A0A077Z9C4_TRITR Loading...

RNA polymerase II-associated protein 3

AlphaFold DB , UniProt , Accession A0A077Z9C4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 501 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	47.6	Very low	61	Low	97 Å²	97	75.5 Å²	75.5	48%	0.478	41%	0.408	S	S	.	.				0	-60.6	0	-74.6	-173.6	61.8	0	0	111.3	L3 A4 E5 L57	M1-L3 PolarHBondContact O-N 3Å; M1-A4 CarbonylContact O-C 3.55Å; M1-A4 VanDerWaalsContact O-CA 3.32Å; M1-A4 WeakPolarHBondContact O-CA 3.45Å; M1-A4 VanDerWaalsContact O-CB 3.24Å; M1-A4 WeakPolarHBondContact O-CB 3.37Å; M1-A4 PolarHBondContact O-N 3.47Å; M1-E5 PolarHBondContact O-N 3.13Å; M1-L57 HydrophobicContact CG-CD2 4.1Å
2	Q	53.7	Low	61.5	Low	147 Å²	147	77.4 Å²	77.4	69%	0.687	41%	0.405	S	S	*	.	H	α-helix	trans	-55.7	-44	-179.4	-157.7	152.5	-0.6	0	0	114.3	A4 E5 D6	Q2-A4 VanDerWaalsContact C-N 3.25Å; Q2-A4 PolarHBondContact O-N 3.44Å; Q2-E5 PolarHBondContact O-N 3.19Å; Q2-D6 WeakPolarHBondContact O-CB 3.44Å; Q2-D6 VanDerWaalsContact O-CG 3.23Å; Q2-D6 PolarHBondContact O-N 3.45Å
3	L	56.5	Low	62.5	Low	142 Å²	142	77.9 Å²	77.9	74%	0.743	41%	0.413	S	S	*	.	H	α-helix	trans	-60.1	-32	171.7	-72.7	168	0	0	0	113.9	M1 S7	M1-L3 PolarHBondContact O-N 3Å; L3-S7 VanDerWaalsContact O-CB 3.3Å; L3-S7 WeakPolarHBondContact O-CB 3.48Å; L3-S7 PolarHBondContact O-N 2.65Å; L3-S7 PolarHBondContact O-OG 2.72Å
4	A	54.7	Low	63.3	Low	13 Å²	13	77.8 Å²	77.8	11%	0.107	41%	0.409	C	S	.	.	H	α-helix	trans	-76.1	-42.4	177.3	0	0	0	0	0	110.8	M1 Q2 S7 L8 L53	M1-A4 CarbonylContact O-C 3.55Å; M1-A4 VanDerWaalsContact O-CA 3.32Å; M1-A4 WeakPolarHBondContact O-CA 3.45Å; M1-A4 VanDerWaalsContact O-CB 3.24Å; M1-A4 WeakPolarHBondContact O-CB 3.37Å; M1-A4 PolarHBondContact O-N 3.47Å; Q2-A4 VanDerWaalsContact C-N 3.25Å; Q2-A4 PolarHBondContact O-N 3.44Å; A4-S7 PolarHBondContact O-N 2.96Å; A4-L8 VanDerWaalsContact O-CB 3.29Å; A4-L8 WeakPolarHBondContact O-CB 3.37Å; A4-L8 WeakPolarHBondContact O-CD1 3.39Å; A4-L8 VanDerWaalsContact O-CG 3.23Å; A4-L8 WeakPolarHBondContact O-CG 3.45Å; A4-L8 PolarHBondContact O-N 3.3Å; A4-L53 HydrophobicContact CB-CD1 4.35Å; A4-L53 HydrophobicContact CB-CD2 3.79Å; A4-L53 HydrophobicContact CB-CG 4.46Å
5	E	58.9	Low	63.7	Low	87 Å²	87	72.7 Å²	72.7	41%	0.407	38%	0.382	S	S	.	.	H	α-helix	trans	-61.2	-44.2	172.9	-75.5	169.8	-149.7	0	0	111.6	M1 Q2 L8 S9	M1-E5 PolarHBondContact O-N 3.13Å; Q2-E5 PolarHBondContact O-N 3.19Å; E5-L8 PolarHBondContact O-N 3.3Å; E5-S9 WeakPolarHBondContact O-CB 3.3Å; E5-S9 PolarHBondContact O-N 3.07Å
6	D	66.4	Low	64.2	Low	79 Å²	79	72.3 Å²	72.3	42%	0.422	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-43.1	175.3	-69.8	-23.8	0	0	0	110.9	Q2 L8 S9 N10	Q2-D6 WeakPolarHBondContact O-CB 3.44Å; Q2-D6 VanDerWaalsContact O-CG 3.23Å; Q2-D6 PolarHBondContact O-N 3.45Å; D6-L8 PolarHBondContact O-N 3.35Å; D6-S9 PolarHBondContact O-N 2.91Å; D6-S9 PolarHBondContact O-OG 3.17Å; D6-N10 WeakPolarHBondContact O-CB 3.01Å; D6-N10 PolarHBondContact O-N 3.36Å; D6-N10 PolarHBondContact O-ND2 3.43Å; D6-N10 VanDerWaalsContact O-ND2 3.09Å
7	S	63.2	Low	64.8	Low	54 Å²	54	73.4 Å²	73.4	38%	0.378	39%	0.39	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.3	-62.6	0	0	0	0	111.7	L3 A4 C11	L3-S7 VanDerWaalsContact O-CB 3.3Å; L3-S7 WeakPolarHBondContact O-CB 3.48Å; L3-S7 PolarHBondContact O-N 2.65Å; L3-S7 PolarHBondContact O-OG 2.72Å; A4-S7 PolarHBondContact O-N 2.96Å; S7-C11 WeakPolarHBondContact O-CB 3.42Å; S7-C11 PolarHBondContact O-N 2.87Å; S7-C11 PolarHBondContact O-SG 3.46Å
8	L	63.1	Low	65.3	Low	17 Å²	17	73.2 Å²	73.2	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-69.4	-40.2	178.7	-78.9	160	0	0	0	112.3	A4 E5 D6 C11 R12 V50 L53 L71	A4-L8 VanDerWaalsContact O-CB 3.29Å; A4-L8 WeakPolarHBondContact O-CB 3.37Å; A4-L8 WeakPolarHBondContact O-CD1 3.39Å; A4-L8 VanDerWaalsContact O-CG 3.23Å; A4-L8 WeakPolarHBondContact O-CG 3.45Å; A4-L8 PolarHBondContact O-N 3.3Å; E5-L8 PolarHBondContact O-N 3.3Å; D6-L8 PolarHBondContact O-N 3.35Å; L8-C11 PolarHBondContact O-N 3.25Å; L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.21Å; L8-V50 HydrophobicContact CD2-CG2 3.93Å; L8-L53 HydrophobicContact CG-CD1 4.39Å; L8-L71 HydrophobicContact CD1-CD1 3.77Å; L8-L71 HydrophobicContact CD2-CD1 3.85Å; L8-L71 HydrophobicContact CD2-CD2 3.89Å; L8-L71 HydrophobicContact CG-CD1 4.46Å
9	S	68.8	Low	65.5	Low	55 Å²	55	71.5 Å²	71.5	39%	0.385	37%	0.374	S	S	.	.	H	α-helix	trans	-65.7	-44.4	177.8	88.9	0	0	0	0	110.7	E5 D6 C11 R12 V13	E5-S9 WeakPolarHBondContact O-CB 3.3Å; E5-S9 PolarHBondContact O-N 3.07Å; D6-S9 PolarHBondContact O-N 2.91Å; D6-S9 PolarHBondContact O-OG 3.17Å; S9-C11 VanDerWaalsContact C-N 3.3Å; S9-C11 PolarHBondContact O-N 3.02Å; S9-R12 WeakPolarHBondContact O-CB 3.37Å; S9-R12 PolarHBondContact O-N 3.48Å; S9-R12 VanDerWaalsContact O-N 3.12Å; S9-V13 WeakPolarHBondContact O-CG2 3.42Å; S9-V13 PolarHBondContact O-N 3.1Å
10	N	71.2	Confident	65.8	Low	108 Å²	108	69.6 Å²	69.6	58%	0.578	37%	0.366	S	S	*	.	H	α-helix	trans	-59.6	-42.1	173.8	-73.5	-28.6	0	0	0	111.2	D6 V13 E14	D6-N10 WeakPolarHBondContact O-CB 3.01Å; D6-N10 PolarHBondContact O-N 3.36Å; D6-N10 PolarHBondContact O-ND2 3.43Å; D6-N10 VanDerWaalsContact O-ND2 3.09Å; N10-V13 PolarHBondContact O-N 3.2Å; N10-E14 WeakPolarHBondContact O-CB 3.34Å; N10-E14 PolarHBondContact O-N 3.28Å
11	C	67.3	Low	66.2	Low	32 Å²	32	67.6 Å²	67.6	22%	0.216	36%	0.36	C	S	.	.	H	α-helix	trans	-66.6	-35.6	175.9	-70.3	0	0	0	0	113.2	S7 L8 S9 L15 L46	S7-C11 WeakPolarHBondContact O-CB 3.42Å; S7-C11 PolarHBondContact O-N 2.87Å; S7-C11 PolarHBondContact O-SG 3.46Å; L8-C11 PolarHBondContact O-N 3.25Å; S9-C11 VanDerWaalsContact C-N 3.3Å; S9-C11 PolarHBondContact O-N 3.02Å; C11-L15 WeakPolarHBondContact O-CB 3.49Å; C11-L15 WeakPolarHBondContact O-CG 3.49Å; C11-L15 PolarHBondContact O-N 3.45Å; C11-L46 HydrophobicContact CB-CD1 3.34Å; C11-L46 HydrophobicContact CB-CD2 4.19Å; C11-L46 HydrophobicContact CB-CG 4.39Å; C11-L46 VanDerWaalsContact SG-CD1 3.51Å
12	R	66.2	Low	67.2	Low	98 Å²	98	63.2 Å²	63.2	37%	0.37	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-47.7	174.3	-80.5	178.4	163.6	166.4	-0.1	111.2	L8 S9 E14 L15 T16 E74	L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.21Å; S9-R12 WeakPolarHBondContact O-CB 3.37Å; S9-R12 PolarHBondContact O-N 3.48Å; S9-R12 VanDerWaalsContact O-N 3.12Å; R12-E14 VanDerWaalsContact C-N 3.33Å; R12-E14 PolarHBondContact O-N 3.49Å; R12-L15 PolarHBondContact O-N 3.27Å; R12-T16 PolarHBondContact O-N 2.91Å; R12-T16 PolarHBondContact O-OG1 3.39Å; R12-E74 IonicContact CZ-OE2 3.69Å; R12-E74 IonicContact NE-OE1 3.71Å; R12-E74 IonicContact NE-OE2 2.79Å; R12-E74 PolarHBondContact NE-OE2 3.39Å; R12-E74 IonicContact NH2-OE2 3.5Å; R12-E74 PolarHBondContact NH2-OE2 2.71Å
13	V	74.7	Confident	67.7	Low	84 Å²	84	61.9 Å²	61.9	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-46.7	176.5	173.6	0	0	0	0	110.4	S9 N10 L15 T16 N17	S9-V13 WeakPolarHBondContact O-CG2 3.42Å; S9-V13 PolarHBondContact O-N 3.1Å; N10-V13 PolarHBondContact O-N 3.2Å; V13-L15 PolarHBondContact O-N 3.13Å; V13-T16 PolarHBondContact O-N 3.05Å; V13-N17 WeakPolarHBondContact O-CB 3.38Å; V13-N17 VanDerWaalsContact O-CG 3.24Å; V13-N17 PolarHBondContact O-N 2.89Å; V13-N17 PolarHBondContact O-ND2 3.27Å
14	E	73.9	Confident	68.4	Low	76 Å²	76	64 Å²	64	36%	0.355	33%	0.334	S	S	.	.	H	α-helix	trans	-61.2	-44.7	178.6	-177.3	62.8	-171	0	0	112.4	N10 R12 T16 N17 R18 T42	N10-E14 WeakPolarHBondContact O-CB 3.34Å; N10-E14 PolarHBondContact O-N 3.28Å; R12-E14 VanDerWaalsContact C-N 3.33Å; R12-E14 PolarHBondContact O-N 3.49Å; E14-T16 PolarHBondContact O-N 3.2Å; E14-N17 PolarHBondContact O-N 3.38Å; E14-R18 WeakPolarHBondContact O-CG 3.27Å; E14-R18 PolarHBondContact O-N 2.98Å; E14-R18 IonicContact OE1-CZ 2.79Å; E14-R18 IonicContact OE1-NE 3.64Å; E14-R18 PolarHBondContact OE1-NE 2.87Å; E14-R18 IonicContact OE1-NH2 2.7Å; E14-R18 PolarHBondContact OE1-NH2 2.95Å; E14-T42 HydrophobicContact CG-CG2 4.38Å
15	L	69.6	Low	68.9	Low	2 Å²	2	64.2 Å²	64.2	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-41.3	176.6	-79.3	172.3	0	0	0	112.4	C11 R12 V13 R18 L19 L39 T42 L43 L46 K78	C11-L15 WeakPolarHBondContact O-CB 3.49Å; C11-L15 WeakPolarHBondContact O-CG 3.49Å; C11-L15 PolarHBondContact O-N 3.45Å; R12-L15 PolarHBondContact O-N 3.27Å; V13-L15 PolarHBondContact O-N 3.13Å; L15-R18 PolarHBondContact O-N 2.96Å; L15-L19 WeakPolarHBondContact O-CB 3.43Å; L15-L19 PolarHBondContact O-N 3.32Å; L15-L39 HydrophobicContact CD2-CD1 3.98Å; L15-T42 HydrophobicContact CD2-CG2 3.81Å; L15-T42 HydrophobicContact CG-CG2 4.29Å; L15-L43 HydrophobicContact CD1-CD2 3.71Å; L15-L43 HydrophobicContact CD2-CD2 3.53Å; L15-L43 HydrophobicContact CD2-CG 3.95Å; L15-L43 HydrophobicContact CG-CD2 4.3Å; L15-L46 HydrophobicContact CD1-CD2 3.36Å; L15-K78 HydrophobicContact CB-CD 4.4Å; L15-K78 HydrophobicContact CD1-CD 3.93Å
16	T	71.2	Confident	69.2	Low	65 Å²	65	68.6 Å²	68.6	40%	0.399	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-44.4	176.4	-59.3	0	0	0	0	110.7	R12 V13 E14 R18 L19 C20	R12-T16 PolarHBondContact O-N 2.91Å; R12-T16 PolarHBondContact O-OG1 3.39Å; V13-T16 PolarHBondContact O-N 3.05Å; E14-T16 PolarHBondContact O-N 3.2Å; T16-R18 PolarHBondContact O-N 3.07Å; T16-L19 PolarHBondContact O-N 3.33Å; T16-C20 WeakPolarHBondContact O-CB 3.37Å; T16-C20 PolarHBondContact O-N 3.45Å; T16-C20 PolarHBondContact O-SG 3.28Å
17	N	74.7	Confident	68.6	Low	92 Å²	92	71.2 Å²	71.2	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-61.5	-44	177.2	-71.4	-19.3	0	0	0	112.1	V13 E14 C20 A21	V13-N17 WeakPolarHBondContact O-CB 3.38Å; V13-N17 VanDerWaalsContact O-CG 3.24Å; V13-N17 PolarHBondContact O-N 2.89Å; V13-N17 PolarHBondContact O-ND2 3.27Å; E14-N17 PolarHBondContact O-N 3.38Å; N17-C20 PolarHBondContact O-N 2.98Å; N17-A21 PolarHBondContact O-N 2.99Å
18	R	73.8	Confident	68.2	Low	69 Å²	69	73.5 Å²	73.5	26%	0.26	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-39.5	176.3	-71.9	179.5	-176.5	-91.7	-7.9	112.2	E14 L15 T16 A21 V22 E38 L39 T42	E14-R18 WeakPolarHBondContact O-CG 3.27Å; E14-R18 PolarHBondContact O-N 2.98Å; E14-R18 IonicContact OE1-CZ 2.79Å; E14-R18 IonicContact OE1-NE 3.64Å; E14-R18 PolarHBondContact OE1-NE 2.87Å; E14-R18 IonicContact OE1-NH2 2.7Å; E14-R18 PolarHBondContact OE1-NH2 2.95Å; L15-R18 PolarHBondContact O-N 2.96Å; T16-R18 PolarHBondContact O-N 3.07Å; R18-A21 WeakPolarHBondContact O-CB 3.5Å; R18-A21 PolarHBondContact O-N 3.22Å; R18-V22 WeakPolarHBondContact O-CG2 3.32Å; R18-V22 PolarHBondContact O-N 2.94Å; R18-E38 IonicContact NH1-OE2 3.67Å; R18-L39 HydrophobicContact CB-CD1 3.54Å; R18-T42 VanDerWaalsContact CD-OG1 3.26Å; R18-T42 WeakPolarHBondContact CD-OG1 3.27Å; R18-T42 PolarHBondContact NE-OG1 2.95Å
19	L	68.6	Low	68.1	Low	41 Å²	41	74.1 Å²	74.1	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-46.7	174.1	-165.9	85.7	0	0	0	111	L15 T16 A21 V22 L23 L39 L81	L15-L19 WeakPolarHBondContact O-CB 3.43Å; L15-L19 PolarHBondContact O-N 3.32Å; T16-L19 PolarHBondContact O-N 3.33Å; L19-A21 VanDerWaalsContact C-N 3.26Å; L19-A21 PolarHBondContact O-N 3.01Å; L19-V22 WeakPolarHBondContact O-CB 3.3Å; L19-V22 PolarHBondContact O-N 3.46Å; L19-V22 VanDerWaalsContact O-N 3.14Å; L19-L23 HydrophobicContact CD2-CD1 4.3Å; L19-L23 HydrophobicContact CG-CD1 4.35Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 2.84Å; L19-L39 HydrophobicContact CD1-CD2 3.93Å; L19-L81 HydrophobicContact CD1-CD2 3.46Å; L19-L81 VanDerWaalsContact CD1-CD2 3.46Å; L19-L81 HydrophobicContact CD1-CG 4.3Å; L19-L81 HydrophobicContact CD2-CD2 4Å; L19-L81 HydrophobicContact CG-CD2 4.29Å
20	C	71.8	Confident	68.1	Low	33 Å²	33	77.5 Å²	77.5	22%	0.223	39%	0.388	C	S	.	.	H	α-helix	trans	-58.5	-39	175.1	-71.9	0	0	0	0	111.7	T16 N17 L23 R24	T16-C20 WeakPolarHBondContact O-CB 3.37Å; T16-C20 PolarHBondContact O-N 3.45Å; T16-C20 PolarHBondContact O-SG 3.28Å; N17-C20 PolarHBondContact O-N 2.98Å; C20-L23 PolarHBondContact O-N 3.09Å; C20-R24 WeakPolarHBondContact O-CB 3.49Å; C20-R24 VanDerWaalsContact O-CG 3.25Å; C20-R24 WeakPolarHBondContact O-CG 3.47Å; C20-R24 PolarHBondContact O-N 3.02Å
21	A	73.9	Confident	68.3	Low	29 Å²	29	76.3 Å²	76.3	24%	0.24	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-42.5	175	0	0	0	0	0	112.3	N17 R18 L19 R24 C25	N17-A21 PolarHBondContact O-N 2.99Å; R18-A21 WeakPolarHBondContact O-CB 3.5Å; R18-A21 PolarHBondContact O-N 3.22Å; L19-A21 VanDerWaalsContact C-N 3.26Å; L19-A21 PolarHBondContact O-N 3.01Å; A21-R24 PolarHBondContact O-N 3.43Å; A21-C25 PolarHBondContact O-N 3.38Å; A21-C25 PolarHBondContact O-SG 2.66Å
22	V	68.6	Low	68.5	Low	5 Å²	5	75.7 Å²	75.7	3%	0.03	37%	0.374	C	S	.	.	H	α-helix	trans	-61.2	-44	173.9	172.6	0	0	0	0	110.9	R18 L19 R24 C25 L32 R35 L36 L39 L85	R18-V22 WeakPolarHBondContact O-CG2 3.32Å; R18-V22 PolarHBondContact O-N 2.94Å; L19-V22 WeakPolarHBondContact O-CB 3.3Å; L19-V22 PolarHBondContact O-N 3.46Å; L19-V22 VanDerWaalsContact O-N 3.14Å; V22-R24 VanDerWaalsContact C-N 3.28Å; V22-R24 PolarHBondContact O-N 2.93Å; V22-C25 WeakPolarHBondContact O-CB 3.37Å; V22-C25 PolarHBondContact O-N 3.41Å; V22-L32 HydrophobicContact CG1-CD1 3.85Å; V22-R35 HydrophobicContact CG2-CB 3.64Å; V22-L36 HydrophobicContact CG1-CD2 3.8Å; V22-L36 HydrophobicContact CG1-CG 4.2Å; V22-L36 HydrophobicContact CG2-CD2 4.37Å; V22-L39 HydrophobicContact CG2-CD2 4.2Å; V22-L85 HydrophobicContact CG1-CD1 3.95Å
23	L	65.5	Low	68.7	Low	118 Å²	118	73.9 Å²	73.9	62%	0.618	37%	0.369	S	S	*	.	H	α-helix	trans	-67.8	-25.7	179.3	-67.2	173.7	0	0	0	113.3	L19 C20	L19-L23 HydrophobicContact CD2-CD1 4.3Å; L19-L23 HydrophobicContact CG-CD1 4.35Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 2.84Å; C20-L23 PolarHBondContact O-N 3.09Å
24	R	69.7	Low	68.9	Low	187 Å²	187	75.5 Å²	75.5	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-82.3	-13.3	175.4	-73.3	172.7	-177.9	-174.8	-1.5	113.5	C20 A21 V22	C20-R24 WeakPolarHBondContact O-CB 3.49Å; C20-R24 VanDerWaalsContact O-CG 3.25Å; C20-R24 WeakPolarHBondContact O-CG 3.47Å; C20-R24 PolarHBondContact O-N 3.02Å; A21-R24 PolarHBondContact O-N 3.43Å; V22-R24 VanDerWaalsContact C-N 3.28Å; V22-R24 PolarHBondContact O-N 2.93Å
25	C	65	Low	69.1	Low	17 Å²	17	75.8 Å²	75.8	12%	0.115	37%	0.369	C	S	.	.	S	Bend	trans	-67.3	137.8	179.7	-72.5	0	0	0	0	111	A21 V22 R27 L32	A21-C25 PolarHBondContact O-N 3.38Å; A21-C25 PolarHBondContact O-SG 2.66Å; V22-C25 WeakPolarHBondContact O-CB 3.37Å; V22-C25 PolarHBondContact O-N 3.41Å; C25-R27 PolarHBondContact O-N 3.05Å; C25-L32 HydrophobicContact CB-CB 4.2Å; C25-L32 HydrophobicContact CB-CD1 3.97Å
