A0A077ZKS7_TRITR Loading...

TRP channel protein nanchung

AlphaFold DB , UniProt , Accession A0A077ZKS7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.9	Very low	31.2	Very low	257 Å²	257	110 Å²	110	100%	1.266	65%	0.653	S	S	*	*				0	115.6	0	-72.1	-174.7	-179.1	0	0	108.1
2	G	31.3	Very low	31.5	Very low	61 Å²	61	107.3 Å²	107.3	63%	0.629	64%	0.639	S	S	*	*			trans	-172.5	52.4	-175.6	0	0	0	0	0	112.3	T4	G2-T4 PolarHBondContact O-N 3.35Å
3	N	28.3	Very low	32.3	Very low	175 Å²	175	101.9 Å²	101.9	94%	0.936	61%	0.605	S	S	*	*			trans	-76.4	68	160.5	-87.9	-1.4	0	0	0	108.3	Q5	N3-Q5 PolarHBondContact O-N 3.09Å
4	T	27.8	Very low	33.1	Very low	102 Å²	102	100.1 Å²	100.1	63%	0.626	59%	0.59	S	S	*	*			trans	-91.3	95.3	172.7	29.3	0	0	0	0	109.5	G2	G2-T4 PolarHBondContact O-N 3.35Å
5	Q	30.1	Very low	33.8	Very low	146 Å²	146	97.1 Å²	97.1	68%	0.682	57%	0.573	S	S	*	*			trans	39.2	83.8	157.6	-63	-179.3	1	0	0	115.2	N3 T7 S8	N3-Q5 PolarHBondContact O-N 3.09Å; Q5-T7 PolarHBondContact O-N 3.45Å; Q5-S8 PolarHBondContact O-N 3.14Å
6	T	36.4	Very low	34.7	Very low	126 Å²	126	95.9 Å²	95.9	77%	0.773	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-11.6	168.3	39.9	0	0	0	0	114.5
7	T	33.1	Very low	35.5	Very low	81 Å²	81	90.5 Å²	90.5	50%	0.497	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-38.8	-178.7	48	0	0	0	0	112.9	Q5 A9 T11	Q5-T7 PolarHBondContact O-N 3.45Å; T7-A9 PolarHBondContact O-N 3.16Å; T7-T11 WeakPolarHBondContact O-CA 3.4Å; T7-T11 WeakPolarHBondContact O-CB 3.29Å; T7-T11 PolarHBondContact O-N 3.46Å; T7-T11 PolarHBondContact O-OG1 2.76Å
8	S	30.7	Very low	36.3	Very low	69 Å²	69	89.4 Å²	89.4	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-49	-159.9	66.3	0	0	0	0	115.5	Q5 T12	Q5-S8 PolarHBondContact O-N 3.14Å; S8-T12 WeakPolarHBondContact O-CB 3.46Å; S8-T12 VanDerWaalsContact O-CG2 3.27Å; S8-T12 WeakPolarHBondContact O-CG2 3.46Å; S8-T12 PolarHBondContact O-N 3.31Å; S8-T12 PolarHBondContact O-OG1 3.08Å
9	A	30.9	Very low	37.1	Very low	53 Å²	53	91.5 Å²	91.5	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-76.7	-46.4	-174.9	0	0	0	0	0	113.6	T7 T11 T12 N13	T7-A9 PolarHBondContact O-N 3.16Å; A9-T11 VanDerWaalsContact C-N 3.29Å; A9-T11 PolarHBondContact O-N 3.28Å; A9-T12 VanDerWaalsContact CA-OG1 3.24Å; A9-T12 WeakPolarHBondContact CA-OG1 3.35Å; A9-T12 PolarHBondContact O-N 3.19Å; A9-T12 PolarHBondContact O-OG1 2.83Å; A9-N13 PolarHBondContact O-N 3.17Å; A9-N13 VanDerWaalsContact O-N 3.1Å
10	T	34.9	Very low	37.9	Very low	75 Å²	75	90.2 Å²	90.2	46%	0.46	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-42	174.3	-44.3	0	0	0	0	109.8	L14	T10-L14 HydrophobicContact CG2-CD1 3.89Å; T10-L14 WeakPolarHBondContact O-CB 3.38Å; T10-L14 WeakPolarHBondContact O-CD1 3.22Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.5Å
11	T	31.7	Very low	38.4	Very low	65 Å²	65	86.4 Å²	86.4	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-68.3	-38.6	174.6	-51.6	0	0	0	0	110.8	T7 A9 N13 V15	T7-T11 WeakPolarHBondContact O-CA 3.4Å; T7-T11 WeakPolarHBondContact O-CB 3.29Å; T7-T11 PolarHBondContact O-N 3.46Å; T7-T11 PolarHBondContact O-OG1 2.76Å; A9-T11 VanDerWaalsContact C-N 3.29Å; A9-T11 PolarHBondContact O-N 3.28Å; T11-N13 PolarHBondContact O-N 3.48Å; T11-V15 HydrophobicContact CG2-CG2 3.74Å; T11-V15 WeakPolarHBondContact O-CA 3.36Å; T11-V15 WeakPolarHBondContact O-CB 3.33Å; T11-V15 WeakPolarHBondContact O-CG2 3.39Å; T11-V15 PolarHBondContact O-N 3.09Å
12	T	34.8	Very low	39.5	Very low	78 Å²	78	79.7 Å²	79.7	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-40.4	179	40.5	0	0	0	0	113	S8 A9 V15 I16	S8-T12 WeakPolarHBondContact O-CB 3.46Å; S8-T12 VanDerWaalsContact O-CG2 3.27Å; S8-T12 WeakPolarHBondContact O-CG2 3.46Å; S8-T12 PolarHBondContact O-N 3.31Å; S8-T12 PolarHBondContact O-OG1 3.08Å; A9-T12 VanDerWaalsContact CA-OG1 3.24Å; A9-T12 WeakPolarHBondContact CA-OG1 3.35Å; A9-T12 PolarHBondContact O-N 3.19Å; A9-T12 PolarHBondContact O-OG1 2.83Å; T12-V15 CarbonylContact O-C 3.38Å; T12-V15 WeakPolarHBondContact O-CB 3.38Å; T12-V15 PolarHBondContact O-N 3.09Å; T12-I16 WeakPolarHBondContact O-CG1 3.35Å; T12-I16 PolarHBondContact O-N 3.14Å
13	N	41.4	Very low	40.6	Very low	37 Å²	37	84.4 Å²	84.4	20%	0.198	46%	0.461	C	S	.	.	H	α-helix	trans	-80.1	-37	180	-77.1	6.1	0	0	0	112.5	A9 T11 V15 I16 G17 F233	A9-N13 PolarHBondContact O-N 3.17Å; A9-N13 VanDerWaalsContact O-N 3.1Å; T11-N13 PolarHBondContact O-N 3.48Å; N13-V15 PolarHBondContact O-N 2.98Å; N13-I16 PolarHBondContact O-N 3.22Å; N13-G17 PolarHBondContact O-N 3.43Å; N13-F233 WeakPolarHBondContact ND2-CD2 3.41Å
14	L	44.7	Very low	41.8	Very low	76 Å²	76	78.6 Å²	78.6	40%	0.398	43%	0.433	S	S	.	.	H	α-helix	trans	-58.7	-38.2	164	-79.6	163.6	0	0	0	110.6	T10 G17 I18	T10-L14 HydrophobicContact CG2-CD1 3.89Å; T10-L14 WeakPolarHBondContact O-CB 3.38Å; T10-L14 WeakPolarHBondContact O-CD1 3.22Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.5Å; L14-G17 CarbonylContact O-C 3.57Å; L14-G17 PolarHBondContact O-N 3.1Å; L14-I18 HydrophobicContact CB-CD1 4.35Å; L14-I18 VanDerWaalsContact O-CB 3.25Å; L14-I18 WeakPolarHBondContact O-CB 3.45Å; L14-I18 WeakPolarHBondContact O-CD1 3.39Å; L14-I18 WeakPolarHBondContact O-CG1 3.1Å; L14-I18 PolarHBondContact O-N 2.82Å
15	V	43.1	Very low	42.9	Very low	55 Å²	55	79.7 Å²	79.7	33%	0.333	43%	0.431	S	S	.	.	H	α-helix	trans	-68.5	-34.8	177.4	164.2	0	0	0	0	111.5	T11 T12 N13 I18 K19	T11-V15 HydrophobicContact CG2-CG2 3.74Å; T11-V15 WeakPolarHBondContact O-CA 3.36Å; T11-V15 WeakPolarHBondContact O-CB 3.33Å; T11-V15 WeakPolarHBondContact O-CG2 3.39Å; T11-V15 PolarHBondContact O-N 3.09Å; T12-V15 CarbonylContact O-C 3.38Å; T12-V15 WeakPolarHBondContact O-CB 3.38Å; T12-V15 PolarHBondContact O-N 3.09Å; N13-V15 PolarHBondContact O-N 2.98Å; V15-I18 PolarHBondContact O-N 3.32Å; V15-K19 HydrophobicContact CG1-CD 4.26Å; V15-K19 HydrophobicContact CG1-CG 4.32Å; V15-K19 VanDerWaalsContact O-CB 3.23Å; V15-K19 WeakPolarHBondContact O-CB 3.13Å; V15-K19 WeakPolarHBondContact O-CG 3.24Å; V15-K19 PolarHBondContact O-N 2.72Å
16	I	48	Very low	44.2	Very low	79 Å²	79	79.1 Å²	79.1	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-66.4	-45.4	172	-68.4	163.2	0	0	0	109.8	T12 N13 I18 K19 R20	T12-I16 WeakPolarHBondContact O-CG1 3.35Å; T12-I16 PolarHBondContact O-N 3.14Å; N13-I16 PolarHBondContact O-N 3.22Å; I16-I18 VanDerWaalsContact C-N 3.35Å; I16-I18 PolarHBondContact O-N 2.76Å; I16-K19 PolarHBondContact O-N 3.06Å; I16-R20 HydrophobicContact CG2-CG 4.48Å; I16-R20 WeakPolarHBondContact O-CB 3.34Å; I16-R20 WeakPolarHBondContact O-CG 3.36Å; I16-R20 PolarHBondContact O-N 3.39Å
17	G	48.8	Very low	46	Very low	4 Å²	4	74.8 Å²	74.8	4%	0.041	41%	0.408	C	S	.	.	H	α-helix	trans	-59.2	-44.1	173.4	0	0	0	0	0	112.3	N13 L14 S21	N13-G17 PolarHBondContact O-N 3.43Å; L14-G17 CarbonylContact O-C 3.57Å; L14-G17 PolarHBondContact O-N 3.1Å; G17-S21 WeakPolarHBondContact O-CB 3.3Å; G17-S21 PolarHBondContact O-N 2.59Å; G17-S21 PolarHBondContact O-OG 3.05Å
18	I	50.3	Low	48.5	Very low	70 Å²	70	77.5 Å²	77.5	36%	0.359	41%	0.413	S	S	.	.	H	α-helix	trans	-68.5	-37.4	177.7	-69	161.7	0	0	0	111.3	L14 V15 I16 S21 Q22	L14-I18 HydrophobicContact CB-CD1 4.35Å; L14-I18 VanDerWaalsContact O-CB 3.25Å; L14-I18 WeakPolarHBondContact O-CB 3.45Å; L14-I18 WeakPolarHBondContact O-CD1 3.39Å; L14-I18 WeakPolarHBondContact O-CG1 3.1Å; L14-I18 PolarHBondContact O-N 2.82Å; V15-I18 PolarHBondContact O-N 3.32Å; I16-I18 VanDerWaalsContact C-N 3.35Å; I16-I18 PolarHBondContact O-N 2.76Å; I18-S21 VanDerWaalsContact CA-OG 3.3Å; I18-S21 WeakPolarHBondContact CA-OG 3.49Å; I18-S21 PolarHBondContact O-N 3.47Å; I18-S21 PolarHBondContact O-OG 2.84Å; I18-Q22 HydrophobicContact CG2-CG 4.48Å; I18-Q22 WeakPolarHBondContact O-CB 3.37Å; I18-Q22 VanDerWaalsContact O-CG 3.23Å; I18-Q22 WeakPolarHBondContact O-CG 3.25Å; I18-Q22 PolarHBondContact O-N 2.67Å
19	K	51.6	Low	51.3	Low	129 Å²	129	74.2 Å²	74.2	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-68.4	-48.1	175.3	-85.4	-175.8	174.1	-176.1	0	111.1	V15 I16 S21 Q22 E23	V15-K19 HydrophobicContact CG1-CD 4.26Å; V15-K19 HydrophobicContact CG1-CG 4.32Å; V15-K19 VanDerWaalsContact O-CB 3.23Å; V15-K19 WeakPolarHBondContact O-CB 3.13Å; V15-K19 WeakPolarHBondContact O-CG 3.24Å; V15-K19 PolarHBondContact O-N 2.72Å; I16-K19 PolarHBondContact O-N 3.06Å; K19-S21 PolarHBondContact O-N 3.42Å; K19-Q22 WeakPolarHBondContact O-CB 3.23Å; K19-Q22 PolarHBondContact O-N 2.98Å; K19-E23 WeakPolarHBondContact O-CG 3.32Å; K19-E23 PolarHBondContact O-N 3.22Å
20	R	52.7	Low	54.1	Low	65 Å²	65	72.5 Å²	72.5	25%	0.245	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-32.1	174.7	-72.5	-176.4	175.2	-177.4	0.2	111.6	I16 E23 C24 E90 A156	I16-R20 HydrophobicContact CG2-CG 4.48Å; I16-R20 WeakPolarHBondContact O-CB 3.34Å; I16-R20 WeakPolarHBondContact O-CG 3.36Å; I16-R20 PolarHBondContact O-N 3.39Å; R20-E23 WeakPolarHBondContact O-CB 3.08Å; R20-E23 PolarHBondContact O-N 3.44Å; R20-C24 WeakPolarHBondContact O-CB 3.49Å; R20-C24 PolarHBondContact O-N 3.06Å; R20-C24 PolarHBondContact O-SG 3.41Å; R20-C24 VanDerWaalsContact O-SG 3.34Å; R20-E90 IonicContact CZ-OE1 3.24Å; R20-E90 IonicContact NH1-OE1 2.79Å; R20-E90 PolarHBondContact NH1-OE1 3.38Å; R20-E90 IonicContact NH2-OE1 3.94Å; R20-A156 HydrophobicContact CB-CB 3.98Å
21	S	47.8	Very low	56.7	Low	11 Å²	11	75.4 Å²	75.4	8%	0.077	38%	0.375	C	S	.	.	H	α-helix	trans	-77.5	-31.7	174.6	77.5	0	0	0	0	113.5	G17 I18 K19 E23 C24 Q25	G17-S21 WeakPolarHBondContact O-CB 3.3Å; G17-S21 PolarHBondContact O-N 2.59Å; G17-S21 PolarHBondContact O-OG 3.05Å; I18-S21 VanDerWaalsContact CA-OG 3.3Å; I18-S21 WeakPolarHBondContact CA-OG 3.49Å; I18-S21 PolarHBondContact O-N 3.47Å; I18-S21 PolarHBondContact O-OG 2.84Å; K19-S21 PolarHBondContact O-N 3.42Å; S21-E23 VanDerWaalsContact C-N 3.28Å; S21-C24 CarbonylContact O-C 3.17Å; S21-C24 WeakPolarHBondContact O-CA 3.3Å; S21-C24 PolarHBondContact O-N 3.17Å; S21-Q25 WeakPolarHBondContact O-CG 3.23Å; S21-Q25 PolarHBondContact O-N 3.35Å
22	Q	51.2	Low	59.5	Low	116 Å²	116	72.7 Å²	72.7	54%	0.542	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-42.5	168.2	-81.4	175	0.6	0	0	110.4	I18 K19 C24 Q25	I18-Q22 HydrophobicContact CG2-CG 4.48Å; I18-Q22 WeakPolarHBondContact O-CB 3.37Å; I18-Q22 VanDerWaalsContact O-CG 3.23Å; I18-Q22 WeakPolarHBondContact O-CG 3.25Å; I18-Q22 PolarHBondContact O-N 2.67Å; K19-Q22 WeakPolarHBondContact O-CB 3.23Å; K19-Q22 PolarHBondContact O-N 2.98Å; Q22-C24 VanDerWaalsContact C-N 3.27Å; Q22-C24 PolarHBondContact O-N 3.12Å; Q22-Q25 PolarHBondContact O-N 2.91Å
23	E	53.6	Low	62.2	Low	160 Å²	160	69 Å²	69	75%	0.748	34%	0.335	S	S	*	.	H	α-helix	trans	-64.4	-32.9	171.1	-68.8	172.1	178.8	0	0	112	K19 R20 S21	K19-E23 WeakPolarHBondContact O-CG 3.32Å; K19-E23 PolarHBondContact O-N 3.22Å; R20-E23 WeakPolarHBondContact O-CB 3.08Å; R20-E23 PolarHBondContact O-N 3.44Å; S21-E23 VanDerWaalsContact C-N 3.28Å
24	C	53.4	Low	64.2	Low	53 Å²	53	69.2 Å²	69.2	36%	0.358	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	19.3	179.2	-67.9	0	0	0	0	115.3	R20 S21 Q22 N26 S27 Y30	R20-C24 WeakPolarHBondContact O-CB 3.49Å; R20-C24 PolarHBondContact O-N 3.06Å; R20-C24 PolarHBondContact O-SG 3.41Å; R20-C24 VanDerWaalsContact O-SG 3.34Å; S21-C24 CarbonylContact O-C 3.17Å; S21-C24 WeakPolarHBondContact O-CA 3.3Å; S21-C24 PolarHBondContact O-N 3.17Å; Q22-C24 VanDerWaalsContact C-N 3.27Å; Q22-C24 PolarHBondContact O-N 3.12Å; C24-N26 PolarHBondContact O-N 3.1Å; C24-S27 WeakPolarHBondContact O-CB 3.13Å; C24-S27 PolarHBondContact O-N 3.15Å; C24-Y30 HydrophobicContact CB-CE2 4.21Å
25	Q	52	Low	65.8	Low	125 Å²	125	68.3 Å²	68.3	58%	0.584	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.9	180	-82.9	-173.7	8.5	0	0	113	S21 Q22 S27	S21-Q25 WeakPolarHBondContact O-CG 3.23Å; S21-Q25 PolarHBondContact O-N 3.35Å; Q22-Q25 PolarHBondContact O-N 2.91Å; Q25-S27 VanDerWaalsContact C-N 3.28Å; Q25-S27 PolarHBondContact O-N 2.75Å
26	N	57.1	Low	67.6	Low	135 Å²	135	74.1 Å²	74.1	72%	0.722	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-2.9	172.3	-77.3	-25.8	0	0	0	114.6	C24 K28	C24-N26 PolarHBondContact O-N 3.1Å; N26-K28 PolarHBondContact O-N 3.21Å
27	S	74.4	Confident	69.1	Low	34 Å²	34	70.8 Å²	70.8	24%	0.238	33%	0.334	C	S	.	.			trans	-64.6	128	175.8	-178.7	0	0	0	0	109.7	C24 Q25 L29 Y30	C24-S27 WeakPolarHBondContact O-CB 3.13Å; C24-S27 PolarHBondContact O-N 3.15Å; Q25-S27 VanDerWaalsContact C-N 3.28Å; Q25-S27 PolarHBondContact O-N 2.75Å; S27-L29 PolarHBondContact O-N 3.44Å; S27-L29 VanDerWaalsContact O-N 3.14Å; S27-Y30 PolarHBondContact O-N 2.88Å
28	K	86.1	Confident	70.9	Confident	138 Å²	138	74.6 Å²	74.6	60%	0.6	35%	0.351	S	S	*	.	H	α-helix	trans	-58.2	-28.5	-179.6	-61.2	177.8	-179.2	174.5	0	111.9	N26 R31 F68	N26-K28 PolarHBondContact O-N 3.21Å; K28-R31 PolarHBondContact O-N 2.81Å; K28-F68 HydrophobicContact CB-CE1 3.89Å; K28-F68 HydrophobicContact CB-CZ 3.67Å
29	L	89.7	Confident	72.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.7	-49.2	176.9	174.8	58	0	0	0	112.1	S27 R31 L32 I33 F68 W149 G155 L161 I164	S27-L29 PolarHBondContact O-N 3.44Å; S27-L29 VanDerWaalsContact O-N 3.14Å; L29-R31 PolarHBondContact O-N 3.42Å; L29-L32 WeakPolarHBondContact O-CB 3.21Å; L29-L32 PolarHBondContact O-N 2.67Å; L29-I33 PolarHBondContact O-N 2.78Å; L29-F68 HydrophobicContact CB-CE1 4.33Å; L29-W149 HydrophobicContact CD1-CH2 4.06Å; L29-W149 HydrophobicContact CD1-CZ2 3.6Å; L29-G155 VanDerWaalsContact CD2-N 3.32Å; L29-L161 HydrophobicContact CD1-CB 3.84Å; L29-L161 HydrophobicContact CD1-CD1 3.83Å; L29-L161 HydrophobicContact CD1-CG 4.4Å; L29-I164 HydrophobicContact CD1-CD1 3.98Å; L29-I164 HydrophobicContact CD2-CD1 3.7Å; L29-I164 HydrophobicContact CG-CD1 3.68Å
30	Y	88.8	Confident	74.6	Confident	18 Å²	18	68.9 Å²	68.9	7%	0.071	33%	0.328	C	S	.	.	H	α-helix	trans	-72.4	-11.7	-176.6	-59.9	-53.1	0	0	0	114	C24 S27 L32 I33 D34 Y35 G155 A156 E159 I164	C24-Y30 HydrophobicContact CB-CE2 4.21Å; S27-Y30 PolarHBondContact O-N 2.88Å; Y30-L32 VanDerWaalsContact C-N 3.34Å; Y30-I33 WeakPolarHBondContact CA-O 3.43Å; Y30-I33 CarbonylContact O-C 3.49Å; Y30-D34 PolarHBondContact O-N 3.42Å; Y30-Y35 HydrophobicContact CD1-CD2 4.26Å; Y30-Y35 AromaticContact CD1-CE2 3.83Å; Y30-Y35 HydrophobicContact CD1-CE2 3.83Å; Y30-Y35 HydrophobicContact CE1-CD2 4.08Å; Y30-Y35 HydrophobicContact CE1-CE1 4.38Å; Y30-Y35 AromaticContact CE1-CE2 3.23Å; Y30-Y35 HydrophobicContact CE1-CE2 3.23Å; Y30-Y35 AromaticContact CE1-CZ 3.46Å; Y30-Y35 VanDerWaalsContact CE1-CZ 3.46Å; Y30-Y35 HydrophobicContact CE2-CE2 4.26Å; Y30-Y35 AromaticContact CZ-CE2 3.5Å; Y30-Y35 AromaticContact CZ-CZ 3.76Å; Y30-Y35 PolarHBondContact OH-OH 2.96Å; Y30-G155 WeakPolarHBondContact OH-CA 3.32Å; Y30-A156 PolarHBondContact OH-N 3.45Å; Y30-E159 WeakPolarHBondContact CE1-OE1 3.22Å; Y30-E159 PolarHBondContact OH-OE1 2.64Å; Y30-I164 HydrophobicContact CD1-CD1 3.96Å; Y30-I164 HydrophobicContact CE1-CD1 3.68Å
31	R	88.9	Confident	76.4	Confident	136 Å²	136	65.8 Å²	65.8	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-73.4	-29.6	169	-63.7	-176.5	-176.5	172.1	0	112.1	K28 L29 E40	K28-R31 PolarHBondContact O-N 2.81Å; L29-R31 PolarHBondContact O-N 3.42Å; R31-E40 PolarHBondContact O-N 3.01Å
32	L	91.7	Very high	78.6	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.037	31%	0.313	C	S	.	.	H	α-helix	trans	-70.6	-51.7	176.5	-60.5	177.3	0	0	0	110.3	L29 Y30 G39 E40 L41 K64 I65 F68 L161	L29-L32 WeakPolarHBondContact O-CB 3.21Å; L29-L32 PolarHBondContact O-N 2.67Å; Y30-L32 VanDerWaalsContact C-N 3.34Å; L32-G39 CarbonylContact O-C 3.09Å; L32-G39 WeakPolarHBondContact O-CA 3.27Å; L32-E40 PolarHBondContact O-N 2.93Å; L32-E40 VanDerWaalsContact O-N 3.11Å; L32-L41 HydrophobicContact CB-CD1 4.05Å; L32-L41 HydrophobicContact CB-CG 4.29Å; L32-L41 PolarHBondContact O-N 3.33Å; L32-L41 VanDerWaalsContact O-N 3.15Å; L32-K64 HydrophobicContact CD2-CB 4.3Å; L32-K64 HydrophobicContact CD2-CD 4.11Å; L32-I65 HydrophobicContact CD1-CG1 4.46Å; L32-F68 HydrophobicContact CD1-CD2 4.49Å; L32-F68 HydrophobicContact CD1-CE2 3.95Å; L32-F68 HydrophobicContact CD1-CZ 4.07Å; L32-L161 HydrophobicContact CB-CD1 4.14Å; L32-L161 HydrophobicContact CD1-CD2 4.13Å
33	I	90.2	Very high	80.5	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.313	C	S	.	.	S	Bend	trans	-148.9	127.2	175.3	-57	-179.9	0	0	0	108.4	L29 Y30 E38 L41 I42 L161 I164 C165 V176	L29-I33 PolarHBondContact O-N 2.78Å; Y30-I33 WeakPolarHBondContact CA-O 3.43Å; Y30-I33 CarbonylContact O-C 3.49Å; I33-E38 CarbonylContact C-O 3.31Å; I33-E38 WeakPolarHBondContact CA-O 3.16Å; I33-L41 HydrophobicContact CD1-CB 4.34Å; I33-L41 HydrophobicContact CD1-CD1 4.33Å; I33-L41 HydrophobicContact CG1-CB 4.12Å; I33-L41 HydrophobicContact CG1-CD1 4.34Å; I33-I42 HydrophobicContact CD1-CD1 4.37Å; I33-I42 HydrophobicContact CD1-CG1 4.41Å; I33-I42 HydrophobicContact CG1-CG1 4.18Å; I33-I42 HydrophobicContact CG2-CG1 4.4Å; I33-L161 HydrophobicContact CB-CD1 3.85Å; I33-L161 HydrophobicContact CD1-CD1 3.85Å; I33-L161 HydrophobicContact CD1-CG 4.38Å; I33-L161 HydrophobicContact CG1-CD1 3.85Å; I33-I164 HydrophobicContact CB-CG2 4.21Å; I33-I164 HydrophobicContact CG2-CG2 3.78Å; I33-C165 WeakPolarHBondContact CD1-SG 3.36Å; I33-V176 HydrophobicContact CD1-CG1 4.13Å
34	D	85	Confident	82.2	Confident	43 Å²	43	62.4 Å²	62.4	23%	0.23	30%	0.295	C	S	.	.			trans	-98.3	175.6	176.3	76.9	9.8	0	0	0	112.6	Y30 K36 G37 E38 N168	Y30-D34 PolarHBondContact O-N 3.42Å; D34-K36 PolarHBondContact O-N 3.49Å; D34-K36 VanDerWaalsContact OD1-CA 3.3Å; D34-K36 WeakPolarHBondContact OD1-CA 3.3Å; D34-K36 WeakPolarHBondContact OD1-CB 3.42Å; D34-K36 PolarHBondContact OD1-N 3.27Å; D34-G37 PolarHBondContact O-N 3.1Å; D34-G37 PolarHBondContact OD1-N 3.49Å; D34-E38 PolarHBondContact N-O 2.83Å; D34-E38 PolarHBondContact OD1-N 2.87Å; D34-N168 PolarHBondContact O-ND2 3.07Å; D34-N168 VanDerWaalsContact O-ND2 3.1Å
35	Y	77.8	Confident	84	Confident	57 Å²	57	60 Å²	60	22%	0.224	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-8.5	176.6	-63	-77	0	0	0	114.2	Y30 G37 E159 L167	Y30-Y35 HydrophobicContact CD1-CD2 4.26Å; Y30-Y35 AromaticContact CD1-CE2 3.83Å; Y30-Y35 HydrophobicContact CD1-CE2 3.83Å; Y30-Y35 HydrophobicContact CE1-CD2 4.08Å; Y30-Y35 HydrophobicContact CE1-CE1 4.38Å; Y30-Y35 AromaticContact CE1-CE2 3.23Å; Y30-Y35 HydrophobicContact CE1-CE2 3.23Å; Y30-Y35 AromaticContact CE1-CZ 3.46Å; Y30-Y35 VanDerWaalsContact CE1-CZ 3.46Å; Y30-Y35 HydrophobicContact CE2-CE2 4.26Å; Y30-Y35 AromaticContact CZ-CE2 3.5Å; Y30-Y35 AromaticContact CZ-CZ 3.76Å; Y30-Y35 PolarHBondContact OH-OH 2.96Å; Y35-G37 VanDerWaalsContact C-N 3.27Å; Y35-E159 PolarHBondContact OH-OE1 3.18Å; Y35-L167 HydrophobicContact CD1-CD2 3.74Å; Y35-L167 HydrophobicContact CE1-CD2 3.71Å
36	K	81	Confident	85.9	Confident	176 Å²	176	58.7 Å²	58.7	77%	0.765	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.7	175.9	-61.3	-180	177.5	177.8	0	111.2	D34	D34-K36 PolarHBondContact O-N 3.49Å; D34-K36 VanDerWaalsContact OD1-CA 3.3Å; D34-K36 WeakPolarHBondContact OD1-CA 3.3Å; D34-K36 WeakPolarHBondContact OD1-CB 3.42Å; D34-K36 PolarHBondContact OD1-N 3.27Å
37	G	79.2	Confident	87.5	Confident	10 Å²	10	56.6 Å²	56.6	10%	0.103	26%	0.257	C	S	.	.	S	Bend	trans	81.9	17.7	179.5	0	0	0	0	0	113.6	D34 Y35 N168 H173	D34-G37 PolarHBondContact O-N 3.1Å; D34-G37 PolarHBondContact OD1-N 3.49Å; Y35-G37 VanDerWaalsContact C-N 3.27Å; G37-N168 WeakPolarHBondContact CA-OD1 3.44Å; G37-N168 PolarHBondContact N-OD1 2.85Å; G37-N168 VanDerWaalsContact N-OD1 3.12Å; G37-H173 VanDerWaalsContact CA-CE1 3.43Å; G37-H173 WeakPolarHBondContact CA-CE1 3.23Å; G37-H173 WeakPolarHBondContact CA-NE2 3.03Å; G37-H173 PolarHBondContact O-CE1 2.95Å; G37-H173 VanDerWaalsContact O-CE1 3.27Å; G37-H173 PolarHBondContact O-NE2 3.45Å
38	E	86.2	Confident	88.2	Confident	83 Å²	83	55.1 Å²	55.1	39%	0.388	25%	0.246	S	C	.	.			trans	-112.1	175.6	174.7	-66.9	-61.8	151.4	0	0	110.2	I33 D34 K46	I33-E38 CarbonylContact C-O 3.31Å; I33-E38 WeakPolarHBondContact CA-O 3.16Å; D34-E38 PolarHBondContact N-O 2.83Å; D34-E38 PolarHBondContact OD1-N 2.87Å; E38-K46 IonicContact OE1-NZ 3.09Å; E38-K46 PolarHBondContact OE1-NZ 2.83Å; E38-K46 VanDerWaalsContact OE1-NZ 3.09Å; E38-K46 IonicContact OE2-NZ 3.24Å; E38-K46 PolarHBondContact OE2-NZ 3.26Å
39	G	88.7	Confident	88.4	Confident	12 Å²	12	53.1 Å²	53.1	12%	0.124	24%	0.24	C	C	.	.	S	Bend	trans	140.7	169.7	-179.4	0	0	0	0	0	112	L32 L41 I42 Q43	L32-G39 CarbonylContact O-C 3.09Å; L32-G39 WeakPolarHBondContact O-CA 3.27Å; G39-L41 PolarHBondContact O-N 2.8Å; G39-I42 PolarHBondContact O-N 3.44Å; G39-Q43 WeakPolarHBondContact O-CG 3.37Å; G39-Q43 PolarHBondContact O-N 3.09Å; G39-Q43 VanDerWaalsContact O-N 3.09Å
40	E	90.8	Very high	88.4	Confident	68 Å²	68	58.1 Å²	58.1	32%	0.318	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-46.8	-175.4	-66.4	176.4	-177.1	0	0	111.8	R31 L32 I42 Q43 W44 K64	R31-E40 PolarHBondContact O-N 3.01Å; L32-E40 PolarHBondContact O-N 2.93Å; L32-E40 VanDerWaalsContact O-N 3.11Å; E40-I42 VanDerWaalsContact C-N 3.26Å; E40-I42 PolarHBondContact O-N 3.2Å; E40-Q43 PolarHBondContact O-N 2.93Å; E40-W44 PolarHBondContact O-N 3Å; E40-K64 IonicContact OE2-NZ 2.55Å; E40-K64 PolarHBondContact OE2-NZ 3.24Å
41	L	91.7	Very high	88.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-33.5	-177.3	-67.1	179.8	0	0	0	112.3	L32 I33 G39 W44 M45 L60 I61 I65 L161	L32-L41 HydrophobicContact CB-CD1 4.05Å; L32-L41 HydrophobicContact CB-CG 4.29Å; L32-L41 PolarHBondContact O-N 3.33Å; L32-L41 VanDerWaalsContact O-N 3.15Å; I33-L41 HydrophobicContact CD1-CB 4.34Å; I33-L41 HydrophobicContact CD1-CD1 4.33Å; I33-L41 HydrophobicContact CG1-CB 4.12Å; I33-L41 HydrophobicContact CG1-CD1 4.34Å; G39-L41 PolarHBondContact O-N 2.8Å; L41-W44 PolarHBondContact O-N 2.99Å; L41-M45 VanDerWaalsContact O-CB 3.3Å; L41-M45 WeakPolarHBondContact O-CB 3.27Å; L41-M45 PolarHBondContact O-N 2.85Å; L41-L60 HydrophobicContact CD2-CD2 4.4Å; L41-I61 HydrophobicContact CD2-CG1 3.89Å; L41-I65 HydrophobicContact CD1-CD1 4.17Å; L41-L161 HydrophobicContact CD1-CD2 3.69Å
42	I	92.4	Very high	88.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-69.2	-40.2	177.1	-68.9	-54.9	0	0	0	111.3	I33 G39 E40 M45 K46 L172 V176	I33-I42 HydrophobicContact CD1-CD1 4.37Å; I33-I42 HydrophobicContact CD1-CG1 4.41Å; I33-I42 HydrophobicContact CG1-CG1 4.18Å; I33-I42 HydrophobicContact CG2-CG1 4.4Å; G39-I42 PolarHBondContact O-N 3.44Å; E40-I42 VanDerWaalsContact C-N 3.26Å; E40-I42 PolarHBondContact O-N 3.2Å; I42-M45 PolarHBondContact O-N 2.55Å; I42-K46 HydrophobicContact CG2-CD 4.42Å; I42-K46 WeakPolarHBondContact O-CG 3.39Å; I42-K46 PolarHBondContact O-N 2.95Å; I42-L172 HydrophobicContact CB-CD2 4.32Å; I42-L172 HydrophobicContact CD1-CD2 4Å; I42-L172 HydrophobicContact CD1-CG 4.17Å; I42-L172 HydrophobicContact CG2-CD2 3.52Å; I42-V176 HydrophobicContact CD1-CG2 4.25Å
43	Q	90.9	Very high	88.3	Confident	119 Å²	119	61 Å²	61	56%	0.556	31%	0.314	S	S	*	.	H	α-helix	trans	-64	-44.7	174	-67.4	175	19	0	0	111.5	G39 E40 M45 K46 H47	G39-Q43 WeakPolarHBondContact O-CG 3.37Å; G39-Q43 PolarHBondContact O-N 3.09Å; G39-Q43 VanDerWaalsContact O-N 3.09Å; E40-Q43 PolarHBondContact O-N 2.93Å; Q43-M45 VanDerWaalsContact C-N 3.32Å; Q43-M45 PolarHBondContact O-N 2.74Å; Q43-K46 PolarHBondContact O-N 2.88Å; Q43-H47 PolarHBondContact O-N 3.16Å
44	W	89.8	Confident	88.2	Confident	96 Å²	96	65.4 Å²	65.4	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-34.2	176.4	-73.6	110.2	0	0	0	112.8	E40 L41 H47 S48 L57 L60	E40-W44 PolarHBondContact O-N 3Å; L41-W44 PolarHBondContact O-N 2.99Å; W44-H47 PolarHBondContact O-N 2.74Å; W44-S48 WeakPolarHBondContact O-CB 3.43Å; W44-S48 PolarHBondContact O-N 3.46Å; W44-S48 PolarHBondContact O-OG 2.65Å; W44-L57 HydrophobicContact CB-CD1 3.74Å; W44-L60 HydrophobicContact CB-CD2 4.06Å; W44-L60 HydrophobicContact CD2-CD2 3.92Å; W44-L60 HydrophobicContact CG-CD2 3.46Å; W44-L60 VanDerWaalsContact CG-CD2 3.46Å
45	M	91.5	Very high	88.3	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-66.5	-45.6	174	-171.7	59.4	148.4	0	0	111.6	L41 I42 Q43 H47 S48 M49 Y54 L57 L172 E175 V176 I179	L41-M45 VanDerWaalsContact O-CB 3.3Å; L41-M45 WeakPolarHBondContact O-CB 3.27Å; L41-M45 PolarHBondContact O-N 2.85Å; I42-M45 PolarHBondContact O-N 2.55Å; Q43-M45 VanDerWaalsContact C-N 3.32Å; Q43-M45 PolarHBondContact O-N 2.74Å; M45-H47 VanDerWaalsContact C-N 3.26Å; M45-H47 PolarHBondContact O-N 2.95Å; M45-S48 PolarHBondContact O-N 2.87Å; M45-M49 HydrophobicContact CG-CG 4.48Å; M45-M49 HydrophobicContact CG-SD 4.35Å; M45-M49 WeakPolarHBondContact O-CB 3.32Å; M45-M49 VanDerWaalsContact O-CG 3.29Å; M45-M49 WeakPolarHBondContact O-CG 3.29Å; M45-M49 PolarHBondContact O-N 3.49Å; M45-M49 HydrophobicContact SD-CG 4.38Å; M45-Y54 HydrophobicContact CE-CE1 4.27Å; M45-Y54 HydrophobicContact SD-CD1 4.23Å; M45-Y54 HydrophobicContact SD-CE1 3.97Å; M45-L57 HydrophobicContact CB-CD2 4.22Å; M45-L57 HydrophobicContact CE-CD2 4.42Å; M45-L57 HydrophobicContact CG-CD2 4.35Å; M45-L57 HydrophobicContact SD-CD2 3.22Å; M45-L57 WeakPolarHBondContact SD-CD2 3.49Å; M45-L172 HydrophobicContact CB-CD1 3.91Å; M45-L172 HydrophobicContact CB-CG 4.21Å; M45-L172 HydrophobicContact CG-CD1 3.29Å; M45-L172 HydrophobicContact CG-CG 3.86Å; M45-E175 HydrophobicContact CE-CB 3.12Å; M45-E175 HydrophobicContact CE-CG 4.21Å; M45-V176 HydrophobicContact CB-CG2 3.99Å; M45-V176 HydrophobicContact CE-CG2 4.3Å; M45-V176 HydrophobicContact CG-CG2 3.93Å; M45-V176 HydrophobicContact SD-CG2 4.43Å; M45-I179 HydrophobicContact CE-CD1 3.88Å; M45-I179 HydrophobicContact SD-CD1 4.31Å
46	K	91.5	Very high	88.7	Confident	98 Å²	98	70.9 Å²	70.9	43%	0.426	36%	0.364	S	S	.	.	H	α-helix	trans	-55.8	-43.2	173.3	-70.9	168.2	-175.7	170.2	0	110.8	E38 I42 Q43 S50 L172	E38-K46 IonicContact OE1-NZ 3.09Å; E38-K46 PolarHBondContact OE1-NZ 2.83Å; E38-K46 VanDerWaalsContact OE1-NZ 3.09Å; E38-K46 IonicContact OE2-NZ 3.24Å; E38-K46 PolarHBondContact OE2-NZ 3.26Å; I42-K46 HydrophobicContact CG2-CD 4.42Å; I42-K46 WeakPolarHBondContact O-CG 3.39Å; I42-K46 PolarHBondContact O-N 2.95Å; Q43-K46 PolarHBondContact O-N 2.88Å; K46-S50 PolarHBondContact O-N 2.95Å; K46-L172 HydrophobicContact CD-CD2 4.31Å; K46-L172 HydrophobicContact CG-CD1 4.45Å; K46-L172 HydrophobicContact CG-CD2 3.71Å
47	H	90.5	Very high	89.1	Confident	91 Å²	91	62.5 Å²	62.5	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-48.2	177.6	-175.3	67.2	0	0	0	112.8	Q43 W44 M45 M49 S50 I51	Q43-H47 PolarHBondContact O-N 3.16Å; W44-H47 PolarHBondContact O-N 2.74Å; M45-H47 VanDerWaalsContact C-N 3.26Å; M45-H47 PolarHBondContact O-N 2.95Å; H47-M49 VanDerWaalsContact C-N 3.35Å; H47-M49 PolarHBondContact O-N 2.99Å; H47-S50 WeakPolarHBondContact O-CB 3.43Å; H47-S50 PolarHBondContact O-N 3.41Å; H47-S50 VanDerWaalsContact O-N 3.1Å; H47-I51 WeakPolarHBondContact CE1-CD1 3.3Å; H47-I51 WeakPolarHBondContact NE2-CD1 3.34Å; H47-I51 PolarHBondContact O-N 3.41Å; H47-I51 VanDerWaalsContact O-N 3.13Å
48	S	90.9	Very high	89.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-40.2	-179.4	-56.1	0	0	0	0	111.7	W44 M45 S50 I51 G52 D53 L57	W44-S48 WeakPolarHBondContact O-CB 3.43Å; W44-S48 PolarHBondContact O-N 3.46Å; W44-S48 PolarHBondContact O-OG 2.65Å; M45-S48 PolarHBondContact O-N 2.87Å; S48-S50 VanDerWaalsContact C-N 3.31Å; S48-S50 PolarHBondContact O-N 3.29Å; S48-I51 PolarHBondContact O-N 3.09Å; S48-G52 WeakPolarHBondContact O-CA 3.3Å; S48-G52 PolarHBondContact O-N 2.93Å; S48-D53 WeakPolarHBondContact CA-O 3.45Å; S48-D53 VanDerWaalsContact CB-O 3.26Å; S48-D53 WeakPolarHBondContact CB-O 3.43Å; S48-D53 PolarHBondContact O-N 3.15Å; S48-L57 WeakPolarHBondContact OG-CB 3.37Å
49	M	88.6	Confident	89.7	Confident	97 Å²	97	62.7 Å²	62.7	48%	0.478	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-35.1	173.6	-72.3	-176	72.7	0	0	112.8	M45 H47 Y54 L172	M45-M49 HydrophobicContact CG-CG 4.48Å; M45-M49 HydrophobicContact CG-SD 4.35Å; M45-M49 WeakPolarHBondContact O-CB 3.32Å; M45-M49 VanDerWaalsContact O-CG 3.29Å; M45-M49 WeakPolarHBondContact O-CG 3.29Å; M45-M49 PolarHBondContact O-N 3.49Å; M45-M49 HydrophobicContact SD-CG 4.38Å; H47-M49 VanDerWaalsContact C-N 3.35Å; H47-M49 PolarHBondContact O-N 2.99Å; M49-Y54 HydrophobicContact CG-CE1 4.09Å; M49-L172 HydrophobicContact SD-CD1 3.41Å; M49-L172 WeakPolarHBondContact SD-CD1 2.91Å
50	S	90.7	Very high	89.8	Confident	105 Å²	105	63.5 Å²	63.5	73%	0.734	34%	0.339	S	S	*	.	H	α-helix	trans	-71.3	-33	177.8	-176.1	0	0	0	0	112.9	K46 H47 S48	K46-S50 PolarHBondContact O-N 2.95Å; H47-S50 WeakPolarHBondContact O-CB 3.43Å; H47-S50 PolarHBondContact O-N 3.41Å; H47-S50 VanDerWaalsContact O-N 3.1Å; S48-S50 VanDerWaalsContact C-N 3.31Å; S48-S50 PolarHBondContact O-N 3.29Å
51	I	91.4	Very high	89.7	Confident	102 Å²	102	60.3 Å²	60.3	52%	0.523	32%	0.324	S	S	.	.	H	α-helix	trans	-86.9	-27	179.9	-64.9	173.1	0	0	0	111	H47 S48 D53	H47-I51 WeakPolarHBondContact CE1-CD1 3.3Å; H47-I51 WeakPolarHBondContact NE2-CD1 3.34Å; H47-I51 PolarHBondContact O-N 3.41Å; H47-I51 VanDerWaalsContact O-N 3.13Å; S48-I51 PolarHBondContact O-N 3.09Å; I51-D53 VanDerWaalsContact C-N 3.29Å; I51-D53 HydrophobicContact CG2-CB 3.93Å
52	G	88.2	Confident	89.8	Confident	57 Å²	57	65.8 Å²	65.8	59%	0.588	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	14.6	-171.6	0	0	0	0	0	113.5	S48	S48-G52 WeakPolarHBondContact O-CA 3.3Å; S48-G52 PolarHBondContact O-N 2.93Å
53	D	88.3	Confident	89.8	Confident	62 Å²	62	72 Å²	72	33%	0.332	38%	0.382	S	S	.	.			trans	-119.2	121.9	176.6	-174.8	3.9	0	0	0	109.9	S48 I51 N55	S48-D53 WeakPolarHBondContact CA-O 3.45Å; S48-D53 VanDerWaalsContact CB-O 3.26Å; S48-D53 WeakPolarHBondContact CB-O 3.43Å; S48-D53 PolarHBondContact O-N 3.15Å; I51-D53 VanDerWaalsContact C-N 3.29Å; I51-D53 HydrophobicContact CG2-CB 3.93Å; D53-N55 WeakPolarHBondContact OD1-CB 3.26Å; D53-N55 PolarHBondContact OD1-N 3.31Å; D53-N55 PolarHBondContact OD1-ND2 3.43Å
54	Y	87.4	Confident	89.9	Confident	92 Å²	92	69.5 Å²	69.5	36%	0.361	37%	0.369	S	S	.	.			trans	-104.4	-5.6	-177.8	-62.8	-89.3	0	0	0	112.9	M45 M49 I56 L57 D58	M45-Y54 HydrophobicContact CE-CE1 4.27Å; M45-Y54 HydrophobicContact SD-CD1 4.23Å; M45-Y54 HydrophobicContact SD-CE1 3.97Å; M49-Y54 HydrophobicContact CG-CE1 4.09Å; Y54-I56 VanDerWaalsContact C-N 3.28Å; Y54-I56 PolarHBondContact O-N 3Å; Y54-L57 HydrophobicContact CD1-CD2 4.48Å; Y54-L57 WeakPolarHBondContact O-CB 3.43Å; Y54-L57 PolarHBondContact O-N 3.27Å; Y54-D58 PolarHBondContact O-N 3.47Å
55	N	87.5	Confident	90.1	Very high	120 Å²	120	64.9 Å²	64.9	64%	0.642	35%	0.352	S	S	*	.	H	α-helix	trans	-61.5	-37.9	-175.3	-66.4	-52.3	0	0	0	112.3	D53 L57 D58 G59	D53-N55 WeakPolarHBondContact OD1-CB 3.26Å; D53-N55 PolarHBondContact OD1-N 3.31Å; D53-N55 PolarHBondContact OD1-ND2 3.43Å; N55-L57 VanDerWaalsContact C-N 3.34Å; N55-D58 PolarHBondContact O-N 2.89Å; N55-G59 PolarHBondContact O-N 3.26Å; N55-G59 VanDerWaalsContact O-N 3.1Å
56	I	86.5	Confident	90.2	Very high	96 Å²	96	67.2 Å²	67.2	49%	0.492	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-42.6	177.2	-60.5	175.1	0	0	0	110.2	Y54 L60	Y54-I56 VanDerWaalsContact C-N 3.28Å; Y54-I56 PolarHBondContact O-N 3Å; I56-L60 VanDerWaalsContact O-CB 3.3Å; I56-L60 WeakPolarHBondContact O-CB 3.46Å; I56-L60 PolarHBondContact O-N 3.24Å
57	L	88.4	Confident	90.4	Very high	0 Å²	0	67 Å²	67	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-67.1	-43	179.1	179	66.6	0	0	0	111.4	W44 M45 S48 Y54 N55 G59 L60 I61 I179	W44-L57 HydrophobicContact CB-CD1 3.74Å; M45-L57 HydrophobicContact CB-CD2 4.22Å; M45-L57 HydrophobicContact CE-CD2 4.42Å; M45-L57 HydrophobicContact CG-CD2 4.35Å; M45-L57 HydrophobicContact SD-CD2 3.22Å; M45-L57 WeakPolarHBondContact SD-CD2 3.49Å; S48-L57 WeakPolarHBondContact OG-CB 3.37Å; Y54-L57 HydrophobicContact CD1-CD2 4.48Å; Y54-L57 WeakPolarHBondContact O-CB 3.43Å; Y54-L57 PolarHBondContact O-N 3.27Å; N55-L57 VanDerWaalsContact C-N 3.34Å; L57-G59 PolarHBondContact O-N 3Å; L57-L60 WeakPolarHBondContact O-CB 3.42Å; L57-L60 PolarHBondContact O-N 3.15Å; L57-I61 HydrophobicContact CD1-CD1 3.95Å; L57-I61 HydrophobicContact CD1-CG1 4.09Å; L57-I61 HydrophobicContact CD2-CD1 4.31Å; L57-I61 HydrophobicContact CG-CD1 3.73Å; L57-I61 HydrophobicContact CG-CG1 4.26Å; L57-I61 VanDerWaalsContact O-CB 3.31Å; L57-I61 WeakPolarHBondContact O-CB 3.49Å; L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.27Å; L57-I61 PolarHBondContact O-N 2.99Å; L57-I179 HydrophobicContact CD2-CD1 3.79Å
58	D	88.6	Confident	90.6	Very high	58 Å²	58	63.5 Å²	63.5	31%	0.31	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-47.9	178.1	-71.3	-20	0	0	0	111	Y54 N55 L60 I61 E62 I179	Y54-D58 PolarHBondContact O-N 3.47Å; N55-D58 PolarHBondContact O-N 2.89Å; D58-L60 VanDerWaalsContact C-N 3.33Å; D58-L60 PolarHBondContact O-N 3.33Å; D58-I61 PolarHBondContact O-N 3.21Å; D58-E62 PolarHBondContact O-N 2.96Å; D58-I179 VanDerWaalsContact OD1-CG2 3.28Å; D58-I179 WeakPolarHBondContact OD1-CG2 3.22Å
59	G	90.1	Very high	90.8	Very high	38 Å²	38	64 Å²	64	39%	0.392	36%	0.361	S	S	.	.	H	α-helix	trans	-64	-36.3	175.7	0	0	0	0	0	113.2	N55 L57 L63	N55-G59 PolarHBondContact O-N 3.26Å; N55-G59 VanDerWaalsContact O-N 3.1Å; L57-G59 PolarHBondContact O-N 3Å; G59-L63 VanDerWaalsContact O-CB 3.3Å; G59-L63 WeakPolarHBondContact O-CB 3.31Å; G59-L63 PolarHBondContact O-N 2.89Å
60	L	89.6	Confident	91.1	Very high	30 Å²	30	61 Å²	61	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-67.6	-43.7	175.8	-170.1	76.7	0	0	0	111.9	L41 W44 I56 L57 D58 L63 K64	L41-L60 HydrophobicContact CD2-CD2 4.4Å; W44-L60 HydrophobicContact CB-CD2 4.06Å; W44-L60 HydrophobicContact CD2-CD2 3.92Å; W44-L60 HydrophobicContact CG-CD2 3.46Å; W44-L60 VanDerWaalsContact CG-CD2 3.46Å; I56-L60 VanDerWaalsContact O-CB 3.3Å; I56-L60 WeakPolarHBondContact O-CB 3.46Å; I56-L60 PolarHBondContact O-N 3.24Å; L57-L60 WeakPolarHBondContact O-CB 3.42Å; L57-L60 PolarHBondContact O-N 3.15Å; D58-L60 VanDerWaalsContact C-N 3.33Å; D58-L60 PolarHBondContact O-N 3.33Å; L60-L63 PolarHBondContact O-N 2.92Å; L60-K64 HydrophobicContact CD1-CD 4.22Å; L60-K64 HydrophobicContact CD1-CG 4.25Å; L60-K64 HydrophobicContact CG-CD 4.22Å; L60-K64 HydrophobicContact CG-CG 4.28Å; L60-K64 VanDerWaalsContact O-CB 3.3Å; L60-K64 WeakPolarHBondContact O-CB 3.28Å; L60-K64 WeakPolarHBondContact O-CG 3.48Å; L60-K64 PolarHBondContact O-N 2.72Å
61	I	90.6	Very high	91	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.3	-49.6	176.2	-79.3	175.6	0	0	0	109.1	L41 L57 D58 L63 I65 I179 L180 F184	L41-I61 HydrophobicContact CD2-CG1 3.89Å; L57-I61 HydrophobicContact CD1-CD1 3.95Å; L57-I61 HydrophobicContact CD1-CG1 4.09Å; L57-I61 HydrophobicContact CD2-CD1 4.31Å; L57-I61 HydrophobicContact CG-CD1 3.73Å; L57-I61 HydrophobicContact CG-CG1 4.26Å; L57-I61 VanDerWaalsContact O-CB 3.31Å; L57-I61 WeakPolarHBondContact O-CB 3.49Å; L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.27Å; L57-I61 PolarHBondContact O-N 2.99Å; D58-I61 PolarHBondContact O-N 3.21Å; I61-L63 PolarHBondContact O-N 3.06Å; I61-I65 HydrophobicContact CB-CD1 4.29Å; I61-I65 HydrophobicContact CG1-CD1 4.46Å; I61-I65 HydrophobicContact CG2-CD1 3.69Å; I61-I65 WeakPolarHBondContact O-CB 3.37Å; I61-I65 WeakPolarHBondContact O-CG1 3.24Å; I61-I65 PolarHBondContact O-N 3.25Å; I61-I179 HydrophobicContact CD1-CB 4.17Å; I61-I179 HydrophobicContact CD1-CD1 4.47Å; I61-I179 HydrophobicContact CD1-CG2 3.56Å; I61-I179 HydrophobicContact CG2-CG2 4.42Å; I61-L180 HydrophobicContact CG2-CD2 3.89Å; I61-F184 HydrophobicContact CG2-CE2 4.25Å
62	E	92.2	Very high	91	Very high	116 Å²	116	54.6 Å²	54.6	54%	0.542	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-50.4	177.8	-169.8	175.3	178.7	0	0	111.2	D58 T66	D58-E62 PolarHBondContact O-N 2.96Å; E62-T66 WeakPolarHBondContact O-CB 3.49Å; E62-T66 PolarHBondContact O-N 3.37Å; E62-T66 PolarHBondContact O-OG1 3.49Å
63	L	92.8	Very high	91.2	Very high	130 Å²	130	52.4 Å²	52.4	68%	0.681	30%	0.298	S	S	*	.	H	α-helix	trans	-64.6	-46.1	-178.2	-176.8	70.6	0	0	0	113.1	G59 L60 I61 P67	G59-L63 VanDerWaalsContact O-CB 3.3Å; G59-L63 WeakPolarHBondContact O-CB 3.31Å; G59-L63 PolarHBondContact O-N 2.89Å; L60-L63 PolarHBondContact O-N 2.92Å; I61-L63 PolarHBondContact O-N 3.06Å; L63-P67 WeakPolarHBondContact O-CD 3.31Å
64	K	92.4	Very high	91.2	Very high	67 Å²	67	54.8 Å²	54.8	29%	0.291	31%	0.305	S	S	.	.	H	α-helix	trans	-79.4	-28.4	-173.5	-71.6	-157.4	176.1	-153.6	0	113.4	L32 E40 L60 F68	L32-K64 HydrophobicContact CD2-CB 4.3Å; L32-K64 HydrophobicContact CD2-CD 4.11Å; E40-K64 IonicContact OE2-NZ 2.55Å; E40-K64 PolarHBondContact OE2-NZ 3.24Å; L60-K64 HydrophobicContact CD1-CD 4.22Å; L60-K64 HydrophobicContact CD1-CG 4.25Å; L60-K64 HydrophobicContact CG-CD 4.22Å; L60-K64 HydrophobicContact CG-CG 4.28Å; L60-K64 VanDerWaalsContact O-CB 3.3Å; L60-K64 WeakPolarHBondContact O-CB 3.28Å; L60-K64 WeakPolarHBondContact O-CG 3.48Å; L60-K64 PolarHBondContact O-N 2.72Å; K64-F68 WeakPolarHBondContact O-CD2 3.35Å; K64-F68 VanDerWaalsContact O-CE2 3.27Å; K64-F68 WeakPolarHBondContact O-CE2 3.42Å
65	I	94.2	Very high	91.4	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-95.3	-31.8	-172.8	-58.7	176.9	0	0	0	111.8	L32 L41 I61 P67 F68 L69 W149 L161 L180 F184	L32-I65 HydrophobicContact CD1-CG1 4.46Å; L41-I65 HydrophobicContact CD1-CD1 4.17Å; I61-I65 HydrophobicContact CB-CD1 4.29Å; I61-I65 HydrophobicContact CG1-CD1 4.46Å; I61-I65 HydrophobicContact CG2-CD1 3.69Å; I61-I65 WeakPolarHBondContact O-CB 3.37Å; I61-I65 WeakPolarHBondContact O-CG1 3.24Å; I61-I65 PolarHBondContact O-N 3.25Å; I65-P67 VanDerWaalsContact C-N 3.25Å; I65-P67 VanDerWaalsContact O-N 3.09Å; I65-F68 WeakPolarHBondContact O-CB 3.45Å; I65-F68 PolarHBondContact O-N 3.05Å; I65-L69 HydrophobicContact CG2-CD1 4Å; I65-L69 HydrophobicContact CG2-CD2 4.29Å; I65-L69 HydrophobicContact CG2-CG 4.07Å; I65-W149 HydrophobicContact CG2-CH2 3.94Å; I65-W149 HydrophobicContact CG2-CZ3 3.68Å; I65-L161 HydrophobicContact CD1-CD2 3.68Å; I65-L161 HydrophobicContact CG1-CD2 4.18Å; I65-L180 HydrophobicContact CD1-CD2 3.11Å; I65-F184 HydrophobicContact CB-CE2 3.99Å; I65-F184 HydrophobicContact CB-CZ 4.36Å; I65-F184 HydrophobicContact CG2-CD2 4.42Å; I65-F184 HydrophobicContact CG2-CE2 3.9Å; I65-F184 HydrophobicContact CG2-CZ 4.46Å
