContact O-N 3.28Å; E252-I257 PolarHBondContact O-N 2.94Å
253	E	91.5	Very high	87.2	Confident	137 Å²	137	112.3 Å²	112.3	64%	0.64	57%	0.568	S	S	*	*	H	α-helix	trans	-61	-39.1	174.1	-76.9	177.6	-175.8	0	0	112.5	S249	S249-E253 WeakPolarHBondContact O-CG 3.4Å; S249-E253 PolarHBondContact O-N 3.35Å
254	L	89.4	Confident	86.9	Confident	138 Å²	138	115.7 Å²	115.7	72%	0.723	57%	0.572	S	S	*	*	H	α-helix	trans	-71.1	-36.7	178.7	-172.2	122.1	0	0	0	112.4	A250 E251 E252	A250-L254 WeakPolarHBondContact O-CB 3.37Å; A250-L254 PolarHBondContact O-N 3.22Å; E251-L254 PolarHBondContact O-N 3.23Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.05Å
255	H	89.6	Confident	86.6	Confident	118 Å²	118	117.9 Å²	117.9	55%	0.546	58%	0.582	S	S	.	*	H	α-helix	trans	-87.3	-6.7	179.5	-72.7	-64.7	0	0	0	114	E251 E252 I257	E251-H255 PolarHBondContact O-CD2 3.39Å; E251-H255 VanDerWaalsContact O-CD2 3.22Å; E251-H255 PolarHBondContact O-N 3.45Å; E252-H255 PolarHBondContact O-N 3.45Å; H255-I257 VanDerWaalsContact C-N 3.26Å; H255-I257 HydrophobicContact CB-CD1 3.95Å; H255-I257 HydrophobicContact CB-CG1 4.01Å; H255-I257 PolarHBondContact O-N 3.01Å
256	G	81.2	Confident	86.1	Confident	49 Å²	49	116.5 Å²	116.5	51%	0.505	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.3	26.5	178.1	0	0	0	0	0	113.8	E252	E252-G256 PolarHBondContact O-N 3.28Å
257	I	66.2	Low	85.5	Confident	120 Å²	120	119.3 Å²	119.3	62%	0.615	58%	0.581	S	S	*	*			trans	-96.3	100.8	-179.9	-53.8	173.8	0	0	0	107	E252 H255	E252-I257 PolarHBondContact O-N 2.94Å; H255-I257 VanDerWaalsContact C-N 3.26Å; H255-I257 HydrophobicContact CB-CD1 3.95Å; H255-I257 HydrophobicContact CB-CG1 4.01Å; H255-I257 PolarHBondContact O-N 3.01Å
258	Y	60.1	Low	84.9	Confident	262 Å²	262	116.4 Å²	116.4	100%	1.027	58%	0.58	S	S	*	*			trans	-104	0	170.5	-59.6	-79.2	0	0	0	110.7

Retrieved 258 of 258 residues in 101.7 ms (Link to these results)

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