26	K	65.1	Low	69.2	Low	180 Å²	180	75.9 Å²	75.9	78%	0.783	37%	0.369	S	S	*	.			trans	-61.5	135.2	168	-70.9	-178	177.7	179.4	0	108.8	N28 S29	K26-N28 PolarHBondContact O-N 3.33Å; K26-S29 PolarHBondContact O-N 3.4Å; K26-S29 PolarHBondContact O-OG 3.31Å
27	R	55.1	Low	69.4	Low	134 Å²	134	78 Å²	78	51%	0.506	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-26.3	-169.9	-71.5	-178.2	176	159.5	1.7	115.6	C25 W501	C25-R27 PolarHBondContact O-N 3.05Å; R27-W501 PolarHBondContact NH2-O 3.24Å
28	N	54.6	Low	69.5	Low	101 Å²	101	76.3 Å²	76.3	54%	0.54	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	21.8	-173.5	-59	10.7	0	0	0	113	K26 E96	K26-N28 PolarHBondContact O-N 3.33Å; N28-E96 PolarHBondContact ND2-OE1 2.91Å
29	S	60.5	Low	69.6	Low	31 Å²	31	73.2 Å²	73.2	22%	0.217	35%	0.353	C	S	.	.			trans	-86	141.6	176.9	69.3	0	0	0	0	111.5	K26 E31 L32	K26-S29 PolarHBondContact O-N 3.4Å; K26-S29 PolarHBondContact O-OG 3.31Å; S29-E31 PolarHBondContact O-N 3.49Å; S29-E31 VanDerWaalsContact O-N 3.12Å; S29-E31 WeakPolarHBondContact OG-CB 3.33Å; S29-L32 WeakPolarHBondContact O-CB 3.5Å; S29-L32 PolarHBondContact O-N 2.93Å; S29-L32 PolarHBondContact OG-N 3.5Å
30	T	69.9	Low	69.6	Low	126 Å²	126	72.9 Å²	72.9	77%	0.773	35%	0.353	S	S	*	.	H	α-helix	trans	-54	-25.5	163.3	48.7	0	0	0	0	111.8	L32 H33 Q34	T30-L32 VanDerWaalsContact C-N 3.33Å; T30-L32 PolarHBondContact O-N 2.91Å; T30-H33 PolarHBondContact O-N 3.19Å; T30-Q34 PolarHBondContact O-N 3.39Å
31	E	75.1	Confident	69.7	Low	83 Å²	83	75.1 Å²	75.1	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-37.8	172.1	-172.2	-177.7	-171.6	0	0	112.1	S29 H33 Q34 R35	S29-E31 PolarHBondContact O-N 3.49Å; S29-E31 VanDerWaalsContact O-N 3.12Å; S29-E31 WeakPolarHBondContact OG-CB 3.33Å; E31-H33 PolarHBondContact O-N 3.37Å; E31-Q34 PolarHBondContact O-N 3.46Å; E31-R35 HydrophobicContact CG-CG 3.99Å; E31-R35 WeakPolarHBondContact O-CB 3.4Å; E31-R35 WeakPolarHBondContact O-CG 3.49Å; E31-R35 PolarHBondContact O-N 3.06Å; E31-R35 IonicContact OE1-CZ 3.2Å; E31-R35 IonicContact OE1-NE 2.81Å; E31-R35 PolarHBondContact OE1-NE 3.12Å; E31-R35 IonicContact OE1-NH2 3.39Å; E31-R35 PolarHBondContact OE1-NH2 2.68Å
32	L	71.4	Confident	69.6	Low	19 Å²	19	75 Å²	75	10%	0.099	37%	0.366	C	S	.	.	H	α-helix	trans	-58.5	-48.4	178.8	179.8	66.9	0	0	0	111.8	V22 C25 S29 T30 R35 L36 A89	V22-L32 HydrophobicContact CG1-CD1 3.85Å; C25-L32 HydrophobicContact CB-CB 4.2Å; C25-L32 HydrophobicContact CB-CD1 3.97Å; S29-L32 WeakPolarHBondContact O-CB 3.5Å; S29-L32 PolarHBondContact O-N 2.93Å; S29-L32 PolarHBondContact OG-N 3.5Å; T30-L32 VanDerWaalsContact C-N 3.33Å; T30-L32 PolarHBondContact O-N 2.91Å; L32-R35 PolarHBondContact O-N 3.03Å; L32-L36 HydrophobicContact CD1-CD1 4.31Å; L32-L36 HydrophobicContact CD1-CG 4.48Å; L32-L36 HydrophobicContact CG-CD1 4.05Å; L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 VanDerWaalsContact O-CG 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 2.79Å; L32-A89 HydrophobicContact CD2-CB 3.86Å
33	H	70.4	Confident	69.4	Low	60 Å²	60	74.9 Å²	74.9	28%	0.278	37%	0.365	S	S	.	.	H	α-helix	trans	-62.6	-43.5	178.2	-77.8	44.3	0	0	0	111.6	T30 E31 R35 L36 E37 A89 Q93	T30-H33 PolarHBondContact O-N 3.19Å; E31-H33 PolarHBondContact O-N 3.37Å; H33-R35 PolarHBondContact O-N 3.41Å; H33-L36 PolarHBondContact O-N 2.7Å; H33-E37 PolarHBondContact O-N 2.8Å; H33-A89 VanDerWaalsContact CE1-CB 3.49Å; H33-A89 WeakPolarHBondContact CE1-CB 3.45Å; H33-Q93 PolarHBondContact CE1-NE2 3.12Å; H33-Q93 PolarHBondContact NE2-NE2 3.08Å; H33-Q93 PolarHBondContact NE2-OE1 3.39Å
34	Q	78.2	Confident	69.4	Low	118 Å²	118	73.7 Å²	73.7	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-60.4	-45.5	176.9	-176.3	179.8	-10.8	0	0	111.5	T30 E31 L36 E37 E38	T30-Q34 PolarHBondContact O-N 3.39Å; E31-Q34 PolarHBondContact O-N 3.46Å; Q34-L36 VanDerWaalsContact C-N 3.33Å; Q34-L36 PolarHBondContact O-N 2.95Å; Q34-E37 PolarHBondContact O-N 3.17Å; Q34-E38 PolarHBondContact NE2-OE1 3.5Å; Q34-E38 WeakPolarHBondContact O-CB 3.4Å; Q34-E38 WeakPolarHBondContact O-CG 3.41Å; Q34-E38 PolarHBondContact O-N 3.25Å
35	R	78	Confident	69.3	Low	82 Å²	82	69.6 Å²	69.6	31%	0.309	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-35.3	178.4	-63.1	-73	-172.4	-169	2.5	112.2	V22 E31 L32 H33 E38 L39	V22-R35 HydrophobicContact CG2-CB 3.64Å; E31-R35 HydrophobicContact CG-CG 3.99Å; E31-R35 WeakPolarHBondContact O-CB 3.4Å; E31-R35 WeakPolarHBondContact O-CG 3.49Å; E31-R35 PolarHBondContact O-N 3.06Å; E31-R35 IonicContact OE1-CZ 3.2Å; E31-R35 IonicContact OE1-NE 2.81Å; E31-R35 PolarHBondContact OE1-NE 3.12Å; E31-R35 IonicContact OE1-NH2 3.39Å; E31-R35 PolarHBondContact OE1-NH2 2.68Å; L32-R35 PolarHBondContact O-N 3.03Å; H33-R35 PolarHBondContact O-N 3.41Å; R35-E38 IonicContact NH1-OE2 2.66Å; R35-E38 PolarHBondContact O-N 3.22Å; R35-L39 VanDerWaalsContact O-CB 3.3Å; R35-L39 WeakPolarHBondContact O-CB 3.34Å; R35-L39 PolarHBondContact O-N 3.18Å
36	L	72.4	Confident	69.2	Low	3 Å²	3	69.5 Å²	69.5	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-67.7	-38.6	174.7	-77.1	171.3	0	0	0	112.4	V22 L32 H33 Q34 S40 L85 K86 A89	V22-L36 HydrophobicContact CG1-CD2 3.8Å; V22-L36 HydrophobicContact CG1-CG 4.2Å; V22-L36 HydrophobicContact CG2-CD2 4.37Å; L32-L36 HydrophobicContact CD1-CD1 4.31Å; L32-L36 HydrophobicContact CD1-CG 4.48Å; L32-L36 HydrophobicContact CG-CD1 4.05Å; L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 VanDerWaalsContact O-CG 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 2.79Å; H33-L36 PolarHBondContact O-N 2.7Å; Q34-L36 VanDerWaalsContact C-N 3.33Å; Q34-L36 PolarHBondContact O-N 2.95Å; L36-S40 VanDerWaalsContact O-CB 3.29Å; L36-S40 WeakPolarHBondContact O-CB 3.46Å; L36-S40 PolarHBondContact O-N 3.09Å; L36-L85 HydrophobicContact CD1-CB 4.17Å; L36-L85 HydrophobicContact CD2-CB 3.49Å; L36-L85 VanDerWaalsContact CD2-CB 3.49Å; L36-L85 HydrophobicContact CD2-CD1 3.95Å; L36-L85 HydrophobicContact CD2-CG 4.36Å; L36-L85 HydrophobicContact CG-CB 4.48Å; L36-K86 HydrophobicContact CB-CG 4.34Å; L36-K86 HydrophobicContact CD1-CG 4.19Å; L36-A89 HydrophobicContact CD1-CB 4.2Å
37	E	75.3	Confident	68.9	Low	110 Å²	110	66.2 Å²	66.2	51%	0.514	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-44.9	172.5	-77.1	-56.4	143.6	0	0	111.8	H33 Q34 L39 S40 S41 K86	H33-E37 PolarHBondContact O-N 2.8Å; Q34-E37 PolarHBondContact O-N 3.17Å; E37-L39 PolarHBondContact O-N 3.04Å; E37-S40 WeakPolarHBondContact O-CB 3.34Å; E37-S40 PolarHBondContact O-N 3.38Å; E37-S41 PolarHBondContact O-N 3.24Å; E37-K86 WeakPolarHBondContact OE1-CE 3.48Å; E37-K86 IonicContact OE1-NZ 2.92Å; E37-K86 PolarHBondContact OE1-NZ 3.05Å; E37-K86 IonicContact OE2-NZ 3.35Å
38	E	77.4	Confident	69.2	Low	57 Å²	57	65.1 Å²	65.1	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-55.7	-49	173.8	-80.4	175.4	-162.2	0	0	111.7	R18 Q34 R35 S40 S41 T42	R18-E38 IonicContact NH1-OE2 3.67Å; Q34-E38 PolarHBondContact NE2-OE1 3.5Å; Q34-E38 WeakPolarHBondContact O-CB 3.4Å; Q34-E38 WeakPolarHBondContact O-CG 3.41Å; Q34-E38 PolarHBondContact O-N 3.25Å; R35-E38 IonicContact NH1-OE2 2.66Å; R35-E38 PolarHBondContact O-N 3.22Å; E38-S40 VanDerWaalsContact C-N 3.34Å; E38-S40 PolarHBondContact O-N 3.14Å; E38-S41 PolarHBondContact O-N 3.31Å; E38-T42 PolarHBondContact O-N 2.81Å; E38-T42 PolarHBondContact O-OG1 3.22Å
39	L	74.4	Confident	69.5	Low	4 Å²	4	62.7 Å²	62.7	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-40.1	178.1	-175.4	69.8	0	0	0	111.7	L15 R18 L19 V22 R35 E37 T42 L43 I82	L15-L39 HydrophobicContact CD2-CD1 3.98Å; R18-L39 HydrophobicContact CB-CD1 3.54Å; L19-L39 HydrophobicContact CD1-CD2 3.93Å; V22-L39 HydrophobicContact CG2-CD2 4.2Å; R35-L39 VanDerWaalsContact O-CB 3.3Å; R35-L39 WeakPolarHBondContact O-CB 3.34Å; R35-L39 PolarHBondContact O-N 3.18Å; E37-L39 PolarHBondContact O-N 3.04Å; L39-T42 PolarHBondContact O-N 3.36Å; L39-L43 PolarHBondContact O-N 3.29Å; L39-L43 VanDerWaalsContact O-N 3.08Å; L39-I82 HydrophobicContact CB-CD1 4.13Å; L39-I82 HydrophobicContact CD2-CD1 3.66Å; L39-I82 HydrophobicContact CD2-CG1 3.57Å; L39-I82 HydrophobicContact CG-CD1 3.5Å; L39-I82 HydrophobicContact CG-CG1 4.03Å
40	S	69.3	Low	69.5	Low	33 Å²	33	61.8 Å²	61.8	23%	0.231	31%	0.313	C	S	.	.	H	α-helix	trans	-61.9	-45.3	175.4	-172.2	0	0	0	0	111.4	L36 E37 E38 T42 L43 V44	L36-S40 VanDerWaalsContact O-CB 3.29Å; L36-S40 WeakPolarHBondContact O-CB 3.46Å; L36-S40 PolarHBondContact O-N 3.09Å; E37-S40 WeakPolarHBondContact O-CB 3.34Å; E37-S40 PolarHBondContact O-N 3.38Å; E38-S40 VanDerWaalsContact C-N 3.34Å; E38-S40 PolarHBondContact O-N 3.14Å; S40-T42 VanDerWaalsContact C-N 3.34Å; S40-T42 PolarHBondContact O-N 3.47Å; S40-L43 PolarHBondContact O-N 2.97Å; S40-V44 WeakPolarHBondContact O-CG2 3.39Å; S40-V44 PolarHBondContact O-N 3.23Å; S40-V44 VanDerWaalsContact O-N 3.1Å
41	S	73.6	Confident	68.8	Low	80 Å²	80	61.6 Å²	61.6	56%	0.559	30%	0.303	S	S	*	.	H	α-helix	trans	-61.5	-41.5	176.8	-173.7	0	0	0	0	111.8	E37 E38 V44 Q45	E37-S41 PolarHBondContact O-N 3.24Å; E38-S41 PolarHBondContact O-N 3.31Å; S41-V44 PolarHBondContact O-N 3.47Å; S41-Q45 PolarHBondContact O-N 3.3Å
42	T	72.1	Confident	68.2	Low	27 Å²	27	60.4 Å²	60.4	17%	0.166	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-40.3	177.2	-51.4	0	0	0	0	112	E14 L15 R18 E38 L39 S40 Q45 L46	E14-T42 HydrophobicContact CG-CG2 4.38Å; L15-T42 HydrophobicContact CD2-CG2 3.81Å; L15-T42 HydrophobicContact CG-CG2 4.29Å; R18-T42 VanDerWaalsContact CD-OG1 3.26Å; R18-T42 WeakPolarHBondContact CD-OG1 3.27Å; R18-T42 PolarHBondContact NE-OG1 2.95Å; E38-T42 PolarHBondContact O-N 2.81Å; E38-T42 PolarHBondContact O-OG1 3.22Å; L39-T42 PolarHBondContact O-N 3.36Å; S40-T42 VanDerWaalsContact C-N 3.34Å; S40-T42 PolarHBondContact O-N 3.47Å; T42-Q45 PolarHBondContact O-N 2.78Å; T42-L46 WeakPolarHBondContact O-CB 3.26Å; T42-L46 PolarHBondContact O-N 3.2Å
43	L	65.2	Low	67.6	Low	2 Å²	2	62 Å²	62	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-39.7	176.2	-77.8	-173.1	0	0	0	112.8	L15 L39 S40 L46 R47 L75 K78 D79 I82	L15-L43 HydrophobicContact CD1-CD2 3.71Å; L15-L43 HydrophobicContact CD2-CD2 3.53Å; L15-L43 HydrophobicContact CD2-CG 3.95Å; L15-L43 HydrophobicContact CG-CD2 4.3Å; L39-L43 PolarHBondContact O-N 3.29Å; L39-L43 VanDerWaalsContact O-N 3.08Å; S40-L43 PolarHBondContact O-N 2.97Å; L43-L46 PolarHBondContact O-N 3.35Å; L43-R47 PolarHBondContact O-N 3.08Å; L43-L75 HydrophobicContact CD2-CD2 3.78Å; L43-K78 HydrophobicContact CD1-CB 3.95Å; L43-K78 HydrophobicContact CD2-CB 4Å; L43-K78 HydrophobicContact CD2-CD 4.29Å; L43-D79 VanDerWaalsContact CD1-OD1 3.28Å; L43-D79 WeakPolarHBondContact CD1-OD1 3.42Å; L43-I82 HydrophobicContact CD1-CD1 3.27Å; L43-I82 HydrophobicContact CD1-CG1 4.12Å; L43-I82 HydrophobicContact CG-CD1 4.02Å
44	V	65.7	Low	66.8	Low	93 Å²	93	61.1 Å²	61.1	56%	0.564	31%	0.305	S	S	*	.	H	α-helix	trans	-62.2	-46.1	175.5	172.8	0	0	0	0	110.5	S40 S41 L46 R47 H48	S40-V44 WeakPolarHBondContact O-CG2 3.39Å; S40-V44 PolarHBondContact O-N 3.23Å; S40-V44 VanDerWaalsContact O-N 3.1Å; S41-V44 PolarHBondContact O-N 3.47Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.06Å; V44-R47 WeakPolarHBondContact O-CB 3.49Å; V44-R47 PolarHBondContact O-N 3.27Å; V44-H48 PolarHBondContact O-N 3.39Å
45	Q	66.1	Low	65.5	Low	101 Å²	101	64.9 Å²	64.9	47%	0.472	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-40.9	176.4	-171.9	61.9	38.8	0	0	111.7	S41 T42 R47 H48 N49	S41-Q45 PolarHBondContact O-N 3.3Å; T42-Q45 PolarHBondContact O-N 2.78Å; Q45-R47 VanDerWaalsContact C-N 3.35Å; Q45-R47 PolarHBondContact O-N 3.4Å; Q45-H48 WeakPolarHBondContact O-CB 3.48Å; Q45-H48 PolarHBondContact O-N 2.97Å; Q45-N49 PolarHBondContact NE2-OD1 2.66Å; Q45-N49 WeakPolarHBondContact O-CB 3.45Å; Q45-N49 PolarHBondContact O-N 3.48Å; Q45-N49 PolarHBondContact O-OD1 2.65Å
46	L	63.3	Low	64	Low	15 Å²	15	64.7 Å²	64.7	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-40.7	178	-172.2	60.7	0	0	0	111.6	C11 L15 T42 L43 V44 H48 N49 V50 L75	C11-L46 HydrophobicContact CB-CD1 3.34Å; C11-L46 HydrophobicContact CB-CD2 4.19Å; C11-L46 HydrophobicContact CB-CG 4.39Å; C11-L46 VanDerWaalsContact SG-CD1 3.51Å; L15-L46 HydrophobicContact CD1-CD2 3.36Å; T42-L46 WeakPolarHBondContact O-CB 3.26Å; T42-L46 PolarHBondContact O-N 3.2Å; L43-L46 PolarHBondContact O-N 3.35Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.06Å; L46-H48 VanDerWaalsContact C-N 3.3Å; L46-H48 PolarHBondContact O-N 3.31Å; L46-N49 PolarHBondContact O-N 3.31Å; L46-V50 HydrophobicContact CD1-CG2 4.42Å; L46-V50 HydrophobicContact CG-CG2 4.34Å; L46-V50 WeakPolarHBondContact O-CB 3.26Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 2.76Å; L46-L75 HydrophobicContact CB-CD2 4.38Å; L46-L75 HydrophobicContact CD2-CD2 3.68Å; L46-L75 HydrophobicContact CG-CD2 4.12Å
47	R	58.7	Low	62.8	Low	111 Å²	111	67.1 Å²	67.1	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-59.1	-44.4	174.5	-170.6	-175.6	-53.2	-159.9	-0.4	111.2	L43 V44 Q45 H51 D79	L43-R47 PolarHBondContact O-N 3.08Å; V44-R47 WeakPolarHBondContact O-CB 3.49Å; V44-R47 PolarHBondContact O-N 3.27Å; Q45-R47 VanDerWaalsContact C-N 3.35Å; Q45-R47 PolarHBondContact O-N 3.4Å; R47-H51 VanDerWaalsContact O-CB 3.31Å; R47-H51 WeakPolarHBondContact O-CB 3.45Å; R47-H51 PolarHBondContact O-N 2.85Å; R47-D79 IonicContact CZ-OD2 3.6Å; R47-D79 IonicContact NH2-OD1 3.89Å; R47-D79 PolarHBondContact NH2-OD1 3.23Å; R47-D79 IonicContact NH2-OD2 3.13Å; R47-D79 PolarHBondContact NH2-OD2 3.37Å
48	H	61.3	Low	61.1	Low	112 Å²	112	71.7 Å²	71.7	52%	0.519	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-46	175.4	-172.8	76.3	0	0	0	111.5	V44 Q45 L46 H51 T52	V44-H48 PolarHBondContact O-N 3.39Å; Q45-H48 WeakPolarHBondContact O-CB 3.48Å; Q45-H48 PolarHBondContact O-N 2.97Å; L46-H48 VanDerWaalsContact C-N 3.3Å; L46-H48 PolarHBondContact O-N 3.31Å; H48-H51 CarbonylContact O-C 3.57Å; H48-H51 PolarHBondContact O-N 3.08Å; H48-T52 WeakPolarHBondContact O-CG2 3.05Å; H48-T52 PolarHBondContact O-N 3.4Å; H48-T52 PolarHBondContact O-OG1 2.86Å; H48-T52 VanDerWaalsContact O-OG1 3.12Å
49	N	62.2	Low	59.8	Low	50 Å²	50	70.3 Å²	70.3	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-43	179	-69.4	-4.4	0	0	0	112.3	Q45 L46 H51 T52 L53	Q45-N49 PolarHBondContact NE2-OD1 2.66Å; Q45-N49 WeakPolarHBondContact O-CB 3.45Å; Q45-N49 PolarHBondContact O-N 3.48Å; Q45-N49 PolarHBondContact O-OD1 2.65Å; L46-N49 PolarHBondContact O-N 3.31Å; N49-H51 VanDerWaalsContact C-N 3.31Å; N49-H51 PolarHBondContact O-N 3.06Å; N49-T52 WeakPolarHBondContact CA-OG1 3.41Å; N49-T52 PolarHBondContact O-N 2.64Å; N49-T52 PolarHBondContact O-OG1 3.2Å; N49-L53 VanDerWaalsContact O-CB 3.25Å; N49-L53 WeakPolarHBondContact O-CB 3.35Å; N49-L53 WeakPolarHBondContact O-CD1 3.38Å; N49-L53 WeakPolarHBondContact O-CG 3.49Å; N49-L53 PolarHBondContact O-N 2.97Å