66	T	94.8	Very high	91.7	Very high	50 Å²	50	49.1 Å²	49.1	31%	0.307	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-45.6	-42.4	176.7	-66	0	0	0	0	113.5	E62 F68 L69	E62-T66 WeakPolarHBondContact O-CB 3.49Å; E62-T66 PolarHBondContact O-N 3.37Å; E62-T66 PolarHBondContact O-OG1 3.49Å; T66-F68 PolarHBondContact O-N 3.09Å; T66-F68 VanDerWaalsContact O-N 3.15Å; T66-L69 PolarHBondContact O-N 3.08Å; T66-L69 VanDerWaalsContact O-N 3.1Å
67	P	94	Very high	91.9	Very high	95 Å²	95	45.5 Å²	45.5	62%	0.617	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-62.7	-18	177.1	-24.5	35.5	0	0	0	115.9	L63 I65	L63-P67 WeakPolarHBondContact O-CD 3.31Å; I65-P67 VanDerWaalsContact C-N 3.25Å; I65-P67 VanDerWaalsContact O-N 3.09Å
68	F	95.1	Very high	91.9	Very high	17 Å²	17	45.6 Å²	45.6	8%	0.075	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-92.3	-7.2	178.3	-64.2	-103.1	0	0	0	112.8	K28 L29 L32 K64 I65 T66 W149 D150 Q153	K28-F68 HydrophobicContact CB-CE1 3.89Å; K28-F68 HydrophobicContact CB-CZ 3.67Å; L29-F68 HydrophobicContact CB-CE1 4.33Å; L32-F68 HydrophobicContact CD1-CD2 4.49Å; L32-F68 HydrophobicContact CD1-CE2 3.95Å; L32-F68 HydrophobicContact CD1-CZ 4.07Å; K64-F68 WeakPolarHBondContact O-CD2 3.35Å; K64-F68 VanDerWaalsContact O-CE2 3.27Å; K64-F68 WeakPolarHBondContact O-CE2 3.42Å; I65-F68 WeakPolarHBondContact O-CB 3.45Å; I65-F68 PolarHBondContact O-N 3.05Å; T66-F68 PolarHBondContact O-N 3.09Å; T66-F68 VanDerWaalsContact O-N 3.15Å; F68-W149 HydrophobicContact CB-CD2 4.35Å; F68-W149 HydrophobicContact CB-CH2 3.77Å; F68-W149 HydrophobicContact CB-CZ2 3.35Å; F68-W149 HydrophobicContact CB-CZ3 4.44Å; F68-W149 HydrophobicContact CD1-CH2 4.39Å; F68-W149 AromaticContact CD1-CZ2 3.55Å; F68-W149 HydrophobicContact CD1-CZ2 3.55Å; F68-W149 HydrophobicContact CG-CH2 4.11Å; F68-W149 AromaticContact CG-CZ2 3.63Å; F68-W149 HydrophobicContact CG-CZ2 3.63Å; F68-D150 WeakPolarHBondContact O-CB 2.95Å; F68-D150 PolarHBondContact O-N 3.3Å; F68-Q153 HydrophobicContact CB-CB 4.43Å; F68-Q153 HydrophobicContact CD1-CB 3.77Å; F68-Q153 HydrophobicContact CD1-CG 4.37Å
69	L	96.2	Very high	91.9	Very high	12 Å²	12	43.1 Å²	43.1	6%	0.063	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-109.1	142.5	-173	-55.4	179.2	0	0	0	111.1	I65 T66 G71 G72 G73 C148 W149 F184	I65-L69 HydrophobicContact CG2-CD1 4Å; I65-L69 HydrophobicContact CG2-CD2 4.29Å; I65-L69 HydrophobicContact CG2-CG 4.07Å; T66-L69 PolarHBondContact O-N 3.08Å; T66-L69 VanDerWaalsContact O-N 3.1Å; L69-G71 PolarHBondContact O-N 3.38Å; L69-G72 PolarHBondContact O-N 3.48Å; L69-G73 VanDerWaalsContact CB-N 3.34Å; L69-C148 WeakPolarHBondContact CA-O 3.28Å; L69-W149 HydrophobicContact CD2-CB 4.33Å; L69-W149 HydrophobicContact CD2-CD2 4Å; L69-W149 HydrophobicContact CD2-CE3 3.41Å; L69-W149 VanDerWaalsContact CD2-CE3 3.41Å; L69-W149 HydrophobicContact CD2-CG 4.43Å; L69-W149 HydrophobicContact CD2-CZ3 3.92Å; L69-F184 HydrophobicContact CD1-CB 4.23Å; L69-F184 HydrophobicContact CD1-CD1 3.43Å; L69-F184 VanDerWaalsContact CD1-CD1 3.43Å; L69-F184 HydrophobicContact CD1-CD2 3.86Å; L69-F184 HydrophobicContact CD1-CE1 3.57Å; L69-F184 HydrophobicContact CD1-CE2 3.98Å; L69-F184 HydrophobicContact CD1-CG 3.56Å; L69-F184 HydrophobicContact CD1-CZ 3.82Å
70	Y	93.4	Very high	91.8	Very high	34 Å²	34	42.1 Å²	42.1	13%	0.133	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-65.2	129.1	170.6	-69.5	-53.3	0	0	0	111	G72 G73 K74 G75 K76 V78 C148 D150 I151	Y70-G72 PolarHBondContact O-N 2.91Å; Y70-G72 VanDerWaalsContact O-N 3.12Å; Y70-G73 PolarHBondContact O-N 3.38Å; Y70-K74 PolarHBondContact O-N 3.17Å; Y70-G75 PolarHBondContact O-N 3.47Å; Y70-K76 HydrophobicContact CD1-CB 4.13Å; Y70-K76 HydrophobicContact CD1-CD 3.78Å; Y70-K76 HydrophobicContact CD2-CB 3.44Å; Y70-K76 VanDerWaalsContact CD2-CB 3.44Å; Y70-K76 HydrophobicContact CD2-CD 4.21Å; Y70-K76 HydrophobicContact CD2-CG 4.46Å; Y70-K76 HydrophobicContact CE1-CD 3.79Å; Y70-K76 HydrophobicContact CE2-CB 4.03Å; Y70-K76 HydrophobicContact CE2-CD 4.15Å; Y70-K76 HydrophobicContact CG-CB 3.48Å; Y70-K76 VanDerWaalsContact CG-CB 3.48Å; Y70-K76 HydrophobicContact CG-CD 4.02Å; Y70-K76 HydrophobicContact CG-CG 4.4Å; Y70-V78 HydrophobicContact CE2-CG2 4.28Å; Y70-C148 PolarHBondContact N-O 2.89Å; Y70-D150 HydrophobicContact CD1-CB 4.19Å; Y70-D150 HydrophobicContact CE1-CB 3.8Å; Y70-D150 VanDerWaalsContact CE1-OD1 3.23Å; Y70-D150 WeakPolarHBondContact CE1-OD1 3.47Å; Y70-D150 HydrophobicContact CE2-CB 4.41Å; Y70-D150 PolarHBondContact OH-OD1 2.91Å; Y70-I151 PolarHBondContact OH-N 2.87Å; Y70-I151 VanDerWaalsContact OH-N 3.09Å
71	G	89.8	Confident	91.6	Very high	40 Å²	40	41.7 Å²	41.7	41%	0.412	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	55	28.5	179.8	0	0	0	0	0	113.9	L69 K74	L69-G71 PolarHBondContact O-N 3.38Å; G71-K74 WeakPolarHBondContact O-CB 3.48Å; G71-K74 WeakPolarHBondContact O-CG 3.42Å
72	G	90.9	Very high	91.4	Very high	32 Å²	32	45 Å²	45	33%	0.33	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	68.3	31.5	-177.2	0	0	0	0	0	114.4	L69 Y70	L69-G72 PolarHBondContact O-N 3.48Å; Y70-G72 PolarHBondContact O-N 2.91Å; Y70-G72 VanDerWaalsContact O-N 3.12Å
73	G	91.9	Very high	91.3	Very high	11 Å²	11	39.6 Å²	39.6	11%	0.113	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	101.6	-0.9	-179.3	0	0	0	0	0	114	L69 Y70 G75	L69-G73 VanDerWaalsContact CB-N 3.34Å; Y70-G73 PolarHBondContact O-N 3.38Å; G73-G75 PolarHBondContact O-N 2.8Å
74	K	90.1	Very high	90.9	Very high	112 Å²	112	33.5 Å²	33.5	49%	0.487	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-22	169.9	-77.8	-176.3	-173.8	178.2	0	112.5	Y70 G71 Q121 K186	Y70-K74 PolarHBondContact O-N 3.17Å; G71-K74 WeakPolarHBondContact O-CB 3.48Å; G71-K74 WeakPolarHBondContact O-CG 3.42Å; K74-Q121 VanDerWaalsContact CB-NE2 3.33Å; K74-Q121 PolarHBondContact O-NE2 2.96Å; K74-K186 WeakPolarHBondContact O-CD 3.06Å; K74-K186 WeakPolarHBondContact O-CE 3.43Å; K74-K186 PolarHBondContact O-NZ 2.98Å
75	G	91.1	Very high	90.5	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	20%	0.201	C	C	.	.			trans	74.4	167.7	-178.4	0	0	0	0	0	113.5	Y70 G73 L147	Y70-G75 PolarHBondContact O-N 3.47Å; G73-G75 PolarHBondContact O-N 2.8Å; G75-L147 CarbonylContact C-O 3.55Å; G75-L147 WeakPolarHBondContact CA-O 3.2Å
76	K	92.3	Very high	90	Very high	80 Å²	80	38.5 Å²	38.5	35%	0.348	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.2	-176.6	-175	-177.7	-179.7	-175.2	0	109.8	Y70 V78 E146 L147	Y70-K76 HydrophobicContact CD1-CB 4.13Å; Y70-K76 HydrophobicContact CD1-CD 3.78Å; Y70-K76 HydrophobicContact CD2-CB 3.44Å; Y70-K76 VanDerWaalsContact CD2-CB 3.44Å; Y70-K76 HydrophobicContact CD2-CD 4.21Å; Y70-K76 HydrophobicContact CD2-CG 4.46Å; Y70-K76 HydrophobicContact CE1-CD 3.79Å; Y70-K76 HydrophobicContact CE2-CB 4.03Å; Y70-K76 HydrophobicContact CE2-CD 4.15Å; Y70-K76 HydrophobicContact CG-CB 3.48Å; Y70-K76 VanDerWaalsContact CG-CB 3.48Å; Y70-K76 HydrophobicContact CG-CD 4.02Å; Y70-K76 HydrophobicContact CG-CG 4.4Å; K76-V78 PolarHBondContact O-N 3.15Å; K76-E146 WeakPolarHBondContact O-CA 3.41Å; K76-L147 PolarHBondContact N-O 3.23Å; K76-L147 PolarHBondContact O-N 3.06Å
77	L	90.6	Very high	89.6	Confident	19 Å²	19	36.1 Å²	36.1	10%	0.099	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	113.4	167.9	-66.3	175.6	0	0	0	109.1	L112 Q117 M124 M125 L128 E146	L77-L112 HydrophobicContact CB-CD1 4.22Å; L77-Q117 PolarHBondContact O-NE2 2.85Å; L77-Q117 PolarHBondContact O-OE1 3.3Å; L77-M124 HydrophobicContact CD1-CG 4.44Å; L77-M125 HydrophobicContact CD2-CE 4.36Å; L77-L128 HydrophobicContact CD1-CD1 3.53Å; L77-E146 HydrophobicContact CD2-CB 3.93Å; L77-E146 HydrophobicContact CD2-CG 4.44Å
78	V	90	Very high	88.9	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.1	177.7	-178.8	0	0	0	0	109.1	Y70 K76 I80 E82 L83 Y144 R145 L147 I151	Y70-V78 HydrophobicContact CE2-CG2 4.28Å; K76-V78 PolarHBondContact O-N 3.15Å; V78-I80 PolarHBondContact O-N 3.48Å; V78-E82 HydrophobicContact CG1-CB 4.3Å; V78-L83 HydrophobicContact CG1-CD2 4.03Å; V78-L83 HydrophobicContact CG1-CG 4.16Å; V78-Y144 CarbonylContact O-C 3.42Å; V78-Y144 VanDerWaalsContact O-CA 3.29Å; V78-Y144 WeakPolarHBondContact O-CA 3.45Å; V78-R145 PolarHBondContact N-O 3.24Å; V78-R145 PolarHBondContact O-N 2.87Å; V78-L147 HydrophobicContact CB-CD1 4.38Å; V78-L147 HydrophobicContact CG2-CB 4.48Å; V78-L147 HydrophobicContact CG2-CD1 4.12Å; V78-I151 HydrophobicContact CB-CD1 4.3Å; V78-I151 HydrophobicContact CG1-CD1 3.63Å; V78-I151 HydrophobicContact CG2-CD1 3.9Å
79	P	88.5	Confident	88.3	Confident	7 Å²	7	35.5 Å²	35.5	5%	0.045	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.6	172.8	-14	24.9	0	0	0	111	S81 E82 L83 N110 Y144	P79-S81 PolarHBondContact O-N 2.76Å; P79-E82 HydrophobicContact CB-CB 4.43Å; P79-E82 VanDerWaalsContact O-CB 3.3Å; P79-E82 WeakPolarHBondContact O-CB 3.41Å; P79-E82 PolarHBondContact O-N 3.49Å; P79-L83 PolarHBondContact O-N 2.81Å; P79-N110 HydrophobicContact CG-CB 4.45Å; P79-N110 VanDerWaalsContact CG-CG 3.46Å; P79-N110 WeakPolarHBondContact CG-OD1 3.28Å; P79-Y144 HydrophobicContact CB-CD1 4.22Å; P79-Y144 HydrophobicContact CB-CE1 4.04Å; P79-Y144 HydrophobicContact CG-CD1 4.26Å; P79-Y144 HydrophobicContact CG-CE1 3.96Å
80	I	88.3	Confident	87.6	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.082	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-32.1	175.8	-76.7	169	0	0	0	111.5	V78 E82 L83 I84 S142 K143 R145 E250	V78-I80 PolarHBondContact O-N 3.48Å; I80-E82 PolarHBondContact O-N 2.63Å; I80-L83 PolarHBondContact O-N 3.22Å; I80-L83 VanDerWaalsContact O-N 3.15Å; I80-I84 HydrophobicContact CG2-CD1 3.5Å; I80-I84 VanDerWaalsContact CG2-CD1 3.5Å; I80-I84 HydrophobicContact CG2-CG1 4.06Å; I80-I84 WeakPolarHBondContact O-CB 3.18Å; I80-I84 VanDerWaalsContact O-CG1 3.3Å; I80-I84 WeakPolarHBondContact O-CG1 3.37Å; I80-I84 PolarHBondContact O-N 3.02Å; I80-S142 WeakPolarHBondContact CD1-O 3.41Å; I80-K143 WeakPolarHBondContact CB-O 3.37Å; I80-K143 PolarHBondContact N-O 3.15Å; I80-R145 HydrophobicContact CG1-CB 4.42Å; I80-E250 HydrophobicContact CB-CG 4.5Å; I80-E250 HydrophobicContact CD1-CB 4.15Å; I80-E250 HydrophobicContact CD1-CG 4.3Å; I80-E250 WeakPolarHBondContact CD1-OE2 3.33Å; I80-E250 HydrophobicContact CG1-CG 4.2Å; I80-E250 HydrophobicContact CG2-CB 3.77Å; I80-E250 HydrophobicContact CG2-CG 3.63Å
81	S	83.5	Confident	86.8	Confident	21 Å²	21	36.6 Å²	36.6	15%	0.147	20%	0.2	C	C	.	.	H	α-helix	trans	-58.4	-32.6	174.2	54.3	0	0	0	0	113.2	P79 K85	P79-S81 PolarHBondContact O-N 2.76Å; S81-K85 WeakPolarHBondContact O-CB 3.48Å; S81-K85 PolarHBondContact O-N 3.29Å
82	E	87.4	Confident	86	Confident	71 Å²	71	36 Å²	36	33%	0.332	19%	0.187	S	C	.	.	H	α-helix	trans	-70.2	-44.8	176.1	-171.1	179.6	163	0	0	110.9	V78 P79 I80 K85 L86	V78-E82 HydrophobicContact CG1-CB 4.3Å; P79-E82 HydrophobicContact CB-CB 4.43Å; P79-E82 VanDerWaalsContact O-CB 3.3Å; P79-E82 WeakPolarHBondContact O-CB 3.41Å; P79-E82 PolarHBondContact O-N 3.49Å; I80-E82 PolarHBondContact O-N 2.63Å; E82-K85 WeakPolarHBondContact O-CB 3.43Å; E82-K85 PolarHBondContact O-N 2.64Å; E82-L86 WeakPolarHBondContact O-CG 3.4Å; E82-L86 PolarHBondContact O-N 3.37Å
83	L	89.3	Confident	85.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-42.5	177	-57.5	179.5	0	0	0	111.9	V78 P79 I80 K85 L86 R87 R145 L147 I151 I193 Y198	V78-L83 HydrophobicContact CG1-CD2 4.03Å; V78-L83 HydrophobicContact CG1-CG 4.16Å; P79-L83 PolarHBondContact O-N 2.81Å; I80-L83 PolarHBondContact O-N 3.22Å; I80-L83 VanDerWaalsContact O-N 3.15Å; L83-K85 VanDerWaalsContact C-N 3.31Å; L83-K85 PolarHBondContact O-N 2.89Å; L83-L86 PolarHBondContact O-N 3.45Å; L83-R87 WeakPolarHBondContact O-CB 3.45Å; L83-R87 PolarHBondContact O-N 3.45Å; L83-R145 HydrophobicContact CD1-CB 4.18Å; L83-L147 HydrophobicContact CD1-CD1 4.46Å; L83-L147 HydrophobicContact CD2-CD1 4.07Å; L83-I151 HydrophobicContact CD2-CD1 3.71Å; L83-I193 HydrophobicContact CD2-CG2 4.47Å; L83-Y198 HydrophobicContact CB-CE2 4.27Å; L83-Y198 VanDerWaalsContact CB-OH 3.28Å; L83-Y198 WeakPolarHBondContact CB-OH 3.34Å; L83-Y198 WeakPolarHBondContact CD1-OH 3.3Å
84	I	84.5	Confident	84.2	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-40.7	174.3	-73	171.7	0	0	0	111	I80 R87 N88 D245 S246 H249	I80-I84 HydrophobicContact CG2-CD1 3.5Å; I80-I84 VanDerWaalsContact CG2-CD1 3.5Å; I80-I84 HydrophobicContact CG2-CG1 4.06Å; I80-I84 WeakPolarHBondContact O-CB 3.18Å; I80-I84 VanDerWaalsContact O-CG1 3.3Å; I80-I84 WeakPolarHBondContact O-CG1 3.37Å; I80-I84 PolarHBondContact O-N 3.02Å; I84-R87 PolarHBondContact O-N 3.21Å; I84-N88 VanDerWaalsContact CG2-ND2 3.34Å; I84-N88 WeakPolarHBondContact CG2-ND2 3.35Å; I84-N88 WeakPolarHBondContact O-CB 3.34Å; I84-N88 PolarHBondContact O-N 2.76Å; I84-N88 PolarHBondContact O-ND2 2.96Å; I84-D245 HydrophobicContact CG2-CB 3.79Å; I84-D245 WeakPolarHBondContact CG2-OD1 3.48Å; I84-S246 WeakPolarHBondContact CD1-O 3.3Å; I84-H249 WeakPolarHBondContact CD1-O 3.46Å
85	K	83.9	Confident	83.1	Confident	103 Å²	103	36 Å²	36	45%	0.448	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-48.3	176.4	-176.8	-174.4	172.5	-169.8	0	111.1	S81 E82 L83 R87 N88 D89	S81-K85 WeakPolarHBondContact O-CB 3.48Å; S81-K85 PolarHBondContact O-N 3.29Å; E82-K85 WeakPolarHBondContact O-CB 3.43Å; E82-K85 PolarHBondContact O-N 2.64Å; L83-K85 VanDerWaalsContact C-N 3.31Å; L83-K85 PolarHBondContact O-N 2.89Å; K85-R87 VanDerWaalsContact C-N 3.31Å; K85-R87 PolarHBondContact O-N 2.63Å; K85-N88 PolarHBondContact O-N 3.14Å; K85-D89 WeakPolarHBondContact O-CB 3.46Å; K85-D89 VanDerWaalsContact O-CG 3.26Å; K85-D89 PolarHBondContact O-N 3.11Å
86	L	85.5	Confident	81.5	Confident	68 Å²	68	39 Å²	39	36%	0.356	21%	0.208	S	C	.	.	H	α-helix	trans	-56.4	-46.4	177.4	-70	170.4	0	0	0	111.7	E82 L83 D89 E90 I151	E82-L86 WeakPolarHBondContact O-CG 3.4Å; E82-L86 PolarHBondContact O-N 3.37Å; L83-L86 PolarHBondContact O-N 3.45Å; L86-D89 PolarHBondContact O-N 3.37Å; L86-E90 PolarHBondContact O-N 3.17Å; L86-I151 HydrophobicContact CD1-CG2 3.62Å
87	R	85	Confident	79.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-45.8	176	-179.4	169.3	67.6	-173.6	-4.7	112.6	L83 I84 K85 E90 R91 E195 Y230 D245 E250	L83-R87 WeakPolarHBondContact O-CB 3.45Å; L83-R87 PolarHBondContact O-N 3.45Å; I84-R87 PolarHBondContact O-N 3.21Å; K85-R87 VanDerWaalsContact C-N 3.31Å; K85-R87 PolarHBondContact O-N 2.63Å; R87-E90 PolarHBondContact O-N 3.18Å; R87-R91 PolarHBondContact O-N 3.33Å; R87-E195 WeakPolarHBondContact CD-OE2 3.27Å; R87-E195 HydrophobicContact CG-CB 4.29Å; R87-E195 WeakPolarHBondContact CG-OE2 3.48Å; R87-Y230 VanDerWaalsContact NH1-CE2 3.29Å; R87-D245 IonicContact CZ-OD1 2.77Å; R87-D245 IonicContact NE-OD1 3.11Å; R87-D245 PolarHBondContact NE-OD1 3.42Å; R87-D245 IonicContact NE-OD2 3.54Å; R87-D245 IonicContact NH2-OD1 3.34Å; R87-D245 PolarHBondContact NH2-OD1 3.01Å; R87-E250 PolarHBondContact NH2-O 2.71Å
88	N	80.6	Confident	78.2	Confident	14 Å²	14	45.7 Å²	45.7	8%	0.075	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-39.1	177.3	-82.5	-50.7	0	0	0	112.7	I84 K85 E90 R91 N92 D245	I84-N88 VanDerWaalsContact CG2-ND2 3.34Å; I84-N88 WeakPolarHBondContact CG2-ND2 3.35Å; I84-N88 WeakPolarHBondContact O-CB 3.34Å; I84-N88 PolarHBondContact O-N 2.76Å; I84-N88 PolarHBondContact O-ND2 2.96Å; K85-N88 PolarHBondContact O-N 3.14Å; N88-E90 VanDerWaalsContact C-N 3.34Å; N88-R91 PolarHBondContact O-N 2.99Å; N88-R91 PolarHBondContact OD1-NH1 3.17Å; N88-N92 VanDerWaalsContact O-CB 3.28Å; N88-N92 WeakPolarHBondContact O-CB 3.11Å; N88-N92 PolarHBondContact O-N 3.5Å; N88-N92 PolarHBondContact O-ND2 2.76Å; N88-N92 VanDerWaalsContact O-ND2 3.07Å; N88-D245 PolarHBondContact OD1-OD2 3.2Å; N88-D245 VanDerWaalsContact OD1-OD2 3.08Å
89	D	82.1	Confident	76.1	Confident	85 Å²	85	57.2 Å²	57.2	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-42.5	176.6	-71.1	-20.5	0	0	0	110.1	K85 L86 N92 A93	K85-D89 WeakPolarHBondContact O-CB 3.46Å; K85-D89 VanDerWaalsContact O-CG 3.26Å; K85-D89 PolarHBondContact O-N 3.11Å; L86-D89 PolarHBondContact O-N 3.37Å; D89-N92 PolarHBondContact O-N 3.46Å; D89-A93 WeakPolarHBondContact O-CB 3.5Å; D89-A93 PolarHBondContact O-N 2.96Å
90	E	80.8	Confident	74.1	Confident	34 Å²	34	63.8 Å²	63.8	16%	0.159	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-48.9	174.3	-160.6	-169.8	171.5	0	0	112.1	R20 L86 R87 N88 N92 A93 M94 S194 E195	R20-E90 IonicContact CZ-OE1 3.24Å; R20-E90 IonicContact NH1-OE1 2.79Å; R20-E90 PolarHBondContact NH1-OE1 3.38Å; R20-E90 IonicContact NH2-OE1 3.94Å; L86-E90 PolarHBondContact O-N 3.17Å; R87-E90 PolarHBondContact O-N 3.18Å; N88-E90 VanDerWaalsContact C-N 3.34Å; E90-N92 VanDerWaalsContact C-N 3.33Å; E90-N92 PolarHBondContact O-N 2.92Å; E90-A93 WeakPolarHBondContact O-CB 3.29Å; E90-A93 PolarHBondContact O-N 3.48Å; E90-M94 HydrophobicContact CG-CE 3.84Å; E90-M94 WeakPolarHBondContact O-CG 3.5Å; E90-M94 PolarHBondContact O-N 3.02Å; E90-M94 VanDerWaalsContact OE1-CE 3.23Å; E90-M94 WeakPolarHBondContact OE1-CE 3.22Å; E90-S194 WeakPolarHBondContact OE2-CA 3.44Å; E90-E195 PolarHBondContact OE2-N 3.5Å
91	R	77.5	Confident	72	Confident	35 Å²	35	72.7 Å²	72.7	13%	0.132	36%	0.357	C	S	.	.	H	α-helix	trans	-60.2	-42.8	178.5	-166.6	-175.5	-59.7	130.5	8.6	111.6	R87 N88 M94 L95 E195 D245	R87-R91 PolarHBondContact O-N 3.33Å; N88-R91 PolarHBondContact O-N 2.99Å; N88-R91 PolarHBondContact OD1-NH1 3.17Å; R91-M94 PolarHBondContact O-N 3.33Å; R91-L95 WeakPolarHBondContact O-CG 3.29Å; R91-L95 PolarHBondContact O-N 2.84Å; R91-E195 IonicContact CZ-OE1 3.71Å; R91-E195 IonicContact CZ-OE2 2.63Å; R91-E195 IonicContact NE-OE1 3.34Å; R91-E195 PolarHBondContact NE-OE1 3.27Å; R91-E195 IonicContact NE-OE2 3.2Å; R91-E195 VanDerWaalsContact NH2-CD 3.34Å; R91-E195 IonicContact NH2-OE1 3.72Å; R91-E195 PolarHBondContact NH2-OE1 2.78Å; R91-E195 VanDerWaalsContact NH2-OE1 3.11Å; R91-E195 IonicContact NH2-OE2 3.69Å; R91-E195 PolarHBondContact NH2-OE2 3.18Å; R91-D245 IonicContact CZ-OD2 2.73Å; R91-D245 VanDerWaalsContact CZ-OD2 3.22Å; R91-D245 IonicContact NH1-OD2 2.67Å; R91-D245 PolarHBondContact NH1-OD2 3.25Å; R91-D245 IonicContact NH2-OD2 3.39Å; R91-D245 PolarHBondContact NH2-OD2 3.38Å
92	N	73.1	Confident	70.2	Confident	28 Å²	28	79.3 Å²	79.3	15%	0.15	38%	0.383	C	S	.	.	H	α-helix	trans	-67.2	-34.8	177.5	-80.3	-42.5	0	0	0	112.7	N88 D89 E90 L95 S96 G103	N88-N92 VanDerWaalsContact O-CB 3.28Å; N88-N92 WeakPolarHBondContact O-CB 3.11Å; N88-N92 PolarHBondContact O-N 3.5Å; N88-N92 PolarHBondContact O-ND2 2.76Å; N88-N92 VanDerWaalsContact O-ND2 3.07Å; D89-N92 PolarHBondContact O-N 3.46Å; E90-N92 VanDerWaalsContact C-N 3.33Å; E90-N92 PolarHBondContact O-N 2.92Å; N92-L95 PolarHBondContact O-N 3.43Å; N92-S96 WeakPolarHBondContact O-CB 3.34Å; N92-S96 PolarHBondContact O-N 3.1Å; N92-G103 PolarHBondContact ND2-O 2.85Å; N92-G103 PolarHBondContact OD1-N 2.83Å; N92-G103 PolarHBondContact OD1-O 3.34Å
93	A	74.7	Confident	68.3	Low	59 Å²	59	78 Å²	78	49%	0.488	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-43.1	173.2	0	0	0	0	0	111.2	D89 E90 S96 T97	D89-A93 WeakPolarHBondContact O-CB 3.5Å; D89-A93 PolarHBondContact O-N 2.96Å; E90-A93 WeakPolarHBondContact O-CB 3.29Å; E90-A93 PolarHBondContact O-N 3.48Å; A93-S96 PolarHBondContact O-N 3.13Å; A93-T97 PolarHBondContact O-N 3.2Å
94	M	70.2	Confident	66.1	Low	49 Å²	49	87.8 Å²	87.8	24%	0.241	43%	0.431	C	S	.	.	H	α-helix	trans	-65.8	-36.9	175.2	-63.5	-168.8	-149.2	0	0	113.1	E90 R91 T97 L98 E195	E90-M94 HydrophobicContact CG-CE 3.84Å; E90-M94 WeakPolarHBondContact O-CG 3.5Å; E90-M94 PolarHBondContact O-N 3.02Å; E90-M94 VanDerWaalsContact OE1-CE 3.23Å; E90-M94 WeakPolarHBondContact OE1-CE 3.22Å; R91-M94 PolarHBondContact O-N 3.33Å; M94-T97 PolarHBondContact O-N 3.1Å; M94-T97 PolarHBondContact O-OG1 3.31Å; M94-L98 PolarHBondContact O-N 3.42Å; M94-E195 HydrophobicContact CE-CB 4.37Å
95	L	65.8	Low	64.2	Low	47 Å²	47	89.5 Å²	89.5	25%	0.246	45%	0.45	C	S	.	.	H	α-helix	trans	-70.2	-32.5	176.5	-71.7	171.1	0	0	0	112.7	R91 N92 T97 L98 R99 R100	R91-L95 WeakPolarHBondContact O-CG 3.29Å; R91-L95 PolarHBondContact O-N 2.84Å; N92-L95 PolarHBondContact O-N 3.43Å; L95-T97 VanDerWaalsContact C-N 3.31Å; L95-T97 PolarHBondContact O-N 3.04Å; L95-L98 CarbonylContact O-C 3.57Å; L95-L98 PolarHBondContact O-N 3.44Å; L95-L98 VanDerWaalsContact O-N 3.13Å; L95-R99 PolarHBondContact O-N 3.22Å; L95-R99 VanDerWaalsContact O-N 3.12Å; L95-R100 HydrophobicContact CD2-CB 4.06Å; L95-R100 PolarHBondContact O-N 2.77Å
96	S	57.6	Low	62.4	Low	76 Å²	76	92.3 Å²	92.3	53%	0.531	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-35.2	177.3	-170.5	0	0	0	0	112.1	N92 A93 L98	N92-S96 WeakPolarHBondContact O-CB 3.34Å; N92-S96 PolarHBondContact O-N 3.1Å; A93-S96 PolarHBondContact O-N 3.13Å; S96-L98 VanDerWaalsContact C-N 3.28Å
97	T	57.7	Low	60.4	Low	115 Å²	115	92.7 Å²	92.7	71%	0.706	47%	0.471	S	S	*	.	H	α-helix	trans	-71.4	-26.3	174.1	60.1	0	0	0	0	111.9	A93 M94 L95	A93-T97 PolarHBondContact O-N 3.2Å; M94-T97 PolarHBondContact O-N 3.1Å; M94-T97 PolarHBondContact O-OG1 3.31Å; L95-T97 VanDerWaalsContact C-N 3.31Å; L95-T97 PolarHBondContact O-N 3.04Å
98	L	55.8	Low	58.8	Low	125 Å²	125	93.6 Å²	93.6	65%	0.654	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	7.6	-179.1	-67.3	168.8	0	0	0	114.9	M94 L95 S96 R100	M94-L98 PolarHBondContact O-N 3.42Å; L95-L98 CarbonylContact O-C 3.57Å; L95-L98 PolarHBondContact O-N 3.44Å; L95-L98 VanDerWaalsContact O-N 3.13Å; S96-L98 VanDerWaalsContact C-N 3.28Å; L98-R100 PolarHBondContact O-N 2.91Å
99	R	47.3	Very low	57.4	Low	244 Å²	244	98.8 Å²	98.8	92%	0.921	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	40.4	-177.9	-69.2	-171.9	171.4	-161.6	-0.8	114.8	L95	L95-R99 PolarHBondContact O-N 3.22Å; L95-R99 VanDerWaalsContact O-N 3.12Å
100	R	46.4	Very low	56	Low	146 Å²	146	97 Å²	97	55%	0.551	51%	0.505	S	S	*	.			trans	-109.7	155.9	170.4	-81.6	174.3	97	161.9	-7.3	112.6	L95 L98 E241	L95-R100 HydrophobicContact CD2-CB 4.06Å; L95-R100 PolarHBondContact O-N 2.77Å; L98-R100 PolarHBondContact O-N 2.91Å; R100-E241 IonicContact CZ-OE2 3.52Å; R100-E241 VanDerWaalsContact CZ-OE2 3.29Å; R100-E241 VanDerWaalsContact NH1-CD 3.32Å; R100-E241 IonicContact NH1-OE1 3.22Å; R100-E241 PolarHBondContact NH1-OE1 3.45Å; R100-E241 IonicContact NH1-OE2 2.89Å; R100-E241 PolarHBondContact NH1-OE2 3.28Å; R100-E241 IonicContact NH2-OE2 2.8Å; R100-E241 PolarHBondContact NH2-OE2 3.14Å
101	K	44.1	Very low	54.9	Low	202 Å²	202	101.2 Å²	101.2	88%	0.878	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-58.8	133.3	-174.5	-81.9	-177.3	176.4	176.9	0	111.7
102	K	45.4	Very low	53.8	Low	160 Å²	160	100.2 Å²	100.2	70%	0.696	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-64.4	128.3	173.4	-77.6	-177.6	174	-178.7	0	111.3
103	G	48.4	Very low	53	Low	45 Å²	45	105.9 Å²	105.9	46%	0.464	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-88.1	124.5	161.5	0	0	0	0	0	109.1	N92 G105	N92-G103 PolarHBondContact ND2-O 2.85Å; N92-G103 PolarHBondContact OD1-N 2.83Å; N92-G103 PolarHBondContact OD1-O 3.34Å; G103-G105 PolarHBondContact O-N 3Å; G103-G105 VanDerWaalsContact O-N 3.1Å
104	K	42.4	Very low	52.2	Low	205 Å²	205	110.5 Å²	110.5	89%	0.891	57%	0.566	S	S	*	*			trans	-69.7	107.2	174.3	-73.2	-174.1	177.3	-178.4	0	108.6	K106	K104-K106 PolarHBondContact O-N 3.37Å
105	G	44.6	Very low	51.5	Low	39 Å²	39	110.9 Å²	110.9	40%	0.402	57%	0.571	S	S	.	*			trans	-58.2	131.8	166.5	0	0	0	0	0	109.3	G103	G103-G105 PolarHBondContact O-N 3Å; G103-G105 VanDerWaalsContact O-N 3.1Å
106	K	44.8	Very low	51.4	Low	162 Å²	162	113.5 Å²	113.5	70%	0.704	59%	0.586	S	S	*	*			trans	-88.8	141.6	173	-65	178.8	-176.3	173.7	0	107.6	K104 M247	K104-K106 PolarHBondContact O-N 3.37Å; K106-M247 HydrophobicContact CB-CG 3.82Å; K106-M247 HydrophobicContact CB-SD 3.71Å
107	S	45.1	Very low	51.7	Low	77 Å²	77	111.2 Å²	111.2	54%	0.538	57%	0.567	S	S	.	*			trans	-126.1	129.7	176.2	176.4	0	0	0	0	108
108	G	50.2	Low	52	Low	19 Å²	19	110.5 Å²	110.5	20%	0.196	56%	0.558	C	S	.	*			trans	-90.7	165.5	176.3	0	0	0	0	0	111.4
109	P	52.1	Low	52	Low	123 Å²	123	111.5 Å²	111.5	80%	0.799	56%	0.564	S	S	*	*			trans	-65.3	136.1	178.7	24.8	-31.2	0	0	0	111.9
110	N	52.6	Low	52.2	Low	48 Å²	48	105.3 Å²	105.3	26%	0.257	55%	0.547	S	S	.	.			trans	-92.9	98.3	176.5	-175.8	-0.8	0	0	0	110.7	P79 L112 E113	P79-N110 HydrophobicContact CG-CB 4.45Å; P79-N110 VanDerWaalsContact CG-CG 3.46Å; P79-N110 WeakPolarHBondContact CG-OD1 3.28Å; N110-L112 PolarHBondContact O-N 3Å; N110-L112 PolarHBondContact OD1-N 3.3Å; N110-L112 VanDerWaalsContact OD1-N 3.1Å; N110-E113 HydrophobicContact CB-CB 4.27Å; N110-E113 PolarHBondContact O-N 3.05Å; N110-E113 PolarHBondContact OD1-N 3.45Å
111	I	56.9	Low	52.5	Low	121 Å²	121	103 Å²	103	62%	0.621	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.2	-177.7	-56	166.6	0	0	0	111.9
112	L	55.6	Low	53.1	Low	14 Å²	14	95.8 Å²	95.8	7%	0.073	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	3.5	-177.8	-65.7	-175.9	0	0	0	113.9	L77 N110 N114 V115 L128 Y144	L77-L112 HydrophobicContact CB-CD1 4.22Å; N110-L112 PolarHBondContact O-N 3Å; N110-L112 PolarHBondContact OD1-N 3.3Å; N110-L112 VanDerWaalsContact OD1-N 3.1Å; L112-N114 PolarHBondContact O-N 3.08Å; L112-N114 VanDerWaalsContact O-N 3.16Å; L112-V115 HydrophobicContact CD2-CB 4.11Å; L112-V115 HydrophobicContact CD2-CG1 4.43Å; L112-V115 HydrophobicContact CD2-CG2 4.01Å; L112-V115 PolarHBondContact O-N 3.15Å; L112-V115 VanDerWaalsContact O-N 3.14Å; L112-L128 HydrophobicContact CD1-CD1 3.97Å; L112-L128 HydrophobicContact CD2-CD1 4.44Å; L112-L128 HydrophobicContact CD2-CD2 4.26Å; L112-Y144 HydrophobicContact CB-CE1 4.21Å; L112-Y144 HydrophobicContact CD1-CD1 3.45Å; L112-Y144 VanDerWaalsContact CD1-CD1 3.45Å; L112-Y144 HydrophobicContact CD1-CE1 3.17Å; L112-Y144 HydrophobicContact CD1-CG 4.24Å; L112-Y144 HydrophobicContact CG-CD1 4.29Å; L112-Y144 HydrophobicContact CG-CE1 3.5Å
113	E	55.8	Low	53.7	Low	147 Å²	147	94.1 Å²	94.1	69%	0.687	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-36.6	-175.7	-169.9	169.8	-162.7	0	0	112.4	N110	N110-E113 HydrophobicContact CB-CB 4.27Å; N110-E113 PolarHBondContact O-N 3.05Å; N110-E113 PolarHBondContact OD1-N 3.45Å
114	N	56.5	Low	54.3	Low	157 Å²	157	93.4 Å²	93.4	84%	0.84	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	9.9	-177.5	-62.5	-34.7	0	0	0	114.1	L112	L112-N114 PolarHBondContact O-N 3.08Å; L112-N114 VanDerWaalsContact O-N 3.16Å
115	V	56.6	Low	54.9	Low	57 Å²	57	86.9 Å²	86.9	35%	0.345	48%	0.483	S	S	.	.			trans	-99.1	115.6	-177.3	-177.8	0	0	0	0	109.6	L112 Q117 M124	L112-V115 HydrophobicContact CD2-CB 4.11Å; L112-V115 HydrophobicContact CD2-CG1 4.43Å; L112-V115 HydrophobicContact CD2-CG2 4.01Å; L112-V115 PolarHBondContact O-N 3.15Å; L112-V115 VanDerWaalsContact O-N 3.14Å; V115-Q117 PolarHBondContact O-N 3.4Å; V115-Q117 VanDerWaalsContact O-N 3.14Å; V115-M124 HydrophobicContact CG1-CE 3.51Å
116	N	63.9	Low	55.6	Low	102 Å²	102	91.5 Å²	91.5	55%	0.545	49%	0.492	S	S	.	.			trans	-70.9	107.6	173.2	-173.4	-11.9	0	0	0	110	D118	N116-D118 WeakPolarHBondContact OD1-CB 3.43Å; N116-D118 PolarHBondContact OD1-N 3.09Å; N116-D118 VanDerWaalsContact OD1-N 3.08Å; N116-D118 PolarHBondContact OD1-OD2 3.04Å
117	Q	64.1	Low	56.4	Low	28 Å²	28	85.9 Å²	85.9	13%	0.131	48%	0.476	C	S	.	.			trans	-85.4	-10.9	-176	-60.9	-175.8	26.9	0	0	113.7	L77 V115 N119 M120 M124	L77-Q117 PolarHBondContact O-NE2 2.85Å; L77-Q117 PolarHBondContact O-OE1 3.3Å; V115-Q117 PolarHBondContact O-N 3.4Å; V115-Q117 VanDerWaalsContact O-N 3.14Å; Q117-N119 PolarHBondContact O-N 3.31Å; Q117-N119 VanDerWaalsContact O-N 3.09Å; Q117-M120 PolarHBondContact O-N 3.23Å; Q117-M124 HydrophobicContact CG-SD 4.29Å
118	D	62.6	Low	57.1	Low	100 Å²	100	83.1 Å²	83.1	54%	0.535	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.9	-170.6	-67.3	-26.8	0	0	0	113.4	N116	N116-D118 WeakPolarHBondContact OD1-CB 3.43Å; N116-D118 PolarHBondContact OD1-N 3.09Å; N116-D118 VanDerWaalsContact OD1-N 3.08Å; N116-D118 PolarHBondContact OD1-OD2 3.04Å
119	N	56.2	Low	57.3	Low	145 Å²	145	88.2 Å²	88.2	78%	0.775	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	1.8	-173.8	-70.8	-19.1	0	0	0	115	Q117	Q117-N119 PolarHBondContact O-N 3.31Å; Q117-N119 VanDerWaalsContact O-N 3.09Å
120	M	51.8	Low	57.5	Low	114 Å²	114	92.1 Å²	92.1	56%	0.562	47%	0.47	S	S	*	.			trans	-124.9	56.3	-167.3	-66.4	-163.4	176.6	0	0	114.3	Q117 M124	Q117-M120 PolarHBondContact O-N 3.23Å; M120-M124 HydrophobicContact CB-CB 4.45Å; M120-M124 HydrophobicContact CB-CE 4.01Å; M120-M124 HydrophobicContact CG-CE 4.47Å; M120-M124 WeakPolarHBondContact O-CB 3.23Å; M120-M124 HydrophobicContact SD-CE 3.71Å
121	Q	53.7	Low	57.6	Low	99 Å²	99	96.3 Å²	96.3	46%	0.463	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	139.6	-178.4	-89.3	-177.9	-22.8	0	0	114.7	K74 D123	K74-Q121 VanDerWaalsContact CB-NE2 3.33Å; K74-Q121 PolarHBondContact O-NE2 2.96Å; Q121-D123 PolarHBondContact O-N 3.48Å
122	G	55.2	Low	57.6	Low	50 Å²	50	92.6 Å²	92.6	52%	0.515	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-55.6	174.8	0	0	0	0	0	114.2
123	D	59.2	Low	57.1	Low	125 Å²	125	94.5 Å²	94.5	67%	0.668	50%	0.496	S	S	*	.	H	α-helix	trans	-74.6	-33.6	-178.1	-83.6	-17.5	0	0	0	112.9	Q121 M125 K126 A127	Q121-D123 PolarHBondContact O-N 3.48Å; D123-M125 PolarHBondContact O-N 3.09Å; D123-K126 PolarHBondContact O-N 3.39Å; D123-A127 WeakPolarHBondContact O-CB 3.37Å; D123-A127 PolarHBondContact O-N 3.37Å
124	M	60.2	Low	56.4	Low	30 Å²	30	90.4 Å²	90.4	15%	0.148	49%	0.494	C	S	.	.	H	α-helix	trans	-64.8	-38.8	178.3	-177.4	174.3	-81.7	0	0	112.3	L77 V115 Q117 M120 K126 A127 L128	L77-M124 HydrophobicContact CD1-CG 4.44Å; V115-M124 HydrophobicContact CG1-CE 3.51Å; Q117-M124 HydrophobicContact CG-SD 4.29Å; M120-M124 HydrophobicContact CB-CB 4.45Å; M120-M124 HydrophobicContact CB-CE 4.01Å; M120-M124 HydrophobicContact CG-CE 4.47Å; M120-M124 WeakPolarHBondContact O-CB 3.23Å; M120-M124 HydrophobicContact SD-CE 3.71Å; M124-K126 VanDerWaalsContact C-N 3.35Å; M124-K126 PolarHBondContact O-N 2.8Å; M124-A127 CarbonylContact O-C 3.59Å; M124-A127 PolarHBondContact O-N 2.85Å; M124-L128 HydrophobicContact CG-CD1 3.69Å; M124-L128 HydrophobicContact CG-CG 4.16Å; M124-L128 WeakPolarHBondContact O-CB 3.48Å; M124-L128 WeakPolarHBondContact O-CG 3.39Å; M124-L128 PolarHBondContact O-N 3.29Å; M124-L128 HydrophobicContact SD-CD1 4.3Å
125	M	54.3	Low	55.3	Low	67 Å²	67	87 Å²	87	33%	0.33	50%	0.495	S	S	.	.	H	α-helix	trans	-65.3	-40.5	177.7	-169.2	-169.7	-76.7	0	0	111.1	L77 D123 A127 K129 E146	L77-M125 HydrophobicContact CD2-CE 4.36Å; D123-M125 PolarHBondContact O-N 3.09Å; M125-A127 VanDerWaalsContact C-N 3.35Å; M125-K129 WeakPolarHBondContact O-CB 3.3Å; M125-K129 WeakPolarHBondContact O-CG 3.46Å; M125-K129 PolarHBondContact O-N 2.97Å; M125-E146 VanDerWaalsContact CE-OE2 3.25Å; M125-E146 WeakPolarHBondContact CE-OE2 3.48Å
126	K	60	Low	54.2	Low	136 Å²	136	87.1 Å²	87.1	59%	0.591	51%	0.509	S	S	*	.	H	α-helix	trans	-65.2	-39.1	172.6	-72.4	176.8	-176.9	169.1	0	111.4	D123 M124 R130	D123-K126 PolarHBondContact O-N 3.39Å; M124-K126 VanDerWaalsContact C-N 3.35Å; M124-K126 PolarHBondContact O-N 2.8Å; K126-R130 VanDerWaalsContact O-CG 3.29Å; K126-R130 WeakPolarHBondContact O-CG 3.5Å; K126-R130 PolarHBondContact O-N 3.33Å; K126-R130 VanDerWaalsContact O-N 3.17Å
127	A	62.2	Low	52.8	Low	45 Å²	45	92.2 Å²	92.2	37%	0.372	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-45.6	178.7	0	0	0	0	0	112.4	D123 M124 M125 R130 L131	D123-A127 WeakPolarHBondContact O-CB 3.37Å; D123-A127 PolarHBondContact O-N 3.37Å; M124-A127 CarbonylContact O-C 3.59Å; M124-A127 PolarHBondContact O-N 2.85Å; M125-A127 VanDerWaalsContact C-N 3.35Å; A127-R130 CarbonylContact O-C 3.34Å; A127-R130 WeakPolarHBondContact O-CA 3.3Å; A127-R130 WeakPolarHBondContact O-CB 3.35Å; A127-R130 PolarHBondContact O-N 3.45Å; A127-R130 VanDerWaalsContact O-N 3.09Å; A127-L131 WeakPolarHBondContact O-CG 3.47Å; A127-L131 PolarHBondContact O-N 3.19Å
128	L	58.9	Low	51.5	Low	18 Å²	18	100.3 Å²	100.3	9%	0.094	56%	0.564	C	S	.	*	H	α-helix	trans	-64	-44	176.8	-77.7	165.2	0	0	0	111.5	L77 L112 M124 R130 L131 D132 Y144	L77-L128 HydrophobicContact CD1-CD1 3.53Å; L112-L128 HydrophobicContact CD1-CD1 3.97Å; L112-L128 HydrophobicContact CD2-CD1 4.44Å; L112-L128 HydrophobicContact CD2-CD2 4.26Å; M124-L128 HydrophobicContact CG-CD1 3.69Å; M124-L128 HydrophobicContact CG-CG 4.16Å; M124-L128 WeakPolarHBondContact O-CB 3.48Å; M124-L128 WeakPolarHBondContact O-CG 3.39Å; M124-L128 PolarHBondContact O-N 3.29Å; M124-L128 HydrophobicContact SD-CD1 4.3Å; L128-R130 PolarHBondContact O-N 3.48Å; L128-L131 HydrophobicContact CD2-CD1 4.41Å; L128-L131 PolarHBondContact O-N 3.17Å; L128-L131 VanDerWaalsContact O-N 3.09Å; L128-D132 PolarHBondContact O-N 3.18Å; L128-Y144 HydrophobicContact CD1-CD2 4.35Å; L128-Y144 HydrophobicContact CD2-CD2 4.32Å; L128-Y144 HydrophobicContact CD2-CE2 3.79Å
129	K	54.8	Low	50.4	Low	127 Å²	127	99.2 Å²	99.2	55%	0.552	58%	0.577	S	S	*	*	H	α-helix	trans	-57.8	-31.7	172.1	-78.1	-177.2	178.2	-179.2	0	112.7	M125	M125-K129 WeakPolarHBondContact O-CB 3.3Å; M125-K129 WeakPolarHBondContact O-CG 3.46Å; M125-K129 PolarHBondContact O-N 2.97Å
130	R	55.6	Low	50	Low	204 Å²	204	95.5 Å²	95.5	77%	0.77	57%	0.572	S	S	*	*	H	α-helix	trans	-75.6	-42.4	173	-73.3	172.7	-179.7	-175.6	0.3	112.3	K126 A127 L128 D132 G133	K126-R130 VanDerWaalsContact O-CG 3.29Å; K126-R130 WeakPolarHBondContact O-CG 3.5Å; K126-R130 PolarHBondContact O-N 3.33Å; K126-R130 VanDerWaalsContact O-N 3.17Å; A127-R130 CarbonylContact O-C 3.34Å; A127-R130 WeakPolarHBondContact O-CA 3.3Å; A127-R130 WeakPolarHBondContact O-CB 3.35Å; A127-R130 PolarHBondContact O-N 3.45Å; A127-R130 VanDerWaalsContact O-N 3.09Å; L128-R130 PolarHBondContact O-N 3.48Å; R130-D132 VanDerWaalsContact C-N 3.33Å; R130-D132 PolarHBondContact O-N 3.01Å; R130-G133 PolarHBondContact O-N 2.85Å
131	L	55.1	Low	50.5	Low	137 Å²	137	93.1 Å²	93.1	72%	0.717	56%	0.564	S	S	*	*	H	α-helix	trans	-66.2	-33.4	-180	-74.3	167.5	0	0	0	112.6	A127 L128 G133	A127-L131 WeakPolarHBondContact O-CG 3.47Å; A127-L131 PolarHBondContact O-N 3.19Å; L128-L131 HydrophobicContact CD2-CD1 4.41Å; L128-L131 PolarHBondContact O-N 3.17Å; L128-L131 VanDerWaalsContact O-N 3.09Å; L131-G133 PolarHBondContact O-N 3.2Å
132	D	56.6	Low	51.3	Low	42 Å²	42	91 Å²	91	23%	0.225	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	2.4	175.6	-83.3	-27.5	0	0	0	113.7	L128 R130 K143	L128-D132 PolarHBondContact O-N 3.18Å; R130-D132 VanDerWaalsContact C-N 3.33Å; R130-D132 PolarHBondContact O-N 3.01Å; D132-K143 VanDerWaalsContact OD1-CD 3.24Å; D132-K143 WeakPolarHBondContact OD1-CD 3.46Å; D132-K143 WeakPolarHBondContact OD1-CE 3.42Å; D132-K143 IonicContact OD1-NZ 2.78Å; D132-K143 PolarHBondContact OD1-NZ 3.11Å; D132-K143 PolarHBondContact OD2-N 3.14Å
133	G	45.2	Very low	52.6	Low	54 Å²	54	94.1 Å²	94.1	56%	0.557	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.3	27.1	166.8	0	0	0	0	0	114.7	R130 L131 G135	R130-G133 PolarHBondContact O-N 2.85Å; L131-G133 PolarHBondContact O-N 3.2Å; G133-G135 PolarHBondContact O-N 3.36Å
134	G	41.1	Very low	53.9	Low	61 Å²	61	89 Å²	89	63%	0.629	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	19.7	-175.5	0	0	0	0	0	117.6
135	G	33.9	Very low	55.3	Low	85 Å²	85	89.7 Å²	89.7	88%	0.876	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.8	-177.4	0	0	0	0	0	116.4	G133	G133-G135 PolarHBondContact O-N 3.36Å
136	G	32.5	Very low	57.2	Low	61 Å²	61	89.9 Å²	89.9	63%	0.629	53%	0.532	S	S	*	.	S	Bend	trans	-153	116	-172.8	0	0	0	0	0	114.1
137	K	35.6	Very low	58.9	Low	209 Å²	209	83.4 Å²	83.4	91%	0.909	50%	0.504	S	S	*	.	S	Bend	trans	67.1	109	168.5	-63.6	179.2	175.8	178.1	0	115.4
138	Q	37.1	Very low	60.5	Low	197 Å²	197	81.3 Å²	81.3	92%	0.921	49%	0.487	S	S	*	.	S	Bend	trans	53.8	85.2	168.1	-73	177.3	-8.7	0	0	115.6	G140	Q138-G140 PolarHBondContact O-N 3.2Å
139	G	39.1	Very low	62.3	Low	78 Å²	78	80.5 Å²	80.5	80%	0.804	48%	0.482	S	S	*	.			trans	39.1	69.8	151.4	0	0	0	0	0	116.5	T141	G139-T141 PolarHBondContact O-N 3.09Å; G139-T141 VanDerWaalsContact O-N 3.16Å
140	G	48.2	Very low	64.2	Low	67 Å²	67	76 Å²	76	69%	0.691	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-51.2	121.2	176.1	0	0	0	0	0	111.6	Q138	Q138-G140 PolarHBondContact O-N 3.2Å
141	T	61.1	Low	65.9	Low	63 Å²	63	67.5 Å²	67.5	39%	0.387	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64.7	129.4	175.3	43.6	0	0	0	0	109	G139 K143 E248 W251	G139-T141 PolarHBondContact O-N 3.09Å; G139-T141 VanDerWaalsContact O-N 3.16Å; T141-K143 PolarHBondContact O-N 3.31Å; T141-E248 PolarHBondContact OG1-O 3.27Å; T141-W251 HydrophobicContact CG2-CH2 3.71Å; T141-W251 HydrophobicContact CG2-CZ3 3.57Å
142	S	70.7	Confident	67.6	Low	54 Å²	54	64.9 Å²	64.9	38%	0.378	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-56.6	127.6	174.2	-179.6	0	0	0	0	108.6	I80 Y144	I80-S142 WeakPolarHBondContact CD1-O 3.41Å; S142-Y144 PolarHBondContact O-N 3.18Å; S142-Y144 PolarHBondContact OG-N 3.41Å; S142-Y144 PolarHBondContact OG-O 3.39Å
143	K	82.5	Confident	69.3	Low	116 Å²	116	65.8 Å²	65.8	50%	0.504	43%	0.43	S	S	.	.	S	Bend	trans	-77.2	-1.9	176	-64.5	-171.7	-166.7	133.6	0	113.7	I80 D132 T141	I80-K143 WeakPolarHBondContact CB-O 3.37Å; I80-K143 PolarHBondContact N-O 3.15Å; D132-K143 VanDerWaalsContact OD1-CD 3.24Å; D132-K143 WeakPolarHBondContact OD1-CD 3.46Å; D132-K143 WeakPolarHBondContact OD1-CE 3.42Å; D132-K143 IonicContact OD1-NZ 2.78Å; D132-K143 PolarHBondContact OD1-NZ 3.11Å; D132-K143 PolarHBondContact OD2-N 3.14Å; T141-K143 PolarHBondContact O-N 3.31Å