50	V	58.9	Low	58.2	Low	12 Å²	12	72.5 Å²	72.5	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-59.4	-47.9	173.4	170.1	0	0	0	0	109.2	L8 L46 T52 L53 F54 L68 L75	L8-V50 HydrophobicContact CD2-CG2 3.93Å; L46-V50 HydrophobicContact CD1-CG2 4.42Å; L46-V50 HydrophobicContact CG-CG2 4.34Å; L46-V50 WeakPolarHBondContact O-CB 3.26Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 2.76Å; V50-T52 VanDerWaalsContact C-N 3.27Å; V50-T52 PolarHBondContact O-N 2.78Å; V50-L53 PolarHBondContact O-N 2.61Å; V50-F54 HydrophobicContact CG1-CD2 4.03Å; V50-F54 HydrophobicContact CG1-CE2 4.04Å; V50-F54 WeakPolarHBondContact O-CD2 3.35Å; V50-F54 PolarHBondContact O-N 3.23Å; V50-L68 HydrophobicContact CG1-CD2 4.44Å; V50-L75 HydrophobicContact CG2-CD1 4.36Å
51	H	56.5	Low	56.9	Low	122 Å²	122	74.3 Å²	74.3	57%	0.565	40%	0.395	S	S	*	.	H	α-helix	trans	-63.5	-30.3	179.7	-161	-54.9	0	0	0	113.3	R47 H48 N49	R47-H51 VanDerWaalsContact O-CB 3.31Å; R47-H51 WeakPolarHBondContact O-CB 3.45Å; R47-H51 PolarHBondContact O-N 2.85Å; H48-H51 CarbonylContact O-C 3.57Å; H48-H51 PolarHBondContact O-N 3.08Å; N49-H51 VanDerWaalsContact C-N 3.31Å; N49-H51 PolarHBondContact O-N 3.06Å
52	T	61.7	Low	55.4	Low	58 Å²	58	77 Å²	77	36%	0.356	40%	0.399	S	S	.	.	H	α-helix	trans	-84.1	-38.2	176.6	52.1	0	0	0	0	113	H48 N49 V50 F54 R55	H48-T52 WeakPolarHBondContact O-CG2 3.05Å; H48-T52 PolarHBondContact O-N 3.4Å; H48-T52 PolarHBondContact O-OG1 2.86Å; H48-T52 VanDerWaalsContact O-OG1 3.12Å; N49-T52 WeakPolarHBondContact CA-OG1 3.41Å; N49-T52 PolarHBondContact O-N 2.64Å; N49-T52 PolarHBondContact O-OG1 3.2Å; V50-T52 VanDerWaalsContact C-N 3.27Å; V50-T52 PolarHBondContact O-N 2.78Å; T52-F54 PolarHBondContact O-N 2.67Å; T52-R55 WeakPolarHBondContact O-CB 3.41Å; T52-R55 PolarHBondContact O-N 2.99Å
53	L	59	Low	54.4	Low	52 Å²	52	80.8 Å²	80.8	27%	0.272	42%	0.415	S	S	.	.	H	α-helix	trans	-61.1	-31.7	179.1	-77.2	167.5	0	0	0	112.6	A4 L8 N49 V50 L57	A4-L53 HydrophobicContact CB-CD1 4.35Å; A4-L53 HydrophobicContact CB-CD2 3.79Å; A4-L53 HydrophobicContact CB-CG 4.46Å; L8-L53 HydrophobicContact CG-CD1 4.39Å; N49-L53 VanDerWaalsContact O-CB 3.25Å; N49-L53 WeakPolarHBondContact O-CB 3.35Å; N49-L53 WeakPolarHBondContact O-CD1 3.38Å; N49-L53 WeakPolarHBondContact O-CG 3.49Å; N49-L53 PolarHBondContact O-N 2.97Å; V50-L53 PolarHBondContact O-N 2.61Å; L53-L57 WeakPolarHBondContact O-CD1 3.39Å
54	F	54.3	Low	53.5	Low	42 Å²	42	82.2 Å²	82.2	18%	0.184	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	0.3	177.2	-69	-73.9	0	0	0	114.2	V50 T52 G56 L57 L68	V50-F54 HydrophobicContact CG1-CD2 4.03Å; V50-F54 HydrophobicContact CG1-CE2 4.04Å; V50-F54 WeakPolarHBondContact O-CD2 3.35Å; V50-F54 PolarHBondContact O-N 3.23Å; T52-F54 PolarHBondContact O-N 2.67Å; F54-G56 PolarHBondContact O-N 3.33Å; F54-L57 HydrophobicContact CD1-CD1 4.04Å; F54-L57 HydrophobicContact CE1-CD1 4.39Å; F54-L68 HydrophobicContact CB-CD1 4.23Å; F54-L68 HydrophobicContact CD1-CD1 3.6Å; F54-L68 HydrophobicContact CD2-CD1 3.67Å; F54-L68 HydrophobicContact CD2-CD2 4.21Å; F54-L68 HydrophobicContact CD2-CG 3.84Å; F54-L68 HydrophobicContact CE1-CD1 3.78Å; F54-L68 HydrophobicContact CE1-CG 4.39Å; F54-L68 HydrophobicContact CE2-CD1 3.89Å; F54-L68 HydrophobicContact CE2-CD2 4.45Å; F54-L68 HydrophobicContact CE2-CG 3.75Å; F54-L68 HydrophobicContact CG-CD1 3.56Å; F54-L68 HydrophobicContact CG-CG 4.26Å; F54-L68 HydrophobicContact CZ-CD1 3.93Å; F54-L68 HydrophobicContact CZ-CG 4.03Å
55	R	50.3	Low	52.7	Low	196 Å²	196	80.6 Å²	80.6	74%	0.74	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	105	165.4	-83.6	-173.4	173.2	178.1	1.2	109.4	T52	T52-R55 WeakPolarHBondContact O-CB 3.41Å; T52-R55 PolarHBondContact O-N 2.99Å
56	G	46.4	Very low	52.1	Low	79 Å²	79	83.6 Å²	83.6	81%	0.814	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.3	17.2	164.2	0	0	0	0	0	117	F54	F54-G56 PolarHBondContact O-N 3.33Å
57	L	47.1	Very low	51.7	Low	53 Å²	53	86.9 Å²	86.9	28%	0.277	43%	0.431	S	S	.	.			trans	-81.1	125.1	173.4	-78.5	163.7	0	0	0	111.7	M1 L53 F54 S59 Q64	M1-L57 HydrophobicContact CG-CD2 4.1Å; L53-L57 WeakPolarHBondContact O-CD1 3.39Å; F54-L57 HydrophobicContact CD1-CD1 4.04Å; F54-L57 HydrophobicContact CE1-CD1 4.39Å; L57-S59 PolarHBondContact O-N 3.37Å; L57-Q64 PolarHBondContact O-NE2 3.49Å
58	E	40.8	Very low	51.4	Low	207 Å²	207	84.5 Å²	84.5	97%	0.967	43%	0.426	S	S	*	.			trans	-78.5	29.8	174	-63.1	-175.8	155.6	0	0	113.7
59	S	48.9	Very low	50.9	Low	27 Å²	27	84.5 Å²	84.5	19%	0.189	43%	0.427	C	S	.	.	S	Bend	trans	-92.3	160.8	176.2	41.7	0	0	0	0	112.7	L57 Q64	L57-S59 PolarHBondContact O-N 3.37Å; S59-Q64 PolarHBondContact O-NE2 2.89Å; S59-Q64 VanDerWaalsContact OG-CG 3.31Å; S59-Q64 WeakPolarHBondContact OG-CG 3.46Å; S59-Q64 PolarHBondContact OG-NE2 3.42Å
60	S	41.6	Very low	50.8	Low	50 Å²	50	85.4 Å²	85.4	35%	0.35	44%	0.437	S	S	.	.			trans	-59.1	140.6	-176.5	84.3	0	0	0	0	110.9	E62 E63 Q64	S60-E62 PolarHBondContact O-N 3.1Å; S60-E62 VanDerWaalsContact O-N 3.1Å; S60-E63 PolarHBondContact O-N 2.89Å; S60-Q64 WeakPolarHBondContact O-CG 3.42Å; S60-Q64 PolarHBondContact O-N 3.3Å
61	P	42.3	Very low	50.7	Low	71 Å²	71	85.6 Å²	85.6	46%	0.461	44%	0.437	S	S	.	.	H	α-helix	trans	-55.9	-31.4	-178.6	-25.4	33.1	0	0	0	113.2	I65	P61-I65 HydrophobicContact CB-CD1 4.41Å; P61-I65 VanDerWaalsContact O-CB 3.22Å; P61-I65 WeakPolarHBondContact O-CB 3.49Å; P61-I65 WeakPolarHBondContact O-CD1 3.37Å; P61-I65 WeakPolarHBondContact O-CG1 3.24Å; P61-I65 PolarHBondContact O-N 3.17Å
62	E	41.1	Very low	50.5	Low	137 Å²	137	85.2 Å²	85.2	64%	0.64	43%	0.432	S	S	*	.	H	α-helix	trans	-78.4	-32.6	-171.2	-67.4	154.6	-174.3	0	0	113.7	S60 R66	S60-E62 PolarHBondContact O-N 3.1Å; S60-E62 VanDerWaalsContact O-N 3.1Å; E62-R66 PolarHBondContact O-N 3.06Å; E62-R66 PolarHBondContact O-NE 2.71Å
63	E	51.4	Low	50	Low	107 Å²	107	87.9 Å²	87.9	50%	0.5	44%	0.44	S	S	.	.	H	α-helix	trans	-76.4	-43.9	172.2	-91.5	168.2	160.8	0	0	111.2	S60 I65 R66 E67	S60-E63 PolarHBondContact O-N 2.89Å; E63-I65 VanDerWaalsContact C-N 3.29Å; E63-I65 PolarHBondContact O-N 3.44Å; E63-R66 PolarHBondContact O-N 2.84Å; E63-E67 PolarHBondContact O-N 3.47Å
64	Q	45.1	Very low	49.8	Very low	31 Å²	31	88.1 Å²	88.1	15%	0.145	44%	0.44	C	S	.	.	H	α-helix	trans	-56.5	-45.7	174.2	-68.6	-179.1	-3.7	0	0	110.9	L57 S59 S60 L68	L57-Q64 PolarHBondContact O-NE2 3.49Å; S59-Q64 PolarHBondContact O-NE2 2.89Å; S59-Q64 VanDerWaalsContact OG-CG 3.31Å; S59-Q64 WeakPolarHBondContact OG-CG 3.46Å; S59-Q64 PolarHBondContact OG-NE2 3.42Å; S60-Q64 WeakPolarHBondContact O-CG 3.42Å; S60-Q64 PolarHBondContact O-N 3.3Å; Q64-L68 VanDerWaalsContact O-CB 3.23Å; Q64-L68 WeakPolarHBondContact O-CB 3.5Å; Q64-L68 WeakPolarHBondContact O-CD1 3.42Å; Q64-L68 PolarHBondContact O-N 3.08Å
65	I	49.3	Very low	49.9	Very low	60 Å²	60	86.8 Å²	86.8	31%	0.308	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-44.9	179.3	-72.3	163.8	0	0	0	111.7	P61 E63 E67 L68 E69 Y220	P61-I65 HydrophobicContact CB-CD1 4.41Å; P61-I65 VanDerWaalsContact O-CB 3.22Å; P61-I65 WeakPolarHBondContact O-CB 3.49Å; P61-I65 WeakPolarHBondContact O-CD1 3.37Å; P61-I65 WeakPolarHBondContact O-CG1 3.24Å; P61-I65 PolarHBondContact O-N 3.17Å; E63-I65 VanDerWaalsContact C-N 3.29Å; E63-I65 PolarHBondContact O-N 3.44Å; I65-E67 PolarHBondContact O-N 3.04Å; I65-L68 PolarHBondContact O-N 3.44Å; I65-E69 HydrophobicContact CG2-CG 4.19Å; I65-E69 WeakPolarHBondContact O-CB 3.2Å; I65-E69 VanDerWaalsContact O-CG 3.26Å; I65-E69 WeakPolarHBondContact O-CG 3.08Å; I65-E69 PolarHBondContact O-N 3.29Å; I65-Y220 HydrophobicContact CD1-CD1 4.25Å; I65-Y220 HydrophobicContact CD1-CE1 3.88Å
66	R	55	Low	49.9	Very low	164 Å²	164	80 Å²	80	62%	0.619	41%	0.412	S	S	*	.	H	α-helix	trans	-64.9	-41.7	-179.2	-85.1	-174.2	-77.6	-178.2	-3.1	112.8	E62 E63 S70	E62-R66 PolarHBondContact O-N 3.06Å; E62-R66 PolarHBondContact O-NE 2.71Å; E63-R66 PolarHBondContact O-N 2.84Å; R66-S70 PolarHBondContact O-N 3.47Å; R66-S70 VanDerWaalsContact O-N 3.13Å
67	E	54.1	Low	50.2	Low	84 Å²	84	80 Å²	80	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-40.2	176.4	-70.9	-168.4	161	0	0	111.8	E63 I65 S70 L71	E63-E67 PolarHBondContact O-N 3.47Å; I65-E67 PolarHBondContact O-N 3.04Å; E67-S70 PolarHBondContact O-N 2.76Å; E67-L71 WeakPolarHBondContact O-CB 3.45Å; E67-L71 WeakPolarHBondContact O-CD1 3.31Å; E67-L71 VanDerWaalsContact O-CG 3.23Å; E67-L71 WeakPolarHBondContact O-CG 3.31Å; E67-L71 PolarHBondContact O-N 2.69Å
68	L	51.9	Low	50.7	Low	60 Å²	60	79.2 Å²	79.2	31%	0.314	39%	0.391	S	S	.	.	H	α-helix	trans	-60.3	-44.2	172.3	-103.1	133.2	0	0	0	112.2	V50 F54 Q64 I65 L71 Y72	V50-L68 HydrophobicContact CG1-CD2 4.44Å; F54-L68 HydrophobicContact CB-CD1 4.23Å; F54-L68 HydrophobicContact CD1-CD1 3.6Å; F54-L68 HydrophobicContact CD2-CD1 3.67Å; F54-L68 HydrophobicContact CD2-CD2 4.21Å; F54-L68 HydrophobicContact CD2-CG 3.84Å; F54-L68 HydrophobicContact CE1-CD1 3.78Å; F54-L68 HydrophobicContact CE1-CG 4.39Å; F54-L68 HydrophobicContact CE2-CD1 3.89Å; F54-L68 HydrophobicContact CE2-CD2 4.45Å; F54-L68 HydrophobicContact CE2-CG 3.75Å; F54-L68 HydrophobicContact CG-CD1 3.56Å; F54-L68 HydrophobicContact CG-CG 4.26Å; F54-L68 HydrophobicContact CZ-CD1 3.93Å; F54-L68 HydrophobicContact CZ-CG 4.03Å; Q64-L68 VanDerWaalsContact O-CB 3.23Å; Q64-L68 WeakPolarHBondContact O-CB 3.5Å; Q64-L68 WeakPolarHBondContact O-CD1 3.42Å; Q64-L68 PolarHBondContact O-N 3.08Å; I65-L68 PolarHBondContact O-N 3.44Å; L68-L71 PolarHBondContact O-N 2.78Å; L68-Y72 WeakPolarHBondContact O-CB 3.43Å; L68-Y72 PolarHBondContact O-N 3.45Å
69	E	52	Low	51.4	Low	112 Å²	112	71.3 Å²	71.3	52%	0.523	36%	0.355	S	S	.	.	H	α-helix	trans	-61.3	-46.2	178.9	-79.9	178.7	168.2	0	0	110.9	I65 Y72 Q73	I65-E69 HydrophobicContact CG2-CG 4.19Å; I65-E69 WeakPolarHBondContact O-CB 3.2Å; I65-E69 VanDerWaalsContact O-CG 3.26Å; I65-E69 WeakPolarHBondContact O-CG 3.08Å; I65-E69 PolarHBondContact O-N 3.29Å; E69-Y72 PolarHBondContact O-N 3.41Å; E69-Q73 WeakPolarHBondContact O-CB 3.38Å; E69-Q73 WeakPolarHBondContact O-CG 3.19Å; E69-Q73 PolarHBondContact O-N 3Å
70	S	59.7	Low	51.5	Low	69 Å²	69	76.1 Å²	76.1	48%	0.483	37%	0.369	S	S	.	.	H	α-helix	trans	-61.8	-47.6	177	-177.1	0	0	0	0	112.1	R66 E67 Q73 E74	R66-S70 PolarHBondContact O-N 3.47Å; R66-S70 VanDerWaalsContact O-N 3.13Å; E67-S70 PolarHBondContact O-N 2.76Å; S70-Q73 PolarHBondContact O-N 3.49Å; S70-E74 WeakPolarHBondContact O-CB 3.4Å; S70-E74 PolarHBondContact O-N 2.86Å
71	L	55.8	Low	51.9	Low	16 Å²	16	76.9 Å²	76.9	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-65.5	-39.6	179.2	-72.7	167.3	0	0	0	112.4	L8 E67 L68 E74 L75	L8-L71 HydrophobicContact CD1-CD1 3.77Å; L8-L71 HydrophobicContact CD2-CD1 3.85Å; L8-L71 HydrophobicContact CD2-CD2 3.89Å; L8-L71 HydrophobicContact CG-CD1 4.46Å; E67-L71 WeakPolarHBondContact O-CB 3.45Å; E67-L71 WeakPolarHBondContact O-CD1 3.31Å; E67-L71 VanDerWaalsContact O-CG 3.23Å; E67-L71 WeakPolarHBondContact O-CG 3.31Å; E67-L71 PolarHBondContact O-N 2.69Å; L68-L71 PolarHBondContact O-N 2.78Å; L71-E74 PolarHBondContact O-N 3.24Å; L71-L75 WeakPolarHBondContact O-CB 3.41Å; L71-L75 VanDerWaalsContact O-CG 3.31Å; L71-L75 WeakPolarHBondContact O-CG 3.21Å; L71-L75 PolarHBondContact O-N 3.19Å
72	Y	52.9	Low	52.6	Low	115 Å²	115	74 Å²	74	45%	0.451	35%	0.35	S	S	.	.	H	α-helix	trans	-69.7	-39.2	178.5	-161	-102.3	0	0	0	111.5	L68 E69 L75 L76	L68-Y72 WeakPolarHBondContact O-CB 3.43Å; L68-Y72 PolarHBondContact O-N 3.45Å; E69-Y72 PolarHBondContact O-N 3.41Å; Y72-L75 PolarHBondContact O-N 3.09Å; Y72-L76 HydrophobicContact CD1-CD1 3.44Å; Y72-L76 VanDerWaalsContact CD1-CD1 3.44Å; Y72-L76 HydrophobicContact CD1-CG 4.2Å; Y72-L76 HydrophobicContact CE1-CD1 3.56Å; Y72-L76 HydrophobicContact CE1-CG 4.12Å; Y72-L76 HydrophobicContact CG-CD1 4.45Å; Y72-L76 WeakPolarHBondContact O-CB 3.44Å; Y72-L76 WeakPolarHBondContact O-CD1 3.34Å; Y72-L76 WeakPolarHBondContact O-CG 3.25Å; Y72-L76 PolarHBondContact O-N 2.89Å
73	Q	51	Low	53.3	Low	114 Å²	114	73.1 Å²	73.1	53%	0.533	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-43.5	171.7	-71.8	-66	-23.8	0	0	111.5	E69 S70 L76 V77	E69-Q73 WeakPolarHBondContact O-CB 3.38Å; E69-Q73 WeakPolarHBondContact O-CG 3.19Å; E69-Q73 PolarHBondContact O-N 3Å; S70-Q73 PolarHBondContact O-N 3.49Å; Q73-L76 WeakPolarHBondContact O-CB 3.25Å; Q73-L76 PolarHBondContact O-N 3.37Å; Q73-V77 WeakPolarHBondContact O-CG2 3.39Å; Q73-V77 PolarHBondContact O-N 3.41Å
74	E	55.9	Low	53.2	Low	57 Å²	57	70.8 Å²	70.8	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-45.1	176.5	-166	-172.4	156.7	0	0	111.7	R12 S70 L71 V77 K78	R12-E74 IonicContact CZ-OE2 3.69Å; R12-E74 IonicContact NE-OE1 3.71Å; R12-E74 IonicContact NE-OE2 2.79Å; R12-E74 PolarHBondContact NE-OE2 3.39Å; R12-E74 IonicContact NH2-OE2 3.5Å; R12-E74 PolarHBondContact NH2-OE2 2.71Å; S70-E74 WeakPolarHBondContact O-CB 3.4Å; S70-E74 PolarHBondContact O-N 2.86Å; L71-E74 PolarHBondContact O-N 3.24Å; E74-V77 PolarHBondContact O-N 3.37Å; E74-K78 WeakPolarHBondContact O-CG 3.5Å; E74-K78 PolarHBondContact O-N 3.26Å; E74-K78 WeakPolarHBondContact OE1-CE 3.06Å; E74-K78 IonicContact OE1-NZ 2.65Å; E74-K78 PolarHBondContact OE1-NZ 3.25Å
75	L	55.2	Low	53.5	Low	14 Å²	14	70.9 Å²	70.9	7%	0.073	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-43.7	174.7	-78.4	170.6	0	0	0	112	L43 L46 V50 L71 Y72 V77 K78 D79	L43-L75 HydrophobicContact CD2-CD2 3.78Å; L46-L75 HydrophobicContact CB-CD2 4.38Å; L46-L75 HydrophobicContact CD2-CD2 3.68Å; L46-L75 HydrophobicContact CG-CD2 4.12Å; V50-L75 HydrophobicContact CG2-CD1 4.36Å; L71-L75 WeakPolarHBondContact O-CB 3.41Å; L71-L75 VanDerWaalsContact O-CG 3.31Å; L71-L75 WeakPolarHBondContact O-CG 3.21Å; L71-L75 PolarHBondContact O-N 3.19Å; Y72-L75 PolarHBondContact O-N 3.09Å; L75-V77 PolarHBondContact O-N 3.18Å; L75-K78 PolarHBondContact O-N 2.7Å; L75-D79 WeakPolarHBondContact O-CB 3.48Å; L75-D79 PolarHBondContact O-N 3.01Å
76	L	51.5	Low	54	Low	52 Å²	52	71 Å²	71	27%	0.272	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-43.3	176.6	-87.8	157.8	0	0	0	112.1	Y72 Q73 R80	Y72-L76 HydrophobicContact CD1-CD1 3.44Å; Y72-L76 VanDerWaalsContact CD1-CD1 3.44Å; Y72-L76 HydrophobicContact CD1-CG 4.2Å; Y72-L76 HydrophobicContact CE1-CD1 3.56Å; Y72-L76 HydrophobicContact CE1-CG 4.12Å; Y72-L76 HydrophobicContact CG-CD1 4.45Å; Y72-L76 WeakPolarHBondContact O-CB 3.44Å; Y72-L76 WeakPolarHBondContact O-CD1 3.34Å; Y72-L76 WeakPolarHBondContact O-CG 3.25Å; Y72-L76 PolarHBondContact O-N 2.89Å; Q73-L76 WeakPolarHBondContact O-CB 3.25Å; Q73-L76 PolarHBondContact O-N 3.37Å; L76-R80 WeakPolarHBondContact O-CB 3.19Å; L76-R80 WeakPolarHBondContact O-CG 3.44Å; L76-R80 PolarHBondContact O-N 3.24Å
77	V	51.7	Low	54	Low	79 Å²	79	66.6 Å²	66.6	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-43.3	177.4	172.7	0	0	0	0	110.5	Q73 E74 L75 R80 L81	Q73-V77 WeakPolarHBondContact O-CG2 3.39Å; Q73-V77 PolarHBondContact O-N 3.41Å; E74-V77 PolarHBondContact O-N 3.37Å; L75-V77 PolarHBondContact O-N 3.18Å; V77-R80 WeakPolarHBondContact O-CB 3.4Å; V77-R80 PolarHBondContact O-N 3.48Å; V77-L81 PolarHBondContact O-N 3.32Å
78	K	57.8	Low	53.7	Low	38 Å²	38	64.8 Å²	64.8	17%	0.165	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-42.4	177	-69.7	179.7	-175.2	174.1	0	112	L15 L43 E74 L75 R80 L81 I82	L15-K78 HydrophobicContact CB-CD 4.4Å; L15-K78 HydrophobicContact CD1-CD 3.93Å; L43-K78 HydrophobicContact CD1-CB 3.95Å; L43-K78 HydrophobicContact CD2-CB 4Å; L43-K78 HydrophobicContact CD2-CD 4.29Å; E74-K78 WeakPolarHBondContact O-CG 3.5Å; E74-K78 PolarHBondContact O-N 3.26Å; E74-K78 WeakPolarHBondContact OE1-CE 3.06Å; E74-K78 IonicContact OE1-NZ 2.65Å; E74-K78 PolarHBondContact OE1-NZ 3.25Å; L75-K78 PolarHBondContact O-N 2.7Å; K78-R80 VanDerWaalsContact C-N 3.33Å; K78-R80 PolarHBondContact O-N 3.48Å; K78-L81 WeakPolarHBondContact O-CB 3.24Å; K78-L81 PolarHBondContact O-N 2.92Å; K78-L81 VanDerWaalsContact O-N 3.16Å; K78-I82 WeakPolarHBondContact O-CG1 3.22Å; K78-I82 PolarHBondContact O-N 3.42Å
79	D	54.8	Low	53.8	Low	40 Å²	40	62 Å²	62	21%	0.214	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-44.7	173.6	-104.4	22.2	0	0	0	111.6	L43 R47 L75 L81 I82 K83	L43-D79 VanDerWaalsContact CD1-OD1 3.28Å; L43-D79 WeakPolarHBondContact CD1-OD1 3.42Å; R47-D79 IonicContact CZ-OD2 3.6Å; R47-D79 IonicContact NH2-OD1 3.89Å; R47-D79 PolarHBondContact NH2-OD1 3.23Å; R47-D79 IonicContact NH2-OD2 3.13Å; R47-D79 PolarHBondContact NH2-OD2 3.37Å; L75-D79 WeakPolarHBondContact O-CB 3.48Å; L75-D79 PolarHBondContact O-N 3.01Å; D79-L81 VanDerWaalsContact C-N 3.33Å; D79-L81 PolarHBondContact O-N 3.27Å; D79-I82 PolarHBondContact O-N 3.32Å; D79-K83 WeakPolarHBondContact O-CG 3.11Å; D79-K83 PolarHBondContact O-N 3.36Å
80	R	51.4	Low	54	Low	129 Å²	129	59.9 Å²	59.9	49%	0.487	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-44.5	176.1	-74.3	170.6	-174.6	-175.3	2.9	110.8	L76 V77 K78 K83 H84	L76-R80 WeakPolarHBondContact O-CB 3.19Å; L76-R80 WeakPolarHBondContact O-CG 3.44Å; L76-R80 PolarHBondContact O-N 3.24Å; V77-R80 WeakPolarHBondContact O-CB 3.4Å; V77-R80 PolarHBondContact O-N 3.48Å; K78-R80 VanDerWaalsContact C-N 3.33Å; K78-R80 PolarHBondContact O-N 3.48Å; R80-K83 PolarHBondContact O-N 3.37Å; R80-H84 PolarHBondContact O-CD2 3.14Å; R80-H84 PolarHBondContact O-N 3.33Å
81	L	50.5	Low	53.4	Low	66 Å²	66	60.5 Å²	60.5	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-44.2	179	-174.3	60.8	0	0	0	111.9	L19 V77 K78 D79 K83 H84 L85	L19-L81 HydrophobicContact CD1-CD2 3.46Å; L19-L81 VanDerWaalsContact CD1-CD2 3.46Å; L19-L81 HydrophobicContact CD1-CG 4.3Å; L19-L81 HydrophobicContact CD2-CD2 4Å; L19-L81 HydrophobicContact CG-CD2 4.29Å; V77-L81 PolarHBondContact O-N 3.32Å; K78-L81 WeakPolarHBondContact O-CB 3.24Å; K78-L81 PolarHBondContact O-N 2.92Å; K78-L81 VanDerWaalsContact O-N 3.16Å; D79-L81 VanDerWaalsContact C-N 3.33Å; D79-L81 PolarHBondContact O-N 3.27Å; L81-K83 PolarHBondContact O-N 2.88Å; L81-H84 PolarHBondContact O-N 2.95Å; L81-L85 HydrophobicContact CD1-CD1 4.37Å; L81-L85 HydrophobicContact CD1-CG 4.47Å; L81-L85 HydrophobicContact CG-CD1 4.02Å; L81-L85 VanDerWaalsContact O-CG 3.27Å; L81-L85 WeakPolarHBondContact O-CG 3.23Å; L81-L85 PolarHBondContact O-N 2.77Å
82	I	57.3	Low	52.8	Low	9 Å²	9	63 Å²	63	5%	0.046	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-44.7	175.8	-63.3	-174.1	0	0	0	111.4	L39 L43 K78 D79 H84 L85 K86	L39-I82 HydrophobicContact CB-CD1 4.13Å; L39-I82 HydrophobicContact CD2-CD1 3.66Å; L39-I82 HydrophobicContact CD2-CG1 3.57Å; L39-I82 HydrophobicContact CG-CD1 3.5Å; L39-I82 HydrophobicContact CG-CG1 4.03Å; L43-I82 HydrophobicContact CD1-CD1 3.27Å; L43-I82 HydrophobicContact CD1-CG1 4.12Å; L43-I82 HydrophobicContact CG-CD1 4.02Å; K78-I82 WeakPolarHBondContact O-CG1 3.22Å; K78-I82 PolarHBondContact O-N 3.42Å; D79-I82 PolarHBondContact O-N 3.32Å; I82-H84 VanDerWaalsContact C-N 3.29Å; I82-H84 PolarHBondContact O-N 3.18Å; I82-L85 PolarHBondContact O-N 3.43Å; I82-K86 HydrophobicContact CG2-CD 4.11Å; I82-K86 HydrophobicContact CG2-CG 4.21Å; I82-K86 WeakPolarHBondContact O-CB 3.44Å; I82-K86 PolarHBondContact O-N 3.2Å
83	K	55.3	Low	52.6	Low	120 Å²	120	62.2 Å²	62.2	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-59.2	-43.7	177.8	-75.5	-177.4	-178.7	-177.9	0	111.2	D79 R80 L81 K86 M87	D79-K83 WeakPolarHBondContact O-CG 3.11Å; D79-K83 PolarHBondContact O-N 3.36Å; R80-K83 PolarHBondContact O-N 3.37Å; L81-K83 PolarHBondContact O-N 2.88Å; K83-K86 PolarHBondContact O-N 3.35Å; K83-M87 WeakPolarHBondContact O-CB 3.31Å; K83-M87 VanDerWaalsContact O-CG 3.29Å; K83-M87 WeakPolarHBondContact O-CG 3.26Å; K83-M87 PolarHBondContact O-N 3.16Å
84	H	49.1	Very low	52.2	Low	58 Å²	58	59.7 Å²	59.7	27%	0.269	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-45.4	174.4	-83.8	-64.8	0	0	0	112.5	R80 L81 I82 M87 S88 S124	R80-H84 PolarHBondContact O-CD2 3.14Å; R80-H84 PolarHBondContact O-N 3.33Å; L81-H84 PolarHBondContact O-N 2.95Å; I82-H84 VanDerWaalsContact C-N 3.29Å; I82-H84 PolarHBondContact O-N 3.18Å; H84-M87 PolarHBondContact O-N 3.14Å; H84-S88 PolarHBondContact O-N 3.02Å; H84-S88 PolarHBondContact O-OG 2.89Å; H84-S124 PolarHBondContact NE2-OG 3.18Å
85	L	52.5	Low	51.3	Low	33 Å²	33	60 Å²	60	17%	0.173	31%	0.314	C	S	.	.	H	α-helix	trans	-66.8	-37.6	179.2	-68.1	167.2	0	0	0	112.5	V22 L36 L81 I82 S88 A89	V22-L85 HydrophobicContact CG1-CD1 3.95Å; L36-L85 HydrophobicContact CD1-CB 4.17Å; L36-L85 HydrophobicContact CD2-CB 3.49Å; L36-L85 VanDerWaalsContact CD2-CB 3.49Å; L36-L85 HydrophobicContact CD2-CD1 3.95Å; L36-L85 HydrophobicContact CD2-CG 4.36Å; L36-L85 HydrophobicContact CG-CB 4.48Å; L81-L85 HydrophobicContact CD1-CD1 4.37Å; L81-L85 HydrophobicContact CD1-CG 4.47Å; L81-L85 HydrophobicContact CG-CD1 4.02Å; L81-L85 VanDerWaalsContact O-CG 3.27Å; L81-L85 WeakPolarHBondContact O-CG 3.23Å; L81-L85 PolarHBondContact O-N 2.77Å; I82-L85 PolarHBondContact O-N 3.43Å; L85-S88 WeakPolarHBondContact CA-OG 3.16Å; L85-S88 PolarHBondContact O-OG 3.11Å; L85-A89 WeakPolarHBondContact O-CB 3.5Å; L85-A89 PolarHBondContact O-N 3Å
86	K	58.2	Low	50.4	Low	62 Å²	62	64.5 Å²	64.5	27%	0.27	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-39.4	173	-76.8	-173.2	168	-169.8	0	111.5	L36 E37 I82 K83 S90	L36-K86 HydrophobicContact CB-CG 4.34Å; L36-K86 HydrophobicContact CD1-CG 4.19Å; E37-K86 WeakPolarHBondContact OE1-CE 3.48Å; E37-K86 IonicContact OE1-NZ 2.92Å; E37-K86 PolarHBondContact OE1-NZ 3.05Å; E37-K86 IonicContact OE2-NZ 3.35Å; I82-K86 HydrophobicContact CG2-CD 4.11Å; I82-K86 HydrophobicContact CG2-CG 4.21Å; I82-K86 WeakPolarHBondContact O-CB 3.44Å; I82-K86 PolarHBondContact O-N 3.2Å; K83-K86 PolarHBondContact O-N 3.35Å; K86-S90 WeakPolarHBondContact O-CB 3.23Å; K86-S90 PolarHBondContact O-N 3.49Å; K86-S90 PolarHBondContact O-OG 3.11Å
87	M	54.9	Low	49.8	Very low	72 Å²	72	65.6 Å²	65.6	36%	0.355	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-48	175.2	-77.1	179.4	69.1	0	0	111.7	K83 H84 A89 S90 I91 S119	K83-M87 WeakPolarHBondContact O-CB 3.31Å; K83-M87 VanDerWaalsContact O-CG 3.29Å; K83-M87 WeakPolarHBondContact O-CG 3.26Å; K83-M87 PolarHBondContact O-N 3.16Å; H84-M87 PolarHBondContact O-N 3.14Å; M87-A89 PolarHBondContact O-N 3.09Å; M87-S90 PolarHBondContact O-N 3.26Å; M87-I91 WeakPolarHBondContact O-CD1 3.38Å; M87-I91 VanDerWaalsContact O-CG1 3.25Å; M87-I91 WeakPolarHBondContact O-CG1 3.39Å; M87-I91 PolarHBondContact O-N 3.05Å; M87-S119 WeakPolarHBondContact CE-OG 3.28Å; M87-S119 PolarHBondContact SD-OG 3.12Å
88	S	48.6	Very low	48.9	Very low	45 Å²	45	68 Å²	68	32%	0.315	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-41.5	178.1	59.1	0	0	0	0	111.8	H84 L85 S90 I91 L92	H84-S88 PolarHBondContact O-N 3.02Å; H84-S88 PolarHBondContact O-OG 2.89Å; L85-S88 WeakPolarHBondContact CA-OG 3.16Å; L85-S88 PolarHBondContact O-OG 3.11Å; S88-S90 VanDerWaalsContact C-N 3.35Å; S88-S90 PolarHBondContact O-N 2.89Å; S88-I91 PolarHBondContact O-N 3.25Å; S88-L92 VanDerWaalsContact O-CG 3.31Å; S88-L92 WeakPolarHBondContact O-CG 3.43Å; S88-L92 PolarHBondContact O-N 3.31Å
89	A	54.1	Low	47.7	Very low	3 Å²	3	71.4 Å²	71.4	3%	0.025	37%	0.371	C	S	.	.	H	α-helix	trans	-63.7	-37.2	176.5	0	0	0	0	0	112.8	L32 H33 L36 L85 M87 Q93	L32-A89 HydrophobicContact CD2-CB 3.86Å; H33-A89 VanDerWaalsContact CE1-CB 3.49Å; H33-A89 WeakPolarHBondContact CE1-CB 3.45Å; L36-A89 HydrophobicContact CD1-CB 4.2Å; L85-A89 WeakPolarHBondContact O-CB 3.5Å; L85-A89 PolarHBondContact O-N 3Å; M87-A89 PolarHBondContact O-N 3.09Å; A89-Q93 PolarHBondContact O-N 2.82Å
90	S	55.1	Low	46.8	Very low	66 Å²	66	72.9 Å²	72.9	46%	0.462	38%	0.384	S	S	.	.	H	α-helix	trans	-70.8	-39.1	176.2	-56.8	0	0	0	0	112.3	K86 M87 S88 Q93 S94	K86-S90 WeakPolarHBondContact O-CB 3.23Å; K86-S90 PolarHBondContact O-N 3.49Å; K86-S90 PolarHBondContact O-OG 3.11Å; M87-S90 PolarHBondContact O-N 3.26Å; S88-S90 VanDerWaalsContact C-N 3.35Å; S88-S90 PolarHBondContact O-N 2.89Å; S90-Q93 PolarHBondContact O-N 3.22Å; S90-S94 PolarHBondContact O-N 3Å; S90-S94 VanDerWaalsContact O-N 3.08Å; S90-S94 PolarHBondContact O-OG 2.93Å
91	I	47.7	Very low	46.2	Very low	83 Å²	83	72 Å²	72	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-43.3	177	-69.3	165.1	0	0	0	110.3	M87 S88 Q93 S94 S95	M87-I91 WeakPolarHBondContact O-CD1 3.38Å; M87-I91 VanDerWaalsContact O-CG1 3.25Å; M87-I91 WeakPolarHBondContact O-CG1 3.39Å; M87-I91 PolarHBondContact O-N 3.05Å; S88-I91 PolarHBondContact O-N 3.25Å; I91-Q93 VanDerWaalsContact C-N 3.34Å; I91-Q93 PolarHBondContact O-N 3.18Å; I91-S94 WeakPolarHBondContact CA-OG 3.41Å; I91-S94 PolarHBondContact O-N 3.32Å; I91-S94 VanDerWaalsContact O-N 3.14Å; I91-S94 PolarHBondContact O-OG 3.24Å; I91-S95 PolarHBondContact O-N 2.98Å
92	L	43.3	Very low	45.5	Very low	68 Å²	68	79.1 Å²	79.1	36%	0.356	41%	0.412	S	S	.	.	H	α-helix	trans	-59.6	-41	177	-71.6	167	0	0	0	112.3	S88 S95 E96	S88-L92 VanDerWaalsContact O-CG 3.31Å; S88-L92 WeakPolarHBondContact O-CG 3.43Å; S88-L92 PolarHBondContact O-N 3.31Å; L92-S95 WeakPolarHBondContact O-CB 3.11Å; L92-S95 PolarHBondContact O-N 2.71Å; L92-E96 PolarHBondContact O-N 3.33Å
93	Q	49.3	Very low	44.4	Very low	99 Å²	99	82.8 Å²	82.8	46%	0.463	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-35.9	174.6	-73.1	179.8	-21.7	0	0	113.2	H33 A89 S90 I91 S95 T97	H33-Q93 PolarHBondContact CE1-NE2 3.12Å; H33-Q93 PolarHBondContact NE2-NE2 3.08Å; H33-Q93 PolarHBondContact NE2-OE1 3.39Å; A89-Q93 PolarHBondContact O-N 2.82Å; S90-Q93 PolarHBondContact O-N 3.22Å; I91-Q93 VanDerWaalsContact C-N 3.34Å; I91-Q93 PolarHBondContact O-N 3.18Å; Q93-S95 VanDerWaalsContact C-N 3.35Å; Q93-T97 PolarHBondContact O-N 2.7Å; Q93-T97 PolarHBondContact O-OG1 3.29Å
94	S	42.7	Very low	43.5	Very low	60 Å²	60	84.1 Å²	84.1	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-71.8	-26.4	176.5	66.7	0	0	0	0	113.6	S90 I91 T97 M98	S90-S94 PolarHBondContact O-N 3Å; S90-S94 VanDerWaalsContact O-N 3.08Å; S90-S94 PolarHBondContact O-OG 2.93Å; I91-S94 WeakPolarHBondContact CA-OG 3.41Å; I91-S94 PolarHBondContact O-N 3.32Å; I91-S94 VanDerWaalsContact O-N 3.14Å; I91-S94 PolarHBondContact O-OG 3.24Å; S94-T97 WeakPolarHBondContact CA-OG1 2.98Å; S94-T97 PolarHBondContact O-OG1 3.01Å; S94-T97 VanDerWaalsContact O-OG1 3.13Å; S94-M98 WeakPolarHBondContact O-CB 3.45Å; S94-M98 VanDerWaalsContact O-CG 3.23Å; S94-M98 WeakPolarHBondContact O-CG 3.47Å; S94-M98 PolarHBondContact O-N 3.36Å
95	S	36.7	Very low	42.7	Very low	65 Å²	65	85.5 Å²	85.5	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-43.6	173.4	-173	0	0	0	0	111.8	I91 L92 Q93 T97 M98 D99	I91-S95 PolarHBondContact O-N 2.98Å; L92-S95 WeakPolarHBondContact O-CB 3.11Å; L92-S95 PolarHBondContact O-N 2.71Å; Q93-S95 VanDerWaalsContact C-N 3.35Å; S95-T97 PolarHBondContact O-N 2.86Å; S95-M98 PolarHBondContact O-N 2.88Å; S95-D99 PolarHBondContact O-N 3.32Å
96	E	36.6	Very low	41.6	Very low	107 Å²	107	91.5 Å²	91.5	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-70.2	-32	-178.8	-68.6	-178.8	165.5	0	0	112.8	N28 L92 S100	N28-E96 PolarHBondContact ND2-OE1 2.91Å; L92-E96 PolarHBondContact O-N 3.33Å; E96-S100 PolarHBondContact O-N 2.69Å; E96-S100 PolarHBondContact O-OG 3.09Å
97	T	39.4	Very low	40.3	Very low	76 Å²	76	97.7 Å²	97.7	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-76.3	-25.6	175.5	48.2	0	0	0	0	112.8	Q93 S94 S95 S100 N101	Q93-T97 PolarHBondContact O-N 2.7Å; Q93-T97 PolarHBondContact O-OG1 3.29Å; S94-T97 WeakPolarHBondContact CA-OG1 2.98Å; S94-T97 PolarHBondContact O-OG1 3.01Å; S94-T97 VanDerWaalsContact O-OG1 3.13Å; S95-T97 PolarHBondContact O-N 2.86Å; T97-S100 WeakPolarHBondContact CA-OG 3.41Å; T97-S100 PolarHBondContact O-OG 2.84Å; T97-N101 WeakPolarHBondContact O-CB 3.22Å; T97-N101 PolarHBondContact O-N 3.31Å; T97-N101 PolarHBondContact O-ND2 3.17Å
98	M	32.4	Very low	39	Very low	128 Å²	128	101.3 Å²	101.3	63%	0.631	56%	0.558	S	S	*	*	H	α-helix	trans	-77.8	-37.2	175	-75.9	-73.2	-163.7	0	0	112.6	S94 S95 N101 R102	S94-M98 WeakPolarHBondContact O-CB 3.45Å; S94-M98 VanDerWaalsContact O-CG 3.23Å; S94-M98 WeakPolarHBondContact O-CG 3.47Å; S94-M98 PolarHBondContact O-N 3.36Å; S95-M98 PolarHBondContact O-N 2.88Å; M98-N101 PolarHBondContact O-N 3.2Å; M98-R102 WeakPolarHBondContact O-CB 3.4Å; M98-R102 PolarHBondContact O-N 2.85Å
99	D	32.7	Very low	38	Very low	111 Å²	111	107.5 Å²	107.5	59%	0.594	58%	0.581	S	S	*	*	H	α-helix	trans	-72.5	-30.9	178	-77.2	-24.6	0	0	0	112.9	S95	S95-D99 PolarHBondContact O-N 3.32Å
100	S	36.1	Very low	36.7	Very low	71 Å²	71	112.9 Å²	112.9	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-74.5	-32.7	173.3	47.2	0	0	0	0	113.3	E96 T97	E96-S100 PolarHBondContact O-N 2.69Å; E96-S100 PolarHBondContact O-OG 3.09Å; T97-S100 WeakPolarHBondContact CA-OG 3.41Å; T97-S100 PolarHBondContact O-OG 2.84Å
101	N	37.8	Very low	35.4	Very low	110 Å²	110	116.1 Å²	116.1	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-86.9	-23	179.6	-73.9	-40.4	0	0	0	114.1	T97 M98 A103 N104	T97-N101 WeakPolarHBondContact O-CB 3.22Å; T97-N101 PolarHBondContact O-N 3.31Å; T97-N101 PolarHBondContact O-ND2 3.17Å; M98-N101 PolarHBondContact O-N 3.2Å; N101-A103 PolarHBondContact O-N 2.98Å; N101-N104 PolarHBondContact O-N 3.34Å