144	Y	87	Confident	71.5	Confident	18 Å²	18	64 Å²	64	7%	0.071	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145	-177.3	-59.1	-87.3	0	0	0	110.4	V78 P79 L112 L128 S142	V78-Y144 CarbonylContact O-C 3.42Å; V78-Y144 VanDerWaalsContact O-CA 3.29Å; V78-Y144 WeakPolarHBondContact O-CA 3.45Å; P79-Y144 HydrophobicContact CB-CD1 4.22Å; P79-Y144 HydrophobicContact CB-CE1 4.04Å; P79-Y144 HydrophobicContact CG-CD1 4.26Å; P79-Y144 HydrophobicContact CG-CE1 3.96Å; L112-Y144 HydrophobicContact CB-CE1 4.21Å; L112-Y144 HydrophobicContact CD1-CD1 3.45Å; L112-Y144 VanDerWaalsContact CD1-CD1 3.45Å; L112-Y144 HydrophobicContact CD1-CE1 3.17Å; L112-Y144 HydrophobicContact CD1-CG 4.24Å; L112-Y144 HydrophobicContact CG-CD1 4.29Å; L112-Y144 HydrophobicContact CG-CE1 3.5Å; L128-Y144 HydrophobicContact CD1-CD2 4.35Å; L128-Y144 HydrophobicContact CD2-CD2 4.32Å; L128-Y144 HydrophobicContact CD2-CE2 3.79Å; S142-Y144 PolarHBondContact O-N 3.18Å; S142-Y144 PolarHBondContact OG-N 3.41Å; S142-Y144 PolarHBondContact OG-O 3.39Å
145	R	90.3	Very high	73.8	Confident	44 Å²	44	61.7 Å²	61.7	17%	0.166	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135	170.6	178	155.9	-73	176.2	3.3	109.4	V78 I80 L83 L147 E250	V78-R145 PolarHBondContact N-O 3.24Å; V78-R145 PolarHBondContact O-N 2.87Å; I80-R145 HydrophobicContact CG1-CB 4.42Å; L83-R145 HydrophobicContact CD1-CB 4.18Å; R145-L147 HydrophobicContact CG-CD2 4.04Å; R145-L147 HydrophobicContact CG-CG 4.25Å; R145-E250 IonicContact CZ-OE1 3.65Å; R145-E250 IonicContact CZ-OE2 2.76Å; R145-E250 IonicContact NE-OE1 2.63Å; R145-E250 IonicContact NE-OE2 2.64Å; R145-E250 PolarHBondContact NE-OE2 3.33Å; R145-E250 IonicContact NH1-OE1 2.97Å; R145-E250 PolarHBondContact NH1-OE1 3.36Å; R145-E250 IonicContact NH1-OE2 3.29Å; R145-E250 IonicContact NH2-OE1 3.84Å; R145-E250 PolarHBondContact NH2-OE1 3.22Å; R145-E250 IonicContact NH2-OE2 2.92Å; R145-E250 PolarHBondContact NH2-OE2 3.43Å
146	E	93.2	Very high	76.3	Confident	71 Å²	71	58.8 Å²	58.8	33%	0.332	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125	171.3	-170.1	169.5	-156.5	0	0	109.1	K76 L77 M125 K186	K76-E146 WeakPolarHBondContact O-CA 3.41Å; L77-E146 HydrophobicContact CD2-CB 3.93Å; L77-E146 HydrophobicContact CD2-CG 4.44Å; M125-E146 VanDerWaalsContact CE-OE2 3.25Å; M125-E146 WeakPolarHBondContact CE-OE2 3.48Å; E146-K186 WeakPolarHBondContact OE1-CE 3.48Å; E146-K186 IonicContact OE1-NZ 2.67Å; E146-K186 PolarHBondContact OE1-NZ 3.1Å
147	L	95.2	Very high	78.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.4	174.1	-64.4	177	0	0	0	109.4	G75 K76 V78 L83 R145 I151 I191	G75-L147 CarbonylContact C-O 3.55Å; G75-L147 WeakPolarHBondContact CA-O 3.2Å; K76-L147 PolarHBondContact N-O 3.23Å; K76-L147 PolarHBondContact O-N 3.06Å; V78-L147 HydrophobicContact CB-CD1 4.38Å; V78-L147 HydrophobicContact CG2-CB 4.48Å; V78-L147 HydrophobicContact CG2-CD1 4.12Å; L83-L147 HydrophobicContact CD1-CD1 4.46Å; L83-L147 HydrophobicContact CD2-CD1 4.07Å; R145-L147 HydrophobicContact CG-CD2 4.04Å; R145-L147 HydrophobicContact CG-CG 4.25Å; L147-I151 HydrophobicContact CD1-CD1 3.92Å; L147-I151 HydrophobicContact CD1-CG1 3.91Å; L147-I191 HydrophobicContact CD2-CG1 4.16Å
148	C	96.5	Very high	81.6	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.014	29%	0.285	C	S	.	.	S	Bend	trans	-87.6	-49.8	176.6	-171.3	0	0	0	0	111.2	L69 Y70 K186 L187 D190	L69-C148 WeakPolarHBondContact CA-O 3.28Å; Y70-C148 PolarHBondContact N-O 2.89Å; C148-K186 HydrophobicContact CB-CB 4.19Å; C148-L187 HydrophobicContact CB-CB 4.34Å; C148-L187 HydrophobicContact CB-CD1 4.23Å; C148-D190 VanDerWaalsContact CB-OD1 3.27Å; C148-D190 WeakPolarHBondContact CB-OD1 3.42Å; C148-D190 PolarHBondContact N-OD1 3.24Å
149	W	96.8	Very high	84.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-81.3	131.8	-179.8	-160.7	-76.8	0	0	0	111.6	L29 I65 F68 L69 I151 Q153 R154 L161 L187 D190	L29-W149 HydrophobicContact CD1-CH2 4.06Å; L29-W149 HydrophobicContact CD1-CZ2 3.6Å; I65-W149 HydrophobicContact CG2-CH2 3.94Å; I65-W149 HydrophobicContact CG2-CZ3 3.68Å; F68-W149 HydrophobicContact CB-CD2 4.35Å; F68-W149 HydrophobicContact CB-CH2 3.77Å; F68-W149 HydrophobicContact CB-CZ2 3.35Å; F68-W149 HydrophobicContact CB-CZ3 4.44Å; F68-W149 HydrophobicContact CD1-CH2 4.39Å; F68-W149 AromaticContact CD1-CZ2 3.55Å; F68-W149 HydrophobicContact CD1-CZ2 3.55Å; F68-W149 HydrophobicContact CG-CH2 4.11Å; F68-W149 AromaticContact CG-CZ2 3.63Å; F68-W149 HydrophobicContact CG-CZ2 3.63Å; L69-W149 HydrophobicContact CD2-CB 4.33Å; L69-W149 HydrophobicContact CD2-CD2 4Å; L69-W149 HydrophobicContact CD2-CE3 3.41Å; L69-W149 VanDerWaalsContact CD2-CE3 3.41Å; L69-W149 HydrophobicContact CD2-CG 4.43Å; L69-W149 HydrophobicContact CD2-CZ3 3.92Å; W149-I151 PolarHBondContact O-N 2.55Å; W149-Q153 PolarHBondContact NE1-O 3.33Å; W149-R154 HydrophobicContact CG-CG 4.46Å; W149-R154 PolarHBondContact O-NE 3.26Å; W149-R154 PolarHBondContact O-NH2 3Å; W149-L161 HydrophobicContact CE3-CB 4.37Å; W149-L161 HydrophobicContact CH2-CB 3.34Å; W149-L161 HydrophobicContact CH2-CD2 4.11Å; W149-L161 HydrophobicContact CH2-CG 4.36Å; W149-L161 HydrophobicContact CZ2-CB 4.13Å; W149-L161 HydrophobicContact CZ3-CB 3.47Å; W149-L161 VanDerWaalsContact CZ3-CB 3.47Å; W149-L161 HydrophobicContact CZ3-CD2 4.43Å; W149-L187 HydrophobicContact CB-CD1 4.29Å; W149-L187 HydrophobicContact CE3-CD1 3.92Å; W149-D190 WeakPolarHBondContact CB-OD2 3.44Å; W149-D190 PolarHBondContact N-OD2 3.16Å
150	D	94.8	Very high	86.9	Confident	34 Å²	34	34 Å²	34	18%	0.182	20%	0.203	C	C	.	.			trans	-61.3	124.4	-179.9	178.8	9.9	0	0	0	110.9	F68 Y70 S152 Q153 R154	F68-D150 WeakPolarHBondContact O-CB 2.95Å; F68-D150 PolarHBondContact O-N 3.3Å; Y70-D150 HydrophobicContact CD1-CB 4.19Å; Y70-D150 HydrophobicContact CE1-CB 3.8Å; Y70-D150 VanDerWaalsContact CE1-OD1 3.23Å; Y70-D150 WeakPolarHBondContact CE1-OD1 3.47Å; Y70-D150 HydrophobicContact CE2-CB 4.41Å; Y70-D150 PolarHBondContact OH-OD1 2.91Å; D150-S152 PolarHBondContact O-N 2.82Å; D150-S152 VanDerWaalsContact O-N 3.15Å; D150-S152 PolarHBondContact OD1-N 3.23Å; D150-S152 PolarHBondContact OD1-OG 3.48Å; D150-S152 PolarHBondContact OD2-OG 3.4Å; D150-Q153 HydrophobicContact CB-CB 4.28Å; D150-Q153 HydrophobicContact CB-CG 4.1Å; D150-Q153 PolarHBondContact O-N 3.48Å; D150-R154 WeakPolarHBondContact O-CG 3.38Å; D150-R154 PolarHBondContact O-N 2.88Å
151	I	92.2	Very high	89.1	Confident	24 Å²	24	30.8 Å²	30.8	12%	0.123	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-49.8	-39	176.8	-65.1	171.9	0	0	0	111.7	Y70 V78 L83 L86 L147 W149 Q153 I193	Y70-I151 PolarHBondContact OH-N 2.87Å; Y70-I151 VanDerWaalsContact OH-N 3.09Å; V78-I151 HydrophobicContact CB-CD1 4.3Å; V78-I151 HydrophobicContact CG1-CD1 3.63Å; V78-I151 HydrophobicContact CG2-CD1 3.9Å; L83-I151 HydrophobicContact CD2-CD1 3.71Å; L86-I151 HydrophobicContact CD1-CG2 3.62Å; L147-I151 HydrophobicContact CD1-CD1 3.92Å; L147-I151 HydrophobicContact CD1-CG1 3.91Å; W149-I151 PolarHBondContact O-N 2.55Å; I151-Q153 PolarHBondContact O-N 2.62Å; I151-I193 HydrophobicContact CG2-CD1 3.81Å
152	S	90.4	Very high	90.8	Very high	82 Å²	82	27.8 Å²	27.8	57%	0.573	15%	0.151	S	C	*	.	G	3₁₀ helix	trans	-70.7	-19	-178.6	85.7	0	0	0	0	113.8	D150	D150-S152 PolarHBondContact O-N 2.82Å; D150-S152 VanDerWaalsContact O-N 3.15Å; D150-S152 PolarHBondContact OD1-N 3.23Å; D150-S152 PolarHBondContact OD1-OG 3.48Å; D150-S152 PolarHBondContact OD2-OG 3.4Å
153	Q	92.1	Very high	92	Very high	61 Å²	61	25.2 Å²	25.2	29%	0.285	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-110.7	14.3	-174.8	-56.1	-59.4	-53.3	0	0	112.9	F68 W149 D150 I151	F68-Q153 HydrophobicContact CB-CB 4.43Å; F68-Q153 HydrophobicContact CD1-CB 3.77Å; F68-Q153 HydrophobicContact CD1-CG 4.37Å; W149-Q153 PolarHBondContact NE1-O 3.33Å; D150-Q153 HydrophobicContact CB-CB 4.28Å; D150-Q153 HydrophobicContact CB-CG 4.1Å; D150-Q153 PolarHBondContact O-N 3.48Å; I151-Q153 PolarHBondContact O-N 2.62Å
154	R	91.9	Very high	92.5	Very high	17 Å²	17	19.7 Å²	19.7	6%	0.064	11%	0.109	C	C	.	.			trans	-78.3	165.5	176.7	-71.7	174.5	-179.8	-93.4	-5.9	111.8	W149 D150 G158 E159 D190 I191	W149-R154 HydrophobicContact CG-CG 4.46Å; W149-R154 PolarHBondContact O-NE 3.26Å; W149-R154 PolarHBondContact O-NH2 3Å; D150-R154 WeakPolarHBondContact O-CG 3.38Å; D150-R154 PolarHBondContact O-N 2.88Å; R154-G158 WeakPolarHBondContact CD-O 3.39Å; R154-G158 PolarHBondContact NH1-O 3.08Å; R154-E159 WeakPolarHBondContact CA-O 3.39Å; R154-E159 WeakPolarHBondContact CB-O 3.37Å; R154-D190 IonicContact CZ-OD2 3.83Å; R154-D190 IonicContact NH1-OD2 3.73Å; R154-D190 IonicContact NH2-OD2 2.64Å; R154-D190 PolarHBondContact NH2-OD2 3.34Å; R154-I191 PolarHBondContact NH1-O 3.2Å
155	G	89.3	Confident	92.8	Very high	12 Å²	12	18.9 Å²	18.9	12%	0.124	11%	0.106	C	C	.	.			trans	-72.5	179.4	174.7	0	0	0	0	0	113.5	L29 Y30 L157 G158 E159	L29-G155 VanDerWaalsContact CD2-N 3.32Å; Y30-G155 WeakPolarHBondContact OH-CA 3.32Å; G155-L157 PolarHBondContact O-N 2.83Å; G155-G158 PolarHBondContact O-N 3.25Å; G155-E159 VanDerWaalsContact C-OE2 3.29Å; G155-E159 VanDerWaalsContact CA-CD 3.5Å; G155-E159 WeakPolarHBondContact CA-OE2 3.42Å; G155-E159 PolarHBondContact N-O 2.87Å
156	A	85.7	Confident	93.1	Very high	25 Å²	25	16.8 Å²	16.8	21%	0.207	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.7	-177.2	0	0	0	0	0	114.1	R20 Y30	R20-A156 HydrophobicContact CB-CB 3.98Å; Y30-A156 PolarHBondContact OH-N 3.45Å
157	L	87.4	Confident	93.1	Very high	18 Å²	18	16.2 Å²	16.2	9%	0.094	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	13.1	174.1	-60	174.6	0	0	0	111.5	G155 E159 Y192 S194 Y197	G155-L157 PolarHBondContact O-N 2.83Å; L157-E159 VanDerWaalsContact C-N 3.28Å; L157-E159 VanDerWaalsContact C-OE2 3.29Å; L157-E159 VanDerWaalsContact CA-OE2 3.28Å; L157-E159 WeakPolarHBondContact CA-OE2 3.2Å; L157-E159 WeakPolarHBondContact CB-OE2 3.39Å; L157-E159 PolarHBondContact N-OE2 2.8Å; L157-E159 PolarHBondContact O-N 2.88Å; L157-Y192 HydrophobicContact CB-CD1 4.19Å; L157-Y192 HydrophobicContact CB-CE1 4.08Å; L157-Y192 WeakPolarHBondContact O-CD1 3.39Å; L157-S194 WeakPolarHBondContact O-CB 3.39Å; L157-S194 PolarHBondContact O-N 3.26Å; L157-S194 PolarHBondContact O-OG 3.36Å; L157-Y197 HydrophobicContact CB-CD2 4.44Å; L157-Y197 HydrophobicContact CD1-CD2 4.16Å; L157-Y197 HydrophobicContact CD1-CE2 3.84Å; L157-Y197 HydrophobicContact CD2-CD2 4.49Å; L157-Y197 HydrophobicContact CD2-CE2 4.36Å
158	G	91.2	Very high	92.9	Very high	6 Å²	6	18 Å²	18	6%	0.062	11%	0.106	C	C	.	.	S	Bend	trans	74.9	18	-178.4	0	0	0	0	0	113.9	R154 G155 I193	R154-G158 WeakPolarHBondContact CD-O 3.39Å; R154-G158 PolarHBondContact NH1-O 3.08Å; G155-G158 PolarHBondContact O-N 3.25Å; G158-I193 VanDerWaalsContact CA-CG1 3.42Å; G158-I193 PolarHBondContact O-N 3.32Å
159	E	93.1	Very high	92.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.12	C	C	.	.			trans	-79.3	153.2	179.4	77.6	-82.8	-165.2	0	0	112.4	Y30 Y35 R154 G155 L157 H163 I164 Y192	Y30-E159 WeakPolarHBondContact CE1-OE1 3.22Å; Y30-E159 PolarHBondContact OH-OE1 2.64Å; Y35-E159 PolarHBondContact OH-OE1 3.18Å; R154-E159 WeakPolarHBondContact CA-O 3.39Å; R154-E159 WeakPolarHBondContact CB-O 3.37Å; G155-E159 VanDerWaalsContact C-OE2 3.29Å; G155-E159 VanDerWaalsContact CA-CD 3.5Å; G155-E159 WeakPolarHBondContact CA-OE2 3.42Å; G155-E159 PolarHBondContact N-O 2.87Å; L157-E159 VanDerWaalsContact C-N 3.28Å; L157-E159 VanDerWaalsContact C-OE2 3.29Å; L157-E159 VanDerWaalsContact CA-OE2 3.28Å; L157-E159 WeakPolarHBondContact CA-OE2 3.2Å; L157-E159 WeakPolarHBondContact CB-OE2 3.39Å; L157-E159 PolarHBondContact N-OE2 2.8Å; L157-E159 PolarHBondContact O-N 2.88Å; E159-H163 HydrophobicContact CB-CB 3.86Å; E159-I164 HydrophobicContact CG-CD1 3.99Å; E159-I164 HydrophobicContact CG-CG1 3.55Å; E159-Y192 HydrophobicContact CB-CD1 3.85Å; E159-Y192 HydrophobicContact CB-CE1 3.34Å; E159-Y192 HydrophobicContact CB-CE2 4.2Å; E159-Y192 HydrophobicContact CB-CG 4.46Å; E159-Y192 HydrophobicContact CG-CE1 4.35Å
160	S	95	Very high	92.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.139	C	C	.	.			trans	-95.6	171	168.1	72.5	0	0	0	0	110.6	L162 H163 I164	S160-L162 PolarHBondContact O-N 3.03Å; S160-H163 PolarHBondContact N-ND1 2.6Å; S160-H163 WeakPolarHBondContact O-CB 3.28Å; S160-H163 PolarHBondContact O-N 3.24Å; S160-H163 PolarHBondContact OG-CE1 2.81Å; S160-H163 PolarHBondContact OG-ND1 2.96Å; S160-I164 PolarHBondContact O-N 2.81Å; S160-I164 VanDerWaalsContact O-N 3.16Å
161	L	94.4	Very high	92.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-33.7	177.3	-173.8	66.2	0	0	0	113.3	L29 L32 I33 L41 I65 W149 H163 I164 C165 L180	L29-L161 HydrophobicContact CD1-CB 3.84Å; L29-L161 HydrophobicContact CD1-CD1 3.83Å; L29-L161 HydrophobicContact CD1-CG 4.4Å; L32-L161 HydrophobicContact CB-CD1 4.14Å; L32-L161 HydrophobicContact CD1-CD2 4.13Å; I33-L161 HydrophobicContact CB-CD1 3.85Å; I33-L161 HydrophobicContact CD1-CD1 3.85Å; I33-L161 HydrophobicContact CD1-CG 4.38Å; I33-L161 HydrophobicContact CG1-CD1 3.85Å; L41-L161 HydrophobicContact CD1-CD2 3.69Å; I65-L161 HydrophobicContact CD1-CD2 3.68Å; I65-L161 HydrophobicContact CG1-CD2 4.18Å; W149-L161 HydrophobicContact CE3-CB 4.37Å; W149-L161 HydrophobicContact CH2-CB 3.34Å; W149-L161 HydrophobicContact CH2-CD2 4.11Å; W149-L161 HydrophobicContact CH2-CG 4.36Å; W149-L161 HydrophobicContact CZ2-CB 4.13Å; W149-L161 HydrophobicContact CZ3-CB 3.47Å; W149-L161 VanDerWaalsContact CZ3-CB 3.47Å; W149-L161 HydrophobicContact CZ3-CD2 4.43Å; L161-H163 VanDerWaalsContact C-N 3.29Å; L161-H163 PolarHBondContact O-N 2.9Å; L161-I164 PolarHBondContact O-N 2.81Å; L161-C165 PolarHBondContact O-N 3.49Å; L161-C165 PolarHBondContact O-SG 2.65Å; L161-L180 HydrophobicContact CD2-CD1 4.04Å; L161-L180 HydrophobicContact CD2-CD2 4.28Å; L161-L180 HydrophobicContact CG-CD1 4.05Å
162	L	96.7	Very high	92.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-43	174.9	176.8	58.8	0	0	0	111.1	S160 C165 L166 A177 V181 L187 A202	S160-L162 PolarHBondContact O-N 3.03Å; L162-C165 WeakPolarHBondContact O-CB 3.46Å; L162-C165 PolarHBondContact O-N 3.24Å; L162-L166 HydrophobicContact CD1-CD1 4.4Å; L162-L166 HydrophobicContact CG-CD1 4.48Å; L162-L166 WeakPolarHBondContact O-CG 3.35Å; L162-L166 PolarHBondContact O-N 3.09Å; L162-L166 VanDerWaalsContact O-N 3.14Å; L162-A177 HydrophobicContact CD1-CB 3.67Å; L162-V181 HydrophobicContact CD1-CG2 3.9Å; L162-V181 HydrophobicContact CD2-CG2 3.8Å; L162-L187 HydrophobicContact CB-CD2 4.02Å; L162-L187 HydrophobicContact CB-CG 4.1Å; L162-L187 HydrophobicContact CD2-CG 4.11Å; L162-A202 HydrophobicContact CD2-CB 3.72Å; L162-A202 HydrophobicContact CG-CB 4.08Å
163	H	95.8	Very high	92.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-40.6	177	-63.6	104.3	0	0	0	112.1	E159 S160 L161 C165 L166 L167 D190 Y192	E159-H163 HydrophobicContact CB-CB 3.86Å; S160-H163 PolarHBondContact N-ND1 2.6Å; S160-H163 WeakPolarHBondContact O-CB 3.28Å; S160-H163 PolarHBondContact O-N 3.24Å; S160-H163 PolarHBondContact OG-CE1 2.81Å; S160-H163 PolarHBondContact OG-ND1 2.96Å; L161-H163 VanDerWaalsContact C-N 3.29Å; L161-H163 PolarHBondContact O-N 2.9Å; H163-C165 VanDerWaalsContact C-N 3.32Å; H163-C165 PolarHBondContact O-N 3.5Å; H163-L166 PolarHBondContact O-N 3.08Å; H163-L167 WeakPolarHBondContact O-CB 3.38Å; H163-L167 PolarHBondContact O-N 3.45Å; H163-D190 PolarHBondContact CE1-O 3.45Å; H163-D190 PolarHBondContact NE2-O 2.93Å; H163-Y192 HydrophobicContact CB-CD2 4.4Å; H163-Y192 HydrophobicContact CB-CE2 3.56Å; H163-Y192 AromaticContact CD2-CD2 3.5Å; H163-Y192 AromaticContact CD2-CE2 3.28Å; H163-Y192 WeakPolarHBondContact CD2-CE2 3.45Å; H163-Y192 AromaticContact CG-CD2 3.89Å; H163-Y192 AromaticContact CG-CE2 3.49Å; H163-Y192 VanDerWaalsContact CG-CE2 3.49Å; H163-Y192 AromaticContact NE2-CD2 3.85Å
164	I	93	Very high	92.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-39.7	176.8	-61.5	171.9	0	0	0	111.2	L29 Y30 I33 E159 S160 L161 L167 N168	L29-I164 HydrophobicContact CD1-CD1 3.98Å; L29-I164 HydrophobicContact CD2-CD1 3.7Å; L29-I164 HydrophobicContact CG-CD1 3.68Å; Y30-I164 HydrophobicContact CD1-CD1 3.96Å; Y30-I164 HydrophobicContact CE1-CD1 3.68Å; I33-I164 HydrophobicContact CB-CG2 4.21Å; I33-I164 HydrophobicContact CG2-CG2 3.78Å; E159-I164 HydrophobicContact CG-CD1 3.99Å; E159-I164 HydrophobicContact CG-CG1 3.55Å; S160-I164 PolarHBondContact O-N 2.81Å; S160-I164 VanDerWaalsContact O-N 3.16Å; L161-I164 PolarHBondContact O-N 2.81Å; I164-L167 PolarHBondContact O-N 2.93Å; I164-N168 PolarHBondContact O-N 2.72Å; I164-N168 VanDerWaalsContact O-N 3.16Å; I164-N168 PolarHBondContact O-ND2 3.34Å
165	C	94.7	Very high	92.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.8	-50.5	174.8	-64.2	0	0	0	0	110.9	I33 L161 L162 H163 L167 N168 G169 H173 A177	I33-C165 WeakPolarHBondContact CD1-SG 3.36Å; L161-C165 PolarHBondContact O-N 3.49Å; L161-C165 PolarHBondContact O-SG 2.65Å; L162-C165 WeakPolarHBondContact O-CB 3.46Å; L162-C165 PolarHBondContact O-N 3.24Å; H163-C165 VanDerWaalsContact C-N 3.32Å; H163-C165 PolarHBondContact O-N 3.5Å; C165-L167 VanDerWaalsContact C-N 3.34Å; C165-L167 PolarHBondContact O-N 2.95Å; C165-N168 PolarHBondContact O-N 3.46Å; C165-G169 PolarHBondContact O-N 2.89Å; C165-H173 HydrophobicContact CB-CB 4.23Å; C165-H173 VanDerWaalsContact O-CB 3.27Å; C165-H173 WeakPolarHBondContact O-CB 3.35Å; C165-A177 HydrophobicContact CB-CB 3.87Å
166	L	95.5	Very high	92.8	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-69	-32.4	-179.2	-62.7	177.4	0	0	0	112.2	L162 H163 N168 G169 A177 A202 Q205 N209 M214 L218	L162-L166 HydrophobicContact CD1-CD1 4.4Å; L162-L166 HydrophobicContact CG-CD1 4.48Å; L162-L166 WeakPolarHBondContact O-CG 3.35Å; L162-L166 PolarHBondContact O-N 3.09Å; L162-L166 VanDerWaalsContact O-N 3.14Å; H163-L166 PolarHBondContact O-N 3.08Å; L166-N168 VanDerWaalsContact C-N 3.32Å; L166-N168 PolarHBondContact O-N 3.36Å; L166-G169 WeakPolarHBondContact O-CA 3.21Å; L166-G169 PolarHBondContact O-N 2.92Å; L166-A177 HydrophobicContact CD2-CB 4.2Å; L166-A202 HydrophobicContact CD1-CB 3.63Å; L166-A202 WeakPolarHBondContact CD1-O 3.49Å; L166-Q205 HydrophobicContact CB-CB 4.2Å; L166-Q205 HydrophobicContact CB-CG 3.65Å; L166-Q205 HydrophobicContact CD1-CB 4.41Å; L166-N209 PolarHBondContact O-ND2 3.15Å; L166-M214 HydrophobicContact CD2-CE 4.01Å; L166-M214 HydrophobicContact CD2-CG 3.85Å; L166-M214 HydrophobicContact CD2-SD 4.15Å; L166-L218 HydrophobicContact CD1-CD1 4.49Å
167	L	93.4	Very high	93.3	Very high	58 Å²	58	22.5 Å²	22.5	30%	0.304	13%	0.128	S	C	.	.	H	α-helix	trans	-63.7	-38.2	175.6	-177.7	64.9	0	0	0	112.1	Y35 H163 I164 C165	Y35-L167 HydrophobicContact CD1-CD2 3.74Å; Y35-L167 HydrophobicContact CE1-CD2 3.71Å; H163-L167 WeakPolarHBondContact O-CB 3.38Å; H163-L167 PolarHBondContact O-N 3.45Å; I164-L167 PolarHBondContact O-N 2.93Å; C165-L167 VanDerWaalsContact C-N 3.34Å; C165-L167 PolarHBondContact O-N 2.95Å
168	N	91.1	Very high	93.7	Very high	37 Å²	37	24 Å²	24	20%	0.198	13%	0.134	C	C	.	.	H	α-helix	trans	-70.6	-38.2	172.9	-81.1	-77	0	0	0	111.8	D34 G37 I164 C165 L166 T170 H173	D34-N168 PolarHBondContact O-ND2 3.07Å; D34-N168 VanDerWaalsContact O-ND2 3.1Å; G37-N168 WeakPolarHBondContact CA-OD1 3.44Å; G37-N168 PolarHBondContact N-OD1 2.85Å; G37-N168 VanDerWaalsContact N-OD1 3.12Å; I164-N168 PolarHBondContact O-N 2.72Å; I164-N168 VanDerWaalsContact O-N 3.16Å; I164-N168 PolarHBondContact O-ND2 3.34Å; C165-N168 PolarHBondContact O-N 3.46Å; L166-N168 VanDerWaalsContact C-N 3.32Å; L166-N168 PolarHBondContact O-N 3.36Å; N168-T170 PolarHBondContact O-N 3.33Å; N168-H173 HydrophobicContact CB-CB 4.33Å
169	G	88.6	Confident	93.9	Very high	30 Å²	30	24.7 Å²	24.7	31%	0.309	14%	0.136	S	C	.	.			trans	66.2	8.5	169	0	0	0	0	0	116.1	C165 L166	C165-G169 PolarHBondContact O-N 2.89Å; L166-G169 WeakPolarHBondContact O-CA 3.21Å; L166-G169 PolarHBondContact O-N 2.92Å
170	T	92	Very high	94	Very high	65 Å²	65	24.7 Å²	24.7	40%	0.399	14%	0.136	S	C	.	.			trans	-77.1	156	175.8	86.3	0	0	0	0	110.8	N168 L172 H173 N174	N168-T170 PolarHBondContact O-N 3.33Å; T170-L172 PolarHBondContact O-N 3.04Å; T170-L172 VanDerWaalsContact O-N 3.1Å; T170-H173 PolarHBondContact O-N 3.18Å; T170-H173 PolarHBondContact OG1-ND1 3.4Å; T170-N174 PolarHBondContact O-N 3.16Å
171	N	91.7	Very high	94.1	Very high	141 Å²	141	24.7 Å²	24.7	75%	0.754	14%	0.136	S	C	*	.	H	α-helix	trans	-50	-41.1	178.3	-68	-16.1	0	0	0	112.5	N174 E175	N171-N174 PolarHBondContact O-N 2.95Å; N171-E175 WeakPolarHBondContact O-CG 3.33Å; N171-E175 PolarHBondContact O-N 3.4Å
172	L	92.4	Very high	94.2	Very high	28 Å²	28	30.9 Å²	30.9	15%	0.147	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-44.7	179.6	-165.7	73.6	0	0	0	112.1	I42 M45 K46 M49 T170 N174 E175 V176	I42-L172 HydrophobicContact CB-CD2 4.32Å; I42-L172 HydrophobicContact CD1-CD2 4Å; I42-L172 HydrophobicContact CD1-CG 4.17Å; I42-L172 HydrophobicContact CG2-CD2 3.52Å; M45-L172 HydrophobicContact CB-CD1 3.91Å; M45-L172 HydrophobicContact CB-CG 4.21Å; M45-L172 HydrophobicContact CG-CD1 3.29Å; M45-L172 HydrophobicContact CG-CG 3.86Å; K46-L172 HydrophobicContact CD-CD2 4.31Å; K46-L172 HydrophobicContact CG-CD1 4.45Å; K46-L172 HydrophobicContact CG-CD2 3.71Å; M49-L172 HydrophobicContact SD-CD1 3.41Å; M49-L172 WeakPolarHBondContact SD-CD1 2.91Å; T170-L172 PolarHBondContact O-N 3.04Å; T170-L172 VanDerWaalsContact O-N 3.1Å; L172-N174 VanDerWaalsContact C-N 3.33Å; L172-E175 PolarHBondContact O-N 3.03Å; L172-V176 WeakPolarHBondContact O-CG2 3.35Å; L172-V176 PolarHBondContact O-N 3.44Å; L172-V176 VanDerWaalsContact O-N 3.09Å
173	H	93.9	Very high	94.1	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-67.1	-36.8	177	-66.6	84.9	0	0	0	111.6	G37 C165 N168 T170 E175 V176 A177	G37-H173 VanDerWaalsContact CA-CE1 3.43Å; G37-H173 WeakPolarHBondContact CA-CE1 3.23Å; G37-H173 WeakPolarHBondContact CA-NE2 3.03Å; G37-H173 PolarHBondContact O-CE1 2.95Å; G37-H173 VanDerWaalsContact O-CE1 3.27Å; G37-H173 PolarHBondContact O-NE2 3.45Å; C165-H173 HydrophobicContact CB-CB 4.23Å; C165-H173 VanDerWaalsContact O-CB 3.27Å; C165-H173 WeakPolarHBondContact O-CB 3.35Å; N168-H173 HydrophobicContact CB-CB 4.33Å; T170-H173 PolarHBondContact O-N 3.18Å; T170-H173 PolarHBondContact OG1-ND1 3.4Å; H173-E175 VanDerWaalsContact C-N 3.34Å; H173-V176 PolarHBondContact O-N 3.28Å; H173-A177 WeakPolarHBondContact O-CB 3.4Å; H173-A177 PolarHBondContact O-N 2.94Å
174	N	95	Very high	94.2	Very high	9 Å²	9	33.7 Å²	33.7	5%	0.048	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-37.6	176.8	-73.7	-3.8	0	0	0	111.7	T170 N171 L172 A177 K178 D211 M214	T170-N174 PolarHBondContact O-N 3.16Å; N171-N174 PolarHBondContact O-N 2.95Å; L172-N174 VanDerWaalsContact C-N 3.33Å; N174-A177 WeakPolarHBondContact O-CB 3.44Å; N174-A177 PolarHBondContact O-N 3.45Å; N174-K178 VanDerWaalsContact O-CG 3.29Å; N174-K178 WeakPolarHBondContact O-CG 2.94Å; N174-K178 PolarHBondContact O-N 3.48Å; N174-D211 PolarHBondContact ND2-OD2 3.43Å; N174-M214 HydrophobicContact CB-CE 3.57Å; N174-M214 WeakPolarHBondContact O-CE 3.43Å
175	E	93.8	Very high	94.3	Very high	77 Å²	77	37.4 Å²	37.4	36%	0.36	20%	0.203	S	C	.	.	H	α-helix	trans	-67.4	-40.7	173.1	-66.8	-50.8	128.4	0	0	112	M45 N171 L172 H173 A177 K178 I179	M45-E175 HydrophobicContact CE-CB 3.12Å; M45-E175 HydrophobicContact CE-CG 4.21Å; N171-E175 WeakPolarHBondContact O-CG 3.33Å; N171-E175 PolarHBondContact O-N 3.4Å; L172-E175 PolarHBondContact O-N 3.03Å; H173-E175 VanDerWaalsContact C-N 3.34Å; E175-A177 VanDerWaalsContact C-N 3.35Å; E175-A177 PolarHBondContact O-N 3.16Å; E175-K178 WeakPolarHBondContact O-CB 3.11Å; E175-K178 PolarHBondContact O-N 3.46Å; E175-K178 IonicContact OE1-NZ 3.37Å; E175-K178 PolarHBondContact OE1-NZ 2.92Å; E175-K178 IonicContact OE2-NZ 3.51Å; E175-I179 WeakPolarHBondContact O-CG1 3.23Å; E175-I179 PolarHBondContact O-N 3.37Å
176	V	94	Very high	94.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-45.3	172	175.8	0	0	0	0	110.6	I33 I42 M45 L172 H173 K178 I179 L180	I33-V176 HydrophobicContact CD1-CG1 4.13Å; I42-V176 HydrophobicContact CD1-CG2 4.25Å; M45-V176 HydrophobicContact CB-CG2 3.99Å; M45-V176 HydrophobicContact CE-CG2 4.3Å; M45-V176 HydrophobicContact CG-CG2 3.93Å; M45-V176 HydrophobicContact SD-CG2 4.43Å; L172-V176 WeakPolarHBondContact O-CG2 3.35Å; L172-V176 PolarHBondContact O-N 3.44Å; L172-V176 VanDerWaalsContact O-N 3.09Å; H173-V176 PolarHBondContact O-N 3.28Å; V176-K178 VanDerWaalsContact C-N 3.28Å; V176-K178 PolarHBondContact O-N 2.69Å; V176-I179 PolarHBondContact O-N 3.34Å; V176-I179 VanDerWaalsContact O-N 3.09Å; V176-L180 HydrophobicContact CG1-CD1 4.2Å; V176-L180 HydrophobicContact CG1-CG 4.25Å; V176-L180 VanDerWaalsContact O-CG 3.3Å; V176-L180 WeakPolarHBondContact O-CG 3.16Å; V176-L180 PolarHBondContact O-N 2.9Å
177	A	96.2	Very high	94.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.4	-41.3	176	0	0	0	0	0	112.3	L162 C165 L166 H173 N174 E175 L180 V181 M214	L162-A177 HydrophobicContact CD1-CB 3.67Å; C165-A177 HydrophobicContact CB-CB 3.87Å; L166-A177 HydrophobicContact CD2-CB 4.2Å; H173-A177 WeakPolarHBondContact O-CB 3.4Å; H173-A177 PolarHBondContact O-N 2.94Å; N174-A177 WeakPolarHBondContact O-CB 3.44Å; N174-A177 PolarHBondContact O-N 3.45Å; E175-A177 VanDerWaalsContact C-N 3.35Å; E175-A177 PolarHBondContact O-N 3.16Å; A177-L180 PolarHBondContact O-N 3.28Å; A177-V181 WeakPolarHBondContact O-CG2 3.49Å; A177-V181 PolarHBondContact O-N 3.35Å; A177-M214 HydrophobicContact CB-CE 4.31Å
178	K	96.5	Very high	94.7	Very high	48 Å²	48	38.2 Å²	38.2	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-42.6	175.4	-71	168.4	-171.8	171	0	112	N174 E175 V176 V181 K182 M214 F217	N174-K178 VanDerWaalsContact O-CG 3.29Å; N174-K178 WeakPolarHBondContact O-CG 2.94Å; N174-K178 PolarHBondContact O-N 3.48Å; E175-K178 WeakPolarHBondContact O-CB 3.11Å; E175-K178 PolarHBondContact O-N 3.46Å; E175-K178 IonicContact OE1-NZ 3.37Å; E175-K178 PolarHBondContact OE1-NZ 2.92Å; E175-K178 IonicContact OE2-NZ 3.51Å; V176-K178 VanDerWaalsContact C-N 3.28Å; V176-K178 PolarHBondContact O-N 2.69Å; K178-V181 PolarHBondContact O-N 3.1Å; K178-K182 VanDerWaalsContact O-CG 3.31Å; K178-K182 WeakPolarHBondContact O-CG 3.46Å; K178-K182 PolarHBondContact O-N 3.48Å; K178-K182 VanDerWaalsContact O-N 3.09Å; K178-M214 HydrophobicContact CG-CE 4.12Å; K178-F217 HydrophobicContact CB-CE1 4.04Å; K178-F217 HydrophobicContact CB-CE2 4.03Å; K178-F217 HydrophobicContact CB-CZ 3.68Å; K178-F217 HydrophobicContact CD-CD2 4.49Å; K178-F217 HydrophobicContact CG-CD1 3.95Å; K178-F217 HydrophobicContact CG-CD2 4.05Å; K178-F217 HydrophobicContact CG-CE1 3.77Å; K178-F217 HydrophobicContact CG-CE2 3.85Å; K178-F217 HydrophobicContact CG-CG 4.1Å; K178-F217 HydrophobicContact CG-CZ 3.73Å
179	I	94.3	Very high	95	Very high	21 Å²	21	39.1 Å²	39.1	11%	0.108	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-47.8	176	-63	166.4	0	0	0	109.6	M45 L57 D58 I61 E175 V176 V181 K182 T183	M45-I179 HydrophobicContact CE-CD1 3.88Å; M45-I179 HydrophobicContact SD-CD1 4.31Å; L57-I179 HydrophobicContact CD2-CD1 3.79Å; D58-I179 VanDerWaalsContact OD1-CG2 3.28Å; D58-I179 WeakPolarHBondContact OD1-CG2 3.22Å; I61-I179 HydrophobicContact CD1-CB 4.17Å; I61-I179 HydrophobicContact CD1-CD1 4.47Å; I61-I179 HydrophobicContact CD1-CG2 3.56Å; I61-I179 HydrophobicContact CG2-CG2 4.42Å; E175-I179 WeakPolarHBondContact O-CG1 3.23Å; E175-I179 PolarHBondContact O-N 3.37Å; V176-I179 PolarHBondContact O-N 3.34Å; V176-I179 VanDerWaalsContact O-N 3.09Å; I179-V181 VanDerWaalsContact C-N 3.33Å; I179-V181 PolarHBondContact O-N 2.95Å; I179-K182 PolarHBondContact O-N 3.4Å; I179-K182 VanDerWaalsContact O-N 3.08Å; I179-T183 PolarHBondContact O-N 2.93Å; I179-T183 PolarHBondContact O-OG1 3.38Å
180	L	96.1	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-54.5	-46.2	178.3	-67.2	177.1	0	0	0	113	I61 I65 L161 V176 A177 F184 L187	I61-L180 HydrophobicContact CG2-CD2 3.89Å; I65-L180 HydrophobicContact CD1-CD2 3.11Å; L161-L180 HydrophobicContact CD2-CD1 4.04Å; L161-L180 HydrophobicContact CD2-CD2 4.28Å; L161-L180 HydrophobicContact CG-CD1 4.05Å; V176-L180 HydrophobicContact CG1-CD1 4.2Å; V176-L180 HydrophobicContact CG1-CG 4.25Å; V176-L180 VanDerWaalsContact O-CG 3.3Å; V176-L180 WeakPolarHBondContact O-CG 3.16Å; V176-L180 PolarHBondContact O-N 2.9Å; A177-L180 PolarHBondContact O-N 3.28Å; L180-F184 PolarHBondContact O-N 2.99Å; L180-L187 HydrophobicContact CB-CD2 4.19Å
181	V	97.3	Very high	95.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.5	-35	179.5	171.1	0	0	0	0	111.6	L162 A177 K178 I179 F184 P185 V188 F217 L218 H221	L162-V181 HydrophobicContact CD1-CG2 3.9Å; L162-V181 HydrophobicContact CD2-CG2 3.8Å; A177-V181 WeakPolarHBondContact O-CG2 3.49Å; A177-V181 PolarHBondContact O-N 3.35Å; K178-V181 PolarHBondContact O-N 3.1Å; I179-V181 VanDerWaalsContact C-N 3.33Å; I179-V181 PolarHBondContact O-N 2.95Å; V181-F184 CarbonylContact O-C 3.43Å; V181-P185 VanDerWaalsContact O-CA 3.23Å; V181-P185 WeakPolarHBondContact O-CA 3.47Å; V181-V188 HydrophobicContact CG1-CB 4.23Å; V181-V188 HydrophobicContact CG1-CG2 4.18Å; V181-F217 HydrophobicContact CB-CE1 3.86Å; V181-F217 HydrophobicContact CB-CZ 4.23Å; V181-F217 HydrophobicContact CG1-CE1 3.89Å; V181-F217 HydrophobicContact CG1-CZ 4.24Å; V181-F217 HydrophobicContact CG2-CE1 4.32Å; V181-L218 HydrophobicContact CG2-CD2 4.22Å; V181-H221 HydrophobicContact CG1-CB 3.55Å
182	K	96.2	Very high	95.8	Very high	131 Å²	131	28.2 Å²	28.2	57%	0.57	14%	0.141	S	C	*	.	H	α-helix	trans	-69.8	-44	175.9	-72.8	173.8	-177.3	179.5	0	112	K178 I179 F217	K178-K182 VanDerWaalsContact O-CG 3.31Å; K178-K182 WeakPolarHBondContact O-CG 3.46Å; K178-K182 PolarHBondContact O-N 3.48Å; K178-K182 VanDerWaalsContact O-N 3.09Å; I179-K182 PolarHBondContact O-N 3.4Å; I179-K182 VanDerWaalsContact O-N 3.08Å; K182-F217 HydrophobicContact CG-CZ 4.29Å
183	T	95.2	Very high	95.9	Very high	48 Å²	48	27.8 Å²	27.8	29%	0.294	14%	0.139	S	C	.	.	H	α-helix	trans	-71.3	-38.7	-179.8	-50.7	0	0	0	0	111.4	I179 P185	I179-T183 PolarHBondContact O-N 2.93Å; I179-T183 PolarHBondContact O-OG1 3.38Å; T183-P185 WeakPolarHBondContact O-CD 3.45Å
184	F	96.5	Very high	95.7	Very high	10 Å²	10	27.9 Å²	27.9	4%	0.044	14%	0.14	C	C	.	.	S	Bend	trans	-126.8	77.2	-178.4	-52.1	-68.7	0	0	0	111.5	I61 I65 L69 L180 V181 K186 L187	I61-F184 HydrophobicContact CG2-CE2 4.25Å; I65-F184 HydrophobicContact CB-CE2 3.99Å; I65-F184 HydrophobicContact CB-CZ 4.36Å; I65-F184 HydrophobicContact CG2-CD2 4.42Å; I65-F184 HydrophobicContact CG2-CE2 3.9Å; I65-F184 HydrophobicContact CG2-CZ 4.46Å; L69-F184 HydrophobicContact CD1-CB 4.23Å; L69-F184 HydrophobicContact CD1-CD1 3.43Å; L69-F184 VanDerWaalsContact CD1-CD1 3.43Å; L69-F184 HydrophobicContact CD1-CD2 3.86Å; L69-F184 HydrophobicContact CD1-CE1 3.57Å; L69-F184 HydrophobicContact CD1-CE2 3.98Å; L69-F184 HydrophobicContact CD1-CG 3.56Å; L69-F184 HydrophobicContact CD1-CZ 3.82Å; L180-F184 PolarHBondContact O-N 2.99Å; V181-F184 CarbonylContact O-C 3.43Å; F184-K186 VanDerWaalsContact C-N 3.27Å; F184-K186 PolarHBondContact O-N 3.32Å; F184-K186 VanDerWaalsContact O-N 3.09Å; F184-L187 HydrophobicContact CB-CB 4.21Å; F184-L187 WeakPolarHBondContact O-CB 3.28Å; F184-L187 PolarHBondContact O-N 2.92Å
185	P	96.5	Very high	95.4	Very high	78 Å²	78	27.8 Å²	27.8	51%	0.506	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-55.2	-35	-171.7	-29.4	36.3	0	0	0	115.3	V181 T183 L187 V188	V181-P185 VanDerWaalsContact O-CA 3.23Å; V181-P185 WeakPolarHBondContact O-CA 3.47Å; T183-P185 WeakPolarHBondContact O-CD 3.45Å; P185-L187 PolarHBondContact O-N 3.06Å; P185-V188 WeakPolarHBondContact O-CB 3.45Å; P185-V188 VanDerWaalsContact O-CG1 3.24Å; P185-V188 WeakPolarHBondContact O-CG1 3.39Å; P185-V188 PolarHBondContact O-N 3.16Å
186	K	95.8	Very high	95.2	Very high	73 Å²	73	26.2 Å²	26.2	32%	0.317	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-67.2	-19.5	179.3	-69.3	-171.7	176.8	-166.7	0	113.8	K74 E146 C148 F184 V188 N189	K74-K186 WeakPolarHBondContact O-CD 3.06Å; K74-K186 WeakPolarHBondContact O-CE 3.43Å; K74-K186 PolarHBondContact O-NZ 2.98Å; E146-K186 WeakPolarHBondContact OE1-CE 3.48Å; E146-K186 IonicContact OE1-NZ 2.67Å; E146-K186 PolarHBondContact OE1-NZ 3.1Å; C148-K186 HydrophobicContact CB-CB 4.19Å; F184-K186 VanDerWaalsContact C-N 3.27Å; F184-K186 PolarHBondContact O-N 3.32Å; F184-K186 VanDerWaalsContact O-N 3.09Å; K186-V188 PolarHBondContact O-N 3.39Å; K186-N189 PolarHBondContact O-N 3.18Å
187	L	96.9	Very high	95.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-63.7	-22.1	177.8	-172.3	61.5	0	0	0	112.5	C148 W149 L162 L180 F184 P185 N189 D190	C148-L187 HydrophobicContact CB-CB 4.34Å; C148-L187 HydrophobicContact CB-CD1 4.23Å; W149-L187 HydrophobicContact CB-CD1 4.29Å; W149-L187 HydrophobicContact CE3-CD1 3.92Å; L162-L187 HydrophobicContact CB-CD2 4.02Å; L162-L187 HydrophobicContact CB-CG 4.1Å; L162-L187 HydrophobicContact CD2-CG 4.11Å; L180-L187 HydrophobicContact CB-CD2 4.19Å; F184-L187 HydrophobicContact CB-CB 4.21Å; F184-L187 WeakPolarHBondContact O-CB 3.28Å; F184-L187 PolarHBondContact O-N 2.92Å; P185-L187 PolarHBondContact O-N 3.06Å; L187-N189 PolarHBondContact O-N 3.47Å; L187-D190 HydrophobicContact CD1-CB 4.19Å; L187-D190 WeakPolarHBondContact O-CB 3.42Å; L187-D190 PolarHBondContact O-N 2.98Å; L187-D190 VanDerWaalsContact O-N 3.15Å
188	V	97.9	Very high	95.1	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.018	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-59.1	-29.1	-178.2	78	0	0	0	0	113.4	V181 P185 K186 L218 A223	V181-V188 HydrophobicContact CG1-CB 4.23Å; V181-V188 HydrophobicContact CG1-CG2 4.18Å; P185-V188 WeakPolarHBondContact O-CB 3.45Å; P185-V188 VanDerWaalsContact O-CG1 3.24Å; P185-V188 WeakPolarHBondContact O-CG1 3.39Å; P185-V188 PolarHBondContact O-N 3.16Å; K186-V188 PolarHBondContact O-N 3.39Å; V188-L218 HydrophobicContact CG2-CB 4.5Å; V188-L218 HydrophobicContact CG2-CD2 3.81Å; V188-A223 HydrophobicContact CG2-CB 3.87Å
189	N	97.6	Very high	95.1	Very high	57 Å²	57	25.3 Å²	25.3	31%	0.305	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-104.9	9.9	-177.3	-70.8	-42.2	0	0	0	113.4	K186 L187 G222 A223 D224	K186-N189 PolarHBondContact O-N 3.18Å; L187-N189 PolarHBondContact O-N 3.47Å; N189-G222 PolarHBondContact ND2-O 2.98Å; N189-G222 PolarHBondContact OD1-O 3.3Å; N189-A223 WeakPolarHBondContact OD1-CA 3.47Å; N189-D224 PolarHBondContact OD1-N 3.22Å
190	D	97.4	Very high	95.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.123	C	C	.	.			trans	-62.7	152.6	167.4	-94.6	29.1	0	0	0	110.8	C148 W149 R154 H163 L187	C148-D190 VanDerWaalsContact CB-OD1 3.27Å; C148-D190 WeakPolarHBondContact CB-OD1 3.42Å; C148-D190 PolarHBondContact N-OD1 3.24Å; W149-D190 WeakPolarHBondContact CB-OD2 3.44Å; W149-D190 PolarHBondContact N-OD2 3.16Å; R154-D190 IonicContact CZ-OD2 3.83Å; R154-D190 IonicContact NH1-OD2 3.73Å; R154-D190 IonicContact NH2-OD2 2.64Å; R154-D190 PolarHBondContact NH2-OD2 3.34Å; H163-D190 PolarHBondContact CE1-O 3.45Å; H163-D190 PolarHBondContact NE2-O 2.93Å; L187-D190 HydrophobicContact CD1-CB 4.19Å; L187-D190 WeakPolarHBondContact O-CB 3.42Å; L187-D190 PolarHBondContact O-N 2.98Å; L187-D190 VanDerWaalsContact O-N 3.15Å
191	I	96.9	Very high	95.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-127	161.4	-179.5	57.6	156.2	0	0	0	111.4	L147 R154 I193 Y198 Q200 Q227	L147-I191 HydrophobicContact CD2-CG1 4.16Å; R154-I191 PolarHBondContact NH1-O 3.2Å; I191-I193 HydrophobicContact CG1-CG2 4.43Å; I191-Y198 HydrophobicContact CD1-CE1 4.18Å; I191-Q200 CarbonylContact C-O 3.47Å; I191-Q200 VanDerWaalsContact CA-O 3.22Å; I191-Q200 WeakPolarHBondContact CA-O 3.35Å; I191-Q227 HydrophobicContact CG2-CG 4.15Å
192	Y	96.1	Very high	95.4	Very high	6 Å²	6	24.7 Å²	24.7	2%	0.024	12%	0.124	C	C	.	.			trans	-63.7	139.6	158.3	-81.9	-103.2	0	0	0	110.6	L157 E159 H163 Y197 Y198 G199 Q200	L157-Y192 HydrophobicContact CB-CD1 4.19Å; L157-Y192 HydrophobicContact CB-CE1 4.08Å; L157-Y192 WeakPolarHBondContact O-CD1 3.39Å; E159-Y192 HydrophobicContact CB-CD1 3.85Å; E159-Y192 HydrophobicContact CB-CE1 3.34Å; E159-Y192 HydrophobicContact CB-CE2 4.2Å; E159-Y192 HydrophobicContact CB-CG 4.46Å; E159-Y192 HydrophobicContact CG-CE1 4.35Å; H163-Y192 HydrophobicContact CB-CD2 4.4Å; H163-Y192 HydrophobicContact CB-CE2 3.56Å; H163-Y192 AromaticContact CD2-CD2 3.5Å; H163-Y192 AromaticContact CD2-CE2 3.28Å; H163-Y192 WeakPolarHBondContact CD2-CE2 3.45Å; H163-Y192 AromaticContact CG-CD2 3.89Å; H163-Y192 AromaticContact CG-CE2 3.49Å; H163-Y192 VanDerWaalsContact CG-CE2 3.49Å; H163-Y192 AromaticContact NE2-CD2 3.85Å; Y192-Y197 WeakPolarHBondContact CB-O 3.44Å; Y192-Y197 HydrophobicContact CD1-CD2 4.46Å; Y192-Y197 HydrophobicContact CD1-CG 4.29Å; Y192-Y198 WeakPolarHBondContact O-CA 3.41Å; Y192-G199 PolarHBondContact O-N 3.2Å; Y192-Q200 HydrophobicContact CD2-CB 3.93Å; Y192-Q200 HydrophobicContact CD2-CG 4.38Å; Y192-Q200 HydrophobicContact CG-CB 4.38Å; Y192-Q200 PolarHBondContact N-O 3.08Å
193	I	93.4	Very high	95.5	Very high	19 Å²	19	18.4 Å²	18.4	10%	0.097	10%	0.097	C	C	.	.			trans	-113.1	-4.6	179.6	64	165.5	0	0	0	114.3	L83 I151 G158 I191 Y198	L83-I193 HydrophobicContact CD2-CG2 4.47Å; I151-I193 HydrophobicContact CG2-CD1 3.81Å; G158-I193 VanDerWaalsContact CA-CG1 3.42Å; G158-I193 PolarHBondContact O-N 3.32Å; I191-I193 HydrophobicContact CG1-CG2 4.43Å; I193-Y198 WeakPolarHBondContact O-CD2 3.49Å
194	S	90.8	Very high	95.6	Very high	4 Å²	4	16.1 Å²	16.1	3%	0.028	8%	0.083	C	C	.	.	S	Bend	trans	-69.9	156.2	174.7	57	0	0	0	0	112.3	E90 L157 E196 Y197 Y198	E90-S194 WeakPolarHBondContact OE2-CA 3.44Å; L157-S194 WeakPolarHBondContact O-CB 3.39Å; L157-S194 PolarHBondContact O-N 3.26Å; L157-S194 PolarHBondContact O-OG 3.36Å; S194-E196 PolarHBondContact O-N 3.04Å; S194-Y197 PolarHBondContact O-N 3.33Å; S194-Y198 VanDerWaalsContact O-CA 3.23Å; S194-Y198 WeakPolarHBondContact O-CA 3.24Å; S194-Y198 WeakPolarHBondContact O-CB 3.31Å; S194-Y198 PolarHBondContact O-N 3.47Å