102	R	35.1	Very low	34.3	Very low	216 Å²	216	121.7 Å²	121.7	82%	0.815	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-19.3	177.1	-115	176.3	174.2	168.8	-1.4	114.2	M98	M98-R102 WeakPolarHBondContact O-CB 3.4Å; M98-R102 PolarHBondContact O-N 2.85Å
103	A	35.6	Very low	33.6	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-17.8	176.9	0	0	0	0	0	113.8	N101	N101-A103 PolarHBondContact O-N 2.98Å
104	N	36.5	Very low	32.8	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	-5.1	-164.8	-92.4	-14.9	0	0	0	117.2	N101	N101-N104 PolarHBondContact O-N 3.34Å
105	A	31.5	Very low	32.3	Very low	88 Å²	88	126.9 Å²	126.9	73%	0.727	70%	0.702	S	S	*	*			trans	-125	73.5	-173.1	0	0	0	0	0	113.2
106	N	29.5	Very low	32.3	Very low	159 Å²	159	126.9 Å²	126.9	85%	0.85	71%	0.712	S	S	*	*			trans	-92.1	130.2	151.7	-101.8	-26.8	0	0	0	108
107	K	30.4	Very low	32.5	Very low	191 Å²	191	124.8 Å²	124.8	83%	0.83	71%	0.713	S	S	*	*	S	Bend	trans	98.2	111.7	176	-60.5	173.2	175.7	175.8	0	115.6
108	N	26.9	Very low	32.5	Very low	149 Å²	149	125.8 Å²	125.8	80%	0.797	72%	0.715	S	S	*	*			trans	50.1	97.1	144.3	-62	-8.4	0	0	0	117.3
109	Q	29.1	Very low	33	Very low	174 Å²	174	120.9 Å²	120.9	81%	0.813	69%	0.693	S	S	*	*				-174.7	136.3	126.9	-100.9	153.4	11	0	0	110.2	N111	Q109-N111 PolarHBondContact O-N 3.34Å
110	S	25.8	Very low	33.4	Very low	116 Å²	116	115.8 Å²	115.8	81%	0.811	67%	0.667	S	S	*	*			trans	-49.4	112.7	163.5	46.5	0	0	0	0	110.1
111	N	27.4	Very low	33.5	Very low	135 Å²	135	116.1 Å²	116.1	72%	0.722	67%	0.667	S	S	*	*			trans	-133.5	128.9	172.9	-87	-21.1	0	0	0	110.3	Q109 V113	Q109-N111 PolarHBondContact O-N 3.34Å; N111-V113 PolarHBondContact O-N 2.81Å
112	E	25.7	Very low	33.6	Very low	199 Å²	199	115.4 Å²	115.4	93%	0.93	66%	0.659	S	S	*	*			trans	-44.2	118.8	170.6	-65.6	169	143.6	0	0	110.5
113	V	29.4	Very low	33.9	Very low	135 Å²	135	106.5 Å²	106.5	82%	0.818	63%	0.629	S	S	*	*			trans	-89.3	113.2	171.4	-179.8	0	0	0	0	107.1	N111 S115	N111-V113 PolarHBondContact O-N 2.81Å; V113-S115 PolarHBondContact O-N 3.23Å
114	S	31.4	Very low	34.2	Very low	111 Å²	111	104.3 Å²	104.3	78%	0.776	61%	0.609	S	S	*	*			trans	-45.7	122.5	176.7	52.4	0	0	0	0	112.7	G116	S114-G116 PolarHBondContact O-N 2.78Å; S114-G116 VanDerWaalsContact O-N 3.15Å
115	S	32.9	Very low	34.4	Very low	91 Å²	91	98.5 Å²	98.5	64%	0.636	58%	0.58	S	S	*	*			trans	-65.9	98.6	178.9	55.8	0	0	0	0	112.4	V113	V113-S115 PolarHBondContact O-N 3.23Å
116	G	35.4	Very low	34.7	Very low	64 Å²	64	99 Å²	99	66%	0.66	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-83.9	123.2	170.9	0	0	0	0	0	111.4	S114 L118	S114-G116 PolarHBondContact O-N 2.78Å; S114-G116 VanDerWaalsContact O-N 3.15Å; G116-L118 PolarHBondContact O-N 3.45Å
117	A	41.3	Very low	35.4	Very low	63 Å²	63	92.4 Å²	92.4	52%	0.521	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-60.5	126.5	172	0	0	0	0	0	110.1
118	L	40.3	Very low	35.7	Very low	98 Å²	98	87.1 Å²	87.1	51%	0.513	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	150.1	173.8	-69.6	162.9	0	0	0	109	G116 I127 L185	G116-L118 PolarHBondContact O-N 3.45Å; L118-I127 HydrophobicContact CB-CB 4.1Å; L118-I127 HydrophobicContact CB-CD1 3.98Å; L118-I127 WeakPolarHBondContact O-CA 3.16Å; L118-I127 WeakPolarHBondContact O-CB 3.42Å; L118-I127 PolarHBondContact O-N 3.18Å; L118-L185 HydrophobicContact CB-CD1 4.37Å; L118-L185 HydrophobicContact CD1-CD1 3.82Å
119	S	41.4	Very low	36.2	Very low	24 Å²	24	83.7 Å²	83.7	17%	0.168	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.9	166.7	71.9	0	0	0	0	108.5	M87 P121 S125	M87-S119 WeakPolarHBondContact CE-OG 3.28Å; M87-S119 PolarHBondContact SD-OG 3.12Å; S119-P121 VanDerWaalsContact O-CD 3.29Å; S119-P121 WeakPolarHBondContact O-CD 3.25Å; S119-S125 CarbonylContact C-O 3.53Å; S119-S125 WeakPolarHBondContact CA-O 3.22Å
120	C	41.8	Very low	36.5	Very low	5 Å²	5	78.3 Å²	78.3	3%	0.034	48%	0.482	C	S	.	.			trans	-68.8	121.2	173.2	173.2	0	0	0	0	108.3	K122 C123 S124 S125 I127 C187	C120-K122 PolarHBondContact O-N 3.49Å; C120-K122 VanDerWaalsContact O-N 3.09Å; C120-K122 PolarHBondContact SG-N 3.47Å; C120-C123 WeakPolarHBondContact CB-SG 3.38Å; C120-C123 PolarHBondContact SG-SG 2.93Å; C120-S124 WeakPolarHBondContact O-CA 3.46Å; C120-S124 PolarHBondContact O-N 2.98Å; C120-S125 PolarHBondContact N-O 2.9Å; C120-I127 HydrophobicContact CB-CD1 4.47Å; C120-C187 HydrophobicContact CB-CB 3.77Å; C120-C187 WeakPolarHBondContact SG-CB 3.44Å
121	P	38.1	Very low	37	Very low	77 Å²	77	75.2 Å²	75.2	50%	0.5	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16	-176.7	23.1	-30.8	0	0	0	113.7	S119	S119-P121 VanDerWaalsContact O-CD 3.29Å; S119-P121 WeakPolarHBondContact O-CD 3.25Å
122	K	39.4	Very low	37.5	Very low	95 Å²	95	73 Å²	73	41%	0.413	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-37.8	-177.2	-171.7	-175.6	-174.8	-170.7	0	113.4	C120 C190 I192 V490	C120-K122 PolarHBondContact O-N 3.49Å; C120-K122 VanDerWaalsContact O-N 3.09Å; C120-K122 PolarHBondContact SG-N 3.47Å; K122-C190 HydrophobicContact CB-CB 4.05Å; K122-C190 WeakPolarHBondContact CB-SG 3.33Å; K122-C190 HydrophobicContact CD-CB 3.66Å; K122-C190 HydrophobicContact CG-CB 4.18Å; K122-C190 PolarHBondContact NZ-O 3.39Å; K122-I192 HydrophobicContact CD-CB 4.37Å; K122-I192 HydrophobicContact CD-CD1 4.11Å; K122-I192 VanDerWaalsContact NZ-CD1 3.32Å; K122-V490 HydrophobicContact CB-CG1 4.48Å
123	C	42.9	Very low	38.4	Very low	30 Å²	30	65.6 Å²	65.6	20%	0.203	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-6.5	178	58.4	0	0	0	0	113.2	C120 S125 C187 D189 C190	C120-C123 WeakPolarHBondContact CB-SG 3.38Å; C120-C123 PolarHBondContact SG-SG 2.93Å; C123-S125 PolarHBondContact O-N 2.75Å; C123-S125 WeakPolarHBondContact SG-CB 3.47Å; C123-S125 PolarHBondContact SG-OG 2.85Å; C123-C187 WeakPolarHBondContact CB-SG 3.49Å; C123-C187 WeakPolarHBondContact SG-CB 3.11Å; C123-C187 CovalentContact SG-SG 2.1Å; C123-C187 PolarHBondContact SG-SG 3.11Å; C123-D189 HydrophobicContact CB-CB 4.37Å; C123-C190 WeakPolarHBondContact CB-SG 3.49Å; C123-C190 PolarHBondContact N-SG 3.46Å; C123-C190 PolarHBondContact SG-SG 3.41Å
124	S	42	Very low	39.1	Very low	39 Å²	39	66.9 Å²	66.9	27%	0.273	43%	0.427	S	S	.	.			trans	53.8	18	-169.5	-43.8	0	0	0	0	113.7	H84 C120 L126	H84-S124 PolarHBondContact NE2-OG 3.18Å; C120-S124 WeakPolarHBondContact O-CA 3.46Å; C120-S124 PolarHBondContact O-N 2.98Å; S124-L126 PolarHBondContact O-N 3.24Å
125	S	39.5	Very low	39.8	Very low	25 Å²	25	67.1 Å²	67.1	18%	0.175	41%	0.411	C	S	.	.			trans	-65.5	127.9	177.6	-70.3	0	0	0	0	108.9	S119 C120 C123 I127	S119-S125 CarbonylContact C-O 3.53Å; S119-S125 WeakPolarHBondContact CA-O 3.22Å; C120-S125 PolarHBondContact N-O 2.9Å; C123-S125 PolarHBondContact O-N 2.75Å; C123-S125 WeakPolarHBondContact SG-CB 3.47Å; C123-S125 PolarHBondContact SG-OG 2.85Å; S125-I127 PolarHBondContact O-N 3.48Å
126	L	38.7	Very low	40.5	Very low	100 Å²	100	64.8 Å²	64.8	52%	0.524	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	121.9	171.9	-96.1	144.8	0	0	0	108.3	S124 L128	S124-L126 PolarHBondContact O-N 3.24Å; L126-L128 PolarHBondContact O-N 3.27Å
127	I	44.1	Very low	41	Very low	20 Å²	20	68.5 Å²	68.5	10%	0.103	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	103.9	171.4	-59.5	165.5	0	0	0	103.9	L118 C120 S125 L185	L118-I127 HydrophobicContact CB-CB 4.1Å; L118-I127 HydrophobicContact CB-CD1 3.98Å; L118-I127 WeakPolarHBondContact O-CA 3.16Å; L118-I127 WeakPolarHBondContact O-CB 3.42Å; L118-I127 PolarHBondContact O-N 3.18Å; C120-I127 HydrophobicContact CB-CD1 4.47Å; S125-I127 PolarHBondContact O-N 3.48Å; I127-L185 HydrophobicContact CB-CD1 4.3Å; I127-L185 HydrophobicContact CB-CD2 4.06Å; I127-L185 HydrophobicContact CD1-CB 3.86Å; I127-L185 HydrophobicContact CD1-CD1 3.51Å; I127-L185 HydrophobicContact CD1-CD2 3.76Å; I127-L185 HydrophobicContact CD1-CG 3.79Å; I127-L185 HydrophobicContact CG1-CD1 4.27Å; I127-L185 HydrophobicContact CG1-CD2 3.82Å; I127-L185 HydrophobicContact CG1-CG 4.39Å; I127-L185 HydrophobicContact CG2-CD1 3.6Å; I127-L185 HydrophobicContact CG2-CD2 3.2Å; I127-L185 HydrophobicContact CG2-CG 3.92Å
128	L	37.1	Very low	41.2	Very low	79 Å²	79	68.3 Å²	68.3	41%	0.414	38%	0.38	S	S	.	.			trans	-61.2	142.8	-175.2	-64.8	171.4	0	0	0	110.1	L126 L132 V209	L126-L128 PolarHBondContact O-N 3.27Å; L128-L132 HydrophobicContact CB-CB 3.68Å; L128-L132 HydrophobicContact CB-CD1 4.34Å; L128-L132 HydrophobicContact CD1-CB 3.96Å; L128-L132 HydrophobicContact CD2-CD1 4.11Å; L128-L132 HydrophobicContact CG-CB 4.27Å; L128-V209 HydrophobicContact CD1-CG1 4.01Å
129	N	36.8	Very low	41.4	Very low	77 Å²	77	73.1 Å²	73.1	41%	0.412	40%	0.397	S	S	.	.			trans	-56.2	158.5	-178.6	-140.8	-8.2	0	0	0	110.9	G131 L132	N129-G131 PolarHBondContact O-N 3.05Å; N129-L132 PolarHBondContact O-N 3.1Å
130	A	35.2	Very low	41.8	Very low	62 Å²	62	79.6 Å²	79.6	51%	0.512	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	105.7	172.6	0	0	0	0	0	109.9
131	G	35.9	Very low	42.1	Very low	51 Å²	51	84.5 Å²	84.5	53%	0.526	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	139.6	-24.6	-176.9	0	0	0	0	0	114.6	N129	N129-G131 PolarHBondContact O-N 3.05Å
132	L	37.8	Very low	42.6	Very low	89 Å²	89	82.5 Å²	82.5	47%	0.466	44%	0.437	S	S	.	.	S	Bend	trans	-108.6	99.9	-174.7	-72.9	164.3	0	0	0	110.6	L128 N129	L128-L132 HydrophobicContact CB-CB 3.68Å; L128-L132 HydrophobicContact CB-CD1 4.34Å; L128-L132 HydrophobicContact CD1-CB 3.96Å; L128-L132 HydrophobicContact CD2-CD1 4.11Å; L128-L132 HydrophobicContact CG-CB 4.27Å; N129-L132 PolarHBondContact O-N 3.1Å
133	G	44.3	Very low	43	Very low	42 Å²	42	80.6 Å²	80.6	43%	0.433	44%	0.435	S	S	.	.	S	Bend	trans	129.9	158.7	179.1	0	0	0	0	0	113.9	R135	G133-R135 PolarHBondContact O-N 3.15Å
134	K	44.9	Very low	43.4	Very low	163 Å²	163	85.7 Å²	85.7	71%	0.709	46%	0.455	S	S	*	.			trans	-74.8	114.7	-179	-166.8	175.2	-178.8	179.4	0	110.4	V136	K134-V136 PolarHBondContact O-N 2.63Å
135	R	46.8	Very low	43.8	Very low	115 Å²	115	85.2 Å²	85.2	43%	0.434	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.9	173.1	-63.7	-172.1	-177.1	-167	0.4	110	G133 F137 V207	G133-R135 PolarHBondContact O-N 3.15Å; R135-F137 HydrophobicContact CB-CE2 3.98Å; R135-F137 HydrophobicContact CB-CZ 4.42Å; R135-V207 HydrophobicContact CB-CG2 4.49Å; R135-V207 HydrophobicContact CG-CG1 4.13Å; R135-V207 HydrophobicContact CG-CG2 4Å
136	V	46.9	Very low	44.3	Very low	43 Å²	43	87.4 Å²	87.4	26%	0.261	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	100.8	178.9	-179	0	0	0	0	109	K134 M138 F206	K134-V136 PolarHBondContact O-N 2.63Å; V136-M138 PolarHBondContact O-N 3.12Å; V136-F206 CarbonylContact C-O 3.56Å; V136-F206 HydrophobicContact CB-CD2 4.27Å; V136-F206 HydrophobicContact CB-CE2 3.67Å; V136-F206 HydrophobicContact CB-CZ 4.12Å; V136-F206 HydrophobicContact CG1-CE2 3.77Å; V136-F206 HydrophobicContact CG1-CZ 3.7Å
137	F	45.8	Very low	44.7	Very low	141 Å²	141	87 Å²	87	62%	0.618	46%	0.46	S	S	*	.			trans	-80.5	120.8	179.3	-65.9	-84.7	0	0	0	110.9	R135	R135-F137 HydrophobicContact CB-CE2 3.98Å; R135-F137 HydrophobicContact CB-CZ 4.42Å
138	M	45.9	Very low	45	Very low	60 Å²	60	90.1 Å²	90.1	30%	0.296	47%	0.473	S	S	.	.			trans	-120	124.9	166.8	-105.9	-173.9	48.9	0	0	109.8	V136 R140 F161 F206	V136-M138 PolarHBondContact O-N 3.12Å; M138-R140 HydrophobicContact CE-CB 4.2Å; M138-R140 HydrophobicContact CE-CG 4.07Å; M138-R140 PolarHBondContact O-N 3.22Å; M138-F161 WeakPolarHBondContact CE-O 3.13Å; M138-F206 HydrophobicContact CB-CD1 4.21Å; M138-F206 HydrophobicContact CB-CE1 3.7Å; M138-F206 HydrophobicContact CG-CE1 4.02Å; M138-F206 HydrophobicContact SD-CE1 3.82Å; M138-F206 HydrophobicContact SD-CZ 4.31Å
139	K	44.9	Very low	45.4	Very low	199 Å²	199	92 Å²	92	87%	0.865	50%	0.5	S	S	*	.			trans	-92.7	77.6	172.7	-71.4	-174.2	176.2	-173.8	0	109.9
140	R	49.8	Very low	45.7	Very low	159 Å²	159	92.5 Å²	92.5	60%	0.6	50%	0.502	S	S	*	.			trans	-136.1	135.2	169.4	-69.9	-170	-179	176.5	-2	109.7	M138 L142 F161	M138-R140 HydrophobicContact CE-CB 4.2Å; M138-R140 HydrophobicContact CE-CG 4.07Å; M138-R140 PolarHBondContact O-N 3.22Å; R140-L142 PolarHBondContact O-N 3.41Å; R140-F161 HydrophobicContact CB-CD1 4.28Å; R140-F161 HydrophobicContact CB-CE1 4.11Å
141	S	46.6	Very low	45.9	Very low	109 Å²	109	90.9 Å²	90.9	76%	0.762	49%	0.491	S	S	*	.			trans	-66.2	115.4	168	52.7	0	0	0	0	108.8	F161	S141-F161 WeakPolarHBondContact O-CE1 3.48Å
142	L	48.5	Very low	46.2	Very low	34 Å²	34	88.5 Å²	88.5	18%	0.178	47%	0.467	C	S	.	.			trans	-66	130.7	169	-88.8	141.1	0	0	0	108.6	R140 L145 F161 F175 L204	R140-L142 PolarHBondContact O-N 3.41Å; L142-L145 HydrophobicContact CD2-CD1 4.08Å; L142-L145 HydrophobicContact CD2-CD2 3.99Å; L142-L145 HydrophobicContact CD2-CG 4Å; L142-F161 HydrophobicContact CD2-CB 3.86Å; L142-F161 HydrophobicContact CD2-CD1 3.85Å; L142-F161 HydrophobicContact CD2-CD2 3.92Å; L142-F161 HydrophobicContact CD2-CG 3.51Å; L142-F161 HydrophobicContact CG-CD1 3.82Å; L142-F161 HydrophobicContact CG-CE1 4.41Å; L142-F161 HydrophobicContact CG-CG 4.04Å; L142-F175 HydrophobicContact CD1-CD1 3.92Å; L142-F175 HydrophobicContact CD1-CE1 3.83Å; L142-L204 HydrophobicContact CD1-CB 4.45Å; L142-L204 HydrophobicContact CD1-CD1 4.17Å
143	P	48.9	Very low	46.9	Very low	56 Å²	56	84.5 Å²	84.5	36%	0.364	45%	0.446	S	S	.	.			trans	-60.7	165.1	164	29.7	-35.5	0	0	0	107.8	L145 V157 F161	P143-L145 PolarHBondContact O-N 3.44Å; P143-V157 HydrophobicContact CG-CG1 3.75Å; P143-F161 HydrophobicContact CG-CD2 4.25Å; P143-F161 HydrophobicContact CG-CE2 3.4Å; P143-F161 VanDerWaalsContact CG-CE2 3.4Å; P143-F161 HydrophobicContact CG-CZ 3.76Å
144	E	50.1	Low	47.7	Very low	136 Å²	136	85 Å²	85	64%	0.636	44%	0.439	S	S	*	.			trans	-46.2	104.9	169	-71.6	-179.1	165.4	0	0	108.6	T146 F198	E144-T146 PolarHBondContact O-N 2.83Å; E144-F198 HydrophobicContact CG-CE1 3.93Å; E144-F198 HydrophobicContact CG-CZ 3.84Å
145	L	52.3	Low	48.4	Very low	29 Å²	29	80.1 Å²	80.1	15%	0.152	42%	0.421	C	S	.	.			trans	-63.2	95.6	169.1	-79.2	166.3	0	0	0	103.7	L142 P143 L147 V153 V157 L158 L195	L142-L145 HydrophobicContact CD2-CD1 4.08Å; L142-L145 HydrophobicContact CD2-CD2 3.99Å; L142-L145 HydrophobicContact CD2-CG 4Å; P143-L145 PolarHBondContact O-N 3.44Å; L145-L147 PolarHBondContact O-N 3.49Å; L145-V153 HydrophobicContact CD2-CG1 3.72Å; L145-V157 HydrophobicContact CD2-CG1 4.2Å; L145-L158 HydrophobicContact CD2-CD1 4.27Å; L145-L195 HydrophobicContact CD1-CD1 4.45Å; L145-L195 HydrophobicContact CD1-CD2 4.47Å
146	T	48.6	Very low	49.1	Very low	72 Å²	72	81.6 Å²	81.6	44%	0.442	43%	0.432	S	S	.	.			trans	-62	105.9	178.7	23.6	0	0	0	0	106	E144 K148 N154	E144-T146 PolarHBondContact O-N 2.83Å; T146-K148 PolarHBondContact O-N 3.45Å; T146-N154 WeakPolarHBondContact O-CB 3.06Å; T146-N154 PolarHBondContact O-N 2.87Å
147	L	47.3	Very low	49.9	Very low	90 Å²	90	80.6 Å²	80.6	47%	0.471	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-63.6	124.9	170.9	-71.9	171.2	0	0	0	106.6	L145 G152 L195	L145-L147 PolarHBondContact O-N 3.49Å; L147-G152 CarbonylContact C-O 3.59Å; L147-G152 WeakPolarHBondContact CA-O 3.43Å; L147-L195 HydrophobicContact CD2-CB 4.42Å; L147-L195 HydrophobicContact CD2-CD1 3.43Å; L147-L195 VanDerWaalsContact CD2-CD1 3.43Å; L147-L195 HydrophobicContact CD2-CG 4.48Å; L147-L195 HydrophobicContact CG-CD1 4.29Å
148	K	51.3	Low	50.6	Low	87 Å²	87	74.3 Å²	74.3	38%	0.378	40%	0.399	S	S	.	.			trans	-55.8	154.9	159.6	-69.8	177.8	-172.9	170.5	0	107.7	T146 D150 G151 G152 E191	T146-K148 PolarHBondContact O-N 3.45Å; K148-D150 WeakPolarHBondContact CB-OD1 3.39Å; K148-D150 PolarHBondContact O-N 3.17Å; K148-G151 WeakPolarHBondContact O-CA 3.39Å; K148-G151 PolarHBondContact O-N 3.11Å; K148-G152 PolarHBondContact N-O 3.3Å; K148-E191 IonicContact NZ-OE2 2.72Å
149	A	45.1	Very low	51.1	Low	119 Å²	119	73.8 Å²	73.8	98%	0.983	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.1	-178.8	0	0	0	0	0	113.8	G151	A149-G151 VanDerWaalsContact C-N 3.28Å
150	D	42.9	Very low	51.9	Low	87 Å²	87	70.3 Å²	70.3	47%	0.465	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.8	174.8	63.1	-0.4	0	0	0	113.9	K148 G152	K148-D150 WeakPolarHBondContact CB-OD1 3.39Å; K148-D150 PolarHBondContact O-N 3.17Å; D150-G152 VanDerWaalsContact C-N 3.26Å; D150-G152 WeakPolarHBondContact OD1-CA 3.4Å; D150-G152 PolarHBondContact OD1-N 3.38Å
151	G	40.1	Very low	52.2	Low	27 Å²	27	64.2 Å²	64.2	28%	0.278	37%	0.366	S	S	.	.	S	Bend	trans	76.9	8.4	-173.7	0	0	0	0	0	114	K148 A149	K148-G151 WeakPolarHBondContact O-CA 3.39Å; K148-G151 PolarHBondContact O-N 3.11Å; A149-G151 VanDerWaalsContact C-N 3.28Å
152	G	41.4	Very low	52.6	Low	2 Å²	2	59.1 Å²	59.1	2%	0.021	33%	0.33	C	S	.	.			trans	-76.5	158	172.3	0	0	0	0	0	112.3	L147 K148 D150	L147-G152 CarbonylContact C-O 3.59Å; L147-G152 WeakPolarHBondContact CA-O 3.43Å; K148-G152 PolarHBondContact N-O 3.3Å; D150-G152 VanDerWaalsContact C-N 3.26Å; D150-G152 WeakPolarHBondContact OD1-CA 3.4Å; D150-G152 PolarHBondContact OD1-N 3.38Å
153	V	53.4	Low	53	Low	5 Å²	5	66.3 Å²	66.3	3%	0.03	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-83.1	139.4	175.6	173	0	0	0	0	110.5	L145 L155 L158 L186 E191 L195	L145-V153 HydrophobicContact CD2-CG1 3.72Å; V153-L155 PolarHBondContact O-N 3.17Å; V153-L158 HydrophobicContact CG1-CB 3.98Å; V153-L158 HydrophobicContact CG1-CD1 4.43Å; V153-L158 HydrophobicContact CG1-CD2 4.37Å; V153-L158 HydrophobicContact CG1-CG 4.5Å; V153-L186 HydrophobicContact CB-CD2 4.46Å; V153-L186 HydrophobicContact CG2-CD1 4.44Å; V153-L186 HydrophobicContact CG2-CD2 3.65Å; V153-E191 PolarHBondContact N-O 3.13Å; V153-L195 HydrophobicContact CG2-CD1 3.75Å
154	N	60.1	Low	53	Low	51 Å²	51	67 Å²	67	27%	0.273	36%	0.358	S	S	.	.			trans	-66.7	100.7	165.6	-171	-16.3	0	0	0	110.1	T146 Q156 V157 L158	T146-N154 WeakPolarHBondContact O-CB 3.06Å; T146-N154 PolarHBondContact O-N 2.87Å; N154-Q156 PolarHBondContact O-N 2.98Å; N154-Q156 VanDerWaalsContact O-N 3.14Å; N154-Q156 WeakPolarHBondContact OD1-CB 3.17Å; N154-Q156 PolarHBondContact OD1-N 3.07Å; N154-Q156 VanDerWaalsContact OD1-N 3.12Å; N154-V157 HydrophobicContact CB-CB 4.34Å; N154-V157 HydrophobicContact CB-CG2 4.04Å; N154-V157 WeakPolarHBondContact O-CB 3.48Å; N154-V157 PolarHBondContact O-N 2.93Å; N154-L158 PolarHBondContact O-N 3.3Å
155	L	59	Low	52.7	Low	62 Å²	62	66 Å²	66	33%	0.325	36%	0.357	S	S	.	.	H	α-helix	trans	-54.4	-29.4	179.4	-86.7	162.5	0	0	0	113.6	V153 V157 L158 S159 E191	V153-L155 PolarHBondContact O-N 3.17Å; L155-V157 VanDerWaalsContact C-N 3.33Å; L155-L158 HydrophobicContact CD2-CD2 4.26Å; L155-L158 PolarHBondContact O-N 3.32Å; L155-S159 WeakPolarHBondContact O-CB 3.27Å; L155-S159 PolarHBondContact O-N 3.33Å; L155-S159 PolarHBondContact O-OG 3.45Å; L155-E191 VanDerWaalsContact CD1-CD 3.47Å; L155-E191 HydrophobicContact CD1-CG 4.24Å; L155-E191 WeakPolarHBondContact CD1-OE1 3.46Å
156	Q	63.2	Low	52.5	Low	146 Å²	146	67 Å²	67	68%	0.682	36%	0.363	S	S	*	.	H	α-helix	trans	-69.2	-34.9	178.1	-163.3	171.6	1.3	0	0	111.6	N154 S159	N154-Q156 PolarHBondContact O-N 2.98Å; N154-Q156 VanDerWaalsContact O-N 3.14Å; N154-Q156 WeakPolarHBondContact OD1-CB 3.17Å; N154-Q156 PolarHBondContact OD1-N 3.07Å; N154-Q156 VanDerWaalsContact OD1-N 3.12Å; Q156-S159 PolarHBondContact O-OG 3.32Å; Q156-S159 VanDerWaalsContact O-OG 3.12Å
157	V	62.4	Low	52.5	Low	22 Å²	22	64.8 Å²	64.8	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-75.5	-38.6	172.1	-179.3	0	0	0	0	109.8	P143 L145 N154 L155 S159 E160 F161	P143-V157 HydrophobicContact CG-CG1 3.75Å; L145-V157 HydrophobicContact CD2-CG1 4.2Å; N154-V157 HydrophobicContact CB-CB 4.34Å; N154-V157 HydrophobicContact CB-CG2 4.04Å; N154-V157 WeakPolarHBondContact O-CB 3.48Å; N154-V157 PolarHBondContact O-N 2.93Å; L155-V157 VanDerWaalsContact C-N 3.33Å; V157-S159 PolarHBondContact O-N 3.47Å; V157-E160 WeakPolarHBondContact O-CB 3.4Å; V157-E160 PolarHBondContact O-N 2.88Å; V157-F161 WeakPolarHBondContact O-CD2 3.49Å
158	L	60	Low	52.2	Low	9 Å²	9	68.6 Å²	68.6	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-64.4	-39.3	178.8	-170.9	67.9	0	0	0	112.8	L145 V153 N154 L155 E160 F161 V162 I167 F175 L186	L145-L158 HydrophobicContact CD2-CD1 4.27Å; V153-L158 HydrophobicContact CG1-CB 3.98Å; V153-L158 HydrophobicContact CG1-CD1 4.43Å; V153-L158 HydrophobicContact CG1-CD2 4.37Å; V153-L158 HydrophobicContact CG1-CG 4.5Å; N154-L158 PolarHBondContact O-N 3.3Å; L155-L158 HydrophobicContact CD2-CD2 4.26Å; L155-L158 PolarHBondContact O-N 3.32Å; L158-E160 PolarHBondContact O-N 3.33Å; L158-F161 PolarHBondContact O-N 2.99Å; L158-V162 HydrophobicContact CD1-CG2 4.17Å; L158-V162 HydrophobicContact CG-CG2 4.44Å; L158-V162 PolarHBondContact O-N 3.12Å; L158-I167 HydrophobicContact CD2-CD1 4.39Å; L158-I167 HydrophobicContact CG-CD1 4.45Å; L158-F175 HydrophobicContact CD1-CZ 3.96Å; L158-L186 HydrophobicContact CD1-CD1 3.81Å; L158-L186 HydrophobicContact CD2-CD1 3.72Å; L158-L186 HydrophobicContact CG-CD1 4.46Å
159	S	58.1	Low	51.7	Low	48 Å²	48	67.3 Å²	67.3	34%	0.336	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.5	179.9	63.3	0	0	0	0	113.9	L155 Q156 V157 F161 V162	L155-S159 WeakPolarHBondContact O-CB 3.27Å; L155-S159 PolarHBondContact O-N 3.33Å; L155-S159 PolarHBondContact O-OG 3.45Å; Q156-S159 PolarHBondContact O-OG 3.32Å; Q156-S159 VanDerWaalsContact O-OG 3.12Å; V157-S159 PolarHBondContact O-N 3.47Å; S159-F161 VanDerWaalsContact C-N 3.28Å; S159-V162 CarbonylContact C-O 3.49Å; S159-V162 WeakPolarHBondContact CA-O 3.48Å
160	E	61.4	Low	51.7	Low	127 Å²	127	62.6 Å²	62.6	59%	0.593	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-20.9	168.4	-67.8	177.6	174.3	0	0	112.2	V157 L158	V157-E160 WeakPolarHBondContact O-CB 3.4Å; V157-E160 PolarHBondContact O-N 2.88Å; L158-E160 PolarHBondContact O-N 3.33Å
161	F	56.7	Low	51.8	Low	30 Å²	30	61.3 Å²	61.3	13%	0.132	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-35.7	-175.6	-74.1	-89.5	0	0	0	113.8	M138 R140 S141 L142 P143 V157 L158 S159	M138-F161 WeakPolarHBondContact CE-O 3.13Å; R140-F161 HydrophobicContact CB-CD1 4.28Å; R140-F161 HydrophobicContact CB-CE1 4.11Å; S141-F161 WeakPolarHBondContact O-CE1 3.48Å; L142-F161 HydrophobicContact CD2-CB 3.86Å; L142-F161 HydrophobicContact CD2-CD1 3.85Å; L142-F161 HydrophobicContact CD2-CD2 3.92Å; L142-F161 HydrophobicContact CD2-CG 3.51Å; L142-F161 HydrophobicContact CG-CD1 3.82Å; L142-F161 HydrophobicContact CG-CE1 4.41Å; L142-F161 HydrophobicContact CG-CG 4.04Å; P143-F161 HydrophobicContact CG-CD2 4.25Å; P143-F161 HydrophobicContact CG-CE2 3.4Å; P143-F161 VanDerWaalsContact CG-CE2 3.4Å; P143-F161 HydrophobicContact CG-CZ 3.76Å; V157-F161 WeakPolarHBondContact O-CD2 3.49Å; L158-F161 PolarHBondContact O-N 2.99Å; S159-F161 VanDerWaalsContact C-N 3.28Å
162	V	54.4	Low	52.1	Low	2 Å²	2	60.4 Å²	60.4	1%	0.012	29%	0.294	C	S	.	.	S	Bend	trans	-111.8	129.4	177.5	-173.2	0	0	0	0	107.2	L158 S159 V164 D166 I167 I173	L158-V162 HydrophobicContact CD1-CG2 4.17Å; L158-V162 HydrophobicContact CG-CG2 4.44Å; L158-V162 PolarHBondContact O-N 3.12Å; S159-V162 CarbonylContact C-O 3.49Å; S159-V162 WeakPolarHBondContact CA-O 3.48Å; V162-V164 PolarHBondContact O-N 3.29Å; V162-D166 HydrophobicContact CG1-CB 3.82Å; V162-I167 HydrophobicContact CB-CD1 4.18Å; V162-I167 HydrophobicContact CB-CG1 3.88Å; V162-I167 HydrophobicContact CG1-CD1 4.38Å; V162-I167 HydrophobicContact CG1-CG1 3.55Å; V162-I173 HydrophobicContact CG1-CD1 4.1Å
163	R	56.5	Low	52.6	Low	185 Å²	185	60.5 Å²	60.5	70%	0.698	29%	0.294	S	S	*	.			trans	-56.7	136	175	-72	-178.6	163.1	-174.6	-4.8	108.1	D165 D166 I167	R163-D165 PolarHBondContact O-N 3.41Å; R163-D165 VanDerWaalsContact O-N 3.13Å; R163-D166 HydrophobicContact CB-CB 4.29Å; R163-D166 WeakPolarHBondContact CB-OD2 3.32Å; R163-D166 WeakPolarHBondContact O-CA 3.08Å; R163-D166 VanDerWaalsContact O-CB 3.31Å; R163-D166 WeakPolarHBondContact O-CB 3.17Å; R163-D166 PolarHBondContact O-N 2.87Å; R163-I167 PolarHBondContact O-N 3.1Å
164	V	48.1	Very low	52.5	Low	72 Å²	72	60.4 Å²	60.4	44%	0.436	29%	0.294	S	S	.	.	H	α-helix	trans	-51.8	-39.9	179.5	176.1	0	0	0	0	110.8	V162 D166 I167 Y168	V162-V164 PolarHBondContact O-N 3.29Å; V164-D166 VanDerWaalsContact C-N 3.34Å; V164-D166 PolarHBondContact O-N 3.13Å; V164-I167 WeakPolarHBondContact O-CB 3.5Å; V164-I167 PolarHBondContact O-N 3.22Å; V164-Y168 HydrophobicContact CG1-CD2 4.08Å; V164-Y168 HydrophobicContact CG1-CE2 3.55Å; V164-Y168 WeakPolarHBondContact O-CD2 3.48Å; V164-Y168 PolarHBondContact O-N 3.15Å
165	D	45.6	Very low	52	Low	115 Å²	115	58.3 Å²	58.3	62%	0.615	28%	0.282	S	S	*	.	H	α-helix	trans	-60.5	-40	176	-57	-29.9	0	0	0	112.7	R163 I167 Y168 T169	R163-D165 PolarHBondContact O-N 3.41Å; R163-D165 VanDerWaalsContact O-N 3.13Å; D165-I167 PolarHBondContact O-N 2.79Å; D165-Y168 PolarHBondContact O-N 3.09Å; D165-T169 WeakPolarHBondContact O-CB 3.35Å; D165-T169 PolarHBondContact O-N 3.4Å; D165-T169 VanDerWaalsContact O-N 3.15Å; D165-T169 PolarHBondContact O-OG1 3.19Å
166	D	47.2	Very low	51.4	Low	50 Å²	50	55.6 Å²	55.6	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-65.4	-39.8	178.5	-66.5	-22.7	0	0	0	110.6	V162 R163 V164 Y168 T169 F170	V162-D166 HydrophobicContact CG1-CB 3.82Å; R163-D166 HydrophobicContact CB-CB 4.29Å; R163-D166 WeakPolarHBondContact CB-OD2 3.32Å; R163-D166 WeakPolarHBondContact O-CA 3.08Å; R163-D166 VanDerWaalsContact O-CB 3.31Å; R163-D166 WeakPolarHBondContact O-CB 3.17Å; R163-D166 PolarHBondContact O-N 2.87Å; V164-D166 VanDerWaalsContact C-N 3.34Å; V164-D166 PolarHBondContact O-N 3.13Å; D166-Y168 VanDerWaalsContact C-N 3.26Å; D166-Y168 PolarHBondContact O-N 3.35Å; D166-T169 PolarHBondContact O-N 3.26Å; D166-T169 VanDerWaalsContact O-N 3.1Å; D166-F170 HydrophobicContact CB-CD2 3.9Å; D166-F170 HydrophobicContact CB-CE2 3.7Å; D166-F170 WeakPolarHBondContact O-CD2 3.27Å; D166-F170 PolarHBondContact O-N 3.18Å
167	I	48.1	Very low	50.6	Low	24 Å²	24	50.5 Å²	50.5	12%	0.123	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-39.2	179	-59.3	175	0	0	0	111.8	L158 V162 R163 V164 D165 I173	L158-I167 HydrophobicContact CD2-CD1 4.39Å; L158-I167 HydrophobicContact CG-CD1 4.45Å; V162-I167 HydrophobicContact CB-CD1 4.18Å; V162-I167 HydrophobicContact CB-CG1 3.88Å; V162-I167 HydrophobicContact CG1-CD1 4.38Å; V162-I167 HydrophobicContact CG1-CG1 3.55Å; R163-I167 PolarHBondContact O-N 3.1Å; V164-I167 WeakPolarHBondContact O-CB 3.5Å; V164-I167 PolarHBondContact O-N 3.22Å; D165-I167 PolarHBondContact O-N 2.79Å; I167-I173 HydrophobicContact CG1-CD1 4.28Å
168	Y	42.4	Very low	50	Low	171 Å²	171	54 Å²	54	67%	0.671	26%	0.261	S	S	*	.	H	α-helix	trans	-81.6	-23.4	179.4	-66.2	-67.2	0	0	0	113.5	V164 D165 D166	V164-Y168 HydrophobicContact CG1-CD2 4.08Å; V164-Y168 HydrophobicContact CG1-CE2 3.55Å; V164-Y168 WeakPolarHBondContact O-CD2 3.48Å; V164-Y168 PolarHBondContact O-N 3.15Å; D165-Y168 PolarHBondContact O-N 3.09Å; D166-Y168 VanDerWaalsContact C-N 3.26Å; D166-Y168 PolarHBondContact O-N 3.35Å
169	T	40.1	Very low	49.3	Very low	60 Å²	60	57.3 Å²	57.3	37%	0.368	29%	0.29	S	S	.	.	H	α-helix	trans	-84.3	-27.7	-176.8	-48.8	0	0	0	0	112.2	D165 D166 E210 R211	D165-T169 WeakPolarHBondContact O-CB 3.35Å; D165-T169 PolarHBondContact O-N 3.4Å; D165-T169 VanDerWaalsContact O-N 3.15Å; D165-T169 PolarHBondContact O-OG1 3.19Å; D166-T169 PolarHBondContact O-N 3.26Å; D166-T169 VanDerWaalsContact O-N 3.1Å; T169-E210 HydrophobicContact CG2-CG 4.33Å; T169-R211 WeakPolarHBondContact O-CB 3.41Å; T169-R211 PolarHBondContact O-N 2.83Å
170	F	45.8	Very low	48.5	Very low	20 Å²	20	57.3 Å²	57.3	9%	0.088	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.8	-177.7	-63.7	-64.7	0	0	0	112.3	D166 I173 A188 A208 V209	D166-F170 HydrophobicContact CB-CD2 3.9Å; D166-F170 HydrophobicContact CB-CE2 3.7Å; D166-F170 WeakPolarHBondContact O-CD2 3.27Å; D166-F170 PolarHBondContact O-N 3.18Å; F170-I173 HydrophobicContact CB-CG1 4.12Å; F170-A188 WeakPolarHBondContact O-CB 3.37Å; F170-A208 HydrophobicContact CB-CB 4.02Å; F170-A208 VanDerWaalsContact CD1-C 3.5Å; F170-A208 HydrophobicContact CD1-CB 3.39Å; F170-A208 HydrophobicContact CD2-CB 3.44Å; F170-A208 VanDerWaalsContact CD2-CB 3.44Å; F170-A208 HydrophobicContact CE1-CB 3.58Å; F170-A208 HydrophobicContact CE2-CB 3.66Å; F170-A208 HydrophobicContact CG-CB 3.34Å; F170-A208 HydrophobicContact CZ-CB 3.73Å; F170-V209 CarbonylContact C-O 3.5Å; F170-V209 VanDerWaalsContact CA-O 3.23Å; F170-V209 WeakPolarHBondContact CA-O 3.29Å; F170-V209 VanDerWaalsContact CD1-C 3.48Å; F170-V209 WeakPolarHBondContact CD1-O 3.33Å
171	Q	44.2	Very low	47.9	Very low	59 Å²	59	56.1 Å²	56.1	28%	0.276	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	-36.2	177.5	-147.2	156.9	40.3	0	0	111	A188 V209 R211	Q171-A188 WeakPolarHBondContact O-CB 3.42Å; Q171-A188 PolarHBondContact O-N 2.75Å; Q171-A188 VanDerWaalsContact O-N 3.11Å; Q171-V209 PolarHBondContact N-O 3.04Å; Q171-R211 HydrophobicContact CB-CB 4.06Å; Q171-R211 HydrophobicContact CB-CG 4Å; Q171-R211 HydrophobicContact CG-CB 4.42Å; Q171-R211 HydrophobicContact CG-CG 3.83Å
172	N	46.5	Very low	47.4	Very low	8 Å²	8	56.9 Å²	56.9	4%	0.043	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	135.3	176.5	-62.7	-59.6	0	0	0	109.4	L186 C187 V209	N172-L186 CarbonylContact C-O 3.43Å; N172-L186 WeakPolarHBondContact CA-O 3.36Å; N172-C187 WeakPolarHBondContact OD1-CA 3.41Å; N172-C187 WeakPolarHBondContact OD1-CB 3.34Å; N172-V209 PolarHBondContact O-N 3.08Å