195	E	87.4	Confident	95.7	Very high	8 Å²	8	16.4 Å²	16.4	4%	0.037	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-39.4	176	170.7	62.5	175.7	0	0	113.1	R87 E90 R91 M94 G231 A232 R243	R87-E195 WeakPolarHBondContact CD-OE2 3.27Å; R87-E195 HydrophobicContact CG-CB 4.29Å; R87-E195 WeakPolarHBondContact CG-OE2 3.48Å; E90-E195 PolarHBondContact OE2-N 3.5Å; R91-E195 IonicContact CZ-OE1 3.71Å; R91-E195 IonicContact CZ-OE2 2.63Å; R91-E195 IonicContact NE-OE1 3.34Å; R91-E195 PolarHBondContact NE-OE1 3.27Å; R91-E195 IonicContact NE-OE2 3.2Å; R91-E195 VanDerWaalsContact NH2-CD 3.34Å; R91-E195 IonicContact NH2-OE1 3.72Å; R91-E195 PolarHBondContact NH2-OE1 2.78Å; R91-E195 VanDerWaalsContact NH2-OE1 3.11Å; R91-E195 IonicContact NH2-OE2 3.69Å; R91-E195 PolarHBondContact NH2-OE2 3.18Å; M94-E195 HydrophobicContact CE-CB 4.37Å; E195-G231 WeakPolarHBondContact O-CA 3.35Å; E195-A232 HydrophobicContact CG-CB 4.39Å; E195-A232 PolarHBondContact O-N 3.22Å; E195-R243 IonicContact OE1-CZ 2.81Å; E195-R243 IonicContact OE1-NH1 3.81Å; E195-R243 PolarHBondContact OE1-NH1 3.3Å; E195-R243 IonicContact OE1-NH2 3.71Å; E195-R243 IonicContact OE2-NH1 2.72Å; E195-R243 IonicContact OE2-NH2 3.77Å
196	E	90.2	Very high	95.8	Very high	44 Å²	44	12.7 Å²	12.7	21%	0.206	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-41.1	-176.3	-72.6	-63.8	146	0	0	112.9	S194 G231 A232 F233	S194-E196 PolarHBondContact O-N 3.04Å; E196-G231 CarbonylContact O-C 3.45Å; E196-G231 WeakPolarHBondContact O-CA 3.23Å; E196-A232 PolarHBondContact O-N 3.09Å; E196-A232 VanDerWaalsContact O-N 3.11Å; E196-F233 WeakPolarHBondContact O-CB 3.15Å; E196-F233 PolarHBondContact O-N 3.12Å
197	Y	94.2	Very high	95.9	Very high	29 Å²	29	9.2 Å²	9.2	11%	0.114	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	12.4	-171	-60	-76.7	0	0	0	113.4	L157 Y192 S194 G199 Q200 F233 F234	L157-Y197 HydrophobicContact CB-CD2 4.44Å; L157-Y197 HydrophobicContact CD1-CD2 4.16Å; L157-Y197 HydrophobicContact CD1-CE2 3.84Å; L157-Y197 HydrophobicContact CD2-CD2 4.49Å; L157-Y197 HydrophobicContact CD2-CE2 4.36Å; Y192-Y197 WeakPolarHBondContact CB-O 3.44Å; Y192-Y197 HydrophobicContact CD1-CD2 4.46Å; Y192-Y197 HydrophobicContact CD1-CG 4.29Å; S194-Y197 PolarHBondContact O-N 3.33Å; Y197-G199 PolarHBondContact O-N 3.1Å; Y197-Q200 WeakPolarHBondContact O-CB 3.11Å; Y197-Q200 PolarHBondContact O-N 3.29Å; Y197-F233 HydrophobicContact CD1-CB 4.31Å; Y197-F233 HydrophobicContact CD1-CD1 4.39Å; Y197-F233 HydrophobicContact CD1-CG 4.48Å; Y197-F233 HydrophobicContact CE1-CB 4.05Å; Y197-F233 AromaticContact CE1-CD1 3.76Å; Y197-F233 HydrophobicContact CE1-CD1 3.76Å; Y197-F233 HydrophobicContact CE1-CD2 4.43Å; Y197-F233 HydrophobicContact CE1-CE1 4.31Å; Y197-F233 AromaticContact CE1-CG 3.82Å; Y197-F233 HydrophobicContact CE1-CG 3.82Å; Y197-F234 AromaticContact CD1-CE2 3.85Å; Y197-F234 HydrophobicContact CD1-CE2 3.85Å; Y197-F234 HydrophobicContact CD1-CZ 4.18Å
198	Y	94.9	Very high	95.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.5	126.6	-173.1	-164.1	-78.8	0	0	0	112.9	L83 I191 Y192 I193 S194 Q200 Y230 G231 E250	L83-Y198 HydrophobicContact CB-CE2 4.27Å; L83-Y198 VanDerWaalsContact CB-OH 3.28Å; L83-Y198 WeakPolarHBondContact CB-OH 3.34Å; L83-Y198 WeakPolarHBondContact CD1-OH 3.3Å; I191-Y198 HydrophobicContact CD1-CE1 4.18Å; Y192-Y198 WeakPolarHBondContact O-CA 3.41Å; I193-Y198 WeakPolarHBondContact O-CD2 3.49Å; S194-Y198 VanDerWaalsContact O-CA 3.23Å; S194-Y198 WeakPolarHBondContact O-CA 3.24Å; S194-Y198 WeakPolarHBondContact O-CB 3.31Å; S194-Y198 PolarHBondContact O-N 3.47Å; Y198-Q200 VanDerWaalsContact C-N 3.26Å; Y198-Q200 PolarHBondContact O-N 3.08Å; Y198-Y230 AromaticContact CD1-CD2 3.85Å; Y198-Y230 HydrophobicContact CD1-CD2 3.85Å; Y198-Y230 AromaticContact CD1-CE2 3.17Å; Y198-Y230 HydrophobicContact CD1-CE2 3.17Å; Y198-Y230 AromaticContact CD1-CZ 3.77Å; Y198-Y230 AromaticContact CE1-CE2 3.44Å; Y198-Y230 HydrophobicContact CE1-CE2 3.44Å; Y198-Y230 VanDerWaalsContact CE1-CE2 3.44Å; Y198-Y230 AromaticContact CE1-CZ 3.71Å; Y198-Y230 WeakPolarHBondContact CE1-OH 3.19Å; Y198-Y230 HydrophobicContact CG-CE2 4.21Å; Y198-Y230 PolarHBondContact O-N 2.92Å; Y198-Y230 VanDerWaalsContact O-N 3.09Å; Y198-G231 PolarHBondContact O-N 3.23Å; Y198-G231 VanDerWaalsContact O-N 3.11Å; Y198-E250 HydrophobicContact CE1-CG 4.21Å; Y198-E250 WeakPolarHBondContact CE1-OE1 3.37Å; Y198-E250 PolarHBondContact OH-OE1 3.31Å
199	G	95.6	Very high	95.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-7.2	177.2	0	0	0	0	0	115	Y192 Y197 S201 R228	Y192-G199 PolarHBondContact O-N 3.2Å; Y197-G199 PolarHBondContact O-N 3.1Å; G199-S201 PolarHBondContact O-N 3.27Å; G199-R228 CarbonylContact C-O 3.57Å; G199-R228 VanDerWaalsContact CA-O 3.32Å; G199-R228 WeakPolarHBondContact CA-O 3.2Å
200	Q	97.4	Very high	95.8	Very high	5 Å²	5	17.7 Å²	17.7	2%	0.023	9%	0.088	C	C	.	.			trans	-61	126.4	171.7	-166.7	-177.9	3.7	0	0	109.1	I191 Y192 Y197 Y198 H204 C229 F234	I191-Q200 CarbonylContact C-O 3.47Å; I191-Q200 VanDerWaalsContact CA-O 3.22Å; I191-Q200 WeakPolarHBondContact CA-O 3.35Å; Y192-Q200 HydrophobicContact CD2-CB 3.93Å; Y192-Q200 HydrophobicContact CD2-CG 4.38Å; Y192-Q200 HydrophobicContact CG-CB 4.38Å; Y192-Q200 PolarHBondContact N-O 3.08Å; Y197-Q200 WeakPolarHBondContact O-CB 3.11Å; Y197-Q200 PolarHBondContact O-N 3.29Å; Y198-Q200 VanDerWaalsContact C-N 3.26Å; Y198-Q200 PolarHBondContact O-N 3.08Å; Q200-H204 HydrophobicContact CG-CB 3.75Å; Q200-C229 VanDerWaalsContact CA-SG 3.53Å; Q200-C229 VanDerWaalsContact CB-SG 3.55Å; Q200-F234 HydrophobicContact CB-CE2 4.44Å; Q200-F234 HydrophobicContact CG-CE2 4.41Å
201	S	97.8	Very high	95.7	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.014	10%	0.097	C	C	.	.	B	Isolated β-bridge	trans	-107.2	171.4	179.2	66.9	0	0	0	0	112.1	G199 L203 H204 Q205	G199-S201 PolarHBondContact O-N 3.27Å; S201-L203 PolarHBondContact O-N 3.16Å; S201-L203 PolarHBondContact OG-N 2.99Å; S201-H204 PolarHBondContact N-ND1 2.91Å; S201-H204 WeakPolarHBondContact O-CB 3.43Å; S201-H204 PolarHBondContact O-N 3.39Å; S201-H204 VanDerWaalsContact O-N 3.08Å; S201-H204 PolarHBondContact OG-ND1 3.39Å; S201-Q205 PolarHBondContact O-N 3.12Å; S201-Q205 VanDerWaalsContact O-N 3.08Å
202	A	98.1	Very high	95.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-52.5	-37.6	170.8	0	0	0	0	0	112.6	L162 L166 Q205 A206 L218	L162-A202 HydrophobicContact CD2-CB 3.72Å; L162-A202 HydrophobicContact CG-CB 4.08Å; L166-A202 HydrophobicContact CD1-CB 3.63Å; L166-A202 WeakPolarHBondContact CD1-O 3.49Å; A202-Q205 PolarHBondContact O-N 2.8Å; A202-A206 WeakPolarHBondContact O-CB 3.24Å; A202-A206 PolarHBondContact O-N 3.45Å; A202-L218 HydrophobicContact CB-CD1 4.08Å; A202-L218 HydrophobicContact CB-CD2 4.18Å; A202-L218 WeakPolarHBondContact O-CD1 3.49Å
203	L	98.6	Very high	95.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.2	-42.1	177.7	-176.2	58.9	0	0	0	111.9	S201 A206 I207 V215 L218 L219 A223 P270 L286	S201-L203 PolarHBondContact O-N 3.16Å; S201-L203 PolarHBondContact OG-N 2.99Å; L203-A206 PolarHBondContact O-N 3.1Å; L203-I207 HydrophobicContact CD1-CD1 4.46Å; L203-I207 HydrophobicContact CG-CD1 4.29Å; L203-I207 WeakPolarHBondContact O-CD1 3.44Å; L203-I207 VanDerWaalsContact O-CG1 3.24Å; L203-I207 WeakPolarHBondContact O-CG1 3.43Å; L203-I207 PolarHBondContact O-N 3.37Å; L203-V215 HydrophobicContact CD1-CB 4.49Å; L203-V215 HydrophobicContact CD1-CG1 3.91Å; L203-L218 HydrophobicContact CD1-CB 4.44Å; L203-L219 HydrophobicContact CD1-CD2 4.21Å; L203-L219 HydrophobicContact CD1-CG 4.16Å; L203-L219 HydrophobicContact CD2-CD2 3.83Å; L203-A223 HydrophobicContact CB-CB 4.22Å; L203-A223 HydrophobicContact CD2-CB 4.18Å; L203-P270 HydrophobicContact CD2-CB 3.83Å; L203-P270 HydrophobicContact CD2-CG 3.63Å; L203-P270 HydrophobicContact CG-CB 4.07Å; L203-P270 HydrophobicContact CG-CG 4.09Å; L203-L286 HydrophobicContact CD1-CD2 4.47Å; L203-L286 HydrophobicContact CD2-CD2 4.35Å
204	H	98.5	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-47.4	173.8	-67.7	92.3	0	0	0	111.1	Q200 S201 A206 I207 V208 Q227 E268 P270 F273	Q200-H204 HydrophobicContact CG-CB 3.75Å; S201-H204 PolarHBondContact N-ND1 2.91Å; S201-H204 WeakPolarHBondContact O-CB 3.43Å; S201-H204 PolarHBondContact O-N 3.39Å; S201-H204 VanDerWaalsContact O-N 3.08Å; S201-H204 PolarHBondContact OG-ND1 3.39Å; H204-A206 PolarHBondContact O-N 2.94Å; H204-I207 PolarHBondContact O-N 2.67Å; H204-V208 WeakPolarHBondContact O-CG2 3.47Å; H204-V208 PolarHBondContact O-N 2.95Å; H204-Q227 PolarHBondContact CE1-O 3.19Å; H204-E268 PolarHBondContact NE2-O 3Å; H204-E268 VanDerWaalsContact NE2-O 3.1Å; H204-P270 WeakPolarHBondContact NE2-CD 3.44Å; H204-F273 HydrophobicContact CB-CD1 4.31Å; H204-F273 HydrophobicContact CB-CE1 4.24Å; H204-F273 AromaticContact CD2-CD1 3.92Å; H204-F273 AromaticContact CD2-CD2 3.74Å; H204-F273 AromaticContact CD2-CE1 3.92Å; H204-F273 AromaticContact CD2-CE2 3.75Å; H204-F273 AromaticContact CD2-CG 3.83Å; H204-F273 AromaticContact CD2-CZ 3.84Å
205	Q	97.5	Very high	96.5	Very high	15 Å²	15	24.8 Å²	24.8	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-41.1	-179.1	-170.5	60.3	52.7	0	0	112.2	L166 S201 A202 I207 V208 N209	L166-Q205 HydrophobicContact CB-CB 4.2Å; L166-Q205 HydrophobicContact CB-CG 3.65Å; L166-Q205 HydrophobicContact CD1-CB 4.41Å; S201-Q205 PolarHBondContact O-N 3.12Å; S201-Q205 VanDerWaalsContact O-N 3.08Å; A202-Q205 PolarHBondContact O-N 2.8Å; Q205-I207 VanDerWaalsContact C-N 3.28Å; Q205-I207 PolarHBondContact O-N 2.81Å; Q205-V208 PolarHBondContact O-N 3.39Å; Q205-N209 PolarHBondContact NE2-OD1 3.45Å; Q205-N209 PolarHBondContact O-N 2.79Å; Q205-N209 PolarHBondContact O-OD1 2.83Å
206	A	98.2	Very high	97	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-36.2	176.7	0	0	0	0	0	112.7	A202 L203 H204 N209 E210 D211 M214 V215 L218	A202-A206 WeakPolarHBondContact O-CB 3.24Å; A202-A206 PolarHBondContact O-N 3.45Å; L203-A206 PolarHBondContact O-N 3.1Å; H204-A206 PolarHBondContact O-N 2.94Å; A206-N209 PolarHBondContact O-N 2.69Å; A206-E210 PolarHBondContact O-N 3.49Å; A206-D211 PolarHBondContact O-N 2.89Å; A206-D211 VanDerWaalsContact O-N 3.14Å; A206-M214 HydrophobicContact CB-CB 4.13Å; A206-M214 HydrophobicContact CB-CG 3.75Å; A206-V215 HydrophobicContact CB-CG2 3.85Å; A206-L218 HydrophobicContact CB-CD1 3.7Å
207	I	98.3	Very high	97.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.7	-44.6	174.2	-65.7	166	0	0	0	110.7	L203 H204 Q205 N209 E210 V215 P270 F273 A274 Q279 L286	L203-I207 HydrophobicContact CD1-CD1 4.46Å; L203-I207 HydrophobicContact CG-CD1 4.29Å; L203-I207 WeakPolarHBondContact O-CD1 3.44Å; L203-I207 VanDerWaalsContact O-CG1 3.24Å; L203-I207 WeakPolarHBondContact O-CG1 3.43Å; L203-I207 PolarHBondContact O-N 3.37Å; H204-I207 PolarHBondContact O-N 2.67Å; Q205-I207 VanDerWaalsContact C-N 3.28Å; Q205-I207 PolarHBondContact O-N 2.81Å; I207-N209 PolarHBondContact O-N 3.41Å; I207-E210 PolarHBondContact O-N 2.83Å; I207-V215 HydrophobicContact CG1-CG2 3.69Å; I207-P270 HydrophobicContact CD1-CB 3.69Å; I207-P270 WeakPolarHBondContact CD1-O 3.34Å; I207-F273 HydrophobicContact CG2-CB 4.05Å; I207-A274 HydrophobicContact CG2-CB 3.83Å; I207-Q279 PolarHBondContact O-NE2 3.4Å; I207-L286 HydrophobicContact CD1-CD1 3.89Å; I207-L286 HydrophobicContact CD1-CD2 4.44Å
208	V	96.7	Very high	97.6	Very high	48 Å²	48	29 Å²	29	29%	0.291	15%	0.148	S	C	.	.	H	α-helix	trans	-59.8	-34.9	176.4	172.3	0	0	0	0	111.5	H204 Q205 E210 W266 F273	H204-V208 WeakPolarHBondContact O-CG2 3.47Å; H204-V208 PolarHBondContact O-N 2.95Å; Q205-V208 PolarHBondContact O-N 3.39Å; V208-E210 PolarHBondContact O-N 2.83Å; V208-W266 HydrophobicContact CG2-CZ3 3.97Å; V208-F273 HydrophobicContact CG2-CD1 3.93Å; V208-F273 HydrophobicContact CG2-CE1 4.25Å
209	N	95.8	Very high	97.8	Very high	54 Å²	54	30.4 Å²	30.4	29%	0.289	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.3	175.9	-65.3	-5.6	0	0	0	114.1	L166 Q205 A206 I207 D211	L166-N209 PolarHBondContact O-ND2 3.15Å; Q205-N209 PolarHBondContact NE2-OD1 3.45Å; Q205-N209 PolarHBondContact O-N 2.79Å; Q205-N209 PolarHBondContact O-OD1 2.83Å; A206-N209 PolarHBondContact O-N 2.69Å; I207-N209 PolarHBondContact O-N 3.41Å; N209-D211 HydrophobicContact CB-CB 4.42Å; N209-D211 PolarHBondContact O-N 3.25Å; N209-D211 VanDerWaalsContact O-N 3.16Å
210	E	97.1	Very high	98	Very high	137 Å²	137	36.5 Å²	36.5	64%	0.64	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	25.4	-174.1	-47.7	-168.4	173.2	0	0	113.4	A206 I207 V208 L212	A206-E210 PolarHBondContact O-N 3.49Å; I207-E210 PolarHBondContact O-N 2.83Å; V208-E210 PolarHBondContact O-N 2.83Å; E210-L212 PolarHBondContact O-N 2.5Å
211	D	97.2	Very high	98	Very high	37 Å²	37	39.4 Å²	39.4	20%	0.198	20%	0.197	C	C	.	.			trans	-92	84.9	-178.7	-172.9	-14.7	0	0	0	110.8	N174 A206 N209 A213 M214 V215	N174-D211 PolarHBondContact ND2-OD2 3.43Å; A206-D211 PolarHBondContact O-N 2.89Å; A206-D211 VanDerWaalsContact O-N 3.14Å; N209-D211 HydrophobicContact CB-CB 4.42Å; N209-D211 PolarHBondContact O-N 3.25Å; N209-D211 VanDerWaalsContact O-N 3.16Å; D211-A213 PolarHBondContact O-N 2.85Å; D211-A213 WeakPolarHBondContact OD1-CB 3.27Å; D211-A213 PolarHBondContact OD1-N 3.09Å; D211-A213 VanDerWaalsContact OD1-N 3.08Å; D211-M214 HydrophobicContact CB-CB 3.92Å; D211-M214 PolarHBondContact O-N 3Å; D211-M214 VanDerWaalsContact O-N 3.16Å; D211-M214 PolarHBondContact OD1-N 3.11Å; D211-M214 WeakPolarHBondContact OD2-CB 3.41Å; D211-V215 WeakPolarHBondContact O-CG2 3.4Å; D211-V215 PolarHBondContact O-N 2.99Å
212	L	98	Very high	98	Very high	77 Å²	77	41.5 Å²	41.5	40%	0.403	22%	0.219	S	C	.	.	H	α-helix	trans	-57.9	-32.4	178.6	-173.4	65.2	0	0	0	112.8	E210 R216 D281 C282 L285	E210-L212 PolarHBondContact O-N 2.5Å; L212-R216 WeakPolarHBondContact O-CB 3.49Å; L212-R216 PolarHBondContact O-N 3.11Å; L212-D281 HydrophobicContact CD2-CB 4.08Å; L212-C282 HydrophobicContact CD1-CB 4.16Å; L212-L285 HydrophobicContact CD1-CB 4.34Å; L212-L285 HydrophobicContact CD1-CD2 3.59Å; L212-L285 HydrophobicContact CG-CD2 4.4Å
213	A	98	Very high	98	Very high	64 Å²	64	41.9 Å²	41.9	53%	0.529	22%	0.223	S	C	.	.	H	α-helix	trans	-70	-41.8	179.2	0	0	0	0	0	111	D211 R216 F217	D211-A213 PolarHBondContact O-N 2.85Å; D211-A213 WeakPolarHBondContact OD1-CB 3.27Å; D211-A213 PolarHBondContact OD1-N 3.09Å; D211-A213 VanDerWaalsContact OD1-N 3.08Å; A213-R216 PolarHBondContact O-N 2.96Å; A213-F217 WeakPolarHBondContact O-CB 3.44Å; A213-F217 PolarHBondContact O-N 2.78Å
214	M	98.3	Very high	97.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-67.2	-41.4	173.6	-174.1	60	70.6	0	0	112	L166 N174 A177 K178 A206 D211 R216 F217 L218	L166-M214 HydrophobicContact CD2-CE 4.01Å; L166-M214 HydrophobicContact CD2-CG 3.85Å; L166-M214 HydrophobicContact CD2-SD 4.15Å; N174-M214 HydrophobicContact CB-CE 3.57Å; N174-M214 WeakPolarHBondContact O-CE 3.43Å; A177-M214 HydrophobicContact CB-CE 4.31Å; K178-M214 HydrophobicContact CG-CE 4.12Å; A206-M214 HydrophobicContact CB-CB 4.13Å; A206-M214 HydrophobicContact CB-CG 3.75Å; D211-M214 HydrophobicContact CB-CB 3.92Å; D211-M214 PolarHBondContact O-N 3Å; D211-M214 VanDerWaalsContact O-N 3.16Å; D211-M214 PolarHBondContact OD1-N 3.11Å; D211-M214 WeakPolarHBondContact OD2-CB 3.41Å; M214-R216 VanDerWaalsContact C-N 3.32Å; M214-R216 PolarHBondContact O-N 3.25Å; M214-F217 WeakPolarHBondContact O-CB 3.34Å; M214-F217 PolarHBondContact O-N 3.36Å; M214-F217 VanDerWaalsContact O-N 3.16Å; M214-F217 HydrophobicContact SD-CB 4.48Å; M214-F217 HydrophobicContact SD-CD1 3.87Å; M214-L218 HydrophobicContact CG-CD1 3.97Å; M214-L218 HydrophobicContact CG-CG 4.19Å; M214-L218 WeakPolarHBondContact O-CB 3.15Å; M214-L218 VanDerWaalsContact O-CG 3.31Å; M214-L218 WeakPolarHBondContact O-CG 3.3Å; M214-L218 PolarHBondContact O-N 3.2Å; M214-L218 HydrophobicContact SD-CD1 4.43Å; M214-L218 HydrophobicContact SD-CD2 4.43Å; M214-L218 HydrophobicContact SD-CG 4.09Å
215	V	98.7	Very high	97.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.1	-48.8	174.1	172.4	0	0	0	0	110.3	L203 A206 I207 D211 F217 L218 L219 L285 L286	L203-V215 HydrophobicContact CD1-CB 4.49Å; L203-V215 HydrophobicContact CD1-CG1 3.91Å; A206-V215 HydrophobicContact CB-CG2 3.85Å; I207-V215 HydrophobicContact CG1-CG2 3.69Å; D211-V215 WeakPolarHBondContact O-CG2 3.4Å; D211-V215 PolarHBondContact O-N 2.99Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 2.78Å; V215-L218 PolarHBondContact O-N 2.81Å; V215-L219 HydrophobicContact CG1-CD1 3.87Å; V215-L219 VanDerWaalsContact O-CG 3.24Å; V215-L219 WeakPolarHBondContact O-CG 3.37Å; V215-L219 PolarHBondContact O-N 2.64Å; V215-L285 HydrophobicContact CB-CD2 4.31Å; V215-L285 HydrophobicContact CG1-CD2 3.77Å; V215-L286 HydrophobicContact CG1-CD2 4.4Å
216	R	98.6	Very high	97.9	Very high	148 Å²	148	48.1 Å²	48.1	56%	0.558	26%	0.255	S	S	*	.	H	α-helix	trans	-59.7	-45	176.1	-177.3	177	177.6	162.1	0.4	112	L212 A213 M214 L219 Q220 L285	L212-R216 WeakPolarHBondContact O-CB 3.49Å; L212-R216 PolarHBondContact O-N 3.11Å; A213-R216 PolarHBondContact O-N 2.96Å; M214-R216 VanDerWaalsContact C-N 3.32Å; M214-R216 PolarHBondContact O-N 3.25Å; R216-L219 PolarHBondContact O-N 3.46Å; R216-Q220 VanDerWaalsContact O-CG 3.27Å; R216-Q220 WeakPolarHBondContact O-CG 3.35Å; R216-Q220 PolarHBondContact O-N 2.77Å; R216-L285 HydrophobicContact CB-CD2 3.88Å
217	F	98.6	Very high	97.9	Very high	21 Å²	21	48.9 Å²	48.9	9%	0.092	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-49.8	178.7	173.9	-92.3	0	0	0	111.5	K178 V181 K182 A213 M214 V215 L219 Q220 H221	K178-F217 HydrophobicContact CB-CE1 4.04Å; K178-F217 HydrophobicContact CB-CE2 4.03Å; K178-F217 HydrophobicContact CB-CZ 3.68Å; K178-F217 HydrophobicContact CD-CD2 4.49Å; K178-F217 HydrophobicContact CG-CD1 3.95Å; K178-F217 HydrophobicContact CG-CD2 4.05Å; K178-F217 HydrophobicContact CG-CE1 3.77Å; K178-F217 HydrophobicContact CG-CE2 3.85Å; K178-F217 HydrophobicContact CG-CG 4.1Å; K178-F217 HydrophobicContact CG-CZ 3.73Å; V181-F217 HydrophobicContact CB-CE1 3.86Å; V181-F217 HydrophobicContact CB-CZ 4.23Å; V181-F217 HydrophobicContact CG1-CE1 3.89Å; V181-F217 HydrophobicContact CG1-CZ 4.24Å; V181-F217 HydrophobicContact CG2-CE1 4.32Å; K182-F217 HydrophobicContact CG-CZ 4.29Å; A213-F217 WeakPolarHBondContact O-CB 3.44Å; A213-F217 PolarHBondContact O-N 2.78Å; M214-F217 WeakPolarHBondContact O-CB 3.34Å; M214-F217 PolarHBondContact O-N 3.36Å; M214-F217 VanDerWaalsContact O-N 3.16Å; M214-F217 HydrophobicContact SD-CB 4.48Å; M214-F217 HydrophobicContact SD-CD1 3.87Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 2.78Å; F217-L219 PolarHBondContact O-N 2.84Å; F217-Q220 WeakPolarHBondContact O-CB 3.37Å; F217-Q220 PolarHBondContact O-N 3.11Å; F217-H221 AromaticContact CD2-CE1 3.51Å; F217-H221 AromaticContact CD2-ND1 3.78Å; F217-H221 AromaticContact CE2-CE1 3.11Å; F217-H221 WeakPolarHBondContact CE2-CE1 3.36Å; F217-H221 AromaticContact CE2-ND1 3.62Å; F217-H221 AromaticContact CE2-NE2 3.63Å; F217-H221 AromaticContact CZ-CE1 3.56Å; F217-H221 AromaticContact CZ-ND1 3.76Å; F217-H221 AromaticContact CZ-NE2 3.79Å; F217-H221 PolarHBondContact O-N 2.86Å; F217-H221 VanDerWaalsContact O-N 3.15Å; F217-H221 PolarHBondContact O-ND1 3.37Å
218	L	98.8	Very high	97.8	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-43.6	-179.7	-69.3	172.7	0	0	0	111.6	L166 V181 V188 A202 L203 A206 M214 V215 Q220 H221 G222 A223	L166-L218 HydrophobicContact CD1-CD1 4.49Å; V181-L218 HydrophobicContact CG2-CD2 4.22Å; V188-L218 HydrophobicContact CG2-CB 4.5Å; V188-L218 HydrophobicContact CG2-CD2 3.81Å; A202-L218 HydrophobicContact CB-CD1 4.08Å; A202-L218 HydrophobicContact CB-CD2 4.18Å; A202-L218 WeakPolarHBondContact O-CD1 3.49Å; L203-L218 HydrophobicContact CD1-CB 4.44Å; A206-L218 HydrophobicContact CB-CD1 3.7Å; M214-L218 HydrophobicContact CG-CD1 3.97Å; M214-L218 HydrophobicContact CG-CG 4.19Å; M214-L218 WeakPolarHBondContact O-CB 3.15Å; M214-L218 VanDerWaalsContact O-CG 3.31Å; M214-L218 WeakPolarHBondContact O-CG 3.3Å; M214-L218 PolarHBondContact O-N 3.2Å; M214-L218 HydrophobicContact SD-CD1 4.43Å; M214-L218 HydrophobicContact SD-CD2 4.43Å; M214-L218 HydrophobicContact SD-CG 4.09Å; V215-L218 PolarHBondContact O-N 2.81Å; L218-Q220 VanDerWaalsContact C-N 3.34Å; L218-Q220 PolarHBondContact O-N 3.32Å; L218-H221 CarbonylContact O-C 3.5Å; L218-H221 PolarHBondContact O-N 3.01Å; L218-H221 VanDerWaalsContact O-N 3.08Å; L218-G222 PolarHBondContact O-N 3Å; L218-A223 HydrophobicContact CB-CB 3.9Å; L218-A223 VanDerWaalsContact O-CB 3.23Å; L218-A223 WeakPolarHBondContact O-CB 3.38Å; L218-A223 PolarHBondContact O-N 3.39Å
219	L	98.6	Very high	97.7	Very high	30 Å²	30	48.8 Å²	48.8	16%	0.157	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-40.6	176.4	-68.8	168.2	0	0	0	112.2	L203 V215 R216 F217 H221 G222 V225 L285 L286 A289	L203-L219 HydrophobicContact CD1-CD2 4.21Å; L203-L219 HydrophobicContact CD1-CG 4.16Å; L203-L219 HydrophobicContact CD2-CD2 3.83Å; V215-L219 HydrophobicContact CG1-CD1 3.87Å; V215-L219 VanDerWaalsContact O-CG 3.24Å; V215-L219 WeakPolarHBondContact O-CG 3.37Å; V215-L219 PolarHBondContact O-N 2.64Å; R216-L219 PolarHBondContact O-N 3.46Å; F217-L219 PolarHBondContact O-N 2.84Å; L219-H221 PolarHBondContact O-N 2.87Å; L219-G222 PolarHBondContact O-N 3.36Å; L219-V225 HydrophobicContact CD2-CB 4.31Å; L219-V225 HydrophobicContact CD2-CG2 4.3Å; L219-L285 HydrophobicContact CD1-CD2 4.25Å; L219-L285 HydrophobicContact CD1-CG 3.99Å; L219-L286 HydrophobicContact CD1-CD2 4.08Å; L219-L286 HydrophobicContact CD2-CD2 4.29Å; L219-A289 HydrophobicContact CD1-CB 3.9Å; L219-A289 HydrophobicContact CD2-CB 3.89Å; L219-A289 HydrophobicContact CG-CB 4.33Å
220	Q	98.2	Very high	97.5	Very high	127 Å²	127	46.8 Å²	46.8	59%	0.593	24%	0.241	S	C	*	.	H	α-helix	trans	-64.6	-24.6	175.4	-73.8	174.2	-19.9	0	0	113	R216 F217 L218	R216-Q220 VanDerWaalsContact O-CG 3.27Å; R216-Q220 WeakPolarHBondContact O-CG 3.35Å; R216-Q220 PolarHBondContact O-N 2.77Å; F217-Q220 WeakPolarHBondContact O-CB 3.37Å; F217-Q220 PolarHBondContact O-N 3.11Å; L218-Q220 VanDerWaalsContact C-N 3.34Å; L218-Q220 PolarHBondContact O-N 3.32Å
221	H	98.4	Very high	97.3	Very high	66 Å²	66	40.2 Å²	40.2	31%	0.306	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	15.8	179.3	-65.5	73.1	0	0	0	112.9	V181 F217 L218 L219	V181-H221 HydrophobicContact CG1-CB 3.55Å; F217-H221 AromaticContact CD2-CE1 3.51Å; F217-H221 AromaticContact CD2-ND1 3.78Å; F217-H221 AromaticContact CE2-CE1 3.11Å; F217-H221 WeakPolarHBondContact CE2-CE1 3.36Å; F217-H221 AromaticContact CE2-ND1 3.62Å; F217-H221 AromaticContact CE2-NE2 3.63Å; F217-H221 AromaticContact CZ-CE1 3.56Å; F217-H221 AromaticContact CZ-ND1 3.76Å; F217-H221 AromaticContact CZ-NE2 3.79Å; F217-H221 PolarHBondContact O-N 2.86Å; F217-H221 VanDerWaalsContact O-N 3.15Å; F217-H221 PolarHBondContact O-ND1 3.37Å; L218-H221 CarbonylContact O-C 3.5Å; L218-H221 PolarHBondContact O-N 3.01Å; L218-H221 VanDerWaalsContact O-N 3.08Å; L219-H221 PolarHBondContact O-N 2.87Å
222	G	97.1	Very high	97	Very high	46 Å²	46	38.7 Å²	38.7	47%	0.474	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	22.9	170.3	0	0	0	0	0	115.2	N189 L218 L219 D224	N189-G222 PolarHBondContact ND2-O 2.98Å; N189-G222 PolarHBondContact OD1-O 3.3Å; L218-G222 PolarHBondContact O-N 3Å; L219-G222 PolarHBondContact O-N 3.36Å; G222-D224 PolarHBondContact O-N 3.49Å
223	A	98.4	Very high	96.8	Very high	9 Å²	9	36.4 Å²	36.4	7%	0.074	19%	0.19	C	C	.	.			trans	-57.6	129.4	167.5	0	0	0	0	0	110.9	V188 N189 L203 L218 V225	V188-A223 HydrophobicContact CG2-CB 3.87Å; N189-A223 WeakPolarHBondContact OD1-CA 3.47Å; L203-A223 HydrophobicContact CB-CB 4.22Å; L203-A223 HydrophobicContact CD2-CB 4.18Å; L218-A223 HydrophobicContact CB-CB 3.9Å; L218-A223 VanDerWaalsContact O-CB 3.23Å; L218-A223 WeakPolarHBondContact O-CB 3.38Å; L218-A223 PolarHBondContact O-N 3.39Å; A223-V225 PolarHBondContact O-N 3.37Å
224	D	97.7	Very high	96.7	Very high	65 Å²	65	33.7 Å²	33.7	35%	0.348	17%	0.167	S	C	.	.			trans	-71.2	109.9	179.2	-177.1	6.6	0	0	0	110.7	N189 G222 H226 Q227	N189-D224 PolarHBondContact OD1-N 3.22Å; G222-D224 PolarHBondContact O-N 3.49Å; D224-H226 PolarHBondContact O-N 3.43Å; D224-H226 WeakPolarHBondContact OD1-CA 3.43Å; D224-H226 WeakPolarHBondContact OD1-CB 3.31Å; D224-H226 PolarHBondContact OD1-N 2.78Å; D224-Q227 HydrophobicContact CB-CB 4.17Å; D224-Q227 WeakPolarHBondContact O-CB 3.43Å; D224-Q227 PolarHBondContact O-N 3.49Å
225	V	98.3	Very high	96.4	Very high	14 Å²	14	34.2 Å²	34.2	9%	0.085	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.8	178.1	76.5	0	0	0	0	112.9	L219 A223 P270 L286 A289 A291	L219-V225 HydrophobicContact CD2-CB 4.31Å; L219-V225 HydrophobicContact CD2-CG2 4.3Å; A223-V225 PolarHBondContact O-N 3.37Å; V225-P270 WeakPolarHBondContact O-CD 3.36Å; V225-P270 WeakPolarHBondContact O-CG 3.17Å; V225-L286 HydrophobicContact CG2-CD2 3.91Å; V225-A289 HydrophobicContact CG2-CB 4.47Å; V225-A291 HydrophobicContact CG2-CB 3.62Å
226	H	97.6	Very high	96.2	Very high	67 Å²	67	34.2 Å²	34.2	31%	0.31	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	11	178.4	-55.5	-54.7	0	0	0	113	D224 R228 Y269 K290 M295	D224-H226 PolarHBondContact O-N 3.43Å; D224-H226 WeakPolarHBondContact OD1-CA 3.43Å; D224-H226 WeakPolarHBondContact OD1-CB 3.31Å; D224-H226 PolarHBondContact OD1-N 2.78Å; H226-R228 PolarHBondContact O-N 3.36Å; H226-Y269 WeakPolarHBondContact O-CD1 3.45Å; H226-Y269 WeakPolarHBondContact O-CE1 3.06Å; H226-K290 PolarHBondContact CE1-O 2.79Å; H226-M295 HydrophobicContact CB-CE 3.74Å; H226-M295 HydrophobicContact CB-SD 4.18Å; H226-M295 WeakPolarHBondContact ND1-CE 3.45Å
227	Q	96.9	Very high	95.9	Very high	16 Å²	16	31.1 Å²	31.1	8%	0.075	17%	0.165	C	C	.	.			trans	-57.9	134	175.3	-179.8	53.7	48.8	0	0	110.3	I191 H204 D224 P270	I191-Q227 HydrophobicContact CG2-CG 4.15Å; H204-Q227 PolarHBondContact CE1-O 3.19Å; D224-Q227 HydrophobicContact CB-CB 4.17Å; D224-Q227 WeakPolarHBondContact O-CB 3.43Å; D224-Q227 PolarHBondContact O-N 3.49Å; Q227-P270 WeakPolarHBondContact O-CD 3.39Å
228	R	96.6	Very high	95.6	Very high	44 Å²	44	33.2 Å²	33.2	17%	0.166	18%	0.177	C	C	.	.			trans	-97	134.6	-179.1	-67.9	179.4	73.4	-169.1	-1.3	111.4	G199 H226 Y230 E268 Y269 T298	G199-R228 CarbonylContact C-O 3.57Å; G199-R228 VanDerWaalsContact CA-O 3.32Å; G199-R228 WeakPolarHBondContact CA-O 3.2Å; H226-R228 PolarHBondContact O-N 3.36Å; R228-Y230 HydrophobicContact CB-CD1 3.81Å; R228-Y230 HydrophobicContact CB-CE1 3.71Å; R228-E268 CarbonylContact C-O 3.47Å; R228-E268 WeakPolarHBondContact CA-O 3.43Å; R228-E268 HydrophobicContact CB-CB 4.41Å; R228-E268 IonicContact CZ-OE2 3.05Å; R228-E268 IonicContact NE-OE2 3.29Å; R228-E268 PolarHBondContact NE-OE2 3.17Å; R228-E268 IonicContact NH2-OE1 2.6Å; R228-E268 PolarHBondContact NH2-OE1 3.12Å; R228-E268 IonicContact NH2-OE2 2.98Å; R228-E268 PolarHBondContact NH2-OE2 2.7Å; R228-Y269 HydrophobicContact CG-CD1 3.94Å; R228-Y269 HydrophobicContact CG-CE1 3.27Å; R228-T298 PolarHBondContact NH2-OG1 3.13Å
229	C	95.5	Very high	95.3	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.007	18%	0.177	C	C	.	.			trans	-118	102.5	173.7	-179	0	0	0	0	110.4	Q200 F234 E268 F273	Q200-C229 VanDerWaalsContact CA-SG 3.53Å; Q200-C229 VanDerWaalsContact CB-SG 3.55Å; C229-F234 WeakPolarHBondContact SG-CD2 3.16Å; C229-F234 WeakPolarHBondContact SG-CE2 3.3Å; C229-E268 PolarHBondContact N-O 3.27Å; C229-E268 WeakPolarHBondContact O-CA 3.3Å; C229-E268 WeakPolarHBondContact O-CG 3.38Å; C229-F273 HydrophobicContact CB-CE2 4.39Å; C229-F273 HydrophobicContact CB-CZ 4.22Å
230	Y	91.4	Very high	94.8	Very high	12 Å²	12	34.8 Å²	34.8	5%	0.047	18%	0.182	C	C	.	.			trans	-123.5	32.1	-177	43.7	-102.4	0	0	0	112.4	R87 Y198 R228 R243 E250 W251	R87-Y230 VanDerWaalsContact NH1-CE2 3.29Å; Y198-Y230 AromaticContact CD1-CD2 3.85Å; Y198-Y230 HydrophobicContact CD1-CD2 3.85Å; Y198-Y230 AromaticContact CD1-CE2 3.17Å; Y198-Y230 HydrophobicContact CD1-CE2 3.17Å; Y198-Y230 AromaticContact CD1-CZ 3.77Å; Y198-Y230 AromaticContact CE1-CE2 3.44Å; Y198-Y230 HydrophobicContact CE1-CE2 3.44Å; Y198-Y230 VanDerWaalsContact CE1-CE2 3.44Å; Y198-Y230 AromaticContact CE1-CZ 3.71Å; Y198-Y230 WeakPolarHBondContact CE1-OH 3.19Å; Y198-Y230 HydrophobicContact CG-CE2 4.21Å; Y198-Y230 PolarHBondContact O-N 2.92Å; Y198-Y230 VanDerWaalsContact O-N 3.09Å; R228-Y230 HydrophobicContact CB-CD1 3.81Å; R228-Y230 HydrophobicContact CB-CE1 3.71Å; Y230-R243 PolarHBondContact O-NH2 3.5Å; Y230-E250 WeakPolarHBondContact CE2-O 3.35Å; Y230-E250 WeakPolarHBondContact OH-CB 3.38Å; Y230-E250 WeakPolarHBondContact OH-CG 3.34Å; Y230-E250 PolarHBondContact OH-O 2.95Å; Y230-E250 PolarHBondContact OH-OE1 3.29Å; Y230-W251 HydrophobicContact CD1-CB 4.16Å; Y230-W251 HydrophobicContact CE1-CB 4.13Å; Y230-W251 HydrophobicContact CG-CB 4.43Å
231	G	92.9	Very high	94	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.			trans	-60.2	153.5	170	0	0	0	0	0	112.2	E195 E196 Y198 F233 F234	E195-G231 WeakPolarHBondContact O-CA 3.35Å; E196-G231 CarbonylContact O-C 3.45Å; E196-G231 WeakPolarHBondContact O-CA 3.23Å; Y198-G231 PolarHBondContact O-N 3.23Å; Y198-G231 VanDerWaalsContact O-N 3.11Å; G231-F233 PolarHBondContact O-N 3.34Å; G231-F234 PolarHBondContact O-N 3Å; G231-F234 VanDerWaalsContact O-N 3.11Å
232	A	91.5	Very high	93.2	Very high	5 Å²	5	34.9 Å²	34.9	4%	0.041	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-53.5	-37.9	-179.1	0	0	0	0	0	112.1	E195 E196 F234 C235 K240	E195-A232 HydrophobicContact CG-CB 4.39Å; E195-A232 PolarHBondContact O-N 3.22Å; E196-A232 PolarHBondContact O-N 3.09Å; E196-A232 VanDerWaalsContact O-N 3.11Å; A232-F234 PolarHBondContact O-N 2.85Å; A232-C235 WeakPolarHBondContact O-CB 3.45Å; A232-C235 PolarHBondContact O-N 2.95Å; A232-C235 VanDerWaalsContact O-N 3.12Å; A232-K240 WeakPolarHBondContact O-CE 3.1Å
233	F	93	Very high	92.6	Very high	28 Å²	28	33 Å²	33	12%	0.123	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-59.7	-34.7	-177.8	-173.9	-104.7	0	0	0	112.9	N13 E196 Y197 G231 T264	N13-F233 WeakPolarHBondContact ND2-CD2 3.41Å; E196-F233 WeakPolarHBondContact O-CB 3.15Å; E196-F233 PolarHBondContact O-N 3.12Å; Y197-F233 HydrophobicContact CD1-CB 4.31Å; Y197-F233 HydrophobicContact CD1-CD1 4.39Å; Y197-F233 HydrophobicContact CD1-CG 4.48Å; Y197-F233 HydrophobicContact CE1-CB 4.05Å; Y197-F233 AromaticContact CE1-CD1 3.76Å; Y197-F233 HydrophobicContact CE1-CD1 3.76Å; Y197-F233 HydrophobicContact CE1-CD2 4.43Å; Y197-F233 HydrophobicContact CE1-CE1 4.31Å; Y197-F233 AromaticContact CE1-CG 3.82Å; Y197-F233 HydrophobicContact CE1-CG 3.82Å; G231-F233 PolarHBondContact O-N 3.34Å; F233-T264 HydrophobicContact CE1-CG2 3.74Å; F233-T264 HydrophobicContact CZ-CG2 3.77Å; F233-T264 PolarHBondContact O-OG1 3.08Å
234	F	94.8	Very high	91.8	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.035	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-96.1	9.1	-178.6	-54.4	-75	0	0	0	113.1	Y197 Q200 C229 G231 A232 T264 Y265 W266 F273	Y197-F234 AromaticContact CD1-CE2 3.85Å; Y197-F234 HydrophobicContact CD1-CE2 3.85Å; Y197-F234 HydrophobicContact CD1-CZ 4.18Å; Q200-F234 HydrophobicContact CB-CE2 4.44Å; Q200-F234 HydrophobicContact CG-CE2 4.41Å; C229-F234 WeakPolarHBondContact SG-CD2 3.16Å; C229-F234 WeakPolarHBondContact SG-CE2 3.3Å; G231-F234 PolarHBondContact O-N 3Å; G231-F234 VanDerWaalsContact O-N 3.11Å; A232-F234 PolarHBondContact O-N 2.85Å; F234-T264 WeakPolarHBondContact CA-O 3.38Å; F234-Y265 WeakPolarHBondContact O-CA 3.39Å; F234-Y265 WeakPolarHBondContact O-CD2 3.5Å; F234-W266 HydrophobicContact CD1-CE3 4.13Å; F234-W266 HydrophobicContact CD1-CZ3 4.5Å; F234-W266 HydrophobicContact CE1-CE3 4.01Å; F234-W266 AromaticContact CE1-CZ3 3.99Å; F234-W266 HydrophobicContact CE1-CZ3 3.99Å; F234-F273 HydrophobicContact CD1-CE1 4.01Å; F234-F273 AromaticContact CD1-CZ 3.63Å; F234-F273 HydrophobicContact CD1-CZ 3.63Å; F234-F273 HydrophobicContact CD2-CZ 4.36Å; F234-F273 AromaticContact CE1-CE1 3.63Å; F234-F273 HydrophobicContact CE1-CE1 3.63Å; F234-F273 AromaticContact CE1-CZ 3.71Å; F234-F273 HydrophobicContact CE1-CZ 3.71Å; F234-F273 HydrophobicContact CE2-CZ 4.41Å; F234-F273 AromaticContact CG-CZ 3.97Å; F234-F273 HydrophobicContact CG-CZ 3.97Å; F234-F273 HydrophobicContact CZ-CE1 4.01Å; F234-F273 HydrophobicContact CZ-CZ 4.11Å
235	C	92.9	Very high	91	Very high	12 Å²	12	34.7 Å²	34.7	8%	0.081	18%	0.178	C	C	.	.	S	Bend	trans	-93.7	150.6	177.7	-166.9	0	0	0	0	110.9	A232 D237 K240	A232-C235 WeakPolarHBondContact O-CB 3.45Å; A232-C235 PolarHBondContact O-N 2.95Å; A232-C235 VanDerWaalsContact O-N 3.12Å; C235-D237 PolarHBondContact O-N 3.23Å; C235-K240 HydrophobicContact CB-CG 4.27Å; C235-K240 WeakPolarHBondContact O-CE 3.39Å
236	P	95.4	Very high	89.9	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.			trans	-50.4	136.9	167.1	-29.8	37.8	0	0	0	112.3	D238 Q239 K240 Y260 A261 Y265	P236-D238 VanDerWaalsContact CB-OD1 3.3Å; P236-D238 WeakPolarHBondContact CB-OD1 3.43Å; P236-D238 PolarHBondContact O-N 3.47Å; P236-Q239 HydrophobicContact CB-CB 4.41Å; P236-Q239 HydrophobicContact CB-CG 4.28Å; P236-Q239 VanDerWaalsContact CD-OE1 3.29Å; P236-Q239 VanDerWaalsContact CG-OE1 3.25Å; P236-Q239 PolarHBondContact O-N 2.88Å; P236-K240 PolarHBondContact O-N 2.94Å; P236-Y260 HydrophobicContact CG-CD1 4.34Å; P236-A261 CarbonylContact C-O 3.54Å; P236-A261 VanDerWaalsContact CA-O 3.24Å; P236-A261 WeakPolarHBondContact CA-O 3.44Å; P236-Y265 HydrophobicContact CG-CD1 3.7Å; P236-Y265 HydrophobicContact CG-CD2 3.99Å; P236-Y265 HydrophobicContact CG-CE1 3.9Å; P236-Y265 HydrophobicContact CG-CE2 4.22Å; P236-Y265 HydrophobicContact CG-CG 3.72Å
237	D	92	Very high	88.5	Confident	83 Å²	83	35.3 Å²	35.3	44%	0.444	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-37.4	-174.1	-73.9	-27.7	0	0	0	112.1	C235 Q239 K240 A261 G262	C235-D237 PolarHBondContact O-N 3.23Å; D237-Q239 VanDerWaalsContact C-N 3.27Å; D237-Q239 PolarHBondContact O-N 2.87Å; D237-K240 WeakPolarHBondContact OD1-CE 3.45Å; D237-K240 IonicContact OD1-NZ 3.69Å; D237-K240 PolarHBondContact OD1-NZ 3.25Å; D237-A261 PolarHBondContact N-O 3.4Å; D237-G262 WeakPolarHBondContact OD2-CA 3.48Å
238	D	92.3	Very high	87.2	Confident	65 Å²	65	42.3 Å²	42.3	35%	0.348	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.2	179.4	69.3	-30.1	0	0	0	113.6	P236 T258 N259	P236-D238 VanDerWaalsContact CB-OD1 3.3Å; P236-D238 WeakPolarHBondContact CB-OD1 3.43Å; P236-D238 PolarHBondContact O-N 3.47Å; D238-T258 PolarHBondContact OD1-OG1 2.91Å; D238-T258 WeakPolarHBondContact OD2-CA 3.31Å; D238-T258 WeakPolarHBondContact OD2-CB 3.35Å; D238-T258 PolarHBondContact OD2-OG1 3.32Å; D238-T258 VanDerWaalsContact OD2-OG1 3.1Å; D238-N259 PolarHBondContact OD1-OD1 3.16Å; D238-N259 PolarHBondContact OD2-N 2.87Å; D238-N259 PolarHBondContact OD2-OD1 3.47Å
239	Q	91.2	Very high	86.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-24.3	179.3	-68.8	-179.2	-40.2	0	0	113	P236 D237 E241 S242 R243 N255 N299	P236-Q239 HydrophobicContact CB-CB 4.41Å; P236-Q239 HydrophobicContact CB-CG 4.28Å; P236-Q239 VanDerWaalsContact CD-OE1 3.29Å; P236-Q239 VanDerWaalsContact CG-OE1 3.25Å; P236-Q239 PolarHBondContact O-N 2.88Å; D237-Q239 VanDerWaalsContact C-N 3.27Å; D237-Q239 PolarHBondContact O-N 2.87Å; Q239-E241 VanDerWaalsContact C-N 3.34Å; Q239-E241 PolarHBondContact O-N 3.16Å; Q239-S242 PolarHBondContact O-N 3.02Å; Q239-S242 PolarHBondContact O-OG 3.15Å; Q239-R243 PolarHBondContact O-N 3Å; Q239-N255 PolarHBondContact NE2-O 2.88Å; Q239-N299 PolarHBondContact NE2-OD1 3.01Å; Q239-N299 PolarHBondContact OE1-ND2 2.98Å; Q239-N299 PolarHBondContact OE1-OD1 2.71Å
240	K	87.7	Confident	86.1	Confident	61 Å²	61	42 Å²	42	27%	0.265	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-49.6	-47.4	-171.8	-71.4	177.6	-173.5	178.5	0	114	A232 C235 P236 D237 S242	A232-K240 WeakPolarHBondContact O-CE 3.1Å; C235-K240 HydrophobicContact CB-CG 4.27Å; C235-K240 WeakPolarHBondContact O-CE 3.39Å; P236-K240 PolarHBondContact O-N 2.94Å; D237-K240 WeakPolarHBondContact OD1-CE 3.45Å; D237-K240 IonicContact OD1-NZ 3.69Å; D237-K240 PolarHBondContact OD1-NZ 3.25Å; K240-S242 VanDerWaalsContact C-N 3.32Å; K240-S242 PolarHBondContact O-N 3.04Å
241	E	81.4	Confident	85.9	Confident	146 Å²	146	45.1 Å²	45.1	68%	0.682	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-72.1	-23.9	-178.4	-62.3	-164.3	164.4	0	0	114	R100 Q239	R100-E241 IonicContact CZ-OE2 3.52Å; R100-E241 VanDerWaalsContact CZ-OE2 3.29Å; R100-E241 VanDerWaalsContact NH1-CD 3.32Å; R100-E241 IonicContact NH1-OE1 3.22Å; R100-E241 PolarHBondContact NH1-OE1 3.45Å; R100-E241 IonicContact NH1-OE2 2.89Å; R100-E241 PolarHBondContact NH1-OE2 3.28Å; R100-E241 IonicContact NH2-OE2 2.8Å; R100-E241 PolarHBondContact NH2-OE2 3.14Å; Q239-E241 VanDerWaalsContact C-N 3.34Å; Q239-E241 PolarHBondContact O-N 3.16Å
242	S	81.8	Confident	85.6	Confident	49 Å²	49	45.2 Å²	45.2	34%	0.343	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-93.8	-1.8	-173.6	69.7	0	0	0	0	113.9	Q239 K240	Q239-S242 PolarHBondContact O-N 3.02Å; Q239-S242 PolarHBondContact O-OG 3.15Å; K240-S242 VanDerWaalsContact C-N 3.32Å; K240-S242 PolarHBondContact O-N 3.04Å
243	R	85	Confident	85.4	Confident	8 Å²	8	47.8 Å²	47.8	3%	0.03	24%	0.241	C	C	.	.			trans	-63	134.1	-176.4	-76.2	164.4	76.3	-121.3	0	111.4	E195 Y230 Q239 D253 V254	E195-R243 IonicContact OE1-CZ 2.81Å; E195-R243 IonicContact OE1-NH1 3.81Å; E195-R243 PolarHBondContact OE1-NH1 3.3Å; E195-R243 IonicContact OE1-NH2 3.71Å; E195-R243 IonicContact OE2-NH1 2.72Å; E195-R243 IonicContact OE2-NH2 3.77Å; Y230-R243 PolarHBondContact O-NH2 3.5Å; Q239-R243 PolarHBondContact O-N 3Å; R243-D253 WeakPolarHBondContact CA-O 3.48Å; R243-V254 HydrophobicContact CG-CG1 4.11Å
244	T	81.1	Confident	85.2	Confident	77 Å²	77	47.9 Å²	47.9	47%	0.472	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	163.7	175.5	58.2	0	0	0	0	111	D253	T244-D253 PolarHBondContact N-O 3.33Å; T244-D253 PolarHBondContact O-N 2.83Å; T244-D253 WeakPolarHBondContact OG1-CB 3.42Å
245	D	82.7	Confident	84.9	Confident	32 Å²	32	51.8 Å²	51.8	17%	0.171	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.2	-179.7	-76.8	-107.4	0	0	0	110.1	I84 R87 N88 R91	I84-D245 HydrophobicContact CG2-CB 3.79Å; I84-D245 WeakPolarHBondContact CG2-OD1 3.48Å; R87-D245 IonicContact CZ-OD1 2.77Å; R87-D245 IonicContact NE-OD1 3.11Å; R87-D245 PolarHBondContact NE-OD1 3.42Å; R87-D245 IonicContact NE-OD2 3.54Å; R87-D245 IonicContact NH2-OD1 3.34Å; R87-D245 PolarHBondContact NH2-OD1 3.01Å; N88-D245 PolarHBondContact OD1-OD2 3.2Å; N88-D245 VanDerWaalsContact OD1-OD2 3.08Å; R91-D245 IonicContact CZ-OD2 2.73Å; R91-D245 VanDerWaalsContact CZ-OD2 3.22Å; R91-D245 IonicContact NH1-OD2 2.67Å; R91-D245 PolarHBondContact NH1-OD2 3.25Å; R91-D245 IonicContact NH2-OD2 3.39Å; R91-D245 PolarHBondContact NH2-OD2 3.38Å
246	S	73.9	Confident	84.7	Confident	19 Å²	19	57.8 Å²	57.8	13%	0.133	29%	0.292	C	S	.	.			trans	-98.8	154.8	171.5	-177.7	0	0	0	0	111	I84 E248 H249 D253	I84-S246 WeakPolarHBondContact CD1-O 3.3Å; S246-E248 VanDerWaalsContact C-N 3.34Å; S246-E248 PolarHBondContact OG-N 3.39Å; S246-E248 VanDerWaalsContact OG-N 3.11Å; S246-H249 WeakPolarHBondContact CB-CE1 3.05Å; S246-H249 WeakPolarHBondContact CB-NE2 3.36Å; S246-D253 WeakPolarHBondContact CB-OD2 3.45Å
247	M	69.5	Low	84.4	Confident	74 Å²	74	66.1 Å²	66.1	37%	0.365	33%	0.328	S	S	.	.	S	Bend	trans	-84.3	-13.2	170.2	-69.6	-55.7	-46.5	0	0	112.8	K106	K106-M247 HydrophobicContact CB-CG 3.82Å; K106-M247 HydrophobicContact CB-SD 3.71Å
248	E	68.7	Low	84.5	Confident	163 Å²	163	62.3 Å²	62.3	76%	0.762	31%	0.308	S	S	*	.	S	Bend	trans	-90.9	-20.5	-171.3	-59	-176.4	169.2	0	0	112.4	T141 S246	T141-E248 PolarHBondContact OG1-O 3.27Å; S246-E248 VanDerWaalsContact C-N 3.34Å; S246-E248 PolarHBondContact OG-N 3.39Å; S246-E248 VanDerWaalsContact OG-N 3.11Å
249	H	82.3	Confident	84.5	Confident	24 Å²	24	63.5 Å²	63.5	11%	0.111	31%	0.314	C	S	.	.			trans	-153.4	165.3	-176.6	57.6	69.7	0	0	0	112.7	I84 S246 W251 D253	I84-H249 WeakPolarHBondContact CD1-O 3.46Å; S246-H249 WeakPolarHBondContact CB-CE1 3.05Å; S246-H249 WeakPolarHBondContact CB-NE2 3.36Å; H249-W251 HydrophobicContact CB-CD2 3.77Å; H249-W251 HydrophobicContact CB-CE3 3.73Å; H249-W251 HydrophobicContact CB-CH2 3.44Å; H249-W251 VanDerWaalsContact CB-CH2 3.44Å; H249-W251 HydrophobicContact CB-CZ2 3.45Å; H249-W251 VanDerWaalsContact CB-CZ2 3.45Å; H249-W251 HydrophobicContact CB-CZ3 3.59Å; H249-W251 AromaticContact CD2-CE2 3.52Å; H249-W251 AromaticContact CD2-CZ2 3.46Å; H249-W251 VanDerWaalsContact CD2-CZ2 3.46Å; H249-W251 WeakPolarHBondContact CD2-CZ2 3.49Å; H249-W251 AromaticContact CD2-NE1 3.58Å; H249-W251 AromaticContact CE1-CD1 3.33Å; H249-W251 AromaticContact CE1-CE2 3.69Å; H249-W251 AromaticContact CE1-NE1 3.08Å; H249-W251 PolarHBondContact CE1-NE1 3.22Å; H249-W251 PolarHBondContact CE1-O 3.46Å; H249-W251 VanDerWaalsContact CE1-O 3.24Å; H249-W251 AromaticContact CG-CD2 3.65Å; H249-W251 AromaticContact CG-CE2 3.21Å; H249-W251 AromaticContact CG-CH2 3.94Å; H249-W251 AromaticContact CG-CZ2 3.37Å; H249-W251 AromaticContact CG-NE1 3.49Å; H249-W251 AromaticContact ND1-CD1 3.35Å; H249-W251 AromaticContact ND1-CD2 3.54Å; H249-W251 AromaticContact ND1-CE2 3.35Å; H249-W251 AromaticContact ND1-CG 3.55Å; H249-W251 AromaticContact ND1-NE1 3.2Å; H249-W251 PolarHBondContact ND1-NE1 3.03Å; H249-W251 VanDerWaalsContact ND1-NE1 3.2Å; H249-W251 PolarHBondContact ND1-O 3.43Å; H249-W251 AromaticContact NE2-CE2 3.81Å; H249-W251 AromaticContact NE2-NE1 3.33Å; H249-W251 PolarHBondContact NE2-NE1 3.46Å; H249-D253 IonicContact CE1-OD1 2.87Å; H249-D253 PolarHBondContact CE1-OD1 2.71Å; H249-D253 IonicContact NE2-OD1 3.68Å; H249-D253 PolarHBondContact NE2-OD1 2.94Å
250	E	87.5	Confident	84.7	Confident	15 Å²	15	63.7 Å²	63.7	7%	0.07	32%	0.315	C	S	.	.	S	Bend	trans	-85.8	-29.4	-175.4	-158	-177.8	155.3	0	0	114.8	I80 R87 R145 Y198 Y230	I80-E250 HydrophobicContact CB-CG 4.5Å; I80-E250 HydrophobicContact CD1-CB 4.15Å; I80-E250 HydrophobicContact CD1-CG 4.3Å; I80-E250 WeakPolarHBondContact CD1-OE2 3.33Å; I80-E250 HydrophobicContact CG1-CG 4.2Å; I80-E250 HydrophobicContact CG2-CB 3.77Å; I80-E250 HydrophobicContact CG2-CG 3.63Å; R87-E250 PolarHBondContact NH2-O 2.71Å; R145-E250 IonicContact CZ-OE1 3.65Å; R145-E250 IonicContact CZ-OE2 2.76Å; R145-E250 IonicContact NE-OE1 2.63Å; R145-E250 IonicContact NE-OE2 2.64Å; R145-E250 PolarHBondContact NE-OE2 3.33Å; R145-E250 IonicContact NH1-OE1 2.97Å; R145-E250 PolarHBondContact NH1-OE1 3.36Å; R145-E250 IonicContact NH1-OE2 3.29Å; R145-E250 IonicContact NH2-OE1 3.84Å; R145-E250 PolarHBondContact NH2-OE1 3.22Å; R145-E250 IonicContact NH2-OE2 2.92Å; R145-E250 PolarHBondContact NH2-OE2 3.43Å; Y198-E250 HydrophobicContact CE1-CG 4.21Å; Y198-E250 WeakPolarHBondContact CE1-OE1 3.37Å; Y198-E250 PolarHBondContact OH-OE1 3.31Å; Y230-E250 WeakPolarHBondContact CE2-O 3.35Å; Y230-E250 WeakPolarHBondContact OH-CB 3.38Å; Y230-E250 WeakPolarHBondContact OH-CG 3.34Å; Y230-E250 PolarHBondContact OH-O 2.95Å; Y230-E250 PolarHBondContact OH-OE1 3.29Å
251	W	87.3	Confident	84.9	Confident	77 Å²	77	62.8 Å²	62.8	29%	0.292	32%	0.319	S	S	.	.	S	Bend	trans	-67.8	160.3	177.6	60.9	85.4	0	0	0	110.6	T141 Y230 H249	T141-W251 HydrophobicContact CG2-CH2 3.71Å; T141-W251 HydrophobicContact CG2-CZ3 3.57Å; Y230-W251 HydrophobicContact CD1-CB 4.16Å; Y230-W251 HydrophobicContact CE1-CB 4.13Å; Y230-W251 HydrophobicContact CG-CB 4.43Å; H249-W251 HydrophobicContact CB-CD2 3.77Å; H249-W251 HydrophobicContact CB-CE3 3.73Å; H249-W251 HydrophobicContact CB-CH2 3.44Å; H249-W251 VanDerWaalsContact CB-CH2 3.44Å; H249-W251 HydrophobicContact CB-CZ2 3.45Å; H249-W251 VanDerWaalsContact CB-CZ2 3.45Å; H249-W251 HydrophobicContact CB-CZ3 3.59Å; H249-W251 AromaticContact CD2-CE2 3.52Å; H249-W251 AromaticContact CD2-CZ2 3.46Å; H249-W251 VanDerWaalsContact CD2-CZ2 3.46Å; H249-W251 WeakPolarHBondContact CD2-CZ2 3.49Å; H249-W251 AromaticContact CD2-NE1 3.58Å; H249-W251 AromaticContact CE1-CD1 3.33Å; H249-W251 AromaticContact CE1-CE2 3.69Å; H249-W251 AromaticContact CE1-NE1 3.08Å; H249-W251 PolarHBondContact CE1-NE1 3.22Å; H249-W251 PolarHBondContact CE1-O 3.46Å; H249-W251 VanDerWaalsContact CE1-O 3.24Å; H249-W251 AromaticContact CG-CD2 3.65Å; H249-W251 AromaticContact CG-CE2 3.21Å; H249-W251 AromaticContact CG-CH2 3.94Å; H249-W251 AromaticContact CG-CZ2 3.37Å; H249-W251 AromaticContact CG-NE1 3.49Å; H249-W251 AromaticContact ND1-CD1 3.35Å; H249-W251 AromaticContact ND1-CD2 3.54Å; H249-W251 AromaticContact ND1-CE2 3.35Å; H249-W251 AromaticContact ND1-CG 3.55Å; H249-W251 AromaticContact ND1-NE1 3.2Å; H249-W251 PolarHBondContact ND1-NE1 3.03Å; H249-W251 VanDerWaalsContact ND1-NE1 3.2Å; H249-W251 PolarHBondContact ND1-O 3.43Å; H249-W251 AromaticContact NE2-CE2 3.81Å; H249-W251 AromaticContact NE2-NE1 3.33Å; H249-W251 PolarHBondContact NE2-NE1 3.46Å
252	V	86	Confident	85.1	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	145.8	178.3	-70.6	0	0	0	0	110.7	V254 T298	V252-V254 HydrophobicContact CG2-CG1 4.16Å; V252-T298 WeakPolarHBondContact O-CG2 3.44Å
253	D	86	Confident	85.2	Confident	59 Å²	59	62.8 Å²	62.8	32%	0.316	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132	167.6	-68.7	-32.1	0	0	0	109.2	R243 T244 S246 H249	R243-D253 WeakPolarHBondContact CA-O 3.48Å; T244-D253 PolarHBondContact N-O 3.33Å; T244-D253 PolarHBondContact O-N 2.83Å; T244-D253 WeakPolarHBondContact OG1-CB 3.42Å; S246-D253 WeakPolarHBondContact CB-OD2 3.45Å; H249-D253 IonicContact CE1-OD1 2.87Å; H249-D253 PolarHBondContact CE1-OD1 2.71Å; H249-D253 IonicContact NE2-OD1 3.68Å; H249-D253 PolarHBondContact NE2-OD1 2.94Å
254	V	89.5	Confident	85.5	Confident	30 Å²	30	63.6 Å²	63.6	18%	0.182	32%	0.317	C	S	.	.			trans	-123.5	154.6	-178.6	-60.7	0	0	0	0	110.4	R243 V252 E256 T298	R243-V254 HydrophobicContact CG-CG1 4.11Å; V252-V254 HydrophobicContact CG2-CG1 4.16Å; V254-E256 PolarHBondContact O-N 3.05Å; V254-T298 HydrophobicContact CG1-CG2 4.06Å; V254-T298 HydrophobicContact CG2-CG2 3.81Å
255	N	88.4	Confident	86.2	Confident	89 Å²	89	60.2 Å²	60.2	48%	0.476	30%	0.296	S	S	.	.			trans	-64.6	127.6	172.3	-172.5	-17.2	0	0	0	110.2	Q239 K257	Q239-N255 PolarHBondContact NE2-O 2.88Å; N255-K257 PolarHBondContact O-N 2.92Å; N255-K257 PolarHBondContact OD1-N 3.12Å
256	E	88.2	Confident	86.9	Confident	139 Å²	139	60.9 Å²	60.9	65%	0.65	30%	0.296	S	S	*	.	S	Bend	trans	-57.8	-35.5	177.1	-67.4	-177.3	175	0	0	112.4	V254 T258 Q332	V254-E256 PolarHBondContact O-N 3.05Å; E256-T258 PolarHBondContact O-N 2.96Å; E256-Q332 VanDerWaalsContact O-CG 3.31Å; E256-Q332 WeakPolarHBondContact O-CG 3.41Å; E256-Q332 PolarHBondContact O-NE2 3.28Å
257	K	89.6	Confident	87.9	Confident	174 Å²	174	60 Å²	60	76%	0.757	29%	0.29	S	S	*	.			trans	-80.1	111	177	-172.3	177.3	-179.8	178.7	0	109.4	N255	N255-K257 PolarHBondContact O-N 2.92Å; N255-K257 PolarHBondContact OD1-N 3.12Å
258	T	94.1	Very high	89.2	Confident	4 Å²	4	57 Å²	57	3%	0.025	28%	0.275	C	S	.	.			trans	-141.4	149.6	173.9	175.6	0	0	0	0	111.6	D238 E256 Y260 Q332 K342	D238-T258 PolarHBondContact OD1-OG1 2.91Å; D238-T258 WeakPolarHBondContact OD2-CA 3.31Å; D238-T258 WeakPolarHBondContact OD2-CB 3.35Å; D238-T258 PolarHBondContact OD2-OG1 3.32Å; D238-T258 VanDerWaalsContact OD2-OG1 3.1Å; E256-T258 PolarHBondContact O-N 2.96Å; T258-Y260 HydrophobicContact CG2-CD1 3.57Å; T258-Y260 HydrophobicContact CG2-CD2 4.36Å; T258-Y260 HydrophobicContact CG2-CE1 3.23Å; T258-Y260 HydrophobicContact CG2-CE2 4.08Å; T258-Y260 HydrophobicContact CG2-CG 4.14Å; T258-Y260 PolarHBondContact OG1-N 3.06Å; T258-Q332 PolarHBondContact O-NE2 2.9Å; T258-K342 PolarHBondContact O-NZ 2.85Å
259	N	93.2	Very high	90.7	Very high	89 Å²	89	50.6 Å²	50.6	48%	0.476	24%	0.244	S	C	.	.			trans	-91.6	-0.4	169.6	66.7	10.5	0	0	0	113	D238 A261	D238-N259 PolarHBondContact OD1-OD1 3.16Å; D238-N259 PolarHBondContact OD2-N 2.87Å; D238-N259 PolarHBondContact OD2-OD1 3.47Å; N259-A261 PolarHBondContact O-N 3.07Å; N259-A261 VanDerWaalsContact O-N 3.12Å; N259-A261 WeakPolarHBondContact OD1-CB 3.13Å; N259-A261 PolarHBondContact OD1-N 2.89Å
260	Y	95.2	Very high	91.4	Very high	5 Å²	5	49.4 Å²	49.4	2%	0.02	24%	0.239	C	C	.	.			trans	55.6	21.1	-176.7	-54.1	-69.9	0	0	0	114.3	P236 T258 Y265 N299 N301 I309 N330 Q332 L339 L343	P236-Y260 HydrophobicContact CG-CD1 4.34Å; T258-Y260 HydrophobicContact CG2-CD1 3.57Å; T258-Y260 HydrophobicContact CG2-CD2 4.36Å; T258-Y260 HydrophobicContact CG2-CE1 3.23Å; T258-Y260 HydrophobicContact CG2-CE2 4.08Å; T258-Y260 HydrophobicContact CG2-CG 4.14Å; T258-Y260 PolarHBondContact OG1-N 3.06Å; Y260-Y265 HydrophobicContact CD1-CD1 4.44Å; Y260-Y265 AromaticContact CD1-CE1 3.64Å; Y260-Y265 HydrophobicContact CD1-CE1 3.64Å; Y260-Y265 HydrophobicContact CE1-CE1 4.45Å; Y260-Y265 HydrophobicContact CG-CE1 4.34Å; Y260-N299 HydrophobicContact CE1-CB 4.02Å; Y260-N301 WeakPolarHBondContact CE1-ND2 3.48Å; Y260-I309 HydrophobicContact CD1-CD1 4.02Å; Y260-I309 HydrophobicContact CD2-CD1 4.17Å; Y260-I309 HydrophobicContact CG-CD1 3.75Å; Y260-I309 HydrophobicContact CG-CG1 4.36Å; Y260-N330 PolarHBondContact OH-ND2 2.78Å; Y260-Q332 VanDerWaalsContact OH-CD 3.3Å; Y260-Q332 PolarHBondContact OH-OE1 2.81Å; Y260-Q332 VanDerWaalsContact OH-OE1 3.08Å; Y260-L339 HydrophobicContact CD2-CD1 3.92Å; Y260-L339 HydrophobicContact CE2-CD1 3.53Å; Y260-L343 HydrophobicContact CD2-CD1 4.43Å; Y260-L343 HydrophobicContact CD2-CD2 4.33Å
261	A	90.9	Very high	92	Very high	43 Å²	43	48.9 Å²	48.9	36%	0.355	24%	0.236	S	C	.	.			trans	-67.2	139.3	176.8	0	0	0	0	0	110	P236 D237 N259	P236-A261 CarbonylContact C-O 3.54Å; P236-A261 VanDerWaalsContact CA-O 3.24Å; P236-A261 WeakPolarHBondContact CA-O 3.44Å; D237-A261 PolarHBondContact N-O 3.4Å; N259-A261 PolarHBondContact O-N 3.07Å; N259-A261 VanDerWaalsContact O-N 3.12Å; N259-A261 WeakPolarHBondContact OD1-CB 3.13Å; N259-A261 PolarHBondContact OD1-N 2.89Å
262	G	87.3	Confident	92.5	Very high	19 Å²	19	45.3 Å²	45.3	20%	0.196	22%	0.223	C	C	.	.			trans	146.4	130.1	177.3	0	0	0	0	0	111.2	D237 T264	D237-G262 WeakPolarHBondContact OD2-CA 3.48Å; G262-T264 VanDerWaalsContact C-N 3.26Å; G262-T264 PolarHBondContact O-N 2.53Å
263	R	82.7	Confident	93.1	Very high	175 Å²	175	45.1 Å²	45.1	66%	0.66	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-22.7	-176	-62.3	-176.1	-166.6	165.9	1.3	113.3	W266	R263-W266 PolarHBondContact O-NE1 3.11Å
264	T	91.6	Very high	93.7	Very high	25 Å²	25	42.3 Å²	42.3	15%	0.153	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	11.7	-172.9	48.3	0	0	0	0	113.1	F233 F234 G262 W266	F233-T264 HydrophobicContact CE1-CG2 3.74Å; F233-T264 HydrophobicContact CZ-CG2 3.77Å; F233-T264 PolarHBondContact O-OG1 3.08Å; F234-T264 WeakPolarHBondContact CA-O 3.38Å; G262-T264 VanDerWaalsContact C-N 3.26Å; G262-T264 PolarHBondContact O-N 2.53Å; T264-W266 HydrophobicContact CG2-CH2 4.45Å; T264-W266 HydrophobicContact CG2-CZ2 4.12Å; T264-W266 PolarHBondContact O-N 3.12Å
265	Y	96.2	Very high	94.1	Very high	6 Å²	6	40.9 Å²	40.9	2%	0.024	20%	0.198	C	C	.	.			trans	-76.3	86.9	173.7	173.4	-135.1	0	0	0	110.6	F234 P236 Y260 D297 N299 N301 L306 I309 H310	F234-Y265 WeakPolarHBondContact O-CA 3.39Å; F234-Y265 WeakPolarHBondContact O-CD2 3.5Å; P236-Y265 HydrophobicContact CG-CD1 3.7Å; P236-Y265 HydrophobicContact CG-CD2 3.99Å; P236-Y265 HydrophobicContact CG-CE1 3.9Å; P236-Y265 HydrophobicContact CG-CE2 4.22Å; P236-Y265 HydrophobicContact CG-CG 3.72Å; Y260-Y265 HydrophobicContact CD1-CD1 4.44Å; Y260-Y265 AromaticContact CD1-CE1 3.64Å; Y260-Y265 HydrophobicContact CD1-CE1 3.64Å; Y260-Y265 HydrophobicContact CE1-CE1 4.45Å; Y260-Y265 HydrophobicContact CG-CE1 4.34Å; Y265-D297 WeakPolarHBondContact CE2-OD2 3.19Å; Y265-D297 PolarHBondContact OH-OD2 2.96Å; Y265-N299 PolarHBondContact OH-ND2 3.19Å; Y265-N301 PolarHBondContact OH-ND2 2.81Å; Y265-L306 HydrophobicContact CD1-CD2 4.29Å; Y265-L306 HydrophobicContact CE1-CD2 3.75Å; Y265-L306 HydrophobicContact CE2-CD2 4.17Å; Y265-I309 HydrophobicContact CD1-CD1 4.4Å; Y265-I309 HydrophobicContact CD1-CG2 4.42Å; Y265-I309 HydrophobicContact CE1-CD1 3.76Å; Y265-H310 PolarHBondContact O-CE1 3.5Å; Y265-H310 PolarHBondContact O-NE2 2.97Å
266	W	97	Very high	94.6	Very high	47 Å²	47	37.4 Å²	37.4	18%	0.178	18%	0.181	C	C	.	.			trans	-104	19.4	-175.2	-56.8	-30.2	0	0	0	113.6	V208 F234 R263 T264 S272 F273 C276 H310	V208-W266 HydrophobicContact CG2-CZ3 3.97Å; F234-W266 HydrophobicContact CD1-CE3 4.13Å; F234-W266 HydrophobicContact CD1-CZ3 4.5Å; F234-W266 HydrophobicContact CE1-CE3 4.01Å; F234-W266 AromaticContact CE1-CZ3 3.99Å; F234-W266 HydrophobicContact CE1-CZ3 3.99Å; R263-W266 PolarHBondContact O-NE1 3.11Å; T264-W266 HydrophobicContact CG2-CH2 4.45Å; T264-W266 HydrophobicContact CG2-CZ2 4.12Å; T264-W266 PolarHBondContact O-N 3.12Å; W266-S272 CarbonylContact O-C 3.44Å; W266-S272 WeakPolarHBondContact O-CB 3.33Å; W266-S272 PolarHBondContact O-OG 3.49Å; W266-F273 HydrophobicContact CB-CD2 4.11Å; W266-F273 HydrophobicContact CB-CE2 4.26Å; W266-F273 HydrophobicContact CB-CG 4.43Å; W266-F273 AromaticContact CE3-CD1 3.84Å; W266-F273 HydrophobicContact CE3-CD1 3.84Å; W266-F273 AromaticContact CE3-CE1 3.81Å; W266-F273 HydrophobicContact CE3-CE1 3.81Å; W266-F273 HydrophobicContact CE3-CG 4.41Å; W266-F273 HydrophobicContact CE3-CZ 4.35Å; W266-F273 HydrophobicContact CZ3-CD1 4.4Å; W266-F273 HydrophobicContact CZ3-CE1 4.32Å; W266-C276 HydrophobicContact CB-CB 3.8Å; W266-C276 HydrophobicContact CG-CB 3.7Å; W266-H310 AromaticContact CD1-NE2 3.96Å
267	G	95.6	Very high	95	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	16%	0.158	C	C	.	.			trans	70.5	-151.9	-165.6	0	0	0	0	0	110.8
268	E	97.2	Very high	95.4	Very high	11 Å²	11	29.7 Å²	29.7	5%	0.051	14%	0.144	C	C	.	.	S	Bend	trans	-128.8	-12.7	-169.3	-64.5	173.9	178.1	0	0	114.3	H204 R228 C229 S272 D297 T298	H204-E268 PolarHBondContact NE2-O 3Å; H204-E268 VanDerWaalsContact NE2-O 3.1Å; R228-E268 CarbonylContact C-O 3.47Å; R228-E268 WeakPolarHBondContact CA-O 3.43Å; R228-E268 HydrophobicContact CB-CB 4.41Å; R228-E268 IonicContact CZ-OE2 3.05Å; R228-E268 IonicContact NE-OE2 3.29Å; R228-E268 PolarHBondContact NE-OE2 3.17Å; R228-E268 IonicContact NH2-OE1 2.6Å; R228-E268 PolarHBondContact NH2-OE1 3.12Å; R228-E268 IonicContact NH2-OE2 2.98Å; R228-E268 PolarHBondContact NH2-OE2 2.7Å; C229-E268 PolarHBondContact N-O 3.27Å; C229-E268 WeakPolarHBondContact O-CA 3.3Å; C229-E268 WeakPolarHBondContact O-CG 3.38Å; E268-S272 PolarHBondContact N-OG 3.38Å; E268-D297 HydrophobicContact CB-CB 4.27Å; E268-D297 HydrophobicContact CG-CB 3.76Å; E268-D297 WeakPolarHBondContact OE2-CA 3.29Å; E268-T298 WeakPolarHBondContact OE1-CB 3.4Å; E268-T298 PolarHBondContact OE1-N 3.17Å; E268-T298 PolarHBondContact OE1-OG1 3.35Å; E268-T298 PolarHBondContact OE2-N 3.3Å
269	Y	98.3	Very high	95.6	Very high	27 Å²	27	30.6 Å²	30.6	11%	0.106	15%	0.148	C	C	.	.	S	Bend	trans	-107.7	154	-170.6	-60.2	-75.5	0	0	0	110.8	H226 R228 L271 S272 F273 M295 R296	H226-Y269 WeakPolarHBondContact O-CD1 3.45Å; H226-Y269 WeakPolarHBondContact O-CE1 3.06Å; R228-Y269 HydrophobicContact CG-CD1 3.94Å; R228-Y269 HydrophobicContact CG-CE1 3.27Å; Y269-L271 VanDerWaalsContact C-N 3.25Å; Y269-L271 PolarHBondContact O-N 2.95Å; Y269-L271 VanDerWaalsContact O-N 3.15Å; Y269-S272 PolarHBondContact N-OG 2.97Å; Y269-S272 VanDerWaalsContact N-OG 3.12Å; Y269-S272 PolarHBondContact O-N 3.47Å; Y269-S272 PolarHBondContact O-OG 2.83Å; Y269-F273 WeakPolarHBondContact O-CD2 3.25Å; Y269-F273 PolarHBondContact O-N 3.42Å; Y269-M295 HydrophobicContact CD1-CE 3.08Å; Y269-M295 HydrophobicContact CD1-SD 4.46Å; Y269-M295 HydrophobicContact CD2-CB 4.13Å; Y269-M295 HydrophobicContact CD2-CE 4Å; Y269-M295 HydrophobicContact CE1-CB 4.44Å; Y269-M295 HydrophobicContact CE1-CE 3.09Å; Y269-M295 HydrophobicContact CE1-SD 3.93Å; Y269-M295 HydrophobicContact CE2-CB 3.71Å; Y269-M295 HydrophobicContact CE2-CE 4.05Å; Y269-M295 HydrophobicContact CG-CE 3.54Å; Y269-R296 WeakPolarHBondContact CE2-O 3.48Å; Y269-R296 PolarHBondContact OH-O 3.22Å
270	P	98.7	Very high	95.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-49.8	-43.7	176.2	-32	36.7	0	0	0	113.7	L203 H204 I207 V225 Q227 S272 F273 A274 L286	L203-P270 HydrophobicContact CD2-CB 3.83Å; L203-P270 HydrophobicContact CD2-CG 3.63Å; L203-P270 HydrophobicContact CG-CB 4.07Å; L203-P270 HydrophobicContact CG-CG 4.09Å; H204-P270 WeakPolarHBondContact NE2-CD 3.44Å; I207-P270 HydrophobicContact CD1-CB 3.69Å; I207-P270 WeakPolarHBondContact CD1-O 3.34Å; V225-P270 WeakPolarHBondContact O-CD 3.36Å; V225-P270 WeakPolarHBondContact O-CG 3.17Å; Q227-P270 WeakPolarHBondContact O-CD 3.39Å; P270-S272 VanDerWaalsContact C-N 3.34Å; P270-S272 PolarHBondContact O-N 2.69Å; P270-F273 WeakPolarHBondContact O-CB 3.38Å; P270-F273 PolarHBondContact O-N 3.32Å; P270-A274 PolarHBondContact O-N 2.71Å; P270-L286 HydrophobicContact CB-CD1 4.33Å; P270-L286 HydrophobicContact CB-CD2 4.01Å
271	L	98.8	Very high	96	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-35.7	178.7	-178.6	60.8	0	0	0	112.8	Y269 A275 C283 L286 A291 P293 V303 I319	Y269-L271 VanDerWaalsContact C-N 3.25Å; Y269-L271 PolarHBondContact O-N 2.95Å; Y269-L271 VanDerWaalsContact O-N 3.15Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.26Å; L271-C283 HydrophobicContact CD1-CB 3.96Å; L271-L286 HydrophobicContact CB-CD1 4.46Å; L271-L286 HydrophobicContact CD1-CB 4.26Å; L271-L286 HydrophobicContact CD1-CD1 4.44Å; L271-A291 HydrophobicContact CB-CB 4.06Å; L271-A291 HydrophobicContact CD2-CB 3.96Å; L271-A291 HydrophobicContact CG-CB 4.5Å; L271-P293 HydrophobicContact CD2-CB 3.9Å; L271-V303 HydrophobicContact CD2-CG2 4.37Å; L271-V303 HydrophobicContact CG-CG2 4.25Å; L271-I319 HydrophobicContact CD1-CD1 4.07Å; L271-I319 HydrophobicContact CG-CD1 4.36Å
272	S	98.4	Very high	96.4	Very high	2 Å²	2	31 Å²	31	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-71.4	-36.4	177.5	69.4	0	0	0	0	111.7	W266 E268 Y269 P270 A275 C276	W266-S272 CarbonylContact O-C 3.44Å; W266-S272 WeakPolarHBondContact O-CB 3.33Å; W266-S272 PolarHBondContact O-OG 3.49Å; E268-S272 PolarHBondContact N-OG 3.38Å; Y269-S272 PolarHBondContact N-OG 2.97Å; Y269-S272 VanDerWaalsContact N-OG 3.12Å; Y269-S272 PolarHBondContact O-N 3.47Å; Y269-S272 PolarHBondContact O-OG 2.83Å; P270-S272 VanDerWaalsContact C-N 3.34Å; P270-S272 PolarHBondContact O-N 2.69Å; S272-A275 PolarHBondContact O-N 2.87Å; S272-C276 WeakPolarHBondContact O-CB 3.4Å; S272-C276 PolarHBondContact O-N 2.96Å; S272-C276 PolarHBondContact O-SG 2.84Å
273	F	98.3	Very high	96.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-53.8	171.6	-86.2	-125.3	0	0	0	110.8	H204 I207 V208 C229 F234 W266 Y269 P270 A275 C276 T277	H204-F273 HydrophobicContact CB-CD1 4.31Å; H204-F273 HydrophobicContact CB-CE1 4.24Å; H204-F273 AromaticContact CD2-CD1 3.92Å; H204-F273 AromaticContact CD2-CD2 3.74Å; H204-F273 AromaticContact CD2-CE1 3.92Å; H204-F273 AromaticContact CD2-CE2 3.75Å; H204-F273 AromaticContact CD2-CG 3.83Å; H204-F273 AromaticContact CD2-CZ 3.84Å; I207-F273 HydrophobicContact CG2-CB 4.05Å; V208-F273 HydrophobicContact CG2-CD1 3.93Å; V208-F273 HydrophobicContact CG2-CE1 4.25Å; C229-F273 HydrophobicContact CB-CE2 4.39Å; C229-F273 HydrophobicContact CB-CZ 4.22Å; F234-F273 HydrophobicContact CD1-CE1 4.01Å; F234-F273 AromaticContact CD1-CZ 3.63Å; F234-F273 HydrophobicContact CD1-CZ 3.63Å; F234-F273 HydrophobicContact CD2-CZ 4.36Å; F234-F273 AromaticContact CE1-CE1 3.63Å; F234-F273 HydrophobicContact CE1-CE1 3.63Å; F234-F273 AromaticContact CE1-CZ 3.71Å; F234-F273 HydrophobicContact CE1-CZ 3.71Å; F234-F273 HydrophobicContact CE2-CZ 4.41Å; F234-F273 AromaticContact CG-CZ 3.97Å; F234-F273 HydrophobicContact CG-CZ 3.97Å; F234-F273 HydrophobicContact CZ-CE1 4.01Å; F234-F273 HydrophobicContact CZ-CZ 4.11Å; W266-F273 HydrophobicContact CB-CD2 4.11Å; W266-F273 HydrophobicContact CB-CE2 4.26Å; W266-F273 HydrophobicContact CB-CG 4.43Å; W266-F273 AromaticContact CE3-CD1 3.84Å; W266-F273 HydrophobicContact CE3-CD1 3.84Å; W266-F273 AromaticContact CE3-CE1 3.81Å; W266-F273 HydrophobicContact CE3-CE1 3.81Å; W266-F273 HydrophobicContact CE3-CG 4.41Å; W266-F273 HydrophobicContact CE3-CZ 4.35Å; W266-F273 HydrophobicContact CZ3-CD1 4.4Å; W266-F273 HydrophobicContact CZ3-CE1 4.32Å; Y269-F273 WeakPolarHBondContact O-CD2 3.25Å; Y269-F273 PolarHBondContact O-N 3.42Å; P270-F273 WeakPolarHBondContact O-CB 3.38Å; P270-F273 PolarHBondContact O-N 3.32Å; F273-A275 PolarHBondContact O-N 2.74Å; F273-C276 PolarHBondContact O-N 3.27Å; F273-T277 WeakPolarHBondContact O-CG2 3.48Å; F273-T277 PolarHBondContact O-N 3.45Å; F273-T277 PolarHBondContact O-OG1 3.19Å
274	A	98.7	Very high	97.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-35.3	-179.3	0	0	0	0	0	112.9	I207 P270 T277 R278 Q279 C282 L286	I207-A274 HydrophobicContact CG2-CB 3.83Å; P270-A274 PolarHBondContact O-N 2.71Å; A274-T277 WeakPolarHBondContact CA-OG1 3.33Å; A274-T277 PolarHBondContact O-OG1 3.24Å; A274-R278 PolarHBondContact O-N 3.4Å; A274-Q279 PolarHBondContact O-N 2.8Å; A274-C282 HydrophobicContact CB-CB 4.06Å; A274-L286 HydrophobicContact CB-CD1 3.67Å
275	A	98.6	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.4	-48.2	176.1	0	0	0	0	0	111.6	L271 S272 F273 T277 R278 V303 M307 I315 I319	L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 3.26Å; S272-A275 PolarHBondContact O-N 2.87Å; F273-A275 PolarHBondContact O-N 2.74Å; A275-T277 VanDerWaalsContact C-N 3.3Å; A275-T277 PolarHBondContact O-N 2.94Å; A275-R278 PolarHBondContact O-N 2.73Å; A275-V303 HydrophobicContact CB-CG1 3.58Å; A275-M307 HydrophobicContact CB-CE 3.54Å; A275-M307 HydrophobicContact CB-SD 3.93Å; A275-I315 HydrophobicContact CB-CG2 3.8Å; A275-I319 HydrophobicContact CB-CD1 4.11Å; A275-I319 HydrophobicContact CB-CG1 4.27Å
276	C	97.9	Very high	98.1	Very high	15 Å²	15	28.3 Å²	28.3	10%	0.101	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-30.1	-179.7	-70.4	0	0	0	0	112.8	W266 S272 F273 R278 H310	W266-C276 HydrophobicContact CB-CB 3.8Å; W266-C276 HydrophobicContact CG-CB 3.7Å; S272-C276 WeakPolarHBondContact O-CB 3.4Å; S272-C276 PolarHBondContact O-N 2.96Å; S272-C276 PolarHBondContact O-SG 2.84Å; F273-C276 PolarHBondContact O-N 3.27Å; C276-R278 PolarHBondContact O-N 3.25Å; C276-H310 VanDerWaalsContact SG-CD2 3.59Å
277	T	96.9	Very high	98.2	Very high	29 Å²	29	29.5 Å²	29.5	18%	0.178	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	6.6	172	59.7	0	0	0	0	113.3	F273 A274 A275 Q279	F273-T277 WeakPolarHBondContact O-CG2 3.48Å; F273-T277 PolarHBondContact O-N 3.45Å; F273-T277 PolarHBondContact O-OG1 3.19Å; A274-T277 WeakPolarHBondContact CA-OG1 3.33Å; A274-T277 PolarHBondContact O-OG1 3.24Å; A275-T277 VanDerWaalsContact C-N 3.3Å; A275-T277 PolarHBondContact O-N 2.94Å; T277-Q279 PolarHBondContact OG1-NE2 2.79Å
278	R	97.8	Very high	98.3	Very high	123 Å²	123	33.4 Å²	33.4	46%	0.464	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	50.1	174.9	-53.3	179.2	66.3	104.4	9.6	114.1	A274 A275 C276 P280 L312 D314 I315	A274-R278 PolarHBondContact O-N 3.4Å; A275-R278 PolarHBondContact O-N 2.73Å; C276-R278 PolarHBondContact O-N 3.25Å; R278-P280 WeakPolarHBondContact O-CD 3.4Å; R278-L312 HydrophobicContact CG-CD1 4.29Å; R278-L312 HydrophobicContact CG-CD2 4.02Å; R278-D314 IonicContact CZ-OD1 3.04Å; R278-D314 IonicContact CZ-OD2 2.78Å; R278-D314 IonicContact NH1-OD1 2.64Å; R278-D314 IonicContact NH2-OD1 2.83Å; R278-D314 PolarHBondContact NH2-OD1 2.67Å; R278-D314 IonicContact NH2-OD2 2.74Å; R278-D314 PolarHBondContact NH2-OD2 3.44Å; R278-I315 HydrophobicContact CB-CD1 4.4Å; R278-I315 HydrophobicContact CB-CG1 4.35Å; R278-I315 HydrophobicContact CG-CG1 4.38Å
279	Q	98.2	Very high	98.3	Very high	22 Å²	22	34.6 Å²	34.6	10%	0.103	18%	0.182	C	C	.	.			trans	-112.9	86.5	179.8	-64.2	170.7	36.9	0	0	112.5	I207 A274 T277 D281 C282 C283	I207-Q279 PolarHBondContact O-NE2 3.4Å; A274-Q279 PolarHBondContact O-N 2.8Å; T277-Q279 PolarHBondContact OG1-NE2 2.79Å; Q279-D281 PolarHBondContact O-N 3.34Å; Q279-C282 HydrophobicContact CB-CB 3.6Å; Q279-C282 WeakPolarHBondContact O-CB 3.35Å; Q279-C282 PolarHBondContact O-N 2.92Å; Q279-C283 PolarHBondContact O-N 3.4Å; Q279-C283 PolarHBondContact O-SG 2.89Å; Q279-C283 VanDerWaalsContact O-SG 3.39Å
280	P	98.5	Very high	98.3	Very high	48 Å²	48	41.5 Å²	41.5	31%	0.312	21%	0.212	S	C	.	.	H	α-helix	trans	-55.9	-44.3	-177.6	-28.8	35.1	0	0	0	114.8	R278 C282 C283 R284 I315 L318	R278-P280 WeakPolarHBondContact O-CD 3.4Å; P280-C282 VanDerWaalsContact C-N 3.33Å; P280-C282 PolarHBondContact O-N 3.3Å; P280-C283 WeakPolarHBondContact O-CB 3.08Å; P280-C283 PolarHBondContact O-N 3.49Å; P280-R284 WeakPolarHBondContact O-CG 3.25Å; P280-R284 PolarHBondContact O-N 3.04Å; P280-I315 HydrophobicContact CG-CD1 3.94Å; P280-L318 HydrophobicContact CB-CD2 3.74Å; P280-L318 HydrophobicContact CG-CD2 4.49Å
281	D	98.5	Very high	98.3	Very high	97 Å²	97	41.7 Å²	41.7	52%	0.519	21%	0.214	S	C	.	.	H	α-helix	trans	-69.5	-34.5	-178.1	-64.9	-35.8	0	0	0	111.9	L212 Q279 R284 L285	L212-D281 HydrophobicContact CD2-CB 4.08Å; Q279-D281 PolarHBondContact O-N 3.34Å; D281-R284 PolarHBondContact O-N 3.4Å; D281-R284 IonicContact OD1-CZ 3.65Å; D281-R284 IonicContact OD1-NH1 2.68Å; D281-R284 PolarHBondContact OD1-NH1 2.9Å; D281-L285 WeakPolarHBondContact O-CB 3.19Å; D281-L285 PolarHBondContact O-N 3Å
282	C	98.6	Very high	98.3	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-43.3	173.4	-165.9	0	0	0	0	111	L212 A274 Q279 P280 R284 L285 L286	L212-C282 HydrophobicContact CD1-CB 4.16Å; A274-C282 HydrophobicContact CB-CB 4.06Å; Q279-C282 HydrophobicContact CB-CB 3.6Å; Q279-C282 WeakPolarHBondContact O-CB 3.35Å; Q279-C282 PolarHBondContact O-N 2.92Å; P280-C282 VanDerWaalsContact C-N 3.33Å; P280-C282 PolarHBondContact O-N 3.3Å; C282-R284 VanDerWaalsContact C-N 3.34Å; C282-R284 PolarHBondContact O-N 3.29Å; C282-L285 PolarHBondContact O-N 3.49Å; C282-L286 WeakPolarHBondContact O-CB 3.35Å; C282-L286 VanDerWaalsContact O-CG 3.3Å; C282-L286 WeakPolarHBondContact O-CG 3.34Å; C282-L286 PolarHBondContact O-N 3.33Å
283	C	98.7	Very high	98.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.6	-44.6	173.6	-68.4	0	0	0	0	112.3	L271 Q279 P280 L286 K287 L318 I319 L322	L271-C283 HydrophobicContact CD1-CB 3.96Å; Q279-C283 PolarHBondContact O-N 3.4Å; Q279-C283 PolarHBondContact O-SG 2.89Å; Q279-C283 VanDerWaalsContact O-SG 3.39Å; P280-C283 WeakPolarHBondContact O-CB 3.08Å; P280-C283 PolarHBondContact O-N 3.49Å; C283-L286 PolarHBondContact O-N 3.39Å; C283-K287 WeakPolarHBondContact O-CB 3.34Å; C283-K287 PolarHBondContact O-N 2.83Å; C283-L318 HydrophobicContact CB-CD2 3.94Å; C283-I319 HydrophobicContact CB-CD1 4.46Å; C283-L322 HydrophobicContact CB-CD1 3.99Å
284	R	98.7	Very high	98.3	Very high	123 Å²	123	45.8 Å²	45.8	46%	0.464	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-43.6	176.6	-68.5	173.5	-171.5	126.3	2	111.9	P280 D281 C282 K287 A288 L318 L322	P280-R284 WeakPolarHBondContact O-CG 3.25Å; P280-R284 PolarHBondContact O-N 3.04Å; D281-R284 PolarHBondContact O-N 3.4Å; D281-R284 IonicContact OD1-CZ 3.65Å; D281-R284 IonicContact OD1-NH1 2.68Å; D281-R284 PolarHBondContact OD1-NH1 2.9Å; C282-R284 VanDerWaalsContact C-N 3.34Å; C282-R284 PolarHBondContact O-N 3.29Å; R284-K287 PolarHBondContact O-N 3.31Å; R284-A288 PolarHBondContact O-N 2.93Å; R284-L318 HydrophobicContact CG-CD1 4.36Å; R284-L322 HydrophobicContact CG-CD2 4.49Å
285	L	98.6	Very high	98.3	Very high	44 Å²	44	47.9 Å²	47.9	23%	0.23	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-46.1	177.6	178.5	63.9	0	0	0	111.6	L212 V215 R216 L219 D281 C282 K287 A288 A289	L212-L285 HydrophobicContact CD1-CB 4.34Å; L212-L285 HydrophobicContact CD1-CD2 3.59Å; L212-L285 HydrophobicContact CG-CD2 4.4Å; V215-L285 HydrophobicContact CB-CD2 4.31Å; V215-L285 HydrophobicContact CG1-CD2 3.77Å; R216-L285 HydrophobicContact CB-CD2 3.88Å; L219-L285 HydrophobicContact CD1-CD2 4.25Å; L219-L285 HydrophobicContact CD1-CG 3.99Å; D281-L285 WeakPolarHBondContact O-CB 3.19Å; D281-L285 PolarHBondContact O-N 3Å; C282-L285 PolarHBondContact O-N 3.49Å; L285-K287 VanDerWaalsContact C-N 3.34Å; L285-K287 PolarHBondContact O-N 3.21Å; L285-A288 WeakPolarHBondContact O-CB 3.39Å; L285-A288 PolarHBondContact O-N 3.43Å; L285-A289 PolarHBondContact O-N 2.95Å
286	L	98.7	Very high	98.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-40.5	177.1	-70.1	166.9	0	0	0	111.2	L203 I207 V215 L219 V225 P270 L271 A274 C282 C283 A288 A289 K290 A291	L203-L286 HydrophobicContact CD1-CD2 4.47Å; L203-L286 HydrophobicContact CD2-CD2 4.35Å; I207-L286 HydrophobicContact CD1-CD1 3.89Å; I207-L286 HydrophobicContact CD1-CD2 4.44Å; V215-L286 HydrophobicContact CG1-CD2 4.4Å; L219-L286 HydrophobicContact CD1-CD2 4.08Å; L219-L286 HydrophobicContact CD2-CD2 4.29Å; V225-L286 HydrophobicContact CG2-CD2 3.91Å; P270-L286 HydrophobicContact CB-CD1 4.33Å; P270-L286 HydrophobicContact CB-CD2 4.01Å; L271-L286 HydrophobicContact CB-CD1 4.46Å; L271-L286 HydrophobicContact CD1-CB 4.26Å; L271-L286 HydrophobicContact CD1-CD1 4.44Å; A274-L286 HydrophobicContact CB-CD1 3.67Å; C282-L286 WeakPolarHBondContact O-CB 3.35Å; C282-L286 VanDerWaalsContact O-CG 3.3Å; C282-L286 WeakPolarHBondContact O-CG 3.34Å; C282-L286 PolarHBondContact O-N 3.33Å; C283-L286 PolarHBondContact O-N 3.39Å; L286-A288 PolarHBondContact O-N 3.26Å; L286-A289 CarbonylContact O-C 3.57Å; L286-A289 VanDerWaalsContact O-C 3.31Å; L286-A289 WeakPolarHBondContact O-CA 3.2Å; L286-A289 WeakPolarHBondContact O-CB 3.47Å; L286-A289 PolarHBondContact O-N 2.78Å; L286-A289 VanDerWaalsContact O-N 3.1Å; L286-K290 PolarHBondContact O-N 2.93Å; L286-A291 HydrophobicContact CB-CB 3.99Å; L286-A291 WeakPolarHBondContact O-CB 3.14Å; L286-A291 PolarHBondContact O-N 3.33Å
287	K	98.3	Very high	98.1	Very high	73 Å²	73	53 Å²	53	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-62.1	-42.4	173.7	-178.4	63.4	-179.5	-166.5	0	112.1	C283 R284 L285 A289 K290 A291 L322	C283-K287 WeakPolarHBondContact O-CB 3.34Å; C283-K287 PolarHBondContact O-N 2.83Å; R284-K287 PolarHBondContact O-N 3.31Å; L285-K287 VanDerWaalsContact C-N 3.34Å; L285-K287 PolarHBondContact O-N 3.21Å; K287-A289 PolarHBondContact O-N 2.92Å; K287-K290 WeakPolarHBondContact O-CA 3.46Å; K287-K290 PolarHBondContact O-N 3.31Å; K287-A291 WeakPolarHBondContact CD-O 3.23Å; K287-L322 HydrophobicContact CB-CD1 4.36Å; K287-L322 HydrophobicContact CB-CD2 3.97Å; K287-L322 HydrophobicContact CD-CB 4.42Å; K287-L322 WeakPolarHBondContact CE-O 3.31Å; K287-L322 HydrophobicContact CG-CB 4.27Å; K287-L322 HydrophobicContact CG-CD2 3.85Å; K287-L322 PolarHBondContact NZ-O 3.47Å
288	A	98.2	Very high	98	Very high	83 Å²	83	52.3 Å²	52.3	69%	0.686	26%	0.259	S	S	*	.	H	α-helix	trans	-61.8	-31.9	174	0	0	0	0	0	111.9	R284 L285 L286 K290	R284-A288 PolarHBondContact O-N 2.93Å; L285-A288 WeakPolarHBondContact O-CB 3.39Å; L285-A288 PolarHBondContact O-N 3.43Å; L286-A288 PolarHBondContact O-N 3.26Å; A288-K290 PolarHBondContact O-N 3.27Å
289	A	98.1	Very high	97.9	Very high	35 Å²	35	46.9 Å²	46.9	29%	0.289	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	14.7	170.1	0	0	0	0	0	114.2	L219 V225 L285 L286 K287	L219-A289 HydrophobicContact CD1-CB 3.9Å; L219-A289 HydrophobicContact CD2-CB 3.89Å; L219-A289 HydrophobicContact CG-CB 4.33Å; V225-A289 HydrophobicContact CG2-CB 4.47Å; L285-A289 PolarHBondContact O-N 2.95Å; L286-A289 CarbonylContact O-C 3.57Å; L286-A289 VanDerWaalsContact O-C 3.31Å; L286-A289 WeakPolarHBondContact O-CA 3.2Å; L286-A289 WeakPolarHBondContact O-CB 3.47Å; L286-A289 PolarHBondContact O-N 2.78Å; L286-A289 VanDerWaalsContact O-N 3.1Å; K287-A289 PolarHBondContact O-N 2.92Å
290	K	98	Very high	97.8	Very high	173 Å²	173	45.9 Å²	45.9	75%	0.752	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	23.6	177.4	-51.4	178.7	179.4	177	0	115.6	H226 L286 K287 A288 D292	H226-K290 PolarHBondContact CE1-O 2.79Å; L286-K290 PolarHBondContact O-N 2.93Å; K287-K290 WeakPolarHBondContact O-CA 3.46Å; K287-K290 PolarHBondContact O-N 3.31Å; A288-K290 PolarHBondContact O-N 3.27Å; K290-D292 PolarHBondContact O-N 2.96Å
291	A	98.3	Very high	97.7	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.025	22%	0.22	C	C	.	.			trans	-56.2	133.5	166.5	0	0	0	0	0	111	V225 L271 L286 K287	V225-A291 HydrophobicContact CG2-CB 3.62Å; L271-A291 HydrophobicContact CB-CB 4.06Å; L271-A291 HydrophobicContact CD2-CB 3.96Å; L271-A291 HydrophobicContact CG-CB 4.5Å; L286-A291 HydrophobicContact CB-CB 3.99Å; L286-A291 WeakPolarHBondContact O-CB 3.14Å; L286-A291 PolarHBondContact O-N 3.33Å; K287-A291 WeakPolarHBondContact CD-O 3.23Å
292	D	98.2	Very high	97.8	Very high	66 Å²	66	39.1 Å²	39.1	35%	0.353	20%	0.196	S	C	.	.			trans	-100.2	114	176.2	178.8	14.6	0	0	0	109.8	K290 N294 M295	K290-D292 PolarHBondContact O-N 2.96Å; D292-N294 PolarHBondContact O-N 3.39Å; D292-N294 VanDerWaalsContact O-N 3.16Å; D292-N294 VanDerWaalsContact OD1-CB 3.3Å; D292-N294 WeakPolarHBondContact OD1-CB 3.49Å; D292-N294 PolarHBondContact OD1-N 2.82Å; D292-N294 PolarHBondContact OD1-ND2 3.49Å; D292-M295 HydrophobicContact CB-CG 4.02Å; D292-M295 PolarHBondContact O-N 3.44Å
293	P	98.2	Very high	97.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.2	178.5	29	-36.5	0	0	0	113.8	L271 I319	L271-P293 HydrophobicContact CD2-CB 3.9Å; P293-I319 HydrophobicContact CB-CG2 4.05Å
294	N	98.5	Very high	97.7	Very high	25 Å²	25	39.3 Å²	39.3	13%	0.134	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-4.3	-176.7	-60	-62.4	0	0	0	113.8	D292 G323 K325 I328	D292-N294 PolarHBondContact O-N 3.39Å; D292-N294 VanDerWaalsContact O-N 3.16Å; D292-N294 VanDerWaalsContact OD1-CB 3.3Å; D292-N294 WeakPolarHBondContact OD1-CB 3.49Å; D292-N294 PolarHBondContact OD1-N 2.82Å; D292-N294 PolarHBondContact OD1-ND2 3.49Å; N294-G323 PolarHBondContact ND2-O 2.99Å; N294-K325 WeakPolarHBondContact OD1-CB 3.08Å; N294-K325 WeakPolarHBondContact OD1-CG 3.24Å; N294-K325 PolarHBondContact OD1-N 3.47Å; N294-I328 HydrophobicContact CB-CD1 3.54Å; N294-I328 VanDerWaalsContact OD1-CD1 3.31Å; N294-I328 WeakPolarHBondContact OD1-CD1 3.27Å
295	M	98	Very high	97.7	Very high	44 Å²	44	33.4 Å²	33.4	22%	0.217	18%	0.175	C	C	.	.			trans	-63.3	143.9	173.8	-68.7	-155	-52.8	0	0	110.8	H226 Y269 D292	H226-M295 HydrophobicContact CB-CE 3.74Å; H226-M295 HydrophobicContact CB-SD 4.18Å; H226-M295 WeakPolarHBondContact ND1-CE 3.45Å; Y269-M295 HydrophobicContact CD1-CE 3.08Å; Y269-M295 HydrophobicContact CD1-SD 4.46Å; Y269-M295 HydrophobicContact CD2-CB 4.13Å; Y269-M295 HydrophobicContact CD2-CE 4Å; Y269-M295 HydrophobicContact CE1-CB 4.44Å; Y269-M295 HydrophobicContact CE1-CE 3.09Å; Y269-M295 HydrophobicContact CE1-SD 3.93Å; Y269-M295 HydrophobicContact CE2-CB 3.71Å; Y269-M295 HydrophobicContact CE2-CE 4.05Å; Y269-M295 HydrophobicContact CG-CE 3.54Å; D292-M295 HydrophobicContact CB-CG 4.02Å; D292-M295 PolarHBondContact O-N 3.44Å
296	R	97.2	Very high	97.7	Very high	114 Å²	114	31.4 Å²	31.4	43%	0.43	17%	0.165	S	C	.	.			trans	-106.9	135.9	-175.4	-53.3	-169.7	-36.7	165.8	12.4	110.1	Y269 G300 N301 T302 I328 K329 N331	Y269-R296 WeakPolarHBondContact CE2-O 3.48Å; Y269-R296 PolarHBondContact OH-O 3.22Å; R296-G300 WeakPolarHBondContact CD-O 3.38Å; R296-N301 WeakPolarHBondContact CA-O 3.49Å; R296-T302 HydrophobicContact CG-CG2 4.12Å; R296-I328 HydrophobicContact CG-CG2 4.34Å; R296-K329 PolarHBondContact NH1-O 3.01Å; R296-K329 VanDerWaalsContact NH1-O 3.15Å; R296-N331 PolarHBondContact NH2-OD1 3.13Å
297	D	96	Very high	97.7	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.043	17%	0.165	C	C	.	.			trans	-74.5	-174.5	170.9	72.4	5.7	0	0	0	111.7	Y265 E268 N299 G300 N301	Y265-D297 WeakPolarHBondContact CE2-OD2 3.19Å; Y265-D297 PolarHBondContact OH-OD2 2.96Å; E268-D297 HydrophobicContact CB-CB 4.27Å; E268-D297 HydrophobicContact CG-CB 3.76Å; E268-D297 WeakPolarHBondContact OE2-CA 3.29Å; D297-N299 PolarHBondContact O-N 3.42Å; D297-N299 WeakPolarHBondContact OD1-CA 3.39Å; D297-N299 WeakPolarHBondContact OD1-CB 3.43Å; D297-N299 PolarHBondContact OD1-N 3.14Å; D297-G300 WeakPolarHBondContact O-CA 3.45Å; D297-G300 PolarHBondContact O-N 3.28Å; D297-G300 PolarHBondContact OD1-N 3.48Å; D297-N301 PolarHBondContact N-O 2.9Å; D297-N301 WeakPolarHBondContact OD1-CB 3.45Å; D297-N301 PolarHBondContact OD1-N 3.19Å