173	I	51	Low	47	Very low	4 Å²	4	62.8 Å²	62.8	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	107.1	169.3	-61.5	167.9	0	0	0	107	V162 I167 F170 F175 L186 F206	V162-I173 HydrophobicContact CG1-CD1 4.1Å; I167-I173 HydrophobicContact CG1-CD1 4.28Å; F170-I173 HydrophobicContact CB-CG1 4.12Å; I173-F175 HydrophobicContact CG2-CE2 4.09Å; I173-F175 HydrophobicContact CG2-CZ 4Å; I173-L186 HydrophobicContact CB-CB 4.38Å; I173-L186 PolarHBondContact N-O 3.43Å; I173-L186 WeakPolarHBondContact O-CA 3.31Å; I173-L186 WeakPolarHBondContact O-CB 3.42Å; I173-L186 PolarHBondContact O-N 2.98Å; I173-F206 HydrophobicContact CG2-CD2 4.4Å
174	G	52	Low	46.7	Very low	3 Å²	3	54.7 Å²	54.7	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.7	172.9	0	0	0	0	0	111.2	Y184 F206 V207	G174-Y184 CarbonylContact C-O 3.41Å; G174-Y184 VanDerWaalsContact CA-O 3.23Å; G174-Y184 WeakPolarHBondContact CA-O 3.42Å; G174-F206 CarbonylContact O-C 3.57Å; G174-F206 WeakPolarHBondContact O-CA 3.49Å; G174-F206 WeakPolarHBondContact O-CB 3.41Å; G174-V207 PolarHBondContact N-O 3.37Å; G174-V207 PolarHBondContact O-N 3.46Å
175	F	49.9	Very low	46.7	Very low	7 Å²	7	52 Å²	52	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.6	163.4	-48.4	-99.4	0	0	0	110.3	L142 L158 I173 R183 Y184 L186 L204 S205 F206	L142-F175 HydrophobicContact CD1-CD1 3.92Å; L142-F175 HydrophobicContact CD1-CE1 3.83Å; L158-F175 HydrophobicContact CD1-CZ 3.96Å; I173-F175 HydrophobicContact CG2-CE2 4.09Å; I173-F175 HydrophobicContact CG2-CZ 4Å; F175-R183 PolarHBondContact O-N 3.18Å; F175-R183 VanDerWaalsContact O-N 3.08Å; F175-Y184 HydrophobicContact CB-CD2 4.19Å; F175-Y184 PolarHBondContact N-O 3.43Å; F175-Y184 WeakPolarHBondContact O-CD2 3.36Å; F175-Y184 PolarHBondContact O-N 3.21Å; F175-Y184 VanDerWaalsContact O-O 3.07Å; F175-L186 HydrophobicContact CE2-CD1 3.47Å; F175-L186 VanDerWaalsContact CE2-CD1 3.47Å; F175-L186 HydrophobicContact CE2-CG 3.86Å; F175-L186 HydrophobicContact CZ-CD1 4.03Å; F175-L204 HydrophobicContact CB-CD2 4.27Å; F175-S205 CarbonylContact C-O 3.46Å; F175-S205 WeakPolarHBondContact CA-O 3.44Å; F175-F206 HydrophobicContact CD1-CB 3.81Å; F175-F206 HydrophobicContact CE1-CB 4.14Å; F175-F206 HydrophobicContact CG-CB 4.39Å
176	S	47	Very low	46.9	Very low	6 Å²	6	47.1 Å²	47.1	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130	178.1	172.7	0	0	0	0	109.6	N178 D181 S205	S176-N178 PolarHBondContact OG-O 2.92Å; S176-D181 WeakPolarHBondContact CA-O 3.48Å; S176-D181 VanDerWaalsContact CB-O 3.26Å; S176-D181 WeakPolarHBondContact CB-O 3.09Å; S176-D181 VanDerWaalsContact OG-C 3.3Å; S176-D181 PolarHBondContact OG-O 2.87Å; S176-S205 PolarHBondContact N-O 2.87Å; S176-S205 PolarHBondContact O-N 2.75Å; S176-S205 VanDerWaalsContact O-N 3.08Å
177	R	46.4	Very low	46.9	Very low	39 Å²	39	45 Å²	45	15%	0.147	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-21.8	179.4	-115	178.8	-145.4	169.9	15.8	113.4	R183 Y184 G196 I197 L204	R177-R183 HydrophobicContact CB-CG 4.49Å; R177-Y184 HydrophobicContact CB-CE2 3.87Å; R177-Y184 WeakPolarHBondContact CD-OH 3.48Å; R177-Y184 HydrophobicContact CG-CE2 3.54Å; R177-Y184 PolarHBondContact NE-OH 2.59Å; R177-Y184 PolarHBondContact NH1-OH 3.43Å; R177-Y184 VanDerWaalsContact NH1-OH 3.12Å; R177-Y184 VanDerWaalsContact NH2-CZ 3.31Å; R177-Y184 PolarHBondContact NH2-OH 2.89Å; R177-G196 PolarHBondContact NH2-O 3.35Å; R177-I197 VanDerWaalsContact CZ-O 3.23Å; R177-I197 PolarHBondContact NH1-O 2.91Å; R177-I197 PolarHBondContact NH2-O 2.96Å; R177-L204 HydrophobicContact CB-CD2 4.36Å; R177-L204 HydrophobicContact CG-CD2 3.78Å
178	N	48.6	Very low	46.9	Very low	96 Å²	96	45.4 Å²	45.4	51%	0.513	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	136.7	-179.5	-73.9	-29.7	0	0	0	107.1	S176 G180 D181	S176-N178 PolarHBondContact OG-O 2.92Å; N178-G180 PolarHBondContact O-N 2.9Å; N178-D181 PolarHBondContact O-N 3.38Å
179	A	45.4	Very low	47	Very low	78 Å²	78	41.3 Å²	41.3	65%	0.645	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-0.3	-171.2	0	0	0	0	0	118.5
180	G	41.3	Very low	47.3	Very low	47 Å²	47	38.7 Å²	38.7	49%	0.485	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-36.4	173.8	0	0	0	0	0	115.8	N178	N178-G180 PolarHBondContact O-N 2.9Å
181	D	48.5	Very low	47.5	Very low	103 Å²	103	42.2 Å²	42.2	55%	0.551	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	127.5	-166	-65.6	-38.8	0	0	0	113.7	S176 N178 R183	S176-D181 WeakPolarHBondContact CA-O 3.48Å; S176-D181 VanDerWaalsContact CB-O 3.26Å; S176-D181 WeakPolarHBondContact CB-O 3.09Å; S176-D181 VanDerWaalsContact OG-C 3.3Å; S176-D181 PolarHBondContact OG-O 2.87Å; N178-D181 PolarHBondContact O-N 3.38Å; D181-R183 PolarHBondContact O-N 3.29Å
182	V	47.2	Very low	47.5	Very low	45 Å²	45	40.9 Å²	40.9	27%	0.273	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	110.8	169.9	-178.9	0	0	0	0	108.3	Y184 L185 V207	V182-Y184 WeakPolarHBondContact CG1-O 3.43Å; V182-L185 HydrophobicContact CG1-CD1 3.97Å; V182-L185 HydrophobicContact CG1-CD2 4.12Å; V182-L185 HydrophobicContact CG1-CG 3.87Å; V182-V207 HydrophobicContact CG2-CB 4.46Å; V182-V207 HydrophobicContact CG2-CG2 4.26Å
183	R	44.5	Very low	47.5	Very low	126 Å²	126	40.9 Å²	40.9	48%	0.475	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-13.4	-177.6	-71.6	-163.6	-169.4	165.3	-2.3	113.7	F175 R177 D181	F175-R183 PolarHBondContact O-N 3.18Å; F175-R183 VanDerWaalsContact O-N 3.08Å; R177-R183 HydrophobicContact CB-CG 4.49Å; D181-R183 PolarHBondContact O-N 3.29Å
184	Y	50.3	Low	47	Very low	15 Å²	15	44.2 Å²	44.2	6%	0.059	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.9	-176.6	-49.1	-74.5	0	0	0	108.7	G174 F175 R177 V182 L195 L204	G174-Y184 CarbonylContact C-O 3.41Å; G174-Y184 VanDerWaalsContact CA-O 3.23Å; G174-Y184 WeakPolarHBondContact CA-O 3.42Å; F175-Y184 HydrophobicContact CB-CD2 4.19Å; F175-Y184 PolarHBondContact N-O 3.43Å; F175-Y184 WeakPolarHBondContact O-CD2 3.36Å; F175-Y184 PolarHBondContact O-N 3.21Å; F175-Y184 VanDerWaalsContact O-O 3.07Å; R177-Y184 HydrophobicContact CB-CE2 3.87Å; R177-Y184 WeakPolarHBondContact CD-OH 3.48Å; R177-Y184 HydrophobicContact CG-CE2 3.54Å; R177-Y184 PolarHBondContact NE-OH 2.59Å; R177-Y184 PolarHBondContact NH1-OH 3.43Å; R177-Y184 VanDerWaalsContact NH1-OH 3.12Å; R177-Y184 VanDerWaalsContact NH2-CZ 3.31Å; R177-Y184 PolarHBondContact NH2-OH 2.89Å; V182-Y184 WeakPolarHBondContact CG1-O 3.43Å; Y184-L195 HydrophobicContact CD1-CD2 4.15Å; Y184-L195 HydrophobicContact CG-CD2 4.41Å; Y184-L204 HydrophobicContact CD2-CD2 3.98Å; Y184-L204 HydrophobicContact CE2-CD2 4.08Å
185	L	48.6	Very low	46.4	Very low	17 Å²	17	46.8 Å²	46.8	9%	0.089	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.2	-179.3	-80.7	129.4	0	0	0	110.9	L118 I127 V182 G193	L118-L185 HydrophobicContact CB-CD1 4.37Å; L118-L185 HydrophobicContact CD1-CD1 3.82Å; I127-L185 HydrophobicContact CB-CD1 4.3Å; I127-L185 HydrophobicContact CB-CD2 4.06Å; I127-L185 HydrophobicContact CD1-CB 3.86Å; I127-L185 HydrophobicContact CD1-CD1 3.51Å; I127-L185 HydrophobicContact CD1-CD2 3.76Å; I127-L185 HydrophobicContact CD1-CG 3.79Å; I127-L185 HydrophobicContact CG1-CD1 4.27Å; I127-L185 HydrophobicContact CG1-CD2 3.82Å; I127-L185 HydrophobicContact CG1-CG 4.39Å; I127-L185 HydrophobicContact CG2-CD1 3.6Å; I127-L185 HydrophobicContact CG2-CD2 3.2Å; I127-L185 HydrophobicContact CG2-CG 3.92Å; V182-L185 HydrophobicContact CG1-CD1 3.97Å; V182-L185 HydrophobicContact CG1-CD2 4.12Å; V182-L185 HydrophobicContact CG1-CG 3.87Å; L185-G193 CarbonylContact O-C 3.37Å; L185-G193 WeakPolarHBondContact O-CA 3.33Å; L185-G193 PolarHBondContact O-N 3.16Å
186	L	49.2	Very low	45.8	Very low	12 Å²	12	48.2 Å²	48.2	6%	0.063	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.5	163.1	-66.1	178.8	0	0	0	107.2	V153 L158 N172 I173 F175	V153-L186 HydrophobicContact CB-CD2 4.46Å; V153-L186 HydrophobicContact CG2-CD1 4.44Å; V153-L186 HydrophobicContact CG2-CD2 3.65Å; L158-L186 HydrophobicContact CD1-CD1 3.81Å; L158-L186 HydrophobicContact CD2-CD1 3.72Å; L158-L186 HydrophobicContact CG-CD1 4.46Å; N172-L186 CarbonylContact C-O 3.43Å; N172-L186 WeakPolarHBondContact CA-O 3.36Å; I173-L186 HydrophobicContact CB-CB 4.38Å; I173-L186 PolarHBondContact N-O 3.43Å; I173-L186 WeakPolarHBondContact O-CA 3.31Å; I173-L186 WeakPolarHBondContact O-CB 3.42Å; I173-L186 PolarHBondContact O-N 2.98Å; F175-L186 HydrophobicContact CE2-CD1 3.47Å; F175-L186 VanDerWaalsContact CE2-CD1 3.47Å; F175-L186 HydrophobicContact CE2-CG 3.86Å; F175-L186 HydrophobicContact CZ-CD1 4.03Å
187	C	48.4	Very low	45.3	Very low	4 Å²	4	55.3 Å²	55.3	3%	0.027	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.9	163.6	167.3	0	0	0	0	107.1	C120 C123 N172 D189 C190 E191	C120-C187 HydrophobicContact CB-CB 3.77Å; C120-C187 WeakPolarHBondContact SG-CB 3.44Å; C123-C187 WeakPolarHBondContact CB-SG 3.49Å; C123-C187 WeakPolarHBondContact SG-CB 3.11Å; C123-C187 CovalentContact SG-SG 2.1Å; C123-C187 PolarHBondContact SG-SG 3.11Å; N172-C187 WeakPolarHBondContact OD1-CA 3.41Å; N172-C187 WeakPolarHBondContact OD1-CB 3.34Å; C187-D189 PolarHBondContact O-N 2.96Å; C187-C190 HydrophobicContact CB-CB 3.73Å; C187-C190 PolarHBondContact O-N 3.22Å; C187-C190 PolarHBondContact SG-SG 2.79Å; C187-E191 PolarHBondContact O-N 2.56Å
188	A	46.9	Very low	44.8	Very low	33 Å²	33	58.5 Å²	58.5	27%	0.273	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.5	-178.2	0	0	0	0	0	111.7	F170 Q171 C190	F170-A188 WeakPolarHBondContact O-CB 3.37Å; Q171-A188 WeakPolarHBondContact O-CB 3.42Å; Q171-A188 PolarHBondContact O-N 2.75Å; Q171-A188 VanDerWaalsContact O-N 3.11Å; A188-C190 VanDerWaalsContact C-N 3.29Å; A188-C190 PolarHBondContact O-N 3.06Å
189	D	44.6	Very low	44.3	Very low	86 Å²	86	59.9 Å²	59.9	46%	0.46	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-9.6	175.5	-69.9	-35.2	0	0	0	113.8	C123 C187 R211	C123-D189 HydrophobicContact CB-CB 4.37Å; C187-D189 PolarHBondContact O-N 2.96Å; D189-R211 IonicContact OD1-CZ 3.86Å; D189-R211 IonicContact OD1-NH1 2.68Å; D189-R211 PolarHBondContact OD1-NH1 2.74Å; D189-R211 IonicContact OD1-NH2 3.62Å; D189-R211 PolarHBondContact OD1-NH2 2.94Å; D189-R211 IonicContact OD2-NH2 2.75Å; D189-R211 PolarHBondContact OD2-NH2 3.11Å
190	C	47.7	Very low	44.1	Very low	4 Å²	4	61.2 Å²	61.2	3%	0.027	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-20	-169.2	-73	0	0	0	0	115	K122 C123 C187 A188 I192	K122-C190 HydrophobicContact CB-CB 4.05Å; K122-C190 WeakPolarHBondContact CB-SG 3.33Å; K122-C190 HydrophobicContact CD-CB 3.66Å; K122-C190 HydrophobicContact CG-CB 4.18Å; K122-C190 PolarHBondContact NZ-O 3.39Å; C123-C190 WeakPolarHBondContact CB-SG 3.49Å; C123-C190 PolarHBondContact N-SG 3.46Å; C123-C190 PolarHBondContact SG-SG 3.41Å; C187-C190 HydrophobicContact CB-CB 3.73Å; C187-C190 PolarHBondContact O-N 3.22Å; C187-C190 PolarHBondContact SG-SG 2.79Å; A188-C190 VanDerWaalsContact C-N 3.29Å; A188-C190 PolarHBondContact O-N 3.06Å; C190-I192 WeakPolarHBondContact O-CB 3.23Å; C190-I192 VanDerWaalsContact O-CG1 3.28Å; C190-I192 WeakPolarHBondContact O-CG1 3.47Å; C190-I192 PolarHBondContact O-N 2.83Å
191	E	49	Very low	44.3	Very low	94 Å²	94	68.6 Å²	68.6	44%	0.439	36%	0.36	S	S	.	.	S	Bend	trans	50.5	10.4	-168.8	-64.1	-175.8	-167.7	0	0	114.4	K148 V153 L155 C187	K148-E191 IonicContact NZ-OE2 2.72Å; V153-E191 PolarHBondContact N-O 3.13Å; L155-E191 VanDerWaalsContact CD1-CD 3.47Å; L155-E191 HydrophobicContact CD1-CG 4.24Å; L155-E191 WeakPolarHBondContact CD1-OE1 3.46Å; C187-E191 PolarHBondContact O-N 2.56Å
192	I	45.5	Very low	43.9	Very low	31 Å²	31	66.5 Å²	66.5	16%	0.159	35%	0.351	C	S	.	.			trans	-144.2	123.6	-167.9	-60.8	176.7	0	0	0	106.9	K122 C190	K122-I192 HydrophobicContact CD-CB 4.37Å; K122-I192 HydrophobicContact CD-CD1 4.11Å; K122-I192 VanDerWaalsContact NZ-CD1 3.32Å; C190-I192 WeakPolarHBondContact O-CB 3.23Å; C190-I192 VanDerWaalsContact O-CG1 3.28Å; C190-I192 WeakPolarHBondContact O-CG1 3.47Å; C190-I192 PolarHBondContact O-N 2.83Å
193	G	45.6	Very low	43.7	Very low	8 Å²	8	72.3 Å²	72.3	8%	0.082	38%	0.375	C	S	.	.			trans	-148.5	170.1	145.2	0	0	0	0	0	109.7	L185 L195	L185-G193 CarbonylContact O-C 3.37Å; L185-G193 WeakPolarHBondContact O-CA 3.33Å; L185-G193 PolarHBondContact O-N 3.16Å; G193-L195 PolarHBondContact O-N 3.14Å
194	P	39.7	Very low	43.6	Very low	75 Å²	75	68.4 Å²	68.4	49%	0.487	36%	0.363	S	S	.	.			trans	-66.5	106.1	-168.9	26.3	-32.5	0	0	0	110.2	G196	P194-G196 PolarHBondContact O-N 3.42Å
195	L	40.3	Very low	43.1	Very low	57 Å²	57	68.7 Å²	68.7	30%	0.298	37%	0.367	S	S	.	.			trans	-76.8	96.6	161	-77.1	164.8	0	0	0	106.9	L145 L147 V153 Y184 G193	L145-L195 HydrophobicContact CD1-CD1 4.45Å; L145-L195 HydrophobicContact CD1-CD2 4.47Å; L147-L195 HydrophobicContact CD2-CB 4.42Å; L147-L195 HydrophobicContact CD2-CD1 3.43Å; L147-L195 VanDerWaalsContact CD2-CD1 3.43Å; L147-L195 HydrophobicContact CD2-CG 4.48Å; L147-L195 HydrophobicContact CG-CD1 4.29Å; V153-L195 HydrophobicContact CG2-CD1 3.75Å; Y184-L195 HydrophobicContact CD1-CD2 4.15Å; Y184-L195 HydrophobicContact CG-CD2 4.41Å; G193-L195 PolarHBondContact O-N 3.14Å
196	G	37.5	Very low	43	Very low	37 Å²	37	68.5 Å²	68.5	38%	0.381	37%	0.366	S	S	.	.			trans	-58.1	160.9	168.5	0	0	0	0	0	111.4	R177 P194 F198	R177-G196 PolarHBondContact NH2-O 3.35Å; P194-G196 PolarHBondContact O-N 3.42Å; G196-F198 PolarHBondContact O-N 2.84Å
197	I	35.4	Very low	42.7	Very low	154 Å²	154	69.3 Å²	69.3	79%	0.79	37%	0.371	S	S	*	.			trans	-38.6	118.1	-174.5	-57.2	170.1	0	0	0	111.6	R177	R177-I197 VanDerWaalsContact CZ-O 3.23Å; R177-I197 PolarHBondContact NH1-O 2.91Å; R177-I197 PolarHBondContact NH2-O 2.96Å
198	F	36.4	Very low	42.4	Very low	106 Å²	106	69.1 Å²	69.1	47%	0.465	37%	0.37	S	S	.	.			trans	-70.4	129.5	179.9	172.9	-104	0	0	0	110.9	E144 G196 P200	E144-F198 HydrophobicContact CG-CE1 3.93Å; E144-F198 HydrophobicContact CG-CZ 3.84Å; G196-F198 PolarHBondContact O-N 2.84Å; F198-P200 HydrophobicContact CE1-CB 3.76Å; F198-P200 HydrophobicContact CE1-CG 4.39Å; F198-P200 HydrophobicContact CZ-CB 3.98Å
199	E	38	Very low	42	Very low	126 Å²	126	68.8 Å²	68.8	59%	0.589	36%	0.364	S	S	*	.			trans	-117	122.8	165.2	-80.1	-177.5	172.4	0	0	108.6	K201 T202	E199-K201 PolarHBondContact O-N 3.41Å; E199-T202 PolarHBondContact O-OG1 3.28Å
200	P	42.5	Very low	41.7	Very low	106 Å²	106	70.4 Å²	70.4	69%	0.688	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	5.1	-169	23.2	-31.8	0	0	0	115.8	F198	F198-P200 HydrophobicContact CE1-CB 3.76Å; F198-P200 HydrophobicContact CE1-CG 4.39Å; F198-P200 HydrophobicContact CZ-CB 3.98Å