298	T	93.9	Very high	97.7	Very high	16 Å²	16	28 Å²	28	10%	0.098	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.9	178.2	-63.3	0	0	0	0	113	R228 V252 V254 E268 G300 N331	R228-T298 PolarHBondContact NH2-OG1 3.13Å; V252-T298 WeakPolarHBondContact O-CG2 3.44Å; V254-T298 HydrophobicContact CG1-CG2 4.06Å; V254-T298 HydrophobicContact CG2-CG2 3.81Å; E268-T298 WeakPolarHBondContact OE1-CB 3.4Å; E268-T298 PolarHBondContact OE1-N 3.17Å; E268-T298 PolarHBondContact OE1-OG1 3.35Å; E268-T298 PolarHBondContact OE2-N 3.3Å; T298-G300 PolarHBondContact O-N 2.9Å; T298-N331 PolarHBondContact O-ND2 3.41Å
299	N	95.7	Very high	97.7	Very high	9 Å²	9	24.6 Å²	24.6	5%	0.048	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.7	174.2	-80.8	-51.8	0	0	0	113.1	Q239 Y260 Y265 D297 N301 N331	Q239-N299 PolarHBondContact NE2-OD1 3.01Å; Q239-N299 PolarHBondContact OE1-ND2 2.98Å; Q239-N299 PolarHBondContact OE1-OD1 2.71Å; Y260-N299 HydrophobicContact CE1-CB 4.02Å; Y265-N299 PolarHBondContact OH-ND2 3.19Å; D297-N299 PolarHBondContact O-N 3.42Å; D297-N299 WeakPolarHBondContact OD1-CA 3.39Å; D297-N299 WeakPolarHBondContact OD1-CB 3.43Å; D297-N299 PolarHBondContact OD1-N 3.14Å; N299-N301 PolarHBondContact O-N 3Å; N299-N331 WeakPolarHBondContact O-CB 3.47Å; N299-N331 PolarHBondContact O-N 3.17Å
300	G	96.2	Very high	97.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	79	3.9	-174.1	0	0	0	0	0	113.4	R296 D297 T298 N330 N331	R296-G300 WeakPolarHBondContact CD-O 3.38Å; D297-G300 WeakPolarHBondContact O-CA 3.45Å; D297-G300 PolarHBondContact O-N 3.28Å; D297-G300 PolarHBondContact OD1-N 3.48Å; T298-G300 PolarHBondContact O-N 2.9Å; G300-N330 VanDerWaalsContact O-CA 3.25Å; G300-N330 WeakPolarHBondContact O-CA 3.43Å; G300-N330 WeakPolarHBondContact O-CB 3.4Å; G300-N331 WeakPolarHBondContact CA-OD1 3.33Å
301	N	98	Very high	97.6	Very high	2 Å²	2	21 Å²	21	1%	0.011	10%	0.099	C	C	.	.			trans	-77.5	134.5	-176.4	-73	-34.8	0	0	0	110.6	Y260 Y265 R296 D297 N299 H305 N330	Y260-N301 WeakPolarHBondContact CE1-ND2 3.48Å; Y265-N301 PolarHBondContact OH-ND2 2.81Å; R296-N301 WeakPolarHBondContact CA-O 3.49Å; D297-N301 PolarHBondContact N-O 2.9Å; D297-N301 WeakPolarHBondContact OD1-CB 3.45Å; D297-N301 PolarHBondContact OD1-N 3.19Å; N299-N301 PolarHBondContact O-N 3Å; N301-H305 HydrophobicContact CB-CB 3.74Å; N301-N330 VanDerWaalsContact OD1-CB 3.28Å; N301-N330 WeakPolarHBondContact OD1-CB 3.46Å; N301-N330 PolarHBondContact OD1-ND2 3.01Å
302	T	98.5	Very high	97.6	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.101	C	C	.	.			trans	-87.7	173.9	167.6	68	0	0	0	0	110.7	R296 L304 H305 L306 I328	R296-T302 HydrophobicContact CG-CG2 4.12Å; T302-L304 PolarHBondContact O-N 3.05Å; T302-L304 PolarHBondContact OG1-N 3.26Å; T302-H305 PolarHBondContact N-ND1 3.48Å; T302-H305 VanDerWaalsContact N-ND1 3.12Å; T302-H305 WeakPolarHBondContact O-CB 3.44Å; T302-H305 PolarHBondContact O-N 3.08Å; T302-H305 PolarHBondContact OG1-ND1 2.95Å; T302-L306 PolarHBondContact O-N 3.1Å; T302-I328 HydrophobicContact CG2-CB 4.01Å; T302-I328 HydrophobicContact CG2-CD1 3.96Å; T302-I328 HydrophobicContact CG2-CG2 3.63Å
303	V	98.5	Very high	97.6	Very high	6 Å²	6	19.3 Å²	19.3	4%	0.036	9%	0.091	C	C	.	.	H	α-helix	trans	-55.9	-38.1	175.8	-173.4	0	0	0	0	111.8	L271 A275 H305 L306 M307 I319	L271-V303 HydrophobicContact CD2-CG2 4.37Å; L271-V303 HydrophobicContact CG-CG2 4.25Å; A275-V303 HydrophobicContact CB-CG1 3.58Å; V303-H305 VanDerWaalsContact C-N 3.34Å; V303-H305 PolarHBondContact O-N 2.95Å; V303-L306 WeakPolarHBondContact O-CB 3.39Å; V303-L306 PolarHBondContact O-N 3.23Å; V303-L306 VanDerWaalsContact O-N 3.13Å; V303-M307 HydrophobicContact CG1-CE 4.37Å; V303-M307 WeakPolarHBondContact O-CG 3.15Å; V303-M307 PolarHBondContact O-N 2.85Å; V303-I319 HydrophobicContact CB-CG2 3.9Å; V303-I319 HydrophobicContact CG1-CB 4.41Å; V303-I319 HydrophobicContact CG1-CD1 3.81Å; V303-I319 HydrophobicContact CG1-CG1 3.77Å; V303-I319 HydrophobicContact CG1-CG2 3.84Å
304	L	98.7	Very high	97.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.5	-33.5	176.8	-68.1	179.5	0	0	0	113.4	T302 L306 M307 V308 F316 I319 G324 L326 P336	T302-L304 PolarHBondContact O-N 3.05Å; T302-L304 PolarHBondContact OG1-N 3.26Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L304-M307 PolarHBondContact O-N 2.87Å; L304-V308 PolarHBondContact O-N 2.82Å; L304-F316 HydrophobicContact CB-CE2 3.92Å; L304-F316 HydrophobicContact CB-CZ 4.34Å; L304-F316 HydrophobicContact CD1-CZ 4.38Å; L304-F316 HydrophobicContact CD2-CD1 4.19Å; L304-F316 HydrophobicContact CD2-CD2 3.88Å; L304-F316 HydrophobicContact CD2-CE1 4.1Å; L304-F316 HydrophobicContact CD2-CE2 3.78Å; L304-F316 HydrophobicContact CD2-CG 4.06Å; L304-F316 HydrophobicContact CD2-CZ 3.87Å; L304-F316 HydrophobicContact CG-CE2 4.35Å; L304-F316 HydrophobicContact CG-CZ 4.43Å; L304-I319 HydrophobicContact CD2-CB 3.8Å; L304-I319 HydrophobicContact CD2-CG2 3.51Å; L304-I319 HydrophobicContact CG-CG2 3.84Å; L304-G324 VanDerWaalsContact CD1-C 3.48Å; L304-G324 WeakPolarHBondContact CD1-O 3.21Å; L304-L326 HydrophobicContact CD1-CD2 4.07Å; L304-P336 HydrophobicContact CB-CB 4.46Å; L304-P336 HydrophobicContact CB-CG 3.89Å
305	H	98.7	Very high	97.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.6	-40.9	172.3	-66.1	82.1	0	0	0	110.7	N301 T302 V303 M307 V308 I309 I328 L334 P336 L339	N301-H305 HydrophobicContact CB-CB 3.74Å; T302-H305 PolarHBondContact N-ND1 3.48Å; T302-H305 VanDerWaalsContact N-ND1 3.12Å; T302-H305 WeakPolarHBondContact O-CB 3.44Å; T302-H305 PolarHBondContact O-N 3.08Å; T302-H305 PolarHBondContact OG1-ND1 2.95Å; V303-H305 VanDerWaalsContact C-N 3.34Å; V303-H305 PolarHBondContact O-N 2.95Å; H305-M307 VanDerWaalsContact C-N 3.33Å; H305-M307 PolarHBondContact O-N 3.22Å; H305-V308 WeakPolarHBondContact O-CB 3.5Å; H305-V308 PolarHBondContact O-N 2.8Å; H305-V308 VanDerWaalsContact O-N 3.17Å; H305-I309 WeakPolarHBondContact O-CG1 3.28Å; H305-I309 PolarHBondContact O-N 3.24Å; H305-I328 PolarHBondContact CE1-O 3.17Å; H305-I328 PolarHBondContact NE2-O 3.2Å; H305-L334 PolarHBondContact NE2-O 3.38Å; H305-P336 WeakPolarHBondContact NE2-CD 3.4Å; H305-L339 HydrophobicContact CB-CD2 3.78Å
306	L	98.5	Very high	97.6	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-66.2	-36.2	179.1	-61.3	167	0	0	0	111.8	Y265 T302 V303 L304 V308 I309 H310	Y265-L306 HydrophobicContact CD1-CD2 4.29Å; Y265-L306 HydrophobicContact CE1-CD2 3.75Å; Y265-L306 HydrophobicContact CE2-CD2 4.17Å; T302-L306 PolarHBondContact O-N 3.1Å; V303-L306 WeakPolarHBondContact O-CB 3.39Å; V303-L306 PolarHBondContact O-N 3.23Å; V303-L306 VanDerWaalsContact O-N 3.13Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L306-V308 PolarHBondContact O-N 3.24Å; L306-I309 HydrophobicContact CD2-CD1 4.29Å; L306-I309 PolarHBondContact O-N 3.38Å; L306-I309 VanDerWaalsContact O-N 3.12Å; L306-H310 PolarHBondContact O-CD2 2.93Å; L306-H310 VanDerWaalsContact O-CD2 3.28Å; L306-H310 PolarHBondContact O-N 3.32Å
307	M	98.4	Very high	97.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.6	-32.3	174.4	-64.4	-51	91	0	0	112.1	A275 V303 L304 H305 E311 L312 I315 F316	A275-M307 HydrophobicContact CB-CE 3.54Å; A275-M307 HydrophobicContact CB-SD 3.93Å; V303-M307 HydrophobicContact CG1-CE 4.37Å; V303-M307 WeakPolarHBondContact O-CG 3.15Å; V303-M307 PolarHBondContact O-N 2.85Å; L304-M307 PolarHBondContact O-N 2.87Å; H305-M307 VanDerWaalsContact C-N 3.33Å; H305-M307 PolarHBondContact O-N 3.22Å; M307-E311 WeakPolarHBondContact O-CA 3.49Å; M307-E311 PolarHBondContact O-N 3.48Å; M307-L312 HydrophobicContact CE-CD1 3.91Å; M307-L312 PolarHBondContact O-N 3.47Å; M307-L312 HydrophobicContact SD-CB 3.81Å; M307-L312 HydrophobicContact SD-CD1 3.76Å; M307-L312 HydrophobicContact SD-CG 4.37Å; M307-I315 HydrophobicContact CG-CG2 4.49Å; M307-I315 HydrophobicContact SD-CB 3.68Å; M307-I315 HydrophobicContact SD-CG2 3.41Å; M307-I315 WeakPolarHBondContact SD-CG2 3.28Å; M307-F316 HydrophobicContact CB-CB 4Å; M307-F316 HydrophobicContact CB-CD2 3.71Å; M307-F316 HydrophobicContact CB-CG 4.33Å; M307-F316 HydrophobicContact CG-CB 4.35Å
308	V	98.4	Very high	97.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-68.2	-46	170.5	172.4	0	0	0	0	110.7	L304 H305 L306 H310 E311 F316 P336 L339 A340 K345 M348 V352	L304-V308 PolarHBondContact O-N 2.82Å; H305-V308 WeakPolarHBondContact O-CB 3.5Å; H305-V308 PolarHBondContact O-N 2.8Å; H305-V308 VanDerWaalsContact O-N 3.17Å; L306-V308 PolarHBondContact O-N 3.24Å; V308-H310 VanDerWaalsContact C-N 3.28Å; V308-H310 PolarHBondContact O-N 2.82Å; V308-E311 PolarHBondContact O-N 3.35Å; V308-F316 HydrophobicContact CG2-CD2 4.46Å; V308-F316 HydrophobicContact CG2-CE2 4.12Å; V308-P336 HydrophobicContact CG2-CB 4.03Å; V308-L339 HydrophobicContact CG1-CD2 4.5Å; V308-L339 HydrophobicContact CG1-CG 4.26Å; V308-A340 HydrophobicContact CG1-CB 3.58Å; V308-K345 HydrophobicContact CG1-CD 4.45Å; V308-K345 WeakPolarHBondContact O-CD 3.4Å; V308-M348 HydrophobicContact CG1-CB 4.3Å; V308-M348 HydrophobicContact CG2-CB 4.42Å; V308-M348 HydrophobicContact CG2-CE 3.97Å; V308-V352 HydrophobicContact CG2-CG2 4.16Å
309	I	97.7	Very high	98	Very high	13 Å²	13	16.5 Å²	16.5	7%	0.067	9%	0.085	C	C	.	.	H	α-helix	trans	-61.3	-36.7	-179.9	-67.5	165.8	0	0	0	111.7	Y260 Y265 H305 L306 L339 L343 K345	Y260-I309 HydrophobicContact CD1-CD1 4.02Å; Y260-I309 HydrophobicContact CD2-CD1 4.17Å; Y260-I309 HydrophobicContact CG-CD1 3.75Å; Y260-I309 HydrophobicContact CG-CG1 4.36Å; Y265-I309 HydrophobicContact CD1-CD1 4.4Å; Y265-I309 HydrophobicContact CD1-CG2 4.42Å; Y265-I309 HydrophobicContact CE1-CD1 3.76Å; H305-I309 WeakPolarHBondContact O-CG1 3.28Å; H305-I309 PolarHBondContact O-N 3.24Å; L306-I309 HydrophobicContact CD2-CD1 4.29Å; L306-I309 PolarHBondContact O-N 3.38Å; L306-I309 VanDerWaalsContact O-N 3.12Å; I309-L339 HydrophobicContact CD1-CD2 4.05Å; I309-L339 HydrophobicContact CG1-CD2 3.94Å; I309-L343 HydrophobicContact CG1-CD1 3.91Å; I309-K345 PolarHBondContact O-NZ 2.71Å
310	H	97	Very high	98.2	Very high	50 Å²	50	18.9 Å²	18.9	23%	0.231	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	0.8	179.9	-67.3	-67.2	0	0	0	114.8	Y265 W266 C276 L306 V308 L312	Y265-H310 PolarHBondContact O-CE1 3.5Å; Y265-H310 PolarHBondContact O-NE2 2.97Å; W266-H310 AromaticContact CD1-NE2 3.96Å; C276-H310 VanDerWaalsContact SG-CD2 3.59Å; L306-H310 PolarHBondContact O-CD2 2.93Å; L306-H310 VanDerWaalsContact O-CD2 3.28Å; L306-H310 PolarHBondContact O-N 3.32Å; V308-H310 VanDerWaalsContact C-N 3.28Å; V308-H310 PolarHBondContact O-N 2.82Å; H310-L312 HydrophobicContact CB-CD1 3.76Å; H310-L312 HydrophobicContact CB-CD2 4.46Å; H310-L312 HydrophobicContact CB-CG 3.74Å
311	E	97.3	Very high	98.2	Very high	81 Å²	81	24.9 Å²	24.9	38%	0.379	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	54.7	-178.4	-69.8	170.1	103.7	0	0	113.5	M307 V308 P313 K345 M348	M307-E311 WeakPolarHBondContact O-CA 3.49Å; M307-E311 PolarHBondContact O-N 3.48Å; V308-E311 PolarHBondContact O-N 3.35Å; E311-P313 VanDerWaalsContact C-CD 3.44Å; E311-P313 WeakPolarHBondContact O-CD 3.36Å; E311-K345 HydrophobicContact CG-CD 3.74Å; E311-K345 HydrophobicContact CG-CG 4.33Å; E311-K345 IonicContact OE2-NZ 2.67Å; E311-K345 PolarHBondContact OE2-NZ 3.1Å; E311-M348 HydrophobicContact CB-CG 4.17Å; E311-M348 HydrophobicContact CG-CG 3.82Å
312	L	98	Very high	98.3	Very high	11 Å²	11	26.1 Å²	26.1	6%	0.058	14%	0.135	C	C	.	.			trans	-112.3	73.7	-176.9	-55	178.2	0	0	0	111.2	R278 M307 H310 D314 I315 F316	R278-L312 HydrophobicContact CG-CD1 4.29Å; R278-L312 HydrophobicContact CG-CD2 4.02Å; M307-L312 HydrophobicContact CE-CD1 3.91Å; M307-L312 PolarHBondContact O-N 3.47Å; M307-L312 HydrophobicContact SD-CB 3.81Å; M307-L312 HydrophobicContact SD-CD1 3.76Å; M307-L312 HydrophobicContact SD-CG 4.37Å; H310-L312 HydrophobicContact CB-CD1 3.76Å; H310-L312 HydrophobicContact CB-CD2 4.46Å; H310-L312 HydrophobicContact CB-CG 3.74Å; L312-D314 PolarHBondContact O-N 3.46Å; L312-I315 HydrophobicContact CB-CB 4.25Å; L312-I315 PolarHBondContact O-N 2.77Å; L312-F316 WeakPolarHBondContact O-CB 3.09Å; L312-F316 PolarHBondContact O-N 3.23Å
313	P	98.2	Very high	98.2	Very high	23 Å²	23	27.9 Å²	27.9	15%	0.149	15%	0.153	C	C	.	.	H	α-helix	trans	-65.3	-35.9	-175.1	25.9	-34.5	0	0	0	113.4	E311 F316 D317 M348 H351	E311-P313 VanDerWaalsContact C-CD 3.44Å; E311-P313 WeakPolarHBondContact O-CD 3.36Å; P313-F316 VanDerWaalsContact O-CB 3.3Å; P313-F316 WeakPolarHBondContact O-CB 2.91Å; P313-F316 PolarHBondContact O-N 3.29Å; P313-D317 VanDerWaalsContact O-CG 3.27Å; P313-D317 PolarHBondContact O-N 2.99Å; P313-D317 VanDerWaalsContact O-N 3.1Å; P313-M348 HydrophobicContact CB-SD 4Å; P313-M348 HydrophobicContact CG-SD 4.47Å; P313-H351 PolarHBondContact O-NE2 2.95Å
314	D	97.8	Very high	98.2	Very high	74 Å²	74	27.8 Å²	27.8	40%	0.396	15%	0.153	S	C	.	.	H	α-helix	trans	-66.8	-40.1	179.1	58.9	-50.9	0	0	0	112.6	R278 L312 L318	R278-D314 IonicContact CZ-OD1 3.04Å; R278-D314 IonicContact CZ-OD2 2.78Å; R278-D314 IonicContact NH1-OD1 2.64Å; R278-D314 IonicContact NH2-OD1 2.83Å; R278-D314 PolarHBondContact NH2-OD1 2.67Å; R278-D314 IonicContact NH2-OD2 2.74Å; R278-D314 PolarHBondContact NH2-OD2 3.44Å; L312-D314 PolarHBondContact O-N 3.46Å; D314-L318 PolarHBondContact O-N 2.98Å
315	I	98.5	Very high	98.2	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-76.5	-30.9	174.5	-54.3	-61.4	0	0	0	110.7	A275 R278 P280 M307 L312 D317 L318 I319	A275-I315 HydrophobicContact CB-CG2 3.8Å; R278-I315 HydrophobicContact CB-CD1 4.4Å; R278-I315 HydrophobicContact CB-CG1 4.35Å; R278-I315 HydrophobicContact CG-CG1 4.38Å; P280-I315 HydrophobicContact CG-CD1 3.94Å; M307-I315 HydrophobicContact CG-CG2 4.49Å; M307-I315 HydrophobicContact SD-CB 3.68Å; M307-I315 HydrophobicContact SD-CG2 3.41Å; M307-I315 WeakPolarHBondContact SD-CG2 3.28Å; L312-I315 HydrophobicContact CB-CB 4.25Å; L312-I315 PolarHBondContact O-N 2.77Å; I315-D317 VanDerWaalsContact C-N 3.3Å; I315-D317 PolarHBondContact O-N 2.89Å; I315-L318 PolarHBondContact O-N 3.25Å; I315-I319 HydrophobicContact CG2-CG1 4.05Å; I315-I319 VanDerWaalsContact O-CG1 3.29Å; I315-I319 WeakPolarHBondContact O-CG1 3.37Å; I315-I319 PolarHBondContact O-N 3.46Å
316	F	98.7	Very high	98.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-54.6	-48.3	172.6	-171.3	-77.5	0	0	0	111.1	L304 M307 V308 L312 P313 L318 I319 H320 L326 P336 M348 V352 F355	L304-F316 HydrophobicContact CB-CE2 3.92Å; L304-F316 HydrophobicContact CB-CZ 4.34Å; L304-F316 HydrophobicContact CD1-CZ 4.38Å; L304-F316 HydrophobicContact CD2-CD1 4.19Å; L304-F316 HydrophobicContact CD2-CD2 3.88Å; L304-F316 HydrophobicContact CD2-CE1 4.1Å; L304-F316 HydrophobicContact CD2-CE2 3.78Å; L304-F316 HydrophobicContact CD2-CG 4.06Å; L304-F316 HydrophobicContact CD2-CZ 3.87Å; L304-F316 HydrophobicContact CG-CE2 4.35Å; L304-F316 HydrophobicContact CG-CZ 4.43Å; M307-F316 HydrophobicContact CB-CB 4Å; M307-F316 HydrophobicContact CB-CD2 3.71Å; M307-F316 HydrophobicContact CB-CG 4.33Å; M307-F316 HydrophobicContact CG-CB 4.35Å; V308-F316 HydrophobicContact CG2-CD2 4.46Å; V308-F316 HydrophobicContact CG2-CE2 4.12Å; L312-F316 WeakPolarHBondContact O-CB 3.09Å; L312-F316 PolarHBondContact O-N 3.23Å; P313-F316 VanDerWaalsContact O-CB 3.3Å; P313-F316 WeakPolarHBondContact O-CB 2.91Å; P313-F316 PolarHBondContact O-N 3.29Å; F316-L318 PolarHBondContact O-N 3.39Å; F316-I319 PolarHBondContact O-N 3.27Å; F316-H320 WeakPolarHBondContact O-CB 3.34Å; F316-H320 PolarHBondContact O-N 3.23Å; F316-L326 HydrophobicContact CE1-CD2 3.82Å; F316-L326 HydrophobicContact CZ-CD2 3.59Å; F316-P336 HydrophobicContact CE2-CB 4.28Å; F316-M348 HydrophobicContact CB-CE 4.08Å; F316-M348 HydrophobicContact CD2-CE 3.58Å; F316-M348 HydrophobicContact CE2-CE 4.31Å; F316-M348 HydrophobicContact CG-CE 3.99Å; F316-V352 HydrophobicContact CD2-CG2 4.45Å; F316-V352 HydrophobicContact CE1-CG2 4.2Å; F316-V352 HydrophobicContact CE2-CG2 3.67Å; F316-V352 HydrophobicContact CZ-CB 4.42Å; F316-V352 HydrophobicContact CZ-CG1 4.28Å; F316-V352 HydrophobicContact CZ-CG2 3.54Å; F316-F355 HydrophobicContact CD1-CD2 4.3Å; F316-F355 AromaticContact CD1-CE2 3.87Å; F316-F355 HydrophobicContact CD1-CE2 3.87Å; F316-F355 AromaticContact CE1-CD2 3.92Å; F316-F355 HydrophobicContact CE1-CD2 3.92Å; F316-F355 AromaticContact CE1-CE2 3.94Å; F316-F355 HydrophobicContact CE1-CE2 3.94Å
317	D	98.5	Very high	97.9	Very high	53 Å²	53	40.4 Å²	40.4	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-57.8	-49.2	178.3	-63.3	-9.1	0	0	0	110.9	P313 I315 I319 H320 D321 H351 F355	P313-D317 VanDerWaalsContact O-CG 3.27Å; P313-D317 PolarHBondContact O-N 2.99Å; P313-D317 VanDerWaalsContact O-N 3.1Å; I315-D317 VanDerWaalsContact C-N 3.3Å; I315-D317 PolarHBondContact O-N 2.89Å; D317-I319 PolarHBondContact O-N 2.79Å; D317-H320 WeakPolarHBondContact O-CB 2.98Å; D317-H320 PolarHBondContact O-N 3.4Å; D317-D321 VanDerWaalsContact O-CG 3.31Å; D317-D321 PolarHBondContact O-N 3.42Å; D317-H351 IonicContact OD1-CD2 2.69Å; D317-H351 IonicContact OD1-CE1 3.09Å; D317-H351 PolarHBondContact OD1-CE1 2.84Å; D317-H351 IonicContact OD1-NE2 2.69Å; D317-H351 PolarHBondContact OD1-NE2 3.09Å; D317-H351 IonicContact OD2-CE1 3.09Å; D317-H351 IonicContact OD2-NE2 3.18Å; D317-F355 HydrophobicContact CB-CZ 4.34Å; D317-F355 WeakPolarHBondContact OD1-CE2 3.39Å; D317-F355 WeakPolarHBondContact OD1-CZ 3.09Å
318	L	98.5	Very high	97.9	Very high	20 Å²	20	42.1 Å²	42.1	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-58.9	-45.6	177.6	177.1	64.4	0	0	0	112.1	P280 C283 R284 D314 I315 F316 H320 D321 L322	P280-L318 HydrophobicContact CB-CD2 3.74Å; P280-L318 HydrophobicContact CG-CD2 4.49Å; C283-L318 HydrophobicContact CB-CD2 3.94Å; R284-L318 HydrophobicContact CG-CD1 4.36Å; D314-L318 PolarHBondContact O-N 2.98Å; I315-L318 PolarHBondContact O-N 3.25Å; F316-L318 PolarHBondContact O-N 3.39Å; L318-H320 VanDerWaalsContact C-N 3.32Å; L318-H320 PolarHBondContact O-N 3.45Å; L318-D321 PolarHBondContact O-N 3.1Å; L318-L322 HydrophobicContact CD1-CD1 4.05Å; L318-L322 HydrophobicContact CD1-CG 4.15Å; L318-L322 HydrophobicContact CG-CD1 3.91Å; L318-L322 HydrophobicContact CG-CG 4.38Å; L318-L322 WeakPolarHBondContact O-CB 3.37Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.28Å
319	I	98.6	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.5	-36.5	-178.5	-65.8	-63.5	0	0	0	111.2	L271 A275 C283 P293 V303 L304 I315 F316 D317 L322 G323 G324	L271-I319 HydrophobicContact CD1-CD1 4.07Å; L271-I319 HydrophobicContact CG-CD1 4.36Å; A275-I319 HydrophobicContact CB-CD1 4.11Å; A275-I319 HydrophobicContact CB-CG1 4.27Å; C283-I319 HydrophobicContact CB-CD1 4.46Å; P293-I319 HydrophobicContact CB-CG2 4.05Å; V303-I319 HydrophobicContact CB-CG2 3.9Å; V303-I319 HydrophobicContact CG1-CB 4.41Å; V303-I319 HydrophobicContact CG1-CD1 3.81Å; V303-I319 HydrophobicContact CG1-CG1 3.77Å; V303-I319 HydrophobicContact CG1-CG2 3.84Å; L304-I319 HydrophobicContact CD2-CB 3.8Å; L304-I319 HydrophobicContact CD2-CG2 3.51Å; L304-I319 HydrophobicContact CG-CG2 3.84Å; I315-I319 HydrophobicContact CG2-CG1 4.05Å; I315-I319 VanDerWaalsContact O-CG1 3.29Å; I315-I319 WeakPolarHBondContact O-CG1 3.37Å; I315-I319 PolarHBondContact O-N 3.46Å; F316-I319 PolarHBondContact O-N 3.27Å; D317-I319 PolarHBondContact O-N 2.79Å; I319-L322 HydrophobicContact CD1-CD1 4.41Å; I319-L322 PolarHBondContact O-N 2.88Å; I319-G323 PolarHBondContact O-N 3Å; I319-G324 WeakPolarHBondContact O-CA 3.3Å; I319-G324 PolarHBondContact O-N 3.44Å
320	H	98.3	Very high	97.7	Very high	58 Å²	58	46.6 Å²	46.6	27%	0.269	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-48.6	172.1	178.5	-92.7	0	0	0	110.7	F316 D317 L318 L322 G323 G324 F355	F316-H320 WeakPolarHBondContact O-CB 3.34Å; F316-H320 PolarHBondContact O-N 3.23Å; D317-H320 WeakPolarHBondContact O-CB 2.98Å; D317-H320 PolarHBondContact O-N 3.4Å; L318-H320 VanDerWaalsContact C-N 3.32Å; L318-H320 PolarHBondContact O-N 3.45Å; H320-L322 VanDerWaalsContact C-N 3.27Å; H320-L322 PolarHBondContact O-N 3.43Å; H320-G323 WeakPolarHBondContact O-CA 3.12Å; H320-G323 PolarHBondContact O-N 3.2Å; H320-G324 PolarHBondContact O-N 2.91Å; H320-F355 AromaticContact CE1-CD1 3.86Å; H320-F355 AromaticContact ND1-CD1 3.91Å; H320-F355 AromaticContact ND1-CE1 3.67Å
321	D	98.2	Very high	97.6	Very high	126 Å²	126	47.4 Å²	47.4	67%	0.674	24%	0.244	S	C	*	.	H	α-helix	trans	-62.8	-31.4	177.2	-68.7	-12.9	0	0	0	112.9	D317 L318 G323	D317-D321 VanDerWaalsContact O-CG 3.31Å; D317-D321 PolarHBondContact O-N 3.42Å; L318-D321 PolarHBondContact O-N 3.1Å; D321-G323 PolarHBondContact O-N 2.94Å
322	L	98.2	Very high	97.4	Very high	29 Å²	29	45 Å²	45	15%	0.152	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	6	172.7	-64.1	172.9	0	0	0	113.2	C283 R284 K287 L318 I319 H320	C283-L322 HydrophobicContact CB-CD1 3.99Å; R284-L322 HydrophobicContact CG-CD2 4.49Å; K287-L322 HydrophobicContact CB-CD1 4.36Å; K287-L322 HydrophobicContact CB-CD2 3.97Å; K287-L322 HydrophobicContact CD-CB 4.42Å; K287-L322 WeakPolarHBondContact CE-O 3.31Å; K287-L322 HydrophobicContact CG-CB 4.27Å; K287-L322 HydrophobicContact CG-CD2 3.85Å; K287-L322 PolarHBondContact NZ-O 3.47Å; L318-L322 HydrophobicContact CD1-CD1 4.05Å; L318-L322 HydrophobicContact CD1-CG 4.15Å; L318-L322 HydrophobicContact CG-CD1 3.91Å; L318-L322 HydrophobicContact CG-CG 4.38Å; L318-L322 WeakPolarHBondContact O-CB 3.37Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.28Å; I319-L322 HydrophobicContact CD1-CD1 4.41Å; I319-L322 PolarHBondContact O-N 2.88Å; H320-L322 VanDerWaalsContact C-N 3.27Å; H320-L322 PolarHBondContact O-N 3.43Å
323	G	98	Very high	97.1	Very high	38 Å²	38	47.8 Å²	47.8	39%	0.392	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.3	21.7	173.5	0	0	0	0	0	115	N294 I319 H320 D321	N294-G323 PolarHBondContact ND2-O 2.99Å; I319-G323 PolarHBondContact O-N 3Å; H320-G323 WeakPolarHBondContact O-CA 3.12Å; H320-G323 PolarHBondContact O-N 3.2Å; D321-G323 PolarHBondContact O-N 2.94Å
324	G	98.4	Very high	97	Very high	4 Å²	4	46.9 Å²	46.9	4%	0.041	24%	0.244	C	C	.	.			trans	-68.9	126.3	171.8	0	0	0	0	0	111.6	L304 I319 H320	L304-G324 VanDerWaalsContact CD1-C 3.48Å; L304-G324 WeakPolarHBondContact CD1-O 3.21Å; I319-G324 WeakPolarHBondContact O-CA 3.3Å; I319-G324 PolarHBondContact O-N 3.44Å; H320-G324 PolarHBondContact O-N 2.91Å
325	K	98.2	Very high	97	Very high	135 Å²	135	43.4 Å²	43.4	59%	0.587	23%	0.226	S	C	*	.			trans	-89.3	131	-178.3	-64.2	176.6	-177.3	179.5	0	111.9	N294 H327 I328	N294-K325 WeakPolarHBondContact OD1-CB 3.08Å; N294-K325 WeakPolarHBondContact OD1-CG 3.24Å; N294-K325 PolarHBondContact OD1-N 3.47Å; K325-H327 PolarHBondContact O-N 3.3Å; K325-I328 HydrophobicContact CB-CD1 3.84Å; K325-I328 HydrophobicContact CB-CG1 3.96Å; K325-I328 HydrophobicContact CD-CD1 4.26Å
326	L	96.5	Very high	96.9	Very high	16 Å²	16	43.3 Å²	43.3	8%	0.084	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-20.6	-178.3	-61.4	170.8	0	0	0	114.4	L304 F316 P336 V352 F355 E356	L304-L326 HydrophobicContact CD1-CD2 4.07Å; F316-L326 HydrophobicContact CE1-CD2 3.82Å; F316-L326 HydrophobicContact CZ-CD2 3.59Å; L326-P336 WeakPolarHBondContact O-CD 3.24Å; L326-V352 HydrophobicContact CD2-CG1 4.42Å; L326-F355 HydrophobicContact CD1-CB 3.76Å; L326-E356 HydrophobicContact CD1-CG 4.39Å
327	H	95.3	Very high	96.8	Very high	116 Å²	116	43.3 Å²	43.3	54%	0.537	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	9.6	-169.9	-51.4	-52.1	0	0	0	114.3	K325 E356	K325-H327 PolarHBondContact O-N 3.3Å; H327-E356 IonicContact CE1-OE1 3.91Å; H327-E356 PolarHBondContact CE1-OE1 3.31Å; H327-E356 IonicContact ND1-OE1 2.65Å; H327-E356 PolarHBondContact ND1-OE1 3.09Å
328	I	96.9	Very high	96.7	Very high	36 Å²	36	41 Å²	41	19%	0.185	21%	0.213	C	C	.	.			trans	-69.8	134.2	173.5	-64.4	173	0	0	0	108.5	N294 R296 T302 H305 K325	N294-I328 HydrophobicContact CB-CD1 3.54Å; N294-I328 VanDerWaalsContact OD1-CD1 3.31Å; N294-I328 WeakPolarHBondContact OD1-CD1 3.27Å; R296-I328 HydrophobicContact CG-CG2 4.34Å; T302-I328 HydrophobicContact CG2-CB 4.01Å; T302-I328 HydrophobicContact CG2-CD1 3.96Å; T302-I328 HydrophobicContact CG2-CG2 3.63Å; H305-I328 PolarHBondContact CE1-O 3.17Å; H305-I328 PolarHBondContact NE2-O 3.2Å; K325-I328 HydrophobicContact CB-CD1 3.84Å; K325-I328 HydrophobicContact CB-CG1 3.96Å; K325-I328 HydrophobicContact CD-CD1 4.26Å
329	K	95.6	Very high	96.7	Very high	102 Å²	102	40 Å²	40	44%	0.443	21%	0.208	S	C	.	.			trans	-98.4	135.8	177.9	-64.6	-179.4	179.6	-175.2	0	111.3	R296 T333 L334 T335	R296-K329 PolarHBondContact NH1-O 3.01Å; R296-K329 VanDerWaalsContact NH1-O 3.15Å; K329-T333 WeakPolarHBondContact CD-O 3.37Å; K329-L334 CarbonylContact C-O 3.57Å; K329-L334 VanDerWaalsContact CA-O 3.3Å; K329-L334 WeakPolarHBondContact CA-O 3.49Å; K329-T335 HydrophobicContact CG-CG2 3.99Å
330	N	96.3	Very high	96.6	Very high	5 Å²	5	40 Å²	40	3%	0.027	21%	0.208	C	C	.	.			trans	-78	-174.8	171.4	76.7	4.1	0	0	0	112.2	Y260 G300 N301 Q332 T333 L334	Y260-N330 PolarHBondContact OH-ND2 2.78Å; G300-N330 VanDerWaalsContact O-CA 3.25Å; G300-N330 WeakPolarHBondContact O-CA 3.43Å; G300-N330 WeakPolarHBondContact O-CB 3.4Å; N301-N330 VanDerWaalsContact OD1-CB 3.28Å; N301-N330 WeakPolarHBondContact OD1-CB 3.46Å; N301-N330 PolarHBondContact OD1-ND2 3.01Å; N330-Q332 PolarHBondContact O-N 2.99Å; N330-Q332 WeakPolarHBondContact OD1-CA 3.47Å; N330-Q332 WeakPolarHBondContact OD1-CB 3.3Å; N330-Q332 PolarHBondContact OD1-N 3.02Å; N330-T333 WeakPolarHBondContact O-CA 3.22Å; N330-T333 PolarHBondContact O-N 3.47Å; N330-T333 PolarHBondContact OD1-N 3.12Å; N330-L334 PolarHBondContact N-O 3.2Å; N330-L334 WeakPolarHBondContact OD1-CB 3.43Å; N330-L334 PolarHBondContact OD1-N 3.34Å; N330-L334 PolarHBondContact OD1-O 3.41Å
331	N	94.6	Very high	96.5	Very high	67 Å²	67	37.2 Å²	37.2	36%	0.358	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.3	-177.7	-66.3	-7	0	0	0	112.9	R296 T298 N299 G300 T333	R296-N331 PolarHBondContact NH2-OD1 3.13Å; T298-N331 PolarHBondContact O-ND2 3.41Å; N299-N331 WeakPolarHBondContact O-CB 3.47Å; N299-N331 PolarHBondContact O-N 3.17Å; G300-N331 WeakPolarHBondContact CA-OD1 3.33Å; N331-T333 PolarHBondContact O-N 3.37Å
332	Q	93.2	Very high	96.4	Very high	31 Å²	31	33.9 Å²	33.9	15%	0.145	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	10.2	169.8	-65.1	177.6	-16.6	0	0	112.6	E256 T258 Y260 N330 L334 K342	E256-Q332 VanDerWaalsContact O-CG 3.31Å; E256-Q332 WeakPolarHBondContact O-CG 3.41Å; E256-Q332 PolarHBondContact O-NE2 3.28Å; T258-Q332 PolarHBondContact O-NE2 2.9Å; Y260-Q332 VanDerWaalsContact OH-CD 3.3Å; Y260-Q332 PolarHBondContact OH-OE1 2.81Å; Y260-Q332 VanDerWaalsContact OH-OE1 3.08Å; N330-Q332 PolarHBondContact O-N 2.99Å; N330-Q332 WeakPolarHBondContact OD1-CA 3.47Å; N330-Q332 WeakPolarHBondContact OD1-CB 3.3Å; N330-Q332 PolarHBondContact OD1-N 3.02Å; Q332-L334 HydrophobicContact CB-CD1 3.86Å; Q332-L334 HydrophobicContact CB-CG 3.98Å; Q332-L334 PolarHBondContact O-N 2.63Å; Q332-L334 VanDerWaalsContact OE1-CD1 3.3Å; Q332-K342 VanDerWaalsContact CD-NZ 3.32Å; Q332-K342 VanDerWaalsContact NE2-NZ 3.19Å
333	T	93.7	Very high	96.3	Very high	69 Å²	69	34.2 Å²	34.2	42%	0.423	18%	0.176	S	C	.	.	S	Bend	trans	64.5	15.2	-177	65	0	0	0	0	115.2	K329 N330 N331 I389	K329-T333 WeakPolarHBondContact CD-O 3.37Å; N330-T333 WeakPolarHBondContact O-CA 3.22Å; N330-T333 PolarHBondContact O-N 3.47Å; N330-T333 PolarHBondContact OD1-N 3.12Å; N331-T333 PolarHBondContact O-N 3.37Å; T333-I389 WeakPolarHBondContact O-CD1 3.25Å; T333-I389 WeakPolarHBondContact OG1-CD1 3.37Å
334	L	95.9	Very high	96.3	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.016	16%	0.161	C	C	.	.			trans	-89.1	137.2	-178.3	-55.1	168	0	0	0	110.8	H305 K329 N330 Q332 T338 L339 K342 I389 L394	H305-L334 PolarHBondContact NE2-O 3.38Å; K329-L334 CarbonylContact C-O 3.57Å; K329-L334 VanDerWaalsContact CA-O 3.3Å; K329-L334 WeakPolarHBondContact CA-O 3.49Å; N330-L334 PolarHBondContact N-O 3.2Å; N330-L334 WeakPolarHBondContact OD1-CB 3.43Å; N330-L334 PolarHBondContact OD1-N 3.34Å; N330-L334 PolarHBondContact OD1-O 3.41Å; Q332-L334 HydrophobicContact CB-CD1 3.86Å; Q332-L334 HydrophobicContact CB-CG 3.98Å; Q332-L334 PolarHBondContact O-N 2.63Å; Q332-L334 VanDerWaalsContact OE1-CD1 3.3Å; L334-T338 VanDerWaalsContact CA-OG1 3.28Å; L334-T338 WeakPolarHBondContact CA-OG1 3.44Å; L334-T338 WeakPolarHBondContact CB-OG1 3.28Å; L334-L339 HydrophobicContact CB-CB 4.28Å; L334-L339 HydrophobicContact CD1-CD1 3.9Å; L334-K342 HydrophobicContact CD1-CB 4.39Å; L334-K342 HydrophobicContact CD1-CD 3.39Å; L334-K342 HydrophobicContact CD1-CG 4.49Å; L334-I389 HydrophobicContact CD2-CB 4.4Å; L334-L394 HydrophobicContact CD2-CD1 3.75Å
335	T	96.2	Very high	96.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.012	17%	0.165	C	C	.	.			trans	-81.4	166.7	159.6	67.2	0	0	0	0	110.4	K329 L337 T338 L339	K329-T335 HydrophobicContact CG-CG2 3.99Å; T335-L337 PolarHBondContact O-N 3.4Å; T335-T338 PolarHBondContact N-OG1 2.83Å; T335-T338 PolarHBondContact O-N 3.02Å; T335-T338 VanDerWaalsContact O-N 3.17Å; T335-T338 PolarHBondContact O-OG1 2.9Å; T335-T338 PolarHBondContact OG1-N 2.8Å; T335-T338 PolarHBondContact OG1-OG1 3.26Å; T335-L339 VanDerWaalsContact O-CB 3.28Å; T335-L339 WeakPolarHBondContact O-CB 3.38Å; T335-L339 PolarHBondContact O-N 2.95Å
336	P	97.9	Very high	96.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-51.5	-38.8	172.3	-27.1	36.6	0	0	0	113.6	L304 H305 V308 F316 L326 L339 A340	L304-P336 HydrophobicContact CB-CB 4.46Å; L304-P336 HydrophobicContact CB-CG 3.89Å; H305-P336 WeakPolarHBondContact NE2-CD 3.4Å; V308-P336 HydrophobicContact CG2-CB 4.03Å; F316-P336 HydrophobicContact CE2-CB 4.28Å; L326-P336 WeakPolarHBondContact O-CD 3.24Å; P336-L339 PolarHBondContact O-N 3.44Å; P336-A340 PolarHBondContact O-N 2.89Å
337	L	97	Very high	96.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-53.6	176.3	-178.1	67.7	0	0	0	111.6	T335 L339 A340 A341 F349 V352 L353 E356 N375 I376	T335-L337 PolarHBondContact O-N 3.4Å; L337-L339 VanDerWaalsContact C-N 3.27Å; L337-L339 PolarHBondContact O-N 3.33Å; L337-A340 WeakPolarHBondContact O-CB 3.25Å; L337-A340 PolarHBondContact O-N 2.55Å; L337-A341 PolarHBondContact O-N 3.43Å; L337-A341 VanDerWaalsContact O-N 3.09Å; L337-F349 HydrophobicContact CD1-CD2 3.76Å; L337-F349 HydrophobicContact CD1-CE2 3.68Å; L337-F349 HydrophobicContact CD1-CG 4.49Å; L337-F349 HydrophobicContact CD1-CZ 4.36Å; L337-F349 HydrophobicContact CG-CD2 4.42Å; L337-F349 HydrophobicContact CG-CE2 4.08Å; L337-V352 HydrophobicContact CB-CG1 3.76Å; L337-V352 HydrophobicContact CD1-CB 4.02Å; L337-V352 HydrophobicContact CD1-CG1 4.01Å; L337-V352 HydrophobicContact CG-CG1 4.48Å; L337-L353 HydrophobicContact CD1-CB 4.14Å; L337-E356 WeakPolarHBondContact CD2-OE2 3.28Å; L337-N375 HydrophobicContact CD2-CB 4.46Å; L337-I376 HydrophobicContact CD2-CG1 4.16Å
338	T	96.2	Very high	96.2	Very high	3 Å²	3	30 Å²	30	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-68.7	-26.7	180	56.6	0	0	0	0	112.4	L334 T335 A341 K342 N375 I389 L394	L334-T338 VanDerWaalsContact CA-OG1 3.28Å; L334-T338 WeakPolarHBondContact CA-OG1 3.44Å; L334-T338 WeakPolarHBondContact CB-OG1 3.28Å; T335-T338 PolarHBondContact N-OG1 2.83Å; T335-T338 PolarHBondContact O-N 3.02Å; T335-T338 VanDerWaalsContact O-N 3.17Å; T335-T338 PolarHBondContact O-OG1 2.9Å; T335-T338 PolarHBondContact OG1-N 2.8Å; T335-T338 PolarHBondContact OG1-OG1 3.26Å; T338-A341 WeakPolarHBondContact O-CB 3.5Å; T338-A341 PolarHBondContact O-N 3.33Å; T338-K342 WeakPolarHBondContact O-CB 3.39Å; T338-K342 PolarHBondContact O-N 3.29Å; T338-N375 HydrophobicContact CG2-CB 4.33Å; T338-I389 WeakPolarHBondContact CG2-O 3.49Å; T338-L394 WeakPolarHBondContact O-CD1 3.46Å
339	L	97.4	Very high	96.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.5	-41.7	171.8	179.9	62.3	0	0	0	111	Y260 H305 V308 I309 L334 T335 P336 L337 A341 K342 L343	Y260-L339 HydrophobicContact CD2-CD1 3.92Å; Y260-L339 HydrophobicContact CE2-CD1 3.53Å; H305-L339 HydrophobicContact CB-CD2 3.78Å; V308-L339 HydrophobicContact CG1-CD2 4.5Å; V308-L339 HydrophobicContact CG1-CG 4.26Å; I309-L339 HydrophobicContact CD1-CD2 4.05Å; I309-L339 HydrophobicContact CG1-CD2 3.94Å; L334-L339 HydrophobicContact CB-CB 4.28Å; L334-L339 HydrophobicContact CD1-CD1 3.9Å; T335-L339 VanDerWaalsContact O-CB 3.28Å; T335-L339 WeakPolarHBondContact O-CB 3.38Å; T335-L339 PolarHBondContact O-N 2.95Å; P336-L339 PolarHBondContact O-N 3.44Å; L337-L339 VanDerWaalsContact C-N 3.27Å; L337-L339 PolarHBondContact O-N 3.33Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 2.74Å; L339-K342 PolarHBondContact O-N 2.85Å; L339-L343 HydrophobicContact CD1-CD1 3.87Å; L339-L343 HydrophobicContact CD1-CG 4.01Å; L339-L343 HydrophobicContact CG-CD1 4.02Å; L339-L343 HydrophobicContact CG-CG 4.45Å; L339-L343 WeakPolarHBondContact O-CB 3.37Å; L339-L343 WeakPolarHBondContact O-CG 3.48Å; L339-L343 PolarHBondContact O-N 2.93Å
340	A	97.4	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-40.4	174.5	0	0	0	0	0	111.2	V308 P336 L337 L343 G344 K345 M348 F349	V308-A340 HydrophobicContact CG1-CB 3.58Å; P336-A340 PolarHBondContact O-N 2.89Å; L337-A340 WeakPolarHBondContact O-CB 3.25Å; L337-A340 PolarHBondContact O-N 2.55Å; A340-L343 PolarHBondContact O-N 3.21Å; A340-G344 PolarHBondContact O-N 3.35Å; A340-K345 PolarHBondContact O-N 2.91Å; A340-M348 HydrophobicContact CB-CB 4.31Å; A340-F349 HydrophobicContact CB-CB 3.88Å; A340-F349 HydrophobicContact CB-CD2 4.34Å
341	A	96.8	Very high	96.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-49	172.9	0	0	0	0	0	112.3	L337 T338 L339 L343 G344 F349 A391 L394 I395 H403	L337-A341 PolarHBondContact O-N 3.43Å; L337-A341 VanDerWaalsContact O-N 3.09Å; T338-A341 WeakPolarHBondContact O-CB 3.5Å; T338-A341 PolarHBondContact O-N 3.33Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 2.74Å; A341-L343 VanDerWaalsContact C-N 3.3Å; A341-L343 PolarHBondContact O-N 3.25Å; A341-G344 PolarHBondContact O-N 3Å; A341-F349 HydrophobicContact CB-CD2 4.01Å; A341-F349 HydrophobicContact CB-CE2 3.98Å; A341-A391 HydrophobicContact CB-CB 4.09Å; A341-L394 HydrophobicContact CB-CB 4.2Å; A341-I395 HydrophobicContact CB-CD1 4.03Å; A341-I395 HydrophobicContact CB-CG1 3.86Å; A341-H403 PolarHBondContact O-CD2 2.91Å; A341-H403 VanDerWaalsContact O-CD2 3.24Å; A341-H403 PolarHBondContact O-NE2 3.12Å
342	K	95.9	Very high	96.3	Very high	56 Å²	56	25.3 Å²	25.3	24%	0.243	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-34.8	178.2	179.5	-177	173.4	-136.7	0	113.5	T258 Q332 L334 T338 L339 G344 L394 H403	T258-K342 PolarHBondContact O-NZ 2.85Å; Q332-K342 VanDerWaalsContact CD-NZ 3.32Å; Q332-K342 VanDerWaalsContact NE2-NZ 3.19Å; L334-K342 HydrophobicContact CD1-CB 4.39Å; L334-K342 HydrophobicContact CD1-CD 3.39Å; L334-K342 HydrophobicContact CD1-CG 4.49Å; T338-K342 WeakPolarHBondContact O-CB 3.39Å; T338-K342 PolarHBondContact O-N 3.29Å; L339-K342 PolarHBondContact O-N 2.85Å; K342-G344 VanDerWaalsContact C-N 3.34Å; K342-L394 HydrophobicContact CB-CD1 4.26Å; K342-L394 HydrophobicContact CB-CD2 4.24Å; K342-L394 HydrophobicContact CG-CD2 4.45Å; K342-H403 PolarHBondContact O-CE1 3.15Å; K342-H403 PolarHBondContact O-NE2 3.43Å
343	L	96.1	Very high	96.3	Very high	36 Å²	36	24.1 Å²	24.1	19%	0.188	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.3	-177.6	-65.3	-179.8	0	0	0	112.9	Y260 I309 L339 A340 A341 K345	Y260-L343 HydrophobicContact CD2-CD1 4.43Å; Y260-L343 HydrophobicContact CD2-CD2 4.33Å; I309-L343 HydrophobicContact CG1-CD1 3.91Å; L339-L343 HydrophobicContact CD1-CD1 3.87Å; L339-L343 HydrophobicContact CD1-CG 4.01Å; L339-L343 HydrophobicContact CG-CD1 4.02Å; L339-L343 HydrophobicContact CG-CG 4.45Å; L339-L343 WeakPolarHBondContact O-CB 3.37Å; L339-L343 WeakPolarHBondContact O-CG 3.48Å; L339-L343 PolarHBondContact O-N 2.93Å; A340-L343 PolarHBondContact O-N 3.21Å; A341-L343 VanDerWaalsContact C-N 3.3Å; A341-L343 PolarHBondContact O-N 3.25Å; L343-K345 VanDerWaalsContact C-N 3.25Å; L343-K345 HydrophobicContact CB-CD 3.99Å; L343-K345 HydrophobicContact CB-CG 3.83Å; L343-K345 HydrophobicContact CD1-CD 4.24Å; L343-K345 PolarHBondContact O-N 3.33Å
344	G	96.3	Very high	96.3	Very high	6 Å²	6	24.4 Å²	24.4	6%	0.062	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	17.2	-176.8	0	0	0	0	0	114.3	A340 A341 K342 K346 D402	A340-G344 PolarHBondContact O-N 3.35Å; A341-G344 PolarHBondContact O-N 3Å; K342-G344 VanDerWaalsContact C-N 3.34Å; G344-K346 PolarHBondContact O-N 3.34Å; G344-D402 WeakPolarHBondContact O-CB 3.43Å
345	K	96.1	Very high	96.2	Very high	33 Å²	33	27.5 Å²	27.5	14%	0.143	13%	0.133	C	C	.	.			trans	-86.4	77.3	-169.3	-66.8	-172.8	169.7	-122	0	112.3	V308 I309 E311 A340 L343 Q347 M348 F349	V308-K345 HydrophobicContact CG1-CD 4.45Å; V308-K345 WeakPolarHBondContact O-CD 3.4Å; I309-K345 PolarHBondContact O-NZ 2.71Å; E311-K345 HydrophobicContact CG-CD 3.74Å; E311-K345 HydrophobicContact CG-CG 4.33Å; E311-K345 IonicContact OE2-NZ 2.67Å; E311-K345 PolarHBondContact OE2-NZ 3.1Å; A340-K345 PolarHBondContact O-N 2.91Å; L343-K345 VanDerWaalsContact C-N 3.25Å; L343-K345 HydrophobicContact CB-CD 3.99Å; L343-K345 HydrophobicContact CB-CG 3.83Å; L343-K345 HydrophobicContact CD1-CD 4.24Å; L343-K345 PolarHBondContact O-N 3.33Å; K345-Q347 VanDerWaalsContact C-N 3.34Å; K345-Q347 PolarHBondContact O-N 2.63Å; K345-M348 HydrophobicContact CB-CB 4.28Å; K345-M348 PolarHBondContact O-N 3.23Å; K345-F349 WeakPolarHBondContact O-CB 2.88Å; K345-F349 PolarHBondContact O-N 3.29Å
346	K	96.1	Very high	96	Very high	65 Å²	65	28.4 Å²	28.4	28%	0.283	14%	0.137	S	C	.	.	H	α-helix	trans	-49.9	-46.3	-175.3	-174.8	171.5	-174.8	164.1	0	114.4	G344 F349 N350 Q405 L406 D408	G344-K346 PolarHBondContact O-N 3.34Å; K346-F349 PolarHBondContact O-N 2.85Å; K346-N350 WeakPolarHBondContact O-CB 3.46Å; K346-N350 PolarHBondContact O-N 3.45Å; K346-N350 PolarHBondContact O-ND2 3.44Å; K346-Q405 HydrophobicContact CD-CB 4.02Å; K346-Q405 WeakPolarHBondContact CD-O 3.34Å; K346-Q405 WeakPolarHBondContact CE-O 3.4Å; K346-Q405 PolarHBondContact NZ-O 2.68Å; K346-L406 HydrophobicContact CB-CD2 4.04Å; K346-L406 HydrophobicContact CB-CG 4.22Å; K346-L406 HydrophobicContact CG-CD2 4.24Å; K346-D408 IonicContact NZ-OD2 2.67Å; K346-D408 PolarHBondContact NZ-OD2 2.8Å
347	Q	96.6	Very high	95.7	Very high	117 Å²	117	32.1 Å²	32.1	55%	0.547	15%	0.153	S	C	.	.	H	α-helix	trans	-60.9	-52.1	-179.8	-176.1	179.2	11.6	0	0	111.1	K345 N350 H351	K345-Q347 VanDerWaalsContact C-N 3.34Å; K345-Q347 PolarHBondContact O-N 2.63Å; Q347-N350 PolarHBondContact O-N 3.41Å; Q347-H351 VanDerWaalsContact O-CB 3.32Å; Q347-H351 WeakPolarHBondContact O-CB 3.37Å; Q347-H351 PolarHBondContact O-N 3.2Å
348	M	97.8	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-37.8	179.7	-71.2	-56.2	-57.2	0	0	112.3	V308 E311 P313 F316 A340 K345 N350 H351 V352	V308-M348 HydrophobicContact CG1-CB 4.3Å; V308-M348 HydrophobicContact CG2-CB 4.42Å; V308-M348 HydrophobicContact CG2-CE 3.97Å; E311-M348 HydrophobicContact CB-CG 4.17Å; E311-M348 HydrophobicContact CG-CG 3.82Å; P313-M348 HydrophobicContact CB-SD 4Å; P313-M348 HydrophobicContact CG-SD 4.47Å; F316-M348 HydrophobicContact CB-CE 4.08Å; F316-M348 HydrophobicContact CD2-CE 3.58Å; F316-M348 HydrophobicContact CE2-CE 4.31Å; F316-M348 HydrophobicContact CG-CE 3.99Å; A340-M348 HydrophobicContact CB-CB 4.31Å; K345-M348 HydrophobicContact CB-CB 4.28Å; K345-M348 PolarHBondContact O-N 3.23Å; M348-N350 PolarHBondContact O-N 2.9Å; M348-H351 WeakPolarHBondContact O-CB 3.32Å; M348-H351 PolarHBondContact O-N 3.47Å; M348-V352 VanDerWaalsContact O-CG2 3.28Å; M348-V352 WeakPolarHBondContact O-CG2 3.18Å; M348-V352 PolarHBondContact O-N 3.18Å
349	F	97	Very high	95.3	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-57.3	-51.2	175.9	-179.9	-98.4	0	0	0	111.1	L337 A340 A341 K345 K346 H351 V352 L353 A391 I395 L406	L337-F349 HydrophobicContact CD1-CD2 3.76Å; L337-F349 HydrophobicContact CD1-CE2 3.68Å; L337-F349 HydrophobicContact CD1-CG 4.49Å; L337-F349 HydrophobicContact CD1-CZ 4.36Å; L337-F349 HydrophobicContact CG-CD2 4.42Å; L337-F349 HydrophobicContact CG-CE2 4.08Å; A340-F349 HydrophobicContact CB-CB 3.88Å; A340-F349 HydrophobicContact CB-CD2 4.34Å; A341-F349 HydrophobicContact CB-CD2 4.01Å; A341-F349 HydrophobicContact CB-CE2 3.98Å; K345-F349 WeakPolarHBondContact O-CB 2.88Å; K345-F349 PolarHBondContact O-N 3.29Å; K346-F349 PolarHBondContact O-N 2.85Å; F349-H351 VanDerWaalsContact C-N 3.29Å; F349-H351 PolarHBondContact O-N 3.19Å; F349-V352 PolarHBondContact O-N 3.39Å; F349-L353 HydrophobicContact CE1-CD2 4.26Å; F349-L353 WeakPolarHBondContact O-CB 3.13Å; F349-L353 PolarHBondContact O-N 2.83Å; F349-A391 HydrophobicContact CE2-CB 3.82Å; F349-A391 HydrophobicContact CZ-CB 4.14Å; F349-I395 HydrophobicContact CE1-CD1 4.4Å; F349-I395 HydrophobicContact CE2-CD1 4.14Å; F349-I395 HydrophobicContact CZ-CD1 3.97Å; F349-L406 HydrophobicContact CB-CD2 3.59Å; F349-L406 HydrophobicContact CD1-CD2 3.5Å; F349-L406 HydrophobicContact CD2-CD2 4.43Å; F349-L406 HydrophobicContact CE1-CD2 4.3Å; F349-L406 HydrophobicContact CG-CD2 3.57Å
350	N	95.3	Very high	95.1	Very high	68 Å²	68	45 Å²	45	36%	0.364	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-36	177	-70.9	-23.7	0	0	0	112.2	K346 Q347 M348 N354	K346-N350 WeakPolarHBondContact O-CB 3.46Å; K346-N350 PolarHBondContact O-N 3.45Å; K346-N350 PolarHBondContact O-ND2 3.44Å; Q347-N350 PolarHBondContact O-N 3.41Å; M348-N350 PolarHBondContact O-N 2.9Å; N350-N354 PolarHBondContact O-N 2.78Å; N350-N354 PolarHBondContact O-ND2 2.74Å; N350-N354 VanDerWaalsContact O-ND2 3.1Å
351	H	96.9	Very high	94.9	Very high	39 Å²	39	50.9 Å²	50.9	18%	0.181	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-49.9	177.9	-162.7	70.1	0	0	0	112	P313 D317 Q347 M348 F349 L353 N354 F355	P313-H351 PolarHBondContact O-NE2 2.95Å; D317-H351 IonicContact OD1-CD2 2.69Å; D317-H351 IonicContact OD1-CE1 3.09Å; D317-H351 PolarHBondContact OD1-CE1 2.84Å; D317-H351 IonicContact OD1-NE2 2.69Å; D317-H351 PolarHBondContact OD1-NE2 3.09Å; D317-H351 IonicContact OD2-CE1 3.09Å; D317-H351 IonicContact OD2-NE2 3.18Å; Q347-H351 VanDerWaalsContact O-CB 3.32Å; Q347-H351 WeakPolarHBondContact O-CB 3.37Å; Q347-H351 PolarHBondContact O-N 3.2Å; M348-H351 WeakPolarHBondContact O-CB 3.32Å; M348-H351 PolarHBondContact O-N 3.47Å; F349-H351 VanDerWaalsContact C-N 3.29Å; F349-H351 PolarHBondContact O-N 3.19Å; H351-L353 VanDerWaalsContact C-N 3.33Å; H351-L353 PolarHBondContact O-N 3.27Å; H351-N354 WeakPolarHBondContact O-CB 3.42Å; H351-N354 PolarHBondContact O-N 3.48Å; H351-F355 AromaticContact NE2-CE2 3.79Å; H351-F355 WeakPolarHBondContact O-CD2 3.17Å
352	V	96.7	Very high	94.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-40.4	176	-177.7	0	0	0	0	110.9	V308 F316 L326 L337 M348 F349 N354 F355 E356	V308-V352 HydrophobicContact CG2-CG2 4.16Å; F316-V352 HydrophobicContact CD2-CG2 4.45Å; F316-V352 HydrophobicContact CE1-CG2 4.2Å; F316-V352 HydrophobicContact CE2-CG2 3.67Å; F316-V352 HydrophobicContact CZ-CB 4.42Å; F316-V352 HydrophobicContact CZ-CG1 4.28Å; F316-V352 HydrophobicContact CZ-CG2 3.54Å; L326-V352 HydrophobicContact CD2-CG1 4.42Å; L337-V352 HydrophobicContact CB-CG1 3.76Å; L337-V352 HydrophobicContact CD1-CB 4.02Å; L337-V352 HydrophobicContact CD1-CG1 4.01Å; L337-V352 HydrophobicContact CG-CG1 4.48Å; M348-V352 VanDerWaalsContact O-CG2 3.28Å; M348-V352 WeakPolarHBondContact O-CG2 3.18Å; M348-V352 PolarHBondContact O-N 3.18Å; F349-V352 PolarHBondContact O-N 3.39Å; V352-N354 PolarHBondContact O-N 3.46Å; V352-F355 WeakPolarHBondContact O-CB 3.09Å; V352-F355 PolarHBondContact O-N 2.64Å; V352-E356 PolarHBondContact O-N 2.96Å
353	L	93.8	Very high	94.7	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-33.8	176.8	-174.5	68.7	0	0	0	111.9	L337 F349 H351 F355 E356 K357 Y371 I376 L410	L337-L353 HydrophobicContact CD1-CB 4.14Å; F349-L353 HydrophobicContact CE1-CD2 4.26Å; F349-L353 WeakPolarHBondContact O-CB 3.13Å; F349-L353 PolarHBondContact O-N 2.83Å; H351-L353 VanDerWaalsContact C-N 3.33Å; H351-L353 PolarHBondContact O-N 3.27Å; L353-F355 PolarHBondContact O-N 3.32Å; L353-E356 PolarHBondContact O-N 3.34Å; L353-K357 PolarHBondContact O-N 3.44Å; L353-Y371 HydrophobicContact CD1-CD1 3.53Å; L353-Y371 HydrophobicContact CD1-CE1 3.92Å; L353-Y371 HydrophobicContact CD1-CG 4.32Å; L353-Y371 HydrophobicContact CD2-CD1 4.38Å; L353-Y371 HydrophobicContact CD2-CE1 4.01Å; L353-Y371 HydrophobicContact CG-CD1 3.74Å; L353-Y371 HydrophobicContact CG-CE1 3.55Å; L353-I376 HydrophobicContact CD1-CD1 3.62Å; L353-L410 HydrophobicContact CD1-CD2 3.81Å; L353-L410 HydrophobicContact CD2-CB 4.42Å; L353-L410 HydrophobicContact CD2-CD2 3.65Å; L353-L410 HydrophobicContact CG-CD2 4.3Å
354	N	93.8	Very high	94.6	Very high	75 Å²	75	63.8 Å²	63.8	40%	0.401	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-24.1	174.5	-80.9	-44.6	0	0	0	113.8	N350 H351 V352 K357	N350-N354 PolarHBondContact O-N 2.78Å; N350-N354 PolarHBondContact O-ND2 2.74Å; N350-N354 VanDerWaalsContact O-ND2 3.1Å; H351-N354 WeakPolarHBondContact O-CB 3.42Å; H351-N354 PolarHBondContact O-N 3.48Å; V352-N354 PolarHBondContact O-N 3.46Å; N354-K357 WeakPolarHBondContact O-CE 3.36Å; N354-K357 WeakPolarHBondContact O-CG 3.39Å; N354-K357 PolarHBondContact OD1-NZ 3Å
355	F	93.9	Very high	94.5	Very high	68 Å²	68	69.4 Å²	69.4	30%	0.298	36%	0.363	S	S	.	.	H	α-helix	trans	-80.2	-31.8	173.2	-78.5	-81.2	0	0	0	112.9	F316 D317 H320 L326 H351 V352 L353 K357	F316-F355 HydrophobicContact CD1-CD2 4.3Å; F316-F355 AromaticContact CD1-CE2 3.87Å; F316-F355 HydrophobicContact CD1-CE2 3.87Å; F316-F355 AromaticContact CE1-CD2 3.92Å; F316-F355 HydrophobicContact CE1-CD2 3.92Å; F316-F355 AromaticContact CE1-CE2 3.94Å; F316-F355 HydrophobicContact CE1-CE2 3.94Å; D317-F355 HydrophobicContact CB-CZ 4.34Å; D317-F355 WeakPolarHBondContact OD1-CE2 3.39Å; D317-F355 WeakPolarHBondContact OD1-CZ 3.09Å; H320-F355 AromaticContact CE1-CD1 3.86Å; H320-F355 AromaticContact ND1-CD1 3.91Å; H320-F355 AromaticContact ND1-CE1 3.67Å; L326-F355 HydrophobicContact CD1-CB 3.76Å; H351-F355 AromaticContact NE2-CE2 3.79Å; H351-F355 WeakPolarHBondContact O-CD2 3.17Å; V352-F355 WeakPolarHBondContact O-CB 3.09Å; V352-F355 PolarHBondContact O-N 2.64Å; L353-F355 PolarHBondContact O-N 3.32Å; F355-K357 VanDerWaalsContact C-N 3.31Å
356	E	90.6	Very high	94.2	Very high	20 Å²	20	71.5 Å²	71.5	9%	0.093	38%	0.378	C	S	.	.	H	α-helix	trans	-82.7	-8.5	179.4	-64.6	-163.4	174.2	0	0	113.3	L326 H327 L337 V352 L353 P372	L326-E356 HydrophobicContact CD1-CG 4.39Å; H327-E356 IonicContact CE1-OE1 3.91Å; H327-E356 PolarHBondContact CE1-OE1 3.31Å; H327-E356 IonicContact ND1-OE1 2.65Å; H327-E356 PolarHBondContact ND1-OE1 3.09Å; L337-E356 WeakPolarHBondContact CD2-OE2 3.28Å; V352-E356 PolarHBondContact O-N 2.96Å; L353-E356 PolarHBondContact O-N 3.34Å; E356-P372 HydrophobicContact CB-CG 4.19Å; E356-P372 WeakPolarHBondContact O-CD 3.43Å
357	K	91.4	Very high	94	Very high	78 Å²	78	71.9 Å²	71.9	34%	0.339	39%	0.386	S	S	.	.			trans	-75.7	142.1	-176	88.2	-173.5	161.4	-174.2	0	112.5	L353 N354 F355 V369 Y371	L353-K357 PolarHBondContact O-N 3.44Å; N354-K357 WeakPolarHBondContact O-CE 3.36Å; N354-K357 WeakPolarHBondContact O-CG 3.39Å; N354-K357 PolarHBondContact OD1-NZ 3Å; F355-K357 VanDerWaalsContact C-N 3.31Å; K357-V369 HydrophobicContact CB-CG1 3.54Å; K357-V369 HydrophobicContact CD-CG1 3.84Å; K357-V369 HydrophobicContact CG-CG1 3.82Å; K357-Y371 HydrophobicContact CB-CD1 3.71Å; K357-Y371 HydrophobicContact CB-CE1 3.34Å; K357-Y371 HydrophobicContact CD-CE1 4.47Å
358	E	92.9	Very high	93.8	Very high	125 Å²	125	73.2 Å²	73.2	58%	0.584	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.9	170.8	-172.6	179.5	176.6	0	0	109.5	L360 V369 A370	E358-L360 HydrophobicContact CG-CD2 4.16Å; E358-L360 PolarHBondContact O-N 3.33Å; E358-V369 CarbonylContact O-C 3.58Å; E358-V369 WeakPolarHBondContact O-CA 3.13Å; E358-A370 PolarHBondContact N-O 2.91Å; E358-A370 PolarHBondContact O-N 3.24Å
359	V	92.8	Very high	93.5	Very high	76 Å²	76	75.1 Å²	75.1	46%	0.461	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	107.8	174.4	179.4	0	0	0	0	108.3	T362 T367 V369	V359-T362 HydrophobicContact CG1-CG2 3.74Å; V359-T367 HydrophobicContact CG1-CG2 3.75Å; V359-T367 HydrophobicContact CG2-CG2 4.38Å; V359-V369 HydrophobicContact CG2-CG2 4.49Å
360	L	93.6	Very high	93.3	Very high	74 Å²	74	76.5 Å²	76.5	39%	0.387	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-43.6	-176.2	-67.5	-179.1	0	0	0	112	E358 W368 A370	E358-L360 HydrophobicContact CG-CD2 4.16Å; E358-L360 PolarHBondContact O-N 3.33Å; L360-W368 HydrophobicContact CB-CE3 3.63Å; L360-W368 HydrophobicContact CB-CZ3 4.17Å; L360-W368 HydrophobicContact CD1-CD2 4.1Å; L360-W368 HydrophobicContact CD1-CE3 3.3Å; L360-W368 HydrophobicContact CD1-CH2 3.87Å; L360-W368 HydrophobicContact CD1-CZ3 3.2Å; L360-W368 HydrophobicContact CG-CE3 4.09Å; L360-W368 HydrophobicContact CG-CZ3 4.32Å; L360-W368 PolarHBondContact N-O 3.42Å; L360-A370 HydrophobicContact CD1-CB 3.73Å; L360-A370 HydrophobicContact CD2-CB 4.4Å; L360-A370 HydrophobicContact CG-CB 4.01Å
361	W	93.5	Very high	93	Very high	123 Å²	123	76.5 Å²	76.5	47%	0.466	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	158	172.3	54.1	-97.8	0	0	0	111.5	V366 W368	W361-V366 HydrophobicContact CH2-CG1 4.01Å; W361-V366 HydrophobicContact CZ3-CB 4.45Å; W361-V366 HydrophobicContact CZ3-CG1 3.9Å; W361-W368 AromaticContact CD1-CE3 3.52Å; W361-W368 HydrophobicContact CD2-CB 3.69Å; W361-W368 AromaticContact CE2-CE3 3.96Å; W361-W368 AromaticContact CE2-CG 3.8Å; W361-W368 HydrophobicContact CE3-CB 4.2Å; W361-W368 HydrophobicContact CG-CB 4.19Å; W361-W368 HydrophobicContact CH2-CB 3.99Å; W361-W368 HydrophobicContact CZ2-CB 3.47Å; W361-W368 VanDerWaalsContact CZ2-CB 3.47Å; W361-W368 HydrophobicContact CZ2-CD2 4.25Å; W361-W368 AromaticContact CZ2-CG 3.8Å; W361-W368 HydrophobicContact CZ2-CG 3.8Å; W361-W368 HydrophobicContact CZ3-CB 4.33Å; W361-W368 AromaticContact NE1-CD2 3.53Å; W361-W368 AromaticContact NE1-CE3 3.03Å; W361-W368 AromaticContact NE1-CG 3.79Å; W361-W368 AromaticContact NE1-CZ3 3.86Å; W361-W368 PolarHBondContact O-N 3.26Å
362	T	94.8	Very high	92.7	Very high	96 Å²	96	77.6 Å²	77.6	59%	0.589	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.5	174.3	54.8	0	0	0	0	109.8	V359 V366 T367	V359-T362 HydrophobicContact CG1-CG2 3.74Å; T362-V366 CarbonylContact C-O 3.6Å; T362-V366 WeakPolarHBondContact CA-O 3.47Å; T362-T367 HydrophobicContact CG2-CG2 3.96Å
363	Y	93.6	Very high	92.3	Very high	185 Å²	185	80.5 Å²	80.5	73%	0.725	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	98.9	175.6	-175.6	-99.6	0	0	0	109.6	S365 V366	Y363-S365 PolarHBondContact O-N 3.38Å; Y363-V366 PolarHBondContact N-O 3.2Å; Y363-V366 WeakPolarHBondContact O-CB 3.32Å; Y363-V366 PolarHBondContact O-N 3.45Å
364	G	93.8	Very high	91.9	Very high	81 Å²	81	84.4 Å²	84.4	84%	0.835	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	-119.2	-173	0	0	0	0	0	111.1
365	S	92.7	Very high	91.5	Very high	124 Å²	124	82 Å²	82	87%	0.867	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.5	176.2	53.8	0	0	0	0	114.2	Y363	Y363-S365 PolarHBondContact O-N 3.38Å
366	V	91.7	Very high	91.4	Very high	77 Å²	77	78.8 Å²	78.8	47%	0.467	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	124	-179.4	-176.3	0	0	0	0	109.2	W361 T362 Y363	W361-V366 HydrophobicContact CH2-CG1 4.01Å; W361-V366 HydrophobicContact CZ3-CB 4.45Å; W361-V366 HydrophobicContact CZ3-CG1 3.9Å; T362-V366 CarbonylContact C-O 3.6Å; T362-V366 WeakPolarHBondContact CA-O 3.47Å; Y363-V366 PolarHBondContact N-O 3.2Å; Y363-V366 WeakPolarHBondContact O-CB 3.32Å; Y363-V366 PolarHBondContact O-N 3.45Å
367	T	91.1	Very high	91.4	Very high	74 Å²	74	78.7 Å²	78.7	45%	0.454	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.9	174	-57.8	0	0	0	0	108.1	V359 T362 V369	V359-T367 HydrophobicContact CG1-CG2 3.75Å; V359-T367 HydrophobicContact CG2-CG2 4.38Å; T362-T367 HydrophobicContact CG2-CG2 3.96Å; T367-V369 HydrophobicContact CG2-CG2 3.53Å
368	W	91.8	Very high	91.4	Very high	145 Å²	145	76.5 Å²	76.5	55%	0.549	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.2	171.2	-162	54.7	0	0	0	109.8	L360 W361	L360-W368 HydrophobicContact CB-CE3 3.63Å; L360-W368 HydrophobicContact CB-CZ3 4.17Å; L360-W368 HydrophobicContact CD1-CD2 4.1Å; L360-W368 HydrophobicContact CD1-CE3 3.3Å; L360-W368 HydrophobicContact CD1-CH2 3.87Å; L360-W368 HydrophobicContact CD1-CZ3 3.2Å; L360-W368 HydrophobicContact CG-CE3 4.09Å; L360-W368 HydrophobicContact CG-CZ3 4.32Å; L360-W368 PolarHBondContact N-O 3.42Å; W361-W368 AromaticContact CD1-CE3 3.52Å; W361-W368 HydrophobicContact CD2-CB 3.69Å; W361-W368 AromaticContact CE2-CE3 3.96Å; W361-W368 AromaticContact CE2-CG 3.8Å; W361-W368 HydrophobicContact CE3-CB 4.2Å; W361-W368 HydrophobicContact CG-CB 4.19Å; W361-W368 HydrophobicContact CH2-CB 3.99Å; W361-W368 HydrophobicContact CZ2-CB 3.47Å; W361-W368 VanDerWaalsContact CZ2-CB 3.47Å; W361-W368 HydrophobicContact CZ2-CD2 4.25Å; W361-W368 AromaticContact CZ2-CG 3.8Å; W361-W368 HydrophobicContact CZ2-CG 3.8Å; W361-W368 HydrophobicContact CZ3-CB 4.33Å; W361-W368 AromaticContact NE1-CD2 3.53Å; W361-W368 AromaticContact NE1-CE3 3.03Å; W361-W368 AromaticContact NE1-CG 3.79Å; W361-W368 AromaticContact NE1-CZ3 3.86Å; W361-W368 PolarHBondContact O-N 3.26Å
369	V	91.3	Very high	91.1	Very high	39 Å²	39	74.2 Å²	74.2	24%	0.236	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.1	-169	-177.1	0	0	0	0	108.9	K357 E358 V359 T367 Y371	K357-V369 HydrophobicContact CB-CG1 3.54Å; K357-V369 HydrophobicContact CD-CG1 3.84Å; K357-V369 HydrophobicContact CG-CG1 3.82Å; E358-V369 CarbonylContact O-C 3.58Å; E358-V369 WeakPolarHBondContact O-CA 3.13Å; V359-V369 HydrophobicContact CG2-CG2 4.49Å; T367-V369 HydrophobicContact CG2-CG2 3.53Å; V369-Y371 HydrophobicContact CB-CE2 4.37Å; V369-Y371 HydrophobicContact CG1-CD2 4.41Å; V369-Y371 HydrophobicContact CG1-CE1 4.21Å; V369-Y371 HydrophobicContact CG1-CE2 3.84Å
370	A	92.4	Very high	90.7	Very high	32 Å²	32	73.3 Å²	73.3	26%	0.264	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	148	167.6	0	0	0	0	0	110.5	E358 L360	E358-A370 PolarHBondContact N-O 2.91Å; E358-A370 PolarHBondContact O-N 3.24Å; L360-A370 HydrophobicContact CD1-CB 3.73Å; L360-A370 HydrophobicContact CD2-CB 4.4Å; L360-A370 HydrophobicContact CG-CB 4.01Å
371	Y	91.1	Very high	90.2	Very high	69 Å²	69	76.3 Å²	76.3	27%	0.271	41%	0.411	S	S	.	.			trans	-121.9	132.7	173.7	-63.3	-83.9	0	0	0	108.7	L353 K357 V369 L373 L410	L353-Y371 HydrophobicContact CD1-CD1 3.53Å; L353-Y371 HydrophobicContact CD1-CE1 3.92Å; L353-Y371 HydrophobicContact CD1-CG 4.32Å; L353-Y371 HydrophobicContact CD2-CD1 4.38Å; L353-Y371 HydrophobicContact CD2-CE1 4.01Å; L353-Y371 HydrophobicContact CG-CD1 3.74Å; L353-Y371 HydrophobicContact CG-CE1 3.55Å; K357-Y371 HydrophobicContact CB-CD1 3.71Å; K357-Y371 HydrophobicContact CB-CE1 3.34Å; K357-Y371 HydrophobicContact CD-CE1 4.47Å; V369-Y371 HydrophobicContact CB-CE2 4.37Å; V369-Y371 HydrophobicContact CG1-CD2 4.41Å; V369-Y371 HydrophobicContact CG1-CE1 4.21Å; V369-Y371 HydrophobicContact CG1-CE2 3.84Å; Y371-L373 PolarHBondContact O-N 3.25Å; Y371-L410 HydrophobicContact CD1-CD2 4.28Å; Y371-L410 HydrophobicContact CD2-CD1 3.78Å; Y371-L410 HydrophobicContact CD2-CD2 3.95Å; Y371-L410 HydrophobicContact CE2-CD1 4.23Å; Y371-L410 HydrophobicContact CE2-CD2 4.41Å; Y371-L410 HydrophobicContact CG-CD1 4.43Å; Y371-L410 HydrophobicContact CG-CD2 3.87Å
372	P	89.7	Confident	89.8	Confident	62 Å²	62	78.7 Å²	78.7	40%	0.403	43%	0.428	S	S	.	.			trans	-64.3	130.6	173.1	27.1	-33.1	0	0	0	109.6	E356 I376	E356-P372 HydrophobicContact CB-CG 4.19Å; E356-P372 WeakPolarHBondContact O-CD 3.43Å; P372-I376 WeakPolarHBondContact O-CD1 3.38Å
373	L	88.4	Confident	89.4	Confident	61 Å²	61	77.4 Å²	77.4	32%	0.319	42%	0.42	S	S	.	.			trans	-82.1	-15.5	-175.8	-65.7	179.9	0	0	0	113.5	Y371 N375 I376 D377 L414	Y371-L373 PolarHBondContact O-N 3.25Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.43Å; L373-N375 VanDerWaalsContact O-N 3.09Å; L373-I376 PolarHBondContact O-N 2.92Å; L373-D377 HydrophobicContact CB-CB 4.07Å; L373-D377 PolarHBondContact O-N 3.39Å; L373-L414 HydrophobicContact CD2-CD1 4.28Å; L373-L414 HydrophobicContact CD2-CD2 4.37Å
374	L	84.7	Confident	89	Confident	88 Å²	88	71.1 Å²	71.1	46%	0.461	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-42	-169.7	-178.2	64	0	0	0	115.2	Q380	L374-Q380 HydrophobicContact CD1-CG 4.2Å
375	N	86.2	Confident	88.8	Confident	25 Å²	25	72.1 Å²	72.1	13%	0.134	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-5	179.8	-64.5	-42	0	0	0	113.3	L337 T338 L373 A391	L337-N375 HydrophobicContact CD2-CB 4.46Å; T338-N375 HydrophobicContact CG2-CB 4.33Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.43Å; L373-N375 VanDerWaalsContact O-N 3.09Å; N375-A391 PolarHBondContact O-N 2.95Å
376	I	91.7	Very high	88.5	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-48.8	-176.2	-57.7	179.9	0	0	0	109.7	L337 L353 P372 L373 A391 V392 L410 L414	L337-I376 HydrophobicContact CD2-CG1 4.16Å; L353-I376 HydrophobicContact CD1-CD1 3.62Å; P372-I376 WeakPolarHBondContact O-CD1 3.38Å; L373-I376 PolarHBondContact O-N 2.92Å; I376-A391 PolarHBondContact O-N 3.4Å; I376-V392 HydrophobicContact CG2-CG2 4.27Å; I376-V392 WeakPolarHBondContact O-CB 3.04Å; I376-V392 WeakPolarHBondContact O-CG2 2.71Å; I376-V392 PolarHBondContact O-N 3.17Å; I376-L410 HydrophobicContact CD1-CD2 3.86Å; I376-L414 HydrophobicContact CG2-CD2 3.87Å
377	D	91.4	Very high	88.2	Confident	17 Å²	17	70.7 Å²	70.7	9%	0.091	38%	0.377	C	S	.	.	S	Bend	trans	-83.6	152.9	-172.4	-161.3	10.2	0	0	0	113.2	L373 I379 S390 L414 K418	L373-D377 HydrophobicContact CB-CB 4.07Å; L373-D377 PolarHBondContact O-N 3.39Å; D377-I379 PolarHBondContact O-N 3.49Å; D377-S390 WeakPolarHBondContact O-CB 2.98Å; D377-L414 HydrophobicContact CB-CD2 4.39Å; D377-K418 VanDerWaalsContact CG-CE 3.48Å; D377-K418 WeakPolarHBondContact OD1-CE 3.43Å; D377-K418 IonicContact OD1-NZ 2.88Å; D377-K418 PolarHBondContact OD1-NZ 3.17Å; D377-K418 IonicContact OD2-NZ 3.85Å; D377-K418 PolarHBondContact OD2-NZ 2.96Å
378	T	90.3	Very high	87.7	Confident	33 Å²	33	71.7 Å²	71.7	20%	0.202	39%	0.385	C	S	.	.	S	Bend	trans	-75.1	-4.5	-179.8	59.3	0	0	0	0	114	L386 V387 S390 V392	T378-L386 CarbonylContact O-C 3.59Å; T378-L386 VanDerWaalsContact O-CA 3.32Å; T378-L386 WeakPolarHBondContact O-CA 3.41Å; T378-V387 PolarHBondContact O-N 2.95Å; T378-S390 WeakPolarHBondContact CA-OG 3.2Å; T378-V392 HydrophobicContact CG2-CB 4.04Å; T378-V392 HydrophobicContact CG2-CG1 3.89Å
379	I	86.3	Confident	87.5	Confident	76 Å²	76	66.9 Å²	66.9	39%	0.39	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-125.2	128.8	-178.8	-59.9	174.3	0	0	0	108.6	D377 N385	D377-I379 PolarHBondContact O-N 3.49Å; I379-N385 WeakPolarHBondContact CA-O 3.36Å
380	Q	85.1	Confident	87.6	Confident	57 Å²	57	65.1 Å²	65.1	27%	0.266	36%	0.359	S	S	.	.			trans	-77.3	126.9	172.5	-171.1	179.4	12.2	0	0	110	L374 E382 T383 G384 N385 V387	L374-Q380 HydrophobicContact CD1-CG 4.2Å; Q380-E382 PolarHBondContact O-N 3.48Å; Q380-T383 PolarHBondContact OE1-OG1 3.17Å; Q380-G384 VanDerWaalsContact O-CA 3.25Å; Q380-G384 WeakPolarHBondContact O-CA 3.42Å; Q380-G384 PolarHBondContact O-N 3.43Å; Q380-N385 PolarHBondContact N-O 3.37Å; Q380-V387 HydrophobicContact CB-CG2 3.76Å
381	E	82.2	Confident	87.6	Confident	138 Å²	138	63.6 Å²	63.6	65%	0.645	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-44	-174.4	-63.7	177.4	-171.9	0	0	113.2
382	E	84.7	Confident	87.7	Confident	172 Å²	172	60.5 Å²	60.5	80%	0.804	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-39.3	-174.2	-62.3	178.1	169.6	0	0	113.1	Q380	Q380-E382 PolarHBondContact O-N 3.48Å
383	T	87.6	Confident	87.9	Confident	70 Å²	70	58.4 Å²	58.4	43%	0.429	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-18	-171.8	65	0	0	0	0	112.9	Q380 N385	Q380-T383 PolarHBondContact OE1-OG1 3.17Å; T383-N385 WeakPolarHBondContact CB-ND2 3.38Å; T383-N385 PolarHBondContact O-N 3.02Å; T383-N385 WeakPolarHBondContact OG1-CB 3.17Å; T383-N385 PolarHBondContact OG1-N 2.99Å; T383-N385 PolarHBondContact OG1-ND2 3.5Å
384	G	84.9	Confident	88.2	Confident	52 Å²	52	57.1 Å²	57.1	54%	0.536	32%	0.315	S	S	.	.			trans	68	5.2	-169.8	0	0	0	0	0	114	Q380	Q380-G384 VanDerWaalsContact O-CA 3.25Å; Q380-G384 WeakPolarHBondContact O-CA 3.42Å; Q380-G384 PolarHBondContact O-N 3.43Å
385	N	88.8	Confident	88.8	Confident	103 Å²	103	53 Å²	53	55%	0.551	29%	0.293	S	S	*	.			trans	-76.5	150	-177.5	-69.9	-33.5	0	0	0	111.7	I379 Q380 T383	I379-N385 WeakPolarHBondContact CA-O 3.36Å; Q380-N385 PolarHBondContact N-O 3.37Å; T383-N385 WeakPolarHBondContact CB-ND2 3.38Å; T383-N385 PolarHBondContact O-N 3.02Å; T383-N385 WeakPolarHBondContact OG1-CB 3.17Å; T383-N385 PolarHBondContact OG1-N 2.99Å; T383-N385 PolarHBondContact OG1-ND2 3.5Å
386	L	87	Confident	89.1	Confident	140 Å²	140	55 Å²	55	73%	0.733	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-70.5	131.1	172.9	-103.2	145.2	0	0	0	110.9	T378 P388	T378-L386 CarbonylContact O-C 3.59Å; T378-L386 VanDerWaalsContact O-CA 3.32Å; T378-L386 WeakPolarHBondContact O-CA 3.41Å; L386-P388 WeakPolarHBondContact O-CD 3.23Å
387	V	84.9	Confident	89.2	Confident	30 Å²	30	62.7 Å²	62.7	18%	0.182	34%	0.34	C	S	.	.			trans	-108.1	98.1	177.9	-176.5	0	0	0	0	108.9	T378 Q380 I389 S390	T378-V387 PolarHBondContact O-N 2.95Å; Q380-V387 HydrophobicContact CB-CG2 3.76Å; V387-I389 HydrophobicContact CG1-CG1 3.95Å; V387-I389 PolarHBondContact O-N 2.86Å; V387-S390 WeakPolarHBondContact O-CB 3.38Å; V387-S390 PolarHBondContact O-N 3.1Å; V387-S390 PolarHBondContact O-OG 3.33Å
388	P	82.6	Confident	89.3	Confident	96 Å²	96	63 Å²	63	62%	0.623	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.4	-175.6	26.1	-33.9	0	0	0	113.4	L386 S393	L386-P388 WeakPolarHBondContact O-CD 3.23Å; P388-S393 WeakPolarHBondContact O-CB 3.33Å; P388-S393 PolarHBondContact O-OG 2.85Å
389	I	86.8	Confident	89.3	Confident	44 Å²	44	70.8 Å²	70.8	23%	0.226	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	18.9	-179.9	56.6	135.2	0	0	0	113.7	T333 L334 T338 V387 L394	T333-I389 WeakPolarHBondContact O-CD1 3.25Å; T333-I389 WeakPolarHBondContact OG1-CD1 3.37Å; L334-I389 HydrophobicContact CD2-CB 4.4Å; T338-I389 WeakPolarHBondContact CG2-O 3.49Å; V387-I389 HydrophobicContact CG1-CG1 3.95Å; V387-I389 PolarHBondContact O-N 2.86Å; I389-L394 WeakPolarHBondContact O-CD1 3.43Å
390	S	92.3	Very high	89.6	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.007	38%	0.382	C	S	.	.	S	Bend	trans	-70.3	155.1	173.8	52.4	0	0	0	0	111.6	D377 T378 V387 V392 S393 L394	D377-S390 WeakPolarHBondContact O-CB 2.98Å; T378-S390 WeakPolarHBondContact CA-OG 3.2Å; V387-S390 WeakPolarHBondContact O-CB 3.38Å; V387-S390 PolarHBondContact O-N 3.1Å; V387-S390 PolarHBondContact O-OG 3.33Å; S390-V392 VanDerWaalsContact C-N 3.32Å; S390-V392 PolarHBondContact O-N 3.25Å; S390-S393 PolarHBondContact O-N 3.01Å; S390-S393 VanDerWaalsContact OG-CB 3.23Å; S390-S393 WeakPolarHBondContact OG-CB 3.36Å; S390-S393 PolarHBondContact OG-N 2.92Å; S390-L394 WeakPolarHBondContact O-CG 3.16Å; S390-L394 PolarHBondContact O-N 3Å
391	A	93.1	Very high	90.1	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-56.3	-45.4	179	0	0	0	0	0	112.2	A341 F349 N375 I376 S393 L394 I395	A341-A391 HydrophobicContact CB-CB 4.09Å; F349-A391 HydrophobicContact CE2-CB 3.82Å; F349-A391 HydrophobicContact CZ-CB 4.14Å; N375-A391 PolarHBondContact O-N 2.95Å; I376-A391 PolarHBondContact O-N 3.4Å; A391-S393 VanDerWaalsContact C-N 3.35Å; A391-S393 PolarHBondContact O-N 3.45Å; A391-L394 PolarHBondContact O-N 3.05Å; A391-I395 HydrophobicContact CB-CD1 4.45Å; A391-I395 WeakPolarHBondContact O-CB 3.49Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.42Å; A391-I395 PolarHBondContact O-N 3.35Å
392	V	93.8	Very high	90.7	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.03	38%	0.384	C	S	.	.	H	α-helix	trans	-59.3	-45.3	177.9	170.2	0	0	0	0	111.4	I376 T378 S390 I395 V396 V411 L414 L415	I376-V392 HydrophobicContact CG2-CG2 4.27Å; I376-V392 WeakPolarHBondContact O-CB 3.04Å; I376-V392 WeakPolarHBondContact O-CG2 2.71Å; I376-V392 PolarHBondContact O-N 3.17Å; T378-V392 HydrophobicContact CG2-CB 4.04Å; T378-V392 HydrophobicContact CG2-CG1 3.89Å; S390-V392 VanDerWaalsContact C-N 3.32Å; S390-V392 PolarHBondContact O-N 3.25Å; V392-I395 PolarHBondContact O-N 2.76Å; V392-V396 HydrophobicContact CG1-CG2 4.18Å; V392-V396 WeakPolarHBondContact O-CB 3.45Å; V392-V396 VanDerWaalsContact O-CG2 3.25Å; V392-V396 WeakPolarHBondContact O-CG2 3.43Å; V392-V396 PolarHBondContact O-N 3.03Å; V392-V411 HydrophobicContact CG2-CG1 4.42Å; V392-L414 HydrophobicContact CG2-CD2 3.66Å; V392-L415 HydrophobicContact CG1-CD2 3.87Å
393	S	94.2	Very high	91.2	Very high	18 Å²	18	60.7 Å²	60.7	13%	0.126	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-48.8	178.9	-178.4	0	0	0	0	111.2	P388 S390 A391 I395 V396 F397	P388-S393 WeakPolarHBondContact O-CB 3.33Å; P388-S393 PolarHBondContact O-OG 2.85Å; S390-S393 PolarHBondContact O-N 3.01Å; S390-S393 VanDerWaalsContact OG-CB 3.23Å; S390-S393 WeakPolarHBondContact OG-CB 3.36Å; S390-S393 PolarHBondContact OG-N 2.92Å; A391-S393 VanDerWaalsContact C-N 3.35Å; A391-S393 PolarHBondContact O-N 3.45Å; S393-I395 VanDerWaalsContact C-N 3.3Å; S393-I395 PolarHBondContact O-N 3.12Å; S393-V396 PolarHBondContact O-N 3.21Å; S393-F397 WeakPolarHBondContact O-CB 3.33Å; S393-F397 VanDerWaalsContact O-CD2 3.25Å; S393-F397 WeakPolarHBondContact O-CD2 3.25Å; S393-F397 PolarHBondContact O-N 3.46Å
394	L	94.7	Very high	91.5	Very high	33 Å²	33	63.2 Å²	63.2	17%	0.173	36%	0.359	C	S	.	.	H	α-helix	trans	-63.3	-35.9	-179.5	-67.5	167.3	0	0	0	112.5	L334 T338 A341 K342 I389 S390 A391 G398	L334-L394 HydrophobicContact CD2-CD1 3.75Å; T338-L394 WeakPolarHBondContact O-CD1 3.46Å; A341-L394 HydrophobicContact CB-CB 4.2Å; K342-L394 HydrophobicContact CB-CD1 4.26Å; K342-L394 HydrophobicContact CB-CD2 4.24Å; K342-L394 HydrophobicContact CG-CD2 4.45Å; I389-L394 WeakPolarHBondContact O-CD1 3.43Å; S390-L394 WeakPolarHBondContact O-CG 3.16Å; S390-L394 PolarHBondContact O-N 3Å; A391-L394 PolarHBondContact O-N 3.05Å; L394-G398 WeakPolarHBondContact O-CA 3.34Å; L394-G398 PolarHBondContact O-N 3.45Å; L394-G398 VanDerWaalsContact O-N 3.17Å
395	I	95.8	Very high	91.9	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-73.6	-50.6	178.3	-68.8	164.9	0	0	0	111.1	A341 F349 A391 V392 S393 F397 G398 H403 L406 I407 V411	A341-I395 HydrophobicContact CB-CD1 4.03Å; A341-I395 HydrophobicContact CB-CG1 3.86Å; F349-I395 HydrophobicContact CE1-CD1 4.4Å; F349-I395 HydrophobicContact CE2-CD1 4.14Å; F349-I395 HydrophobicContact CZ-CD1 3.97Å; A391-I395 HydrophobicContact CB-CD1 4.45Å; A391-I395 WeakPolarHBondContact O-CB 3.49Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.42Å; A391-I395 PolarHBondContact O-N 3.35Å; V392-I395 PolarHBondContact O-N 2.76Å; S393-I395 VanDerWaalsContact C-N 3.3Å; S393-I395 PolarHBondContact O-N 3.12Å; I395-F397 PolarHBondContact O-N 3.17Å; I395-G398 PolarHBondContact O-N 3.35Å; I395-H403 WeakPolarHBondContact CG2-O 3.49Å; I395-L406 HydrophobicContact CD1-CB 4.05Å; I395-L406 HydrophobicContact CD1-CD1 4.38Å; I395-L406 HydrophobicContact CG1-CB 4.03Å; I395-L406 HydrophobicContact CG1-CD1 4.01Å; I395-L406 HydrophobicContact CG2-CB 3.76Å; I395-I407 HydrophobicContact CG2-CG1 3.79Å; I395-V411 HydrophobicContact CD1-CG2 3.8Å; I395-V411 HydrophobicContact CG2-CG1 4.41Å
396	V	93.8	Very high	92.2	Very high	66 Å²	66	60.8 Å²	60.8	40%	0.4	33%	0.33	S	S	.	.	H	α-helix	trans	-67.2	-37.3	-175.3	171.2	0	0	0	0	112	V392 S393 G398 L415	V392-V396 HydrophobicContact CG1-CG2 4.18Å; V392-V396 WeakPolarHBondContact O-CB 3.45Å; V392-V396 VanDerWaalsContact O-CG2 3.25Å; V392-V396 WeakPolarHBondContact O-CG2 3.43Å; V392-V396 PolarHBondContact O-N 3.03Å; S393-V396 PolarHBondContact O-N 3.21Å; V396-G398 VanDerWaalsContact C-N 3.33Å; V396-L415 HydrophobicContact CG2-CD1 3.99Å; V396-L415 HydrophobicContact CG2-CD2 4.37Å
397	F	93.4	Very high	92.5	Very high	163 Å²	163	56.4 Å²	56.4	72%	0.715	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	7.7	177.4	-61.9	-64.8	0	0	0	113.3	S393 I395	S393-F397 WeakPolarHBondContact O-CB 3.33Å; S393-F397 VanDerWaalsContact O-CD2 3.25Å; S393-F397 WeakPolarHBondContact O-CD2 3.25Å; S393-F397 PolarHBondContact O-N 3.46Å; I395-F397 PolarHBondContact O-N 3.17Å
398	G	93.1	Very high	92.7	Very high	25 Å²	25	59.4 Å²	59.4	26%	0.258	32%	0.322	S	S	.	.			trans	-67	142.7	173.6	0	0	0	0	0	111.8	L394 I395 V396	L394-G398 WeakPolarHBondContact O-CA 3.34Å; L394-G398 PolarHBondContact O-N 3.45Å; L394-G398 VanDerWaalsContact O-N 3.17Å; I395-G398 PolarHBondContact O-N 3.35Å; V396-G398 VanDerWaalsContact C-N 3.33Å
399	E	90.7	Very high	93	Very high	195 Å²	195	56.4 Å²	56.4	91%	0.911	31%	0.309	S	S	*	.			trans	-94.1	-7.4	-172.7	-63	178.3	178.1	0	0	113.5
400	T	93	Very high	93.2	Very high	65 Å²	65	56.5 Å²	56.5	40%	0.399	31%	0.31	S	S	.	.	S	Bend	trans	-104.3	157.1	-172.6	80.2	0	0	0	0	112.8	D402 H403	T400-D402 PolarHBondContact O-N 2.93Å; T400-D402 VanDerWaalsContact O-N 3.17Å; T400-D402 PolarHBondContact OG1-N 3.15Å; T400-H403 WeakPolarHBondContact O-CB 3.42Å; T400-H403 PolarHBondContact O-N 2.94Å; T400-H403 VanDerWaalsContact O-N 3.12Å; T400-H403 PolarHBondContact OG1-CE1 3.49Å; T400-H403 PolarHBondContact OG1-ND1 2.99Å
401	S	94.6	Very high	93.2	Very high	81 Å²	81	56.5 Å²	56.5	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-56.8	-27.8	172	51.2	0	0	0	0	113.1	H403 L404 Q405	S401-H403 VanDerWaalsContact C-N 3.32Å; S401-L404 WeakPolarHBondContact O-CB 3.37Å; S401-L404 PolarHBondContact O-N 3.04Å; S401-Q405 PolarHBondContact O-N 2.74Å
402	D	94.5	Very high	93.3	Very high	72 Å²	72	61.5 Å²	61.5	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-71.9	-30.9	-178.7	-49.4	-34.7	0	0	0	111.2	G344 T400 L404 Q405 L406	G344-D402 WeakPolarHBondContact O-CB 3.43Å; T400-D402 PolarHBondContact O-N 2.93Å; T400-D402 VanDerWaalsContact O-N 3.17Å; T400-D402 PolarHBondContact OG1-N 3.15Å; D402-L404 VanDerWaalsContact C-N 3.35Å; D402-Q405 PolarHBondContact O-N 3.41Å; D402-L406 PolarHBondContact O-N 3.49Å
403	H	95.5	Very high	93.2	Very high	14 Å²	14	65.8 Å²	65.8	7%	0.065	36%	0.356	C	S	.	.	H	α-helix	trans	-66.8	-36.4	170.9	-64.5	89.5	0	0	0	111.8	A341 K342 I395 T400 S401 Q405 L406	A341-H403 PolarHBondContact O-CD2 2.91Å; A341-H403 VanDerWaalsContact O-CD2 3.24Å; A341-H403 PolarHBondContact O-NE2 3.12Å; K342-H403 PolarHBondContact O-CE1 3.15Å; K342-H403 PolarHBondContact O-NE2 3.43Å; I395-H403 WeakPolarHBondContact CG2-O 3.49Å; T400-H403 WeakPolarHBondContact O-CB 3.42Å; T400-H403 PolarHBondContact O-N 2.94Å; T400-H403 VanDerWaalsContact O-N 3.12Å; T400-H403 PolarHBondContact OG1-CE1 3.49Å; T400-H403 PolarHBondContact OG1-ND1 2.99Å; S401-H403 VanDerWaalsContact C-N 3.32Å; H403-Q405 VanDerWaalsContact C-N 3.28Å; H403-Q405 PolarHBondContact O-N 2.74Å; H403-L406 WeakPolarHBondContact O-CB 3.2Å; H403-L406 PolarHBondContact O-N 3.36Å; H403-L406 VanDerWaalsContact O-N 3.1Å
404	L	93.9	Very high	93.1	Very high	122 Å²	122	66.1 Å²	66.1	64%	0.639	36%	0.356	S	S	*	.	H	α-helix	trans	-61.2	-40.1	174.8	-176.4	63	0	0	0	111.2	S401 D402 L406 I407	S401-L404 WeakPolarHBondContact O-CB 3.37Å; S401-L404 PolarHBondContact O-N 3.04Å; D402-L404 VanDerWaalsContact C-N 3.35Å; L404-L406 PolarHBondContact O-N 2.96Å; L404-I407 HydrophobicContact CD1-CD1 4.02Å; L404-I407 WeakPolarHBondContact O-CB 3.35Å; L404-I407 PolarHBondContact O-N 2.96Å
405	Q	93.7	Very high	93.1	Very high	99 Å²	99	67.2 Å²	67.2	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-67.4	-23.1	177	-62	177.4	25.2	0	0	113.1	K346 S401 D402 H403 I407	K346-Q405 HydrophobicContact CD-CB 4.02Å; K346-Q405 WeakPolarHBondContact CD-O 3.34Å; K346-Q405 WeakPolarHBondContact CE-O 3.4Å; K346-Q405 PolarHBondContact NZ-O 2.68Å; S401-Q405 PolarHBondContact O-N 2.74Å; D402-Q405 PolarHBondContact O-N 3.41Å; H403-Q405 VanDerWaalsContact C-N 3.28Å; H403-Q405 PolarHBondContact O-N 2.74Å; Q405-I407 VanDerWaalsContact C-N 3.28Å
406	L	94.6	Very high	93	Very high	5 Å²	5	71.5 Å²	71.5	3%	0.026	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-14.4	176	-86.4	168.8	0	0	0	113.3	K346 F349 I395 D402 H403 L404 D408	K346-L406 HydrophobicContact CB-CD2 4.04Å; K346-L406 HydrophobicContact CB-CG 4.22Å; K346-L406 HydrophobicContact CG-CD2 4.24Å; F349-L406 HydrophobicContact CB-CD2 3.59Å; F349-L406 HydrophobicContact CD1-CD2 3.5Å; F349-L406 HydrophobicContact CD2-CD2 4.43Å; F349-L406 HydrophobicContact CE1-CD2 4.3Å; F349-L406 HydrophobicContact CG-CD2 3.57Å; I395-L406 HydrophobicContact CD1-CB 4.05Å; I395-L406 HydrophobicContact CD1-CD1 4.38Å; I395-L406 HydrophobicContact CG1-CB 4.03Å; I395-L406 HydrophobicContact CG1-CD1 4.01Å; I395-L406 HydrophobicContact CG2-CB 3.76Å; D402-L406 PolarHBondContact O-N 3.49Å; H403-L406 WeakPolarHBondContact O-CB 3.2Å; H403-L406 PolarHBondContact O-N 3.36Å; H403-L406 VanDerWaalsContact O-N 3.1Å; L404-L406 PolarHBondContact O-N 2.96Å; L406-D408 VanDerWaalsContact C-N 3.33Å
407	I	93.5	Very high	92.9	Very high	48 Å²	48	70.6 Å²	70.6	25%	0.246	38%	0.381	C	S	.	.	S	Bend	trans	-68.1	-35.8	-179.9	-62.7	-175.1	0	0	0	110.9	I395 L404 Q405 V411 E412 L415	I395-I407 HydrophobicContact CG2-CG1 3.79Å; L404-I407 HydrophobicContact CD1-CD1 4.02Å; L404-I407 WeakPolarHBondContact O-CB 3.35Å; L404-I407 PolarHBondContact O-N 2.96Å; Q405-I407 VanDerWaalsContact C-N 3.28Å; I407-V411 CarbonylContact O-C 3.54Å; I407-V411 WeakPolarHBondContact O-CB 3.36Å; I407-E412 HydrophobicContact CG2-CB 4.45Å; I407-E412 WeakPolarHBondContact O-CA 3.26Å; I407-E412 VanDerWaalsContact O-CB 3.23Å; I407-E412 WeakPolarHBondContact O-CB 3.31Å; I407-E412 PolarHBondContact O-N 3.25Å; I407-L415 HydrophobicContact CG2-CD1 4.38Å
408	D	89.6	Confident	92.8	Very high	93 Å²	93	64.8 Å²	64.8	50%	0.497	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	143.6	-177.4	-50.6	-28.2	0	0	0	112.8	K346 L406	K346-D408 IonicContact NZ-OD2 2.67Å; K346-D408 PolarHBondContact NZ-OD2 2.8Å; L406-D408 VanDerWaalsContact C-N 3.33Å
409	G	88.7	Confident	92.7	Very high	34 Å²	34	69.8 Å²	69.8	35%	0.351	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-117.8	171.8	0	0	0	0	0	113.5	V411 E412 N413	G409-V411 PolarHBondContact O-N 3.43Å; G409-E412 PolarHBondContact O-N 3.4Å; G409-N413 WeakPolarHBondContact O-CB 3.23Å; G409-N413 PolarHBondContact O-N 2.92Å; G409-N413 PolarHBondContact O-ND2 3.37Å; G409-N413 VanDerWaalsContact O-ND2 3.15Å
410	L	90.2	Very high	92.8	Very high	45 Å²	45	66.2 Å²	66.2	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-43.4	-173	178.7	63.7	0	0	0	112.2	L353 Y371 I376 N413 L414	L353-L410 HydrophobicContact CD1-CD2 3.81Å; L353-L410 HydrophobicContact CD2-CB 4.42Å; L353-L410 HydrophobicContact CD2-CD2 3.65Å; L353-L410 HydrophobicContact CG-CD2 4.3Å; Y371-L410 HydrophobicContact CD1-CD2 4.28Å; Y371-L410 HydrophobicContact CD2-CD1 3.78Å; Y371-L410 HydrophobicContact CD2-CD2 3.95Å; Y371-L410 HydrophobicContact CE2-CD1 4.23Å; Y371-L410 HydrophobicContact CE2-CD2 4.41Å; Y371-L410 HydrophobicContact CG-CD1 4.43Å; Y371-L410 HydrophobicContact CG-CD2 3.87Å; I376-L410 HydrophobicContact CD1-CD2 3.86Å; L410-N413 PolarHBondContact O-N 3.46Å; L410-L414 WeakPolarHBondContact O-CB 3.35Å; L410-L414 PolarHBondContact O-N 2.79Å
411	V	93.3	Very high	92.7	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-67.4	-44.9	-177.1	174.6	0	0	0	0	110.4	V392 I395 I407 G409 N413 L414 L415	V392-V411 HydrophobicContact CG2-CG1 4.42Å; I395-V411 HydrophobicContact CD1-CG2 3.8Å; I395-V411 HydrophobicContact CG2-CG1 4.41Å; I407-V411 CarbonylContact O-C 3.54Å; I407-V411 WeakPolarHBondContact O-CB 3.36Å; G409-V411 PolarHBondContact O-N 3.43Å; V411-N413 PolarHBondContact O-N 2.85Å; V411-L414 PolarHBondContact O-N 3.28Å; V411-L415 HydrophobicContact CG1-CD1 3.92Å; V411-L415 HydrophobicContact CG1-CG 4.31Å; V411-L415 WeakPolarHBondContact O-CB 3.33Å; V411-L415 VanDerWaalsContact O-CG 3.26Å; V411-L415 WeakPolarHBondContact O-CG 3.46Å; V411-L415 PolarHBondContact O-N 2.76Å
412	E	94.5	Very high	92.3	Very high	105 Å²	105	70.5 Å²	70.5	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-56.1	-50.4	173	178.7	179.7	-161.2	0	0	111.3	I407 G409 L414 L415 E416	I407-E412 HydrophobicContact CG2-CB 4.45Å; I407-E412 WeakPolarHBondContact O-CA 3.26Å; I407-E412 VanDerWaalsContact O-CB 3.23Å; I407-E412 WeakPolarHBondContact O-CB 3.31Å; I407-E412 PolarHBondContact O-N 3.25Å; G409-E412 PolarHBondContact O-N 3.4Å; E412-L414 VanDerWaalsContact C-N 3.31Å; E412-L414 PolarHBondContact O-N 3.5Å; E412-L415 PolarHBondContact O-N 3.19Å; E412-E416 WeakPolarHBondContact O-CB 3.39Å; E412-E416 PolarHBondContact O-N 3.27Å
413	N	92.6	Very high	91.8	Very high	96 Å²	96	68 Å²	68	51%	0.513	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-42.3	178.7	-71.9	-27.7	0	0	0	111.9	G409 L410 V411 E416 A417	G409-N413 WeakPolarHBondContact O-CB 3.23Å; G409-N413 PolarHBondContact O-N 2.92Å; G409-N413 PolarHBondContact O-ND2 3.37Å; G409-N413 VanDerWaalsContact O-ND2 3.15Å; L410-N413 PolarHBondContact O-N 3.46Å; V411-N413 PolarHBondContact O-N 2.85Å; N413-E416 PolarHBondContact O-N 3.33Å; N413-A417 WeakPolarHBondContact O-CB 3.48Å; N413-A417 PolarHBondContact O-N 2.87Å
414	L	92.1	Very high	91.4	Very high	24 Å²	24	72.6 Å²	72.6	13%	0.126	37%	0.37	C	S	.	.	H	α-helix	trans	-67.2	-43.1	178.2	-177.6	58.9	0	0	0	111.7	L373 I376 D377 V392 L410 V411 E412 A417 K418	L373-L414 HydrophobicContact CD2-CD1 4.28Å; L373-L414 HydrophobicContact CD2-CD2 4.37Å; I376-L414 HydrophobicContact CG2-CD2 3.87Å; D377-L414 HydrophobicContact CB-CD2 4.39Å; V392-L414 HydrophobicContact CG2-CD2 3.66Å; L410-L414 WeakPolarHBondContact O-CB 3.35Å; L410-L414 PolarHBondContact O-N 2.79Å; V411-L414 PolarHBondContact O-N 3.28Å; E412-L414 VanDerWaalsContact C-N 3.31Å; E412-L414 PolarHBondContact O-N 3.5Å; L414-A417 PolarHBondContact O-N 3.4Å; L414-K418 WeakPolarHBondContact O-CG 3.3Å; L414-K418 PolarHBondContact O-N 3.12Å
415	L	93.1	Very high	90.9	Very high	56 Å²	56	77 Å²	77	29%	0.293	38%	0.379	S	S	.	.	H	α-helix	trans	-63.8	-41	175.2	-72.3	174.7	0	0	0	111.5	V392 V396 I407 V411 E412 K418 W419	V392-L415 HydrophobicContact CG1-CD2 3.87Å; V396-L415 HydrophobicContact CG2-CD1 3.99Å; V396-L415 HydrophobicContact CG2-CD2 4.37Å; I407-L415 HydrophobicContact CG2-CD1 4.38Å; V411-L415 HydrophobicContact CG1-CD1 3.92Å; V411-L415 HydrophobicContact CG1-CG 4.31Å; V411-L415 WeakPolarHBondContact O-CB 3.33Å; V411-L415 VanDerWaalsContact O-CG 3.26Å; V411-L415 WeakPolarHBondContact O-CG 3.46Å; V411-L415 PolarHBondContact O-N 2.76Å; E412-L415 PolarHBondContact O-N 3.19Å; L415-K418 PolarHBondContact O-N 2.82Å; L415-W419 WeakPolarHBondContact O-CB 3.44Å; L415-W419 PolarHBondContact O-N 3.27Å
416	E	94.5	Very high	90.5	Very high	92 Å²	92	80.3 Å²	80.3	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-65	-43	176.9	-160.5	-160.9	-171.8	0	0	111.1	E412 N413 K418 W419 K420	E412-E416 WeakPolarHBondContact O-CB 3.39Å; E412-E416 PolarHBondContact O-N 3.27Å; N413-E416 PolarHBondContact O-N 3.33Å; E416-K418 PolarHBondContact O-N 3.14Å; E416-W419 PolarHBondContact O-N 3.1Å; E416-K420 VanDerWaalsContact CD-CE 3.45Å; E416-K420 HydrophobicContact CG-CD 4.32Å; E416-K420 WeakPolarHBondContact O-CB 3.49Å; E416-K420 WeakPolarHBondContact O-CG 3.45Å; E416-K420 PolarHBondContact O-N 3.32Å; E416-K420 WeakPolarHBondContact OE1-CE 3.07Å; E416-K420 IonicContact OE1-NZ 3.57Å; E416-K420 PolarHBondContact OE1-NZ 3.24Å; E416-K420 IonicContact OE2-NZ 3.43Å; E416-K420 PolarHBondContact OE2-NZ 2.75Å
417	A	92.2	Very high	90	Very high	47 Å²	47	81.7 Å²	81.7	39%	0.388	40%	0.401	S	S	.	.	H	α-helix	trans	-61.2	-44	175	0	0	0	0	0	111.7	N413 L414 K420 T421	N413-A417 WeakPolarHBondContact O-CB 3.48Å; N413-A417 PolarHBondContact O-N 2.87Å; L414-A417 PolarHBondContact O-N 3.4Å; A417-K420 PolarHBondContact O-N 3.5Å; A417-T421 VanDerWaalsContact O-CB 3.31Å; A417-T421 WeakPolarHBondContact O-CB 3.35Å; A417-T421 PolarHBondContact O-N 2.72Å; A417-T421 PolarHBondContact O-OG1 3.08Å
418	K	90.1	Very high	89.5	Confident	42 Å²	42	84 Å²	84	18%	0.183	41%	0.414	C	S	.	.	H	α-helix	trans	-63.8	-41.1	174.6	-75.9	178.5	-175.8	-69.7	0	112.5	D377 L414 L415 E416 T421 F422 G423	D377-K418 VanDerWaalsContact CG-CE 3.48Å; D377-K418 WeakPolarHBondContact OD1-CE 3.43Å; D377-K418 IonicContact OD1-NZ 2.88Å; D377-K418 PolarHBondContact OD1-NZ 3.17Å; D377-K418 IonicContact OD2-NZ 3.85Å; D377-K418 PolarHBondContact OD2-NZ 2.96Å; L414-K418 WeakPolarHBondContact O-CG 3.3Å; L414-K418 PolarHBondContact O-N 3.12Å; L415-K418 PolarHBondContact O-N 2.82Å; E416-K418 PolarHBondContact O-N 3.14Å; K418-T421 PolarHBondContact O-N 3.38Å; K418-F422 PolarHBondContact O-N 3.12Å; K418-G423 PolarHBondContact O-N 3.39Å; K418-G423 VanDerWaalsContact O-N 3.14Å
419	W	91.8	Very high	89.3	Confident	130 Å²	130	90 Å²	90	49%	0.492	43%	0.43	S	S	.	.	I	π-helix	trans	-62.5	-49.7	176.1	177.1	-110.7	0	0	0	110.8	L415 E416 T421 G423 K424 S427	L415-W419 WeakPolarHBondContact O-CB 3.44Å; L415-W419 PolarHBondContact O-N 3.27Å; E416-W419 PolarHBondContact O-N 3.1Å; W419-T421 VanDerWaalsContact C-N 3.33Å; W419-T421 PolarHBondContact O-N 3.31Å; W419-G423 CarbonylContact O-C 3.46Å; W419-G423 WeakPolarHBondContact O-CA 3.38Å; W419-G423 PolarHBondContact O-N 3.23Å; W419-G423 VanDerWaalsContact O-N 3.12Å; W419-K424 VanDerWaalsContact O-CB 3.3Å; W419-K424 WeakPolarHBondContact O-CB 3.19Å; W419-K424 PolarHBondContact O-N 3.4Å; W419-S427 VanDerWaalsContact CH2-CB 3.45Å
420	K	93.3	Very high	89.1	Confident	120 Å²	120	94.3 Å²	94.3	52%	0.522	44%	0.444	S	S	.	.	I	π-helix	trans	-60.2	-42.8	178.7	-73.7	171.1	-179.9	163.6	0	111.9	E416 A417	E416-K420 VanDerWaalsContact CD-CE 3.45Å; E416-K420 HydrophobicContact CG-CD 4.32Å; E416-K420 WeakPolarHBondContact O-CB 3.49Å; E416-K420 WeakPolarHBondContact O-CG 3.45Å; E416-K420 PolarHBondContact O-N 3.32Å; E416-K420 WeakPolarHBondContact OE1-CE 3.07Å; E416-K420 IonicContact OE1-NZ 3.57Å; E416-K420 PolarHBondContact OE1-NZ 3.24Å; E416-K420 IonicContact OE2-NZ 3.43Å; E416-K420 PolarHBondContact OE2-NZ 2.75Å; A417-K420 PolarHBondContact O-N 3.5Å
421	T	89.8	Confident	89	Confident	91 Å²	91	95.3 Å²	95.3	56%	0.558	45%	0.452	S	S	*	.	I	π-helix	trans	-77.7	-47	-174	-51.2	0	0	0	0	112.6	A417 K418 W419	A417-T421 VanDerWaalsContact O-CB 3.31Å; A417-T421 WeakPolarHBondContact O-CB 3.35Å; A417-T421 PolarHBondContact O-N 2.72Å; A417-T421 PolarHBondContact O-OG1 3.08Å; K418-T421 PolarHBondContact O-N 3.38Å; W419-T421 VanDerWaalsContact C-N 3.33Å; W419-T421 PolarHBondContact O-N 3.31Å
422	F	85.9	Confident	88.6	Confident	144 Å²	144	96.2 Å²	96.2	63%	0.632	46%	0.462	S	S	*	.	I	π-helix	trans	-118.4	-47.3	-169.9	-53.1	-72.2	0	0	0	112.7	K418 K426	K418-F422 PolarHBondContact O-N 3.12Å; F422-K426 PolarHBondContact O-N 2.84Å
423	G	84.7	Confident	88.4	Confident	20 Å²	20	95 Å²	95	21%	0.206	46%	0.463	C	S	.	.	I	π-helix	trans	-65.2	-49.1	-171.2	0	0	0	0	0	113.5	K418 W419 R425 K426 S427	K418-G423 PolarHBondContact O-N 3.39Å; K418-G423 VanDerWaalsContact O-N 3.14Å; W419-G423 CarbonylContact O-C 3.46Å; W419-G423 WeakPolarHBondContact O-CA 3.38Å; W419-G423 PolarHBondContact O-N 3.23Å; W419-G423 VanDerWaalsContact O-N 3.12Å; G423-R425 PolarHBondContact O-N 2.93Å; G423-K426 PolarHBondContact O-N 3.27Å; G423-S427 WeakPolarHBondContact O-CB 3.35Å; G423-S427 PolarHBondContact O-N 3.19Å
424	K	86.6	Confident	88.2	Confident	111 Å²	111	96.1 Å²	96.1	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-44.2	-174.3	-175	176.7	-177.8	177.3	0	111.9	W419 N428	W419-K424 VanDerWaalsContact O-CB 3.3Å; W419-K424 WeakPolarHBondContact O-CB 3.19Å; W419-K424 PolarHBondContact O-N 3.4Å; K424-N428 WeakPolarHBondContact O-CB 3.45Å; K424-N428 PolarHBondContact O-N 2.79Å; K424-N428 PolarHBondContact O-OD1 2.83Å
425	R	85	Confident	88.1	Confident	214 Å²	214	97.9 Å²	97.9	81%	0.808	48%	0.475	S	S	*	.	H	α-helix	trans	-66.9	-44	178.8	-172	175.4	-177.7	170.4	0.6	111.6	G423 R429	G423-R425 PolarHBondContact O-N 2.93Å; R425-R429 WeakPolarHBondContact O-CB 3.39Å; R425-R429 PolarHBondContact O-N 2.67Å; R425-R429 VanDerWaalsContact O-N 3.12Å
426	K	85	Confident	87.9	Confident	169 Å²	169	99.9 Å²	99.9	74%	0.735	49%	0.485	S	S	*	.	H	α-helix	trans	-68.2	-43.3	179.1	-167.7	174.8	-179.4	179.9	0	111.5	F422 G423 R429 L430	F422-K426 PolarHBondContact O-N 2.84Å; G423-K426 PolarHBondContact O-N 3.27Å; K426-R429 PolarHBondContact O-N 3.39Å; K426-L430 PolarHBondContact O-N 2.85Å; K426-L430 VanDerWaalsContact O-N 3.08Å
427	S	83.1	Confident	87.7	Confident	33 Å²	33	100.4 Å²	100.4	23%	0.231	49%	0.489	C	S	.	.	H	α-helix	trans	-61.9	-48.8	175.3	-176.9	0	0	0	0	111.4	W419 G423 R429 L430 V431	W419-S427 VanDerWaalsContact CH2-CB 3.45Å; G423-S427 WeakPolarHBondContact O-CB 3.35Å; G423-S427 PolarHBondContact O-N 3.19Å; S427-R429 PolarHBondContact O-N 3.05Å; S427-L430 PolarHBondContact O-N 3.23Å; S427-V431 WeakPolarHBondContact O-CB 3.21Å; S427-V431 PolarHBondContact O-N 3.04Å
428	N	83.5	Confident	87.6	Confident	98 Å²	98	103.6 Å²	103.6	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-60.3	-34	177.1	-74.5	-1.6	0	0	0	112.6	K424 G432	K424-N428 WeakPolarHBondContact O-CB 3.45Å; K424-N428 PolarHBondContact O-N 2.79Å; K424-N428 PolarHBondContact O-OD1 2.83Å; N428-G432 WeakPolarHBondContact O-CA 3.19Å; N428-G432 PolarHBondContact O-N 2.73Å
429	R	84.9	Confident	87.7	Confident	217 Å²	217	109 Å²	109	82%	0.819	52%	0.515	S	S	*	.	H	α-helix	trans	-69.6	-36	175.4	-172.1	176.9	-178.6	174.7	0.9	112.6	R425 K426 S427 P433	R425-R429 WeakPolarHBondContact O-CB 3.39Å; R425-R429 PolarHBondContact O-N 2.67Å; R425-R429 VanDerWaalsContact O-N 3.12Å; K426-R429 PolarHBondContact O-N 3.39Å; S427-R429 PolarHBondContact O-N 3.05Å; R429-P433 WeakPolarHBondContact O-CD 3.47Å
430	L	85.7	Confident	87.7	Confident	126 Å²	126	110.3 Å²	110.3	66%	0.66	52%	0.524	S	S	*	.	H	α-helix	trans	-85.5	-52.9	-177.4	-169.4	74.9	0	0	0	112	K426 S427 F434	K426-L430 PolarHBondContact O-N 2.85Å; K426-L430 VanDerWaalsContact O-N 3.08Å; S427-L430 PolarHBondContact O-N 3.23Å; L430-F434 WeakPolarHBondContact O-CD2 3.49Å; L430-F434 WeakPolarHBondContact O-CE2 3.49Å
431	V	86.8	Confident	87.5	Confident	65 Å²	65	109.3 Å²	109.3	39%	0.394	52%	0.522	S	S	.	.	H	α-helix	trans	-86	-30.2	-173.3	179.7	0	0	0	0	112	S427 F434 V435	S427-V431 WeakPolarHBondContact O-CB 3.21Å; S427-V431 PolarHBondContact O-N 3.04Å; V431-F434 WeakPolarHBondContact O-CB 3.21Å; V431-F434 PolarHBondContact O-N 2.9Å; V431-V435 HydrophobicContact CG1-CG2 3.64Å; V431-V435 WeakPolarHBondContact O-CG2 3.49Å; V431-V435 PolarHBondContact O-N 3.29Å
432	G	85.8	Confident	87.5	Confident	20 Å²	20	109.6 Å²	109.6	21%	0.206	52%	0.518	C	S	.	.	H	α-helix	trans	-52.5	-49	-177.7	0	0	0	0	0	114	N428 F434 V435 I436	N428-G432 WeakPolarHBondContact O-CA 3.19Å; N428-G432 PolarHBondContact O-N 2.73Å; G432-F434 VanDerWaalsContact C-N 3.34Å; G432-F434 PolarHBondContact O-N 3.46Å; G432-V435 PolarHBondContact O-N 3.48Å; G432-I436 WeakPolarHBondContact O-CB 3.25Å; G432-I436 VanDerWaalsContact O-CG1 3.25Å; G432-I436 WeakPolarHBondContact O-CG1 3.49Å; G432-I436 PolarHBondContact O-N 3.17Å
433	P	89.7	Confident	87.7	Confident	80 Å²	80	105.6 Å²	105.6	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-39.4	175.6	-26.2	35.7	0	0	0	113.9	R429 I436 M437	R429-P433 WeakPolarHBondContact O-CD 3.47Å; P433-I436 PolarHBondContact O-N 2.84Å; P433-M437 VanDerWaalsContact O-CB 3.31Å; P433-M437 WeakPolarHBondContact O-CB 3.31Å; P433-M437 PolarHBondContact O-N 3.43Å
434	F	88.7	Confident	88	Confident	120 Å²	120	106 Å²	106	53%	0.526	52%	0.516	S	S	.	.	H	α-helix	trans	-66.8	-43.7	176.4	-68.8	-78.7	0	0	0	111.5	L430 V431 G432 I436 M437 F438	L430-F434 WeakPolarHBondContact O-CD2 3.49Å; L430-F434 WeakPolarHBondContact O-CE2 3.49Å; V431-F434 WeakPolarHBondContact O-CB 3.21Å; V431-F434 PolarHBondContact O-N 2.9Å; G432-F434 VanDerWaalsContact C-N 3.34Å; G432-F434 PolarHBondContact O-N 3.46Å; F434-I436 VanDerWaalsContact C-N 3.34Å; F434-I436 PolarHBondContact O-N 2.9Å; F434-M437 HydrophobicContact CD1-CE 4.18Å; F434-M437 WeakPolarHBondContact O-CB 3.39Å; F434-M437 PolarHBondContact O-N 2.86Å; F434-M437 VanDerWaalsContact O-N 3.17Å; F434-F438 VanDerWaalsContact O-CD2 3.25Å; F434-F438 WeakPolarHBondContact O-CD2 3.41Å; F434-F438 PolarHBondContact O-N 3.41Å
435	V	89.5	Confident	88.2	Confident	61 Å²	61	104.4 Å²	104.4	37%	0.37	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-45.4	176.3	171.8	0	0	0	0	110.3	V431 G432 M437 F438 Y439	V431-V435 HydrophobicContact CG1-CG2 3.64Å; V431-V435 WeakPolarHBondContact O-CG2 3.49Å; V431-V435 PolarHBondContact O-N 3.29Å; G432-V435 PolarHBondContact O-N 3.48Å; V435-M437 VanDerWaalsContact C-N 3.32Å; V435-M437 PolarHBondContact O-N 2.92Å; V435-F438 PolarHBondContact O-N 3.05Å; V435-Y439 HydrophobicContact CG1-CD2 3.57Å; V435-Y439 HydrophobicContact CG1-CE2 3.36Å; V435-Y439 WeakPolarHBondContact O-CD2 3.4Å; V435-Y439 PolarHBondContact O-N 2.85Å
436	I	89.2	Confident	88.5	Confident	98 Å²	98	98.8 Å²	98.8	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-61.6	-40.1	174.9	-67.1	164.9	0	0	0	111.2	G432 P433 F434 Y439 K440	G432-I436 WeakPolarHBondContact O-CB 3.25Å; G432-I436 VanDerWaalsContact O-CG1 3.25Å; G432-I436 WeakPolarHBondContact O-CG1 3.49Å; G432-I436 PolarHBondContact O-N 3.17Å; P433-I436 PolarHBondContact O-N 2.84Å; F434-I436 VanDerWaalsContact C-N 3.34Å; F434-I436 PolarHBondContact O-N 2.9Å; I436-Y439 PolarHBondContact O-N 3.29Å; I436-K440 HydrophobicContact CG2-CD 4.4Å; I436-K440 WeakPolarHBondContact O-CB 3.39Å; I436-K440 WeakPolarHBondContact O-CG 3.43Å; I436-K440 PolarHBondContact O-N 3.3Å
437	M	90.4	Very high	88.8	Confident	103 Å²	103	96.8 Å²	96.8	51%	0.507	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-46.2	175.9	-175.2	-172.2	75.3	0	0	111.5	P433 F434 V435 K440 M441	P433-M437 VanDerWaalsContact O-CB 3.31Å; P433-M437 WeakPolarHBondContact O-CB 3.31Å; P433-M437 PolarHBondContact O-N 3.43Å; F434-M437 HydrophobicContact CD1-CE 4.18Å; F434-M437 WeakPolarHBondContact O-CB 3.39Å; F434-M437 PolarHBondContact O-N 2.86Å; F434-M437 VanDerWaalsContact O-N 3.17Å; V435-M437 VanDerWaalsContact C-N 3.32Å; V435-M437 PolarHBondContact O-N 2.92Å; M437-K440 PolarHBondContact O-N 2.88Å; M437-M441 WeakPolarHBondContact O-CB 3.25Å; M437-M441 PolarHBondContact O-N 3.46Å
438	F	90.1	Very high	89.1	Confident	113 Å²	113	102.9 Å²	102.9	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-45.1	175.2	-87.3	-70.8	0	0	0	111.9	F434 V435 K440 M441 M442	F434-F438 VanDerWaalsContact O-CD2 3.25Å; F434-F438 WeakPolarHBondContact O-CD2 3.41Å; F434-F438 PolarHBondContact O-N 3.41Å; V435-F438 PolarHBondContact O-N 3.05Å; F438-K440 PolarHBondContact O-N 3.48Å; F438-M441 HydrophobicContact CD1-CE 3.84Å; F438-M441 HydrophobicContact CE1-CE 4.1Å; F438-M441 PolarHBondContact O-N 2.89Å; F438-M442 WeakPolarHBondContact O-CG 3.14Å; F438-M442 PolarHBondContact O-N 3.29Å
439	Y	92.5	Very high	89.4	Confident	157 Å²	157	105.2 Å²	105.2	62%	0.616	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-41.4	175.6	-81.3	-64.6	0	0	0	112.3	V435 I436 M442 A443	V435-Y439 HydrophobicContact CG1-CD2 3.57Å; V435-Y439 HydrophobicContact CG1-CE2 3.36Å; V435-Y439 WeakPolarHBondContact O-CD2 3.4Å; V435-Y439 PolarHBondContact O-N 2.85Å; I436-Y439 PolarHBondContact O-N 3.29Å; Y439-M442 HydrophobicContact CD1-CE 3.84Å; Y439-M442 HydrophobicContact CE1-CE 4.1Å; Y439-A443 WeakPolarHBondContact O-CB 3.35Å; Y439-A443 PolarHBondContact O-N 3.33Å
440	K	92	Very high	89.8	Confident	157 Å²	157	99.6 Å²	99.6	68%	0.683	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-40.2	174.8	-80.5	-173.8	174.6	-174.5	0	112.4	I436 M437 F438 G444	I436-K440 HydrophobicContact CG2-CD 4.4Å; I436-K440 WeakPolarHBondContact O-CB 3.39Å; I436-K440 WeakPolarHBondContact O-CG 3.43Å; I436-K440 PolarHBondContact O-N 3.3Å; M437-K440 PolarHBondContact O-N 2.88Å; F438-K440 PolarHBondContact O-N 3.48Å; K440-G444 PolarHBondContact O-N 3.21Å
441	M	89.6	Confident	90.1	Very high	98 Å²	98	97.5 Å²	97.5	48%	0.483	49%	0.492	S	S	.	.	H	α-helix	trans	-63.2	-52.4	176.5	-174.7	-177.9	78.2	0	0	110.7	M437 F438 A443 G444 D445	M437-M441 WeakPolarHBondContact O-CB 3.25Å; M437-M441 PolarHBondContact O-N 3.46Å; F438-M441 HydrophobicContact CD1-CE 3.84Å; F438-M441 HydrophobicContact CE1-CE 4.1Å; F438-M441 PolarHBondContact O-N 2.89Å; M441-A443 PolarHBondContact O-N 3.47Å; M441-G444 PolarHBondContact O-N 2.96Å; M441-D445 PolarHBondContact O-N 3.47Å
442	M	88.7	Confident	90.3	Very high	98 Å²	98	98.6 Å²	98.6	48%	0.483	50%	0.495	S	S	.	.	H	α-helix	trans	-60.1	-43.6	176.9	-71.1	-167.8	-62.7	0	0	112	F438 Y439 G444 D445 V446	F438-M442 WeakPolarHBondContact O-CG 3.14Å; F438-M442 PolarHBondContact O-N 3.29Å; Y439-M442 HydrophobicContact CD1-CE 3.84Å; Y439-M442 HydrophobicContact CE1-CE 4.1Å; M442-G444 VanDerWaalsContact C-N 3.34Å; M442-G444 PolarHBondContact O-N 2.87Å; M442-D445 PolarHBondContact O-N 3.42Å; M442-V446 WeakPolarHBondContact O-CB 3.2Å; M442-V446 VanDerWaalsContact O-CG2 3.23Å; M442-V446 WeakPolarHBondContact O-CG2 3.23Å; M442-V446 PolarHBondContact O-N 2.83Å
443	A	90.9	Very high	90.6	Very high	60 Å²	60	104 Å²	104	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-40.1	177.4	0	0	0	0	0	112.1	Y439 M441 F447	Y439-A443 WeakPolarHBondContact O-CB 3.35Å; Y439-A443 PolarHBondContact O-N 3.33Å; M441-A443 PolarHBondContact O-N 3.47Å; A443-F447 WeakPolarHBondContact O-CB 3.43Å; A443-F447 PolarHBondContact O-N 2.92Å
444	G	90.2	Very high	90.7	Very high	29 Å²	29	103.2 Å²	103.2	30%	0.299	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-42.9	175.1	0	0	0	0	0	112.6	K440 M441 M442 F447 R448	K440-G444 PolarHBondContact O-N 3.21Å; M441-G444 PolarHBondContact O-N 2.96Å; M442-G444 VanDerWaalsContact C-N 3.34Å; M442-G444 PolarHBondContact O-N 2.87Å; G444-F447 PolarHBondContact O-N 2.88Å; G444-R448 VanDerWaalsContact O-CG 3.26Å; G444-R448 WeakPolarHBondContact O-CG 3.17Å; G444-R448 PolarHBondContact O-N 2.93Å
445	D	90.8	Very high	90.9	Very high	76 Å²	76	102.7 Å²	102.7	41%	0.406	51%	0.505	S	S	.	.	H	α-helix	trans	-73.8	-39.6	179.2	-71.1	-22.7	0	0	0	112.6	M441 M442 F447 R448 F449	M441-D445 PolarHBondContact O-N 3.47Å; M442-D445 PolarHBondContact O-N 3.42Å; D445-F447 VanDerWaalsContact C-N 3.3Å; D445-F447 PolarHBondContact O-N 3.27Å; D445-R448 PolarHBondContact O-N 3.3Å; D445-R448 IonicContact OD1-CZ 3.91Å; D445-R448 IonicContact OD1-NH1 3.91Å; D445-R448 PolarHBondContact OD1-NH1 3.49Å; D445-F449 WeakPolarHBondContact O-CB 3.26Å; D445-F449 PolarHBondContact O-N 2.89Å
446	V	90.6	Very high	91	Very high	96 Å²	96	105.8 Å²	105.8	58%	0.582	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-41.7	171.3	170.3	0	0	0	0	110.4	M442 F449 L450	M442-V446 WeakPolarHBondContact O-CB 3.2Å; M442-V446 VanDerWaalsContact O-CG2 3.23Å; M442-V446 WeakPolarHBondContact O-CG2 3.23Å; M442-V446 PolarHBondContact O-N 2.83Å; V446-F449 PolarHBondContact O-N 3.48Å; V446-L450 VanDerWaalsContact O-CB 3.31Å; V446-L450 WeakPolarHBondContact O-CB 3.33Å; V446-L450 PolarHBondContact O-N 2.84Å
447	F	91.9	Very high	91	Very high	128 Å²	128	105.4 Å²	105.4	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-63.4	-44.2	175.4	179	-97.4	0	0	0	111.8	A443 G444 D445 F449 L450 L451	A443-F447 WeakPolarHBondContact O-CB 3.43Å; A443-F447 PolarHBondContact O-N 2.92Å; G444-F447 PolarHBondContact O-N 2.88Å; D445-F447 VanDerWaalsContact C-N 3.3Å; D445-F447 PolarHBondContact O-N 3.27Å; F447-F449 VanDerWaalsContact C-N 3.35Å; F447-F449 PolarHBondContact O-N 3.46Å; F447-L450 PolarHBondContact O-N 2.85Å; F447-L451 HydrophobicContact CE1-CD1 3.81Å; F447-L451 HydrophobicContact CZ-CD1 4.05Å; F447-L451 VanDerWaalsContact O-CB 3.28Å; F447-L451 WeakPolarHBondContact O-CB 3.28Å; F447-L451 PolarHBondContact O-N 2.84Å
448	R	89.9	Confident	91	Very high	160 Å²	160	106.6 Å²	106.6	60%	0.604	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-45.3	174.4	-74.8	167	-178.8	168.9	-5.3	111.5	G444 D445 L451 I452	G444-R448 VanDerWaalsContact O-CG 3.26Å; G444-R448 WeakPolarHBondContact O-CG 3.17Å; G444-R448 PolarHBondContact O-N 2.93Å; D445-R448 PolarHBondContact O-N 3.3Å; D445-R448 IonicContact OD1-CZ 3.91Å; D445-R448 IonicContact OD1-NH1 3.91Å; D445-R448 PolarHBondContact OD1-NH1 3.49Å; R448-L451 PolarHBondContact O-N 2.93Å; R448-I452 VanDerWaalsContact O-CG1 3.26Å; R448-I452 WeakPolarHBondContact O-CG1 3.29Å; R448-I452 PolarHBondContact O-N 3.49Å
449	F	90.5	Very high	91	Very high	148 Å²	148	103.5 Å²	103.5	65%	0.649	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-44.9	176.8	-177	-93.8	0	0	0	111.6	D445 V446 F447 L451 I452 Y453	D445-F449 WeakPolarHBondContact O-CB 3.26Å; D445-F449 PolarHBondContact O-N 2.89Å; V446-F449 PolarHBondContact O-N 3.48Å; F447-F449 VanDerWaalsContact C-N 3.35Å; F447-F449 PolarHBondContact O-N 3.46Å; F449-L451 VanDerWaalsContact C-N 3.34Å; F449-L451 PolarHBondContact O-N 2.89Å; F449-I452 PolarHBondContact O-N 3.34Å; F449-Y453 WeakPolarHBondContact O-CB 3.31Å; F449-Y453 PolarHBondContact O-N 2.85Å
450	L	91.8	Very high	90.8	Very high	98 Å²	98	103.2 Å²	103.2	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-39.2	177.6	-166	118.5	0	0	0	111.7	V446 F447 Y453 V454	V446-L450 VanDerWaalsContact O-CB 3.31Å; V446-L450 WeakPolarHBondContact O-CB 3.33Å; V446-L450 PolarHBondContact O-N 2.84Å; F447-L450 PolarHBondContact O-N 2.85Å; L450-Y453 WeakPolarHBondContact O-CB 3.48Å; L450-Y453 PolarHBondContact O-N 3.35Å; L450-V454 VanDerWaalsContact O-CG2 3.29Å; L450-V454 WeakPolarHBondContact O-CG2 3.4Å; L450-V454 PolarHBondContact O-N 3.36Å
451	L	92.3	Very high	90.4	Very high	82 Å²	82	97.7 Å²	97.7	43%	0.429	50%	0.498	S	S	.	.	H	α-helix	trans	-65	-45.3	176.5	-168.8	150.6	0	0	0	111.1	F447 R448 F449 Y453 V454 I455	F447-L451 HydrophobicContact CE1-CD1 3.81Å; F447-L451 HydrophobicContact CZ-CD1 4.05Å; F447-L451 VanDerWaalsContact O-CB 3.28Å; F447-L451 WeakPolarHBondContact O-CB 3.28Å; F447-L451 PolarHBondContact O-N 2.84Å; R448-L451 PolarHBondContact O-N 2.93Å; F449-L451 VanDerWaalsContact C-N 3.34Å; F449-L451 PolarHBondContact O-N 2.89Å; L451-Y453 VanDerWaalsContact C-N 3.33Å; L451-Y453 PolarHBondContact O-N 3.32Å; L451-V454 PolarHBondContact O-N 3.05Å; L451-I455 HydrophobicContact CD2-CD1 3.61Å; L451-I455 HydrophobicContact CD2-CG1 4.43Å; L451-I455 WeakPolarHBondContact O-CG1 3.27Å; L451-I455 PolarHBondContact O-N 3.35Å
452	I	90.6	Very high	90.1	Very high	89 Å²	89	98.7 Å²	98.7	46%	0.456	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-45	173.5	-68.5	165.1	0	0	0	110.3	R448 F449 V454 I455 F456	R448-I452 VanDerWaalsContact O-CG1 3.26Å; R448-I452 WeakPolarHBondContact O-CG1 3.29Å; R448-I452 PolarHBondContact O-N 3.49Å; F449-I452 PolarHBondContact O-N 3.34Å; I452-V454 PolarHBondContact O-N 2.99Å; I452-I455 PolarHBondContact O-N 3.49Å; I452-F456 HydrophobicContact CG2-CD2 3.68Å; I452-F456 HydrophobicContact CG2-CE2 3.57Å; I452-F456 VanDerWaalsContact O-CD2 3.27Å; I452-F456 WeakPolarHBondContact O-CD2 3.26Å; I452-F456 PolarHBondContact O-N 3.23Å
453	Y	92	Very high	89.8	Confident	134 Å²	134	95.6 Å²	95.6	53%	0.525	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-44.4	177.8	-179	-99.4	0	0	0	112.3	F449 L450 L451 I455 F456 L457	F449-Y453 WeakPolarHBondContact O-CB 3.31Å; F449-Y453 PolarHBondContact O-N 2.85Å; L450-Y453 WeakPolarHBondContact O-CB 3.48Å; L450-Y453 PolarHBondContact O-N 3.35Å; L451-Y453 VanDerWaalsContact C-N 3.33Å; L451-Y453 PolarHBondContact O-N 3.32Å; Y453-I455 PolarHBondContact O-N 3.49Å; Y453-F456 PolarHBondContact O-N 3.44Å; Y453-L457 HydrophobicContact CD1-CD1 4.34Å; Y453-L457 HydrophobicContact CE1-CD1 3.54Å; Y453-L457 WeakPolarHBondContact O-CB 3.36Å; Y453-L457 PolarHBondContact O-N 3.28Å
454	V	93.3	Very high	89.3	Confident	62 Å²	62	102 Å²	102	38%	0.376	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-41.7	176.4	169.6	0	0	0	0	111.4	L450 L451 I452 F456 L457 F458	L450-V454 VanDerWaalsContact O-CG2 3.29Å; L450-V454 WeakPolarHBondContact O-CG2 3.4Å; L450-V454 PolarHBondContact O-N 3.36Å; L451-V454 PolarHBondContact O-N 3.05Å; I452-V454 PolarHBondContact O-N 2.99Å; V454-F456 PolarHBondContact O-N 2.89Å; V454-L457 PolarHBondContact O-N 3.47Å; V454-F458 HydrophobicContact CG1-CD2 3.7Å; V454-F458 HydrophobicContact CG1-CE2 3.69Å; V454-F458 WeakPolarHBondContact O-CD2 3.08Å; V454-F458 PolarHBondContact O-N 2.82Å
455	I	92	Very high	88.7	Confident	109 Å²	109	105.6 Å²	105.6	56%	0.559	52%	0.516	S	S	*	.	H	α-helix	trans	-60	-46.2	175.3	-68.6	169.4	0	0	0	110.7	L451 I452 Y453 L457 F458 G459	L451-I455 HydrophobicContact CD2-CD1 3.61Å; L451-I455 HydrophobicContact CD2-CG1 4.43Å; L451-I455 WeakPolarHBondContact O-CG1 3.27Å; L451-I455 PolarHBondContact O-N 3.35Å; I452-I455 PolarHBondContact O-N 3.49Å; Y453-I455 PolarHBondContact O-N 3.49Å; I455-L457 VanDerWaalsContact C-N 3.33Å; I455-L457 PolarHBondContact O-N 3.2Å; I455-F458 PolarHBondContact O-N 3.16Å; I455-G459 PolarHBondContact O-N 2.92Å
456	F	91.4	Very high	88.1	Confident	127 Å²	127	106 Å²	106	56%	0.557	52%	0.524	S	S	*	.	H	α-helix	trans	-61	-42.1	175.1	-85.2	-71.9	0	0	0	111.8	I452 Y453 V454 F458 G459 F460	I452-F456 HydrophobicContact CG2-CD2 3.68Å; I452-F456 HydrophobicContact CG2-CE2 3.57Å; I452-F456 VanDerWaalsContact O-CD2 3.27Å; I452-F456 WeakPolarHBondContact O-CD2 3.26Å; I452-F456 PolarHBondContact O-N 3.23Å; Y453-F456 PolarHBondContact O-N 3.44Å; V454-F456 PolarHBondContact O-N 2.89Å; F456-F458 PolarHBondContact O-N 2.93Å; F456-G459 PolarHBondContact O-N 3.49Å; F456-G459 VanDerWaalsContact O-N 3.16Å; F456-F460 HydrophobicContact CB-CD2 4.33Å; F456-F460 HydrophobicContact CB-CE2 4.3Å; F456-F460 HydrophobicContact CD1-CE2 4.03Å; F456-F460 WeakPolarHBondContact O-CD2 3.35Å; F456-F460 PolarHBondContact O-N 2.97Å
457	L	90.4	Very high	87.5	Confident	89 Å²	89	106.7 Å²	106.7	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-41.7	-178.2	-155.1	142.1	0	0	0	112	Y453 V454 I455 F460 S461	Y453-L457 HydrophobicContact CD1-CD1 4.34Å; Y453-L457 HydrophobicContact CE1-CD1 3.54Å; Y453-L457 WeakPolarHBondContact O-CB 3.36Å; Y453-L457 PolarHBondContact O-N 3.28Å; V454-L457 PolarHBondContact O-N 3.47Å; I455-L457 VanDerWaalsContact C-N 3.33Å; I455-L457 PolarHBondContact O-N 3.2Å; L457-F460 PolarHBondContact O-N 3.46Å; L457-S461 WeakPolarHBondContact O-CB 3.37Å; L457-S461 PolarHBondContact O-N 2.85Å
458	F	90.3	Very high	86.7	Confident	129 Å²	129	103.9 Å²	103.9	57%	0.566	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-42.4	170.3	-84.8	-72.1	0	0	0	112.1	V454 I455 F456 F460 S461 Q462	V454-F458 HydrophobicContact CG1-CD2 3.7Å; V454-F458 HydrophobicContact CG1-CE2 3.69Å; V454-F458 WeakPolarHBondContact O-CD2 3.08Å; V454-F458 PolarHBondContact O-N 2.82Å; I455-F458 PolarHBondContact O-N 3.16Å; F456-F458 PolarHBondContact O-N 2.93Å; F458-F460 VanDerWaalsContact C-N 3.34Å; F458-F460 PolarHBondContact O-N 2.91Å; F458-S461 WeakPolarHBondContact CA-OG 3.49Å; F458-S461 PolarHBondContact O-N 3.4Å; F458-S461 PolarHBondContact O-OG 3.43Å; F458-Q462 VanDerWaalsContact O-CG 3.27Å; F458-Q462 WeakPolarHBondContact O-CG 3.29Å; F458-Q462 PolarHBondContact O-N 2.99Å
459	G	89.5	Confident	86	Confident	47 Å²	47	97.8 Å²	97.8	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-45.2	175.5	0	0	0	0	0	112.4	I455 F456 G463	I455-G459 PolarHBondContact O-N 2.92Å; F456-G459 PolarHBondContact O-N 3.49Å; F456-G459 VanDerWaalsContact O-N 3.16Å; G459-G463 PolarHBondContact O-N 2.89Å
460	F	87.5	Confident	85.3	Confident	151 Å²	151	97.7 Å²	97.7	66%	0.662	50%	0.503	S	S	*	.	H	α-helix	trans	-69.1	-36.1	176.4	-77.4	-64.6	0	0	0	112.9	F456 L457 F458 G463 R464	F456-F460 HydrophobicContact CB-CD2 4.33Å; F456-F460 HydrophobicContact CB-CE2 4.3Å; F456-F460 HydrophobicContact CD1-CE2 4.03Å; F456-F460 WeakPolarHBondContact O-CD2 3.35Å; F456-F460 PolarHBondContact O-N 2.97Å; L457-F460 PolarHBondContact O-N 3.46Å; F458-F460 VanDerWaalsContact C-N 3.34Å; F458-F460 PolarHBondContact O-N 2.91Å; F460-G463 PolarHBondContact O-N 3.27Å; F460-R464 WeakPolarHBondContact O-CB 3.46Å; F460-R464 PolarHBondContact O-N 3.49Å
461	S	84.2	Confident	84.3	Confident	42 Å²	42	98 Å²	98	29%	0.294	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-42.4	176.3	73.4	0	0	0	0	111.4	L457 F458 R464 I465	L457-S461 WeakPolarHBondContact O-CB 3.37Å; L457-S461 PolarHBondContact O-N 2.85Å; F458-S461 WeakPolarHBondContact CA-OG 3.49Å; F458-S461 PolarHBondContact O-N 3.4Å; F458-S461 PolarHBondContact O-OG 3.43Å; S461-R464 PolarHBondContact O-N 2.93Å; S461-I465 VanDerWaalsContact O-CG1 3.29Å; S461-I465 WeakPolarHBondContact O-CG1 3.32Å; S461-I465 PolarHBondContact O-N 2.97Å
462	Q	84.3	Confident	83.4	Confident	119 Å²	119	100.1 Å²	100.1	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-65.6	-41.8	174.7	-64.4	-59.2	-25.8	0	0	111.5	F458 R464 I465 C466	F458-Q462 VanDerWaalsContact O-CG 3.27Å; F458-Q462 WeakPolarHBondContact O-CG 3.29Å; F458-Q462 PolarHBondContact O-N 2.99Å; Q462-R464 VanDerWaalsContact C-N 3.34Å; Q462-R464 PolarHBondContact O-N 3.36Å; Q462-I465 PolarHBondContact O-N 3.36Å; Q462-C466 WeakPolarHBondContact O-CB 3.27Å; Q462-C466 PolarHBondContact O-N 3.34Å
463	G	81.1	Confident	82.5	Confident	32 Å²	32	101.3 Å²	101.3	33%	0.33	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-42.3	173.8	0	0	0	0	0	112.5	G459 F460 C466 I467	G459-G463 PolarHBondContact O-N 2.89Å; F460-G463 PolarHBondContact O-N 3.27Å; G463-C466 PolarHBondContact O-N 2.94Å; G463-I467 WeakPolarHBondContact O-CB 3.5Å; G463-I467 VanDerWaalsContact O-CG1 3.27Å; G463-I467 WeakPolarHBondContact O-CG1 3.49Å; G463-I467 PolarHBondContact O-N 2.94Å
464	R	80	Confident	81.5	Confident	196 Å²	196	99.9 Å²	99.9	74%	0.74	52%	0.519	S	S	*	.	H	α-helix	trans	-64.4	-46.6	176.7	-166.7	-177.9	175.9	-171.3	-0.9	111.5	F460 S461 Q462 C466 I467 T468	F460-R464 WeakPolarHBondContact O-CB 3.46Å; F460-R464 PolarHBondContact O-N 3.49Å; S461-R464 PolarHBondContact O-N 2.93Å; Q462-R464 VanDerWaalsContact C-N 3.34Å; Q462-R464 PolarHBondContact O-N 3.36Å; R464-C466 VanDerWaalsContact C-N 3.32Å; R464-C466 PolarHBondContact O-N 2.91Å; R464-I467 PolarHBondContact O-N 2.86Å; R464-T468 WeakPolarHBondContact O-CG2 3.24Å; R464-T468 PolarHBondContact O-N 3.47Å; R464-T468 PolarHBondContact O-OG1 3.4Å
465	I	78	Confident	80.4	Confident	103 Å²	103	99 Å²	99	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-42.1	176.9	-68.1	164.7	0	0	0	110.9	S461 Q462 T468 G469	S461-I465 VanDerWaalsContact O-CG1 3.29Å; S461-I465 WeakPolarHBondContact O-CG1 3.32Å; S461-I465 PolarHBondContact O-N 2.97Å; Q462-I465 PolarHBondContact O-N 3.36Å; I465-T468 WeakPolarHBondContact CA-OG1 3.34Å; I465-T468 PolarHBondContact O-N 3.46Å; I465-T468 PolarHBondContact O-OG1 2.92Å; I465-G469 PolarHBondContact O-N 3.29Å
466	C	78.5	Confident	79.4	Confident	85 Å²	85	102.3 Å²	102.3	57%	0.574	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-43.9	178.4	-170	0	0	0	0	111.8	Q462 G463 R464 G469 K470	Q462-C466 WeakPolarHBondContact O-CB 3.27Å; Q462-C466 PolarHBondContact O-N 3.34Å; G463-C466 PolarHBondContact O-N 2.94Å; R464-C466 VanDerWaalsContact C-N 3.32Å; R464-C466 PolarHBondContact O-N 2.91Å; C466-G469 PolarHBondContact O-N 2.93Å; C466-K470 WeakPolarHBondContact O-CB 3.27Å; C466-K470 PolarHBondContact O-N 3.31Å
467	I	77.3	Confident	78.2	Confident	110 Å²	110	102.2 Å²	102.2	56%	0.564	53%	0.525	S	S	*	.	H	α-helix	trans	-64.6	-46.1	176.6	-68.7	166.4	0	0	0	110.6	G463 R464 G469 K470 I471	G463-I467 WeakPolarHBondContact O-CB 3.5Å; G463-I467 VanDerWaalsContact O-CG1 3.27Å; G463-I467 WeakPolarHBondContact O-CG1 3.49Å; G463-I467 PolarHBondContact O-N 2.94Å; R464-I467 PolarHBondContact O-N 2.86Å; I467-G469 PolarHBondContact O-N 2.93Å; I467-K470 PolarHBondContact O-N 3.47Å; I467-I471 HydrophobicContact CG2-CD1 3.67Å; I467-I471 HydrophobicContact CG2-CG1 4.39Å; I467-I471 VanDerWaalsContact O-CG1 3.24Å; I467-I471 WeakPolarHBondContact O-CG1 3.38Å; I467-I471 PolarHBondContact O-N 3.49Å
468	T	75	Confident	76.8	Confident	69 Å²	69	103.3 Å²	103.3	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-41.9	177.7	47.9	0	0	0	0	112	R464 I465 K470 I471 E472	R464-T468 WeakPolarHBondContact O-CG2 3.24Å; R464-T468 PolarHBondContact O-N 3.47Å; R464-T468 PolarHBondContact O-OG1 3.4Å; I465-T468 WeakPolarHBondContact CA-OG1 3.34Å; I465-T468 PolarHBondContact O-N 3.46Å; I465-T468 PolarHBondContact O-OG1 2.92Å; T468-K470 VanDerWaalsContact C-N 3.34Å; T468-K470 PolarHBondContact O-N 2.97Å; T468-I471 PolarHBondContact O-N 3.49Å; T468-E472 PolarHBondContact O-N 3.02Å
469	G	76.5	Confident	75.3	Confident	32 Å²	32	105.3 Å²	105.3	33%	0.33	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-38	176.5	0	0	0	0	0	112.5	I465 C466 I467 L473	I465-G469 PolarHBondContact O-N 3.29Å; C466-G469 PolarHBondContact O-N 2.93Å; I467-G469 PolarHBondContact O-N 2.93Å; G469-L473 WeakPolarHBondContact O-CB 3.41Å; G469-L473 PolarHBondContact O-N 3.41Å
470	K	74.7	Confident	73.4	Confident	147 Å²	147	112.3 Å²	112.3	64%	0.639	57%	0.569	S	S	*	*	H	α-helix	trans	-70	-37.8	176.2	-140.2	176	-171.1	-178.7	0	112	C466 I467 T468 L473 I474	C466-K470 WeakPolarHBondContact O-CB 3.27Å; C466-K470 PolarHBondContact O-N 3.31Å; I467-K470 PolarHBondContact O-N 3.47Å; T468-K470 VanDerWaalsContact C-N 3.34Å; T468-K470 PolarHBondContact O-N 2.97Å; K470-L473 PolarHBondContact O-N 2.94Å; K470-I474 WeakPolarHBondContact O-CB 3.48Å; K470-I474 WeakPolarHBondContact O-CD1 3.47Å; K470-I474 VanDerWaalsContact O-CG1 3.23Å; K470-I474 WeakPolarHBondContact O-CG1 3.23Å; K470-I474 PolarHBondContact O-N 2.98Å
471	I	72.6	Confident	72.7	Confident	105 Å²	105	110.4 Å²	110.4	54%	0.538	57%	0.565	S	S	.	*	H	α-helix	trans	-64	-44.8	174.4	-69.5	166	0	0	0	110.6	I467 T468 L473 I474 A475	I467-I471 HydrophobicContact CG2-CD1 3.67Å; I467-I471 HydrophobicContact CG2-CG1 4.39Å; I467-I471 VanDerWaalsContact O-CG1 3.24Å; I467-I471 WeakPolarHBondContact O-CG1 3.38Å; I467-I471 PolarHBondContact O-N 3.49Å; T468-I471 PolarHBondContact O-N 3.49Å; I471-L473 VanDerWaalsContact C-N 3.32Å; I471-L473 PolarHBondContact O-N 2.86Å; I471-I474 PolarHBondContact O-N 3.41Å; I471-A475 VanDerWaalsContact O-CB 3.3Å; I471-A475 WeakPolarHBondContact O-CB 3.44Å; I471-A475 PolarHBondContact O-N 3.46Å
472	E	71.9	Confident	72	Confident	126 Å²	126	114 Å²	114	59%	0.589	58%	0.579	S	S	*	*	H	α-helix	trans	-61.5	-39.5	174.9	-85.2	-176.5	161.1	0	0	112.4	T468 A475 R476	T468-E472 PolarHBondContact O-N 3.02Å; E472-A475 PolarHBondContact O-N 3.44Å; E472-R476 WeakPolarHBondContact O-CG 3.44Å; E472-R476 PolarHBondContact O-N 3.37Å
473	L	72.5	Confident	71.4	Confident	113 Å²	113	113.7 Å²	113.7	59%	0.592	58%	0.58	S	S	*	*	H	α-helix	trans	-70.7	-38.7	-179.5	-147	127.2	0	0	0	112	G469 K470 I471 H477	G469-L473 WeakPolarHBondContact O-CB 3.41Å; G469-L473 PolarHBondContact O-N 3.41Å; K470-L473 PolarHBondContact O-N 2.94Å; I471-L473 VanDerWaalsContact C-N 3.32Å; I471-L473 PolarHBondContact O-N 2.86Å; L473-H477 PolarHBondContact O-N 3.11Å; L473-H477 VanDerWaalsContact O-N 3.11Å
474	I	71.7	Confident	70.8	Confident	105 Å²	105	118.5 Å²	118.5	54%	0.538	60%	0.595	S	S	.	*	H	α-helix	trans	-65	-44.5	172.2	-68.2	165.1	0	0	0	110	K470 I471 R476 H477 T478	K470-I474 WeakPolarHBondContact O-CB 3.48Å; K470-I474 WeakPolarHBondContact O-CD1 3.47Å; K470-I474 VanDerWaalsContact O-CG1 3.23Å; K470-I474 WeakPolarHBondContact O-CG1 3.23Å; K470-I474 PolarHBondContact O-N 2.98Å; I471-I474 PolarHBondContact O-N 3.41Å; I474-R476 VanDerWaalsContact C-N 3.34Å; I474-R476 PolarHBondContact O-N 3.08Å; I474-H477 PolarHBondContact O-N 3.4Å; I474-H477 VanDerWaalsContact O-N 3.08Å; I474-T478 PolarHBondContact O-N 2.89Å; I474-T478 PolarHBondContact O-OG1 3.3Å
475	A	69.7	Low	70.2	Confident	44 Å²	44	113.7 Å²	113.7	36%	0.364	59%	0.586	S	S	.	*	H	α-helix	trans	-57.9	-44.6	177.6	0	0	0	0	0	111.9	I471 E472 H477 T478 E479	I471-A475 VanDerWaalsContact O-CB 3.3Å; I471-A475 WeakPolarHBondContact O-CB 3.44Å; I471-A475 PolarHBondContact O-N 3.46Å; E472-A475 PolarHBondContact O-N 3.44Å; A475-H477 VanDerWaalsContact C-N 3.33Å; A475-H477 PolarHBondContact O-N 3.29Å; A475-T478 WeakPolarHBondContact CA-OG1 3.3Å; A475-T478 PolarHBondContact O-N 3Å; A475-T478 PolarHBondContact O-OG1 3.02Å; A475-E479 PolarHBondContact O-N 3.44Å
476	R	69.8	Low	69.7	Low	178 Å²	178	114.4 Å²	114.4	67%	0.672	59%	0.59	S	S	*	*	H	α-helix	trans	-65	-32.4	174.9	-74.5	-176.5	-175.6	-176.3	3.8	113.7	E472 I474	E472-R476 WeakPolarHBondContact O-CG 3.44Å; E472-R476 PolarHBondContact O-N 3.37Å; I474-R476 VanDerWaalsContact C-N 3.34Å; I474-R476 PolarHBondContact O-N 3.08Å
477	H	67.4	Low	69.1	Low	125 Å²	125	116.5 Å²	116.5	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-75.8	-26.6	176.8	-100.7	61.2	0	0	0	113.1	L473 I474 A475	L473-H477 PolarHBondContact O-N 3.11Å; L473-H477 VanDerWaalsContact O-N 3.11Å; I474-H477 PolarHBondContact O-N 3.4Å; I474-H477 VanDerWaalsContact O-N 3.08Å; A475-H477 VanDerWaalsContact C-N 3.33Å; A475-H477 PolarHBondContact O-N 3.29Å
478	T	61	Low	68.4	Low	112 Å²	112	117 Å²	117	69%	0.687	59%	0.593	S	S	*	*	H	α-helix	trans	-79.9	-15.2	173.1	33.5	0	0	0	0	114	I474 A475	I474-T478 PolarHBondContact O-N 2.89Å; I474-T478 PolarHBondContact O-OG1 3.3Å; A475-T478 WeakPolarHBondContact CA-OG1 3.3Å; A475-T478 PolarHBondContact O-N 3Å; A475-T478 PolarHBondContact O-OG1 3.02Å
479	E	57.2	Low	67.9	Low	171 Å²	171	121 Å²	121	80%	0.799	61%	0.607	S	S	*	*			trans	-88.1	-12.2	174.5	-74.2	-177.9	172.2	0	0	113.6	A475	A475-E479 PolarHBondContact O-N 3.44Å
480	M	49.8	Very low	67.1	Low	194 Å²	194	129.1 Å²	129.1	96%	0.956	63%	0.632	S	S	*	*			trans	-94	0	167.4	-73.4	-171.2	-61.9	0	0	110.3

Retrieved 480 of 480 residues in 2416.6 ms (Link to these results)

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