201	K	43.8	Very low	41.1	Very low	201 Å²	201	74.4 Å²	74.4	87%	0.874	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	7	-168.1	-67.2	-172	179.1	-179.4	0	116.1	E199	E199-K201 PolarHBondContact O-N 3.41Å
202	T	40	Very low	40.6	Very low	59 Å²	59	74.1 Å²	74.1	36%	0.362	39%	0.388	S	S	.	.			trans	-110.6	130.5	-175.4	29.8	0	0	0	0	113.7	E199	E199-T202 PolarHBondContact O-OG1 3.28Å
203	E	43.9	Very low	40.1	Very low	168 Å²	168	76.4 Å²	76.4	79%	0.785	40%	0.404	S	S	*	.			trans	-65.2	129.7	168.7	-67.1	-173.3	163.3	0	0	110.4
204	L	41.5	Very low	39.7	Very low	43 Å²	43	79.3 Å²	79.3	23%	0.225	42%	0.419	C	S	.	.			trans	-109.1	141	179.1	-79	156.9	0	0	0	110	L142 F175 R177 Y184	L142-L204 HydrophobicContact CD1-CB 4.45Å; L142-L204 HydrophobicContact CD1-CD1 4.17Å; F175-L204 HydrophobicContact CB-CD2 4.27Å; R177-L204 HydrophobicContact CB-CD2 4.36Å; R177-L204 HydrophobicContact CG-CD2 3.78Å; Y184-L204 HydrophobicContact CD2-CD2 3.98Å; Y184-L204 HydrophobicContact CE2-CD2 4.08Å
205	S	41.7	Very low	39.9	Very low	21 Å²	21	78.3 Å²	78.3	15%	0.147	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.4	167.1	58.8	0	0	0	0	109.6	F175 S176	F175-S205 CarbonylContact C-O 3.46Å; F175-S205 WeakPolarHBondContact CA-O 3.44Å; S176-S205 PolarHBondContact N-O 2.87Å; S176-S205 PolarHBondContact O-N 2.75Å; S176-S205 VanDerWaalsContact O-N 3.08Å
206	F	46	Very low	40.2	Very low	13 Å²	13	80.9 Å²	80.9	6%	0.057	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.4	175.1	72.9	-99.4	0	0	0	112.9	V136 M138 I173 G174 F175 A208	V136-F206 CarbonylContact C-O 3.56Å; V136-F206 HydrophobicContact CB-CD2 4.27Å; V136-F206 HydrophobicContact CB-CE2 3.67Å; V136-F206 HydrophobicContact CB-CZ 4.12Å; V136-F206 HydrophobicContact CG1-CE2 3.77Å; V136-F206 HydrophobicContact CG1-CZ 3.7Å; M138-F206 HydrophobicContact CB-CD1 4.21Å; M138-F206 HydrophobicContact CB-CE1 3.7Å; M138-F206 HydrophobicContact CG-CE1 4.02Å; M138-F206 HydrophobicContact SD-CE1 3.82Å; M138-F206 HydrophobicContact SD-CZ 4.31Å; I173-F206 HydrophobicContact CG2-CD2 4.4Å; G174-F206 CarbonylContact O-C 3.57Å; G174-F206 WeakPolarHBondContact O-CA 3.49Å; G174-F206 WeakPolarHBondContact O-CB 3.41Å; F175-F206 HydrophobicContact CD1-CB 3.81Å; F175-F206 HydrophobicContact CE1-CB 4.14Å; F175-F206 HydrophobicContact CG-CB 4.39Å; F206-A208 HydrophobicContact CD2-CB 4.27Å; F206-A208 HydrophobicContact CE2-CB 4.31Å
207	V	42.6	Very low	41	Very low	29 Å²	29	87.9 Å²	87.9	18%	0.176	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.7	173.6	-179.2	0	0	0	0	106.7	R135 G174 V182	R135-V207 HydrophobicContact CB-CG2 4.49Å; R135-V207 HydrophobicContact CG-CG1 4.13Å; R135-V207 HydrophobicContact CG-CG2 4Å; G174-V207 PolarHBondContact N-O 3.37Å; G174-V207 PolarHBondContact O-N 3.46Å; V182-V207 HydrophobicContact CG2-CB 4.46Å; V182-V207 HydrophobicContact CG2-CG2 4.26Å
208	A	41.6	Very low	42.4	Very low	0 Å²	0	84.1 Å²	84.1	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.6	-175.6	0	0	0	0	0	110	F170 F206	F170-A208 HydrophobicContact CB-CB 4.02Å; F170-A208 VanDerWaalsContact CD1-C 3.5Å; F170-A208 HydrophobicContact CD1-CB 3.39Å; F170-A208 HydrophobicContact CD2-CB 3.44Å; F170-A208 VanDerWaalsContact CD2-CB 3.44Å; F170-A208 HydrophobicContact CE1-CB 3.58Å; F170-A208 HydrophobicContact CE2-CB 3.66Å; F170-A208 HydrophobicContact CG-CB 3.34Å; F170-A208 HydrophobicContact CZ-CB 3.73Å; F206-A208 HydrophobicContact CD2-CB 4.27Å; F206-A208 HydrophobicContact CE2-CB 4.31Å
209	V	38.8	Very low	43.4	Very low	26 Å²	26	79.8 Å²	79.8	16%	0.158	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.6	-177.9	-177.4	0	0	0	0	109	L128 F170 Q171 N172	L128-V209 HydrophobicContact CD1-CG1 4.01Å; F170-V209 CarbonylContact C-O 3.5Å; F170-V209 VanDerWaalsContact CA-O 3.23Å; F170-V209 WeakPolarHBondContact CA-O 3.29Å; F170-V209 VanDerWaalsContact CD1-C 3.48Å; F170-V209 WeakPolarHBondContact CD1-O 3.33Å; Q171-V209 PolarHBondContact N-O 3.04Å; N172-V209 PolarHBondContact O-N 3.08Å
210	E	37.7	Very low	45	Very low	121 Å²	121	78.7 Å²	78.7	57%	0.565	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	135.5	-175.9	-167	167.6	-170.3	0	0	110.6	T169 V212	T169-E210 HydrophobicContact CG2-CG 4.33Å; E210-V212 PolarHBondContact O-N 3.38Å
211	R	36.5	Very low	46.6	Very low	87 Å²	87	76.1 Å²	76.1	33%	0.328	38%	0.38	S	S	.	.			trans	-75	107.7	-177.6	-162	-177.6	-179.5	158.3	8.7	109.5	T169 Q171 D189 V213	T169-R211 WeakPolarHBondContact O-CB 3.41Å; T169-R211 PolarHBondContact O-N 2.83Å; Q171-R211 HydrophobicContact CB-CB 4.06Å; Q171-R211 HydrophobicContact CB-CG 4Å; Q171-R211 HydrophobicContact CG-CB 4.42Å; Q171-R211 HydrophobicContact CG-CG 3.83Å; D189-R211 IonicContact OD1-CZ 3.86Å; D189-R211 IonicContact OD1-NH1 2.68Å; D189-R211 PolarHBondContact OD1-NH1 2.74Å; D189-R211 IonicContact OD1-NH2 3.62Å; D189-R211 PolarHBondContact OD1-NH2 2.94Å; D189-R211 IonicContact OD2-NH2 2.75Å; D189-R211 PolarHBondContact OD2-NH2 3.11Å; R211-V213 VanDerWaalsContact C-N 3.31Å; R211-V213 HydrophobicContact CB-CG2 4.15Å; R211-V213 HydrophobicContact CG-CG2 3.38Å; R211-V213 VanDerWaalsContact NE-CG2 3.34Å; R211-V213 PolarHBondContact O-N 3.11Å
212	V	38.2	Very low	48.2	Very low	88 Å²	88	67.1 Å²	67.1	53%	0.533	34%	0.343	S	S	.	.			trans	-78.2	88.3	163	-172.3	0	0	0	0	107.4	E210 V214 P250	E210-V212 PolarHBondContact O-N 3.38Å; V212-V214 HydrophobicContact CG1-CG2 4.37Å; V212-V214 PolarHBondContact O-N 3.28Å; V212-P250 HydrophobicContact CG1-CG 4.35Å
213	V	35.5	Very low	50.2	Low	80 Å²	80	66.1 Å²	66.1	49%	0.485	33%	0.333	S	S	.	.			trans	-82.5	104.7	171.9	-174.9	0	0	0	0	108.3	R211 D215	R211-V213 VanDerWaalsContact C-N 3.31Å; R211-V213 HydrophobicContact CB-CG2 4.15Å; R211-V213 HydrophobicContact CG-CG2 3.38Å; R211-V213 VanDerWaalsContact NE-CG2 3.34Å; R211-V213 PolarHBondContact O-N 3.11Å; V213-D215 PolarHBondContact O-N 2.86Å; V213-D215 VanDerWaalsContact O-N 3.13Å
214	V	36.3	Very low	52.3	Low	68 Å²	68	61.7 Å²	61.7	41%	0.412	31%	0.314	S	S	.	.			trans	-75.5	95	168.9	-177.5	0	0	0	0	108.3	V212 L216 I219 A248 D249	V212-V214 HydrophobicContact CG1-CG2 4.37Å; V212-V214 PolarHBondContact O-N 3.28Å; V214-L216 PolarHBondContact O-N 3.44Å; V214-I219 HydrophobicContact CB-CD1 4.4Å; V214-I219 HydrophobicContact CG1-CD1 3.28Å; V214-A248 WeakPolarHBondContact CA-O 3.44Å; V214-D249 HydrophobicContact CG1-CB 4.22Å
215	D	44.7	Very low	54.7	Low	55 Å²	55	65.2 Å²	65.2	29%	0.294	33%	0.328	S	S	.	.			trans	-88.2	92	178.4	-168.3	-12.2	0	0	0	110.9	V213 K217 I218 I219	V213-D215 PolarHBondContact O-N 2.86Å; V213-D215 VanDerWaalsContact O-N 3.13Å; D215-K217 PolarHBondContact O-N 3.48Å; D215-K217 VanDerWaalsContact O-N 3.12Å; D215-K217 VanDerWaalsContact OD1-CB 3.25Å; D215-K217 WeakPolarHBondContact OD1-CB 3.38Å; D215-K217 PolarHBondContact OD1-N 3.32Å; D215-I218 HydrophobicContact CB-CB 4.22Å; D215-I218 HydrophobicContact CB-CD1 3.95Å; D215-I218 HydrophobicContact CB-CG1 4.09Å; D215-I218 WeakPolarHBondContact O-CA 3.44Å; D215-I218 PolarHBondContact O-N 3.33Å; D215-I218 WeakPolarHBondContact OD2-CD1 3.25Å; D215-I218 WeakPolarHBondContact OD2-CG1 3.26Å; D215-I219 WeakPolarHBondContact O-CD1 3.28Å; D215-I219 VanDerWaalsContact O-CG1 3.3Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.18Å
216	L	45	Very low	57.1	Low	111 Å²	111	64.2 Å²	64.2	58%	0.581	32%	0.321	S	S	*	.	H	α-helix	trans	-55.5	-27.9	177.4	-69.3	171.8	0	0	0	113	V214 I218 I219	V214-L216 PolarHBondContact O-N 3.44Å; L216-I218 PolarHBondContact O-N 2.89Å; L216-I219 HydrophobicContact CD2-CD1 4.16Å
217	K	56	Low	59.3	Low	184 Å²	184	66.3 Å²	66.3	80%	0.8	33%	0.333	S	S	*	.	H	α-helix	trans	-69.7	-20.6	176.2	-58.7	179.5	177.5	177.6	0	112.2	D215 P221	D215-K217 PolarHBondContact O-N 3.48Å; D215-K217 VanDerWaalsContact O-N 3.12Å; D215-K217 VanDerWaalsContact OD1-CB 3.25Å; D215-K217 WeakPolarHBondContact OD1-CB 3.38Å; D215-K217 PolarHBondContact OD1-N 3.32Å; K217-P221 WeakPolarHBondContact O-CD 3.2Å; K217-P221 VanDerWaalsContact O-CG 3.29Å; K217-P221 WeakPolarHBondContact O-CG 3.46Å
218	I	64.2	Low	61.7	Low	74 Å²	74	67.4 Å²	67.4	38%	0.379	35%	0.345	S	S	.	.	H	α-helix	trans	-97.4	-43.7	177	-61.1	176.5	0	0	0	110.8	D215 L216 S222 A248	D215-I218 HydrophobicContact CB-CB 4.22Å; D215-I218 HydrophobicContact CB-CD1 3.95Å; D215-I218 HydrophobicContact CB-CG1 4.09Å; D215-I218 WeakPolarHBondContact O-CA 3.44Å; D215-I218 PolarHBondContact O-N 3.33Å; D215-I218 WeakPolarHBondContact OD2-CD1 3.25Å; D215-I218 WeakPolarHBondContact OD2-CG1 3.26Å; L216-I218 PolarHBondContact O-N 2.89Å; I218-S222 WeakPolarHBondContact O-CB 3.41Å; I218-S222 PolarHBondContact O-N 2.96Å; I218-S222 PolarHBondContact O-OG 3.35Å; I218-A248 HydrophobicContact CB-CB 4.06Å; I218-A248 HydrophobicContact CG2-CB 3.83Å
219	I	58.2	Low	64.1	Low	16 Å²	16	69.2 Å²	69.2	8%	0.082	35%	0.354	C	S	.	.	H	α-helix	trans	-59	-61.2	-171.7	-62.9	153.6	0	0	0	110.7	V214 D215 L216 S222 F223 A248 D249	V214-I219 HydrophobicContact CB-CD1 4.4Å; V214-I219 HydrophobicContact CG1-CD1 3.28Å; D215-I219 WeakPolarHBondContact O-CD1 3.28Å; D215-I219 VanDerWaalsContact O-CG1 3.3Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.18Å; L216-I219 HydrophobicContact CD2-CD1 4.16Å; I219-S222 PolarHBondContact O-N 2.89Å; I219-F223 VanDerWaalsContact O-CB 3.28Å; I219-F223 WeakPolarHBondContact O-CB 3.25Å; I219-F223 PolarHBondContact O-N 3.34Å; I219-A248 HydrophobicContact CD1-CB 4.34Å; I219-A248 HydrophobicContact CG1-CB 3.44Å; I219-A248 VanDerWaalsContact CG1-CB 3.44Å; I219-D249 HydrophobicContact CD1-CB 3.59Å; I219-D249 HydrophobicContact CG1-CB 3.89Å; I219-D249 HydrophobicContact CG2-CB 4.44Å
220	Y	70.5	Confident	66.8	Low	103 Å²	103	70.9 Å²	70.9	40%	0.404	36%	0.357	S	S	.	.	H	α-helix	trans	-64.7	-47.5	-171.5	-173.9	-103.9	0	0	0	112.2	I65 S222 F223 L224	I65-Y220 HydrophobicContact CD1-CD1 4.25Å; I65-Y220 HydrophobicContact CD1-CE1 3.88Å; Y220-S222 VanDerWaalsContact C-N 3.35Å; Y220-S222 PolarHBondContact O-N 3.34Å; Y220-F223 PolarHBondContact O-N 3.15Å; Y220-L224 HydrophobicContact CD1-CD1 3.87Å; Y220-L224 HydrophobicContact CD1-CG 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.34Å; Y220-L224 HydrophobicContact CE1-CG 4.13Å; Y220-L224 HydrophobicContact CE2-CD1 4.34Å; Y220-L224 HydrophobicContact CE2-CD2 4.48Å; Y220-L224 HydrophobicContact CE2-CG 4.34Å; Y220-L224 WeakPolarHBondContact O-CG 3.16Å; Y220-L224 PolarHBondContact O-N 3.5Å
221	P	76.8	Confident	69.5	Low	52 Å²	52	68.1 Å²	68.1	34%	0.338	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-35.9	176	-25.4	38.5	0	0	0	113.7	K217 K225	K217-P221 WeakPolarHBondContact O-CD 3.2Å; K217-P221 VanDerWaalsContact O-CG 3.29Å; K217-P221 WeakPolarHBondContact O-CG 3.46Å; P221-K225 WeakPolarHBondContact O-CB 3.34Å; P221-K225 WeakPolarHBondContact O-CG 3.36Å; P221-K225 PolarHBondContact O-N 3.43Å
222	S	77.7	Confident	72.2	Confident	12 Å²	12	70.7 Å²	70.7	8%	0.084	38%	0.375	C	S	.	.	H	α-helix	trans	-69.5	-43.8	177.6	-61.6	0	0	0	0	111.1	I218 I219 Y220 K225 G226 H241	I218-S222 WeakPolarHBondContact O-CB 3.41Å; I218-S222 PolarHBondContact O-N 2.96Å; I218-S222 PolarHBondContact O-OG 3.35Å; I219-S222 PolarHBondContact O-N 2.89Å; Y220-S222 VanDerWaalsContact C-N 3.35Å; Y220-S222 PolarHBondContact O-N 3.34Å; S222-K225 PolarHBondContact O-N 2.91Å; S222-G226 PolarHBondContact O-N 3.12Å; S222-H241 WeakPolarHBondContact O-CB 3.4Å
223	F	81.6	Confident	74.9	Confident	38 Å²	38	74 Å²	74	17%	0.167	38%	0.382	C	S	.	.	H	α-helix	trans	-59.5	-47.7	175.8	-178.8	-98.5	0	0	0	111.9	I219 Y220 K225 G226 N227 Y242 A245 I254 S255 N258	I219-F223 VanDerWaalsContact O-CB 3.28Å; I219-F223 WeakPolarHBondContact O-CB 3.25Å; I219-F223 PolarHBondContact O-N 3.34Å; Y220-F223 PolarHBondContact O-N 3.15Å; F223-K225 PolarHBondContact O-N 3.4Å; F223-G226 WeakPolarHBondContact O-CA 3.29Å; F223-G226 PolarHBondContact O-N 3.14Å; F223-G226 VanDerWaalsContact O-N 3.11Å; F223-N227 WeakPolarHBondContact CE1-ND2 3.2Å; F223-N227 PolarHBondContact O-N 3.27Å; F223-Y242 HydrophobicContact CD2-CD1 4.18Å; F223-Y242 HydrophobicContact CD2-CE1 4.21Å; F223-Y242 HydrophobicContact CE2-CE1 4.31Å; F223-A245 HydrophobicContact CB-CB 4.21Å; F223-I254 HydrophobicContact CE2-CG2 3.75Å; F223-I254 HydrophobicContact CZ-CG2 3.6Å; F223-S255 WeakPolarHBondContact CD2-OG 3Å; F223-N258 HydrophobicContact CE2-CB 4.43Å; F223-N258 VanDerWaalsContact CE2-ND2 3.35Å; F223-N258 WeakPolarHBondContact CE2-ND2 3.43Å; F223-N258 VanDerWaalsContact CZ-ND2 3.27Å; F223-N258 WeakPolarHBondContact CZ-ND2 3.43Å
224	L	88.2	Confident	77.7	Confident	74 Å²	74	74.3 Å²	74.3	39%	0.387	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-41.2	176.5	-71.7	-175	0	0	0	112.8	Y220 G226 N227 A228	Y220-L224 HydrophobicContact CD1-CD1 3.87Å; Y220-L224 HydrophobicContact CD1-CG 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.34Å; Y220-L224 HydrophobicContact CE1-CG 4.13Å; Y220-L224 HydrophobicContact CE2-CD1 4.34Å; Y220-L224 HydrophobicContact CE2-CD2 4.48Å; Y220-L224 HydrophobicContact CE2-CG 4.34Å; Y220-L224 WeakPolarHBondContact O-CG 3.16Å; Y220-L224 PolarHBondContact O-N 3.5Å; L224-G226 VanDerWaalsContact C-N 3.27Å; L224-G226 PolarHBondContact O-N 3.15Å; L224-N227 PolarHBondContact O-N 3.27Å; L224-A228 WeakPolarHBondContact O-CB 3.46Å; L224-A228 PolarHBondContact O-N 3.47Å
225	K	90.3	Very high	80.5	Confident	117 Å²	117	73.2 Å²	73.2	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-61.4	-38.8	172.6	-75.6	172.2	-176.3	177	0	111.1	P221 S222 F223 A228 Q229 H241	P221-K225 WeakPolarHBondContact O-CB 3.34Å; P221-K225 WeakPolarHBondContact O-CG 3.36Å; P221-K225 PolarHBondContact O-N 3.43Å; S222-K225 PolarHBondContact O-N 2.91Å; F223-K225 PolarHBondContact O-N 3.4Å; K225-A228 PolarHBondContact O-N 3.31Å; K225-Q229 VanDerWaalsContact O-CG 3.31Å; K225-Q229 WeakPolarHBondContact O-CG 3.37Å; K225-Q229 PolarHBondContact O-N 2.99Å; K225-H241 HydrophobicContact CB-CB 4.29Å
226	G	92.3	Very high	82.9	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-57.8	-50.6	173	0	0	0	0	0	112	S222 F223 L224 A228 Q229 Y230 Y242	S222-G226 PolarHBondContact O-N 3.12Å; F223-G226 WeakPolarHBondContact O-CA 3.29Å; F223-G226 PolarHBondContact O-N 3.14Å; F223-G226 VanDerWaalsContact O-N 3.11Å; L224-G226 VanDerWaalsContact C-N 3.27Å; L224-G226 PolarHBondContact O-N 3.15Å; G226-A228 VanDerWaalsContact C-N 3.34Å; G226-A228 PolarHBondContact O-N 3.33Å; G226-Q229 PolarHBondContact O-N 2.93Å; G226-Y230 WeakPolarHBondContact O-CB 3.41Å; G226-Y230 PolarHBondContact O-N 3.15Å; G226-Y242 PolarHBondContact O-OH 2.96Å
227	N	92	Very high	85.2	Confident	57 Å²	57	73.2 Å²	73.2	31%	0.305	37%	0.372	S	S	.	.	H	α-helix	trans	-59.5	-43.5	176.3	-67.7	-17.6	0	0	0	111.7	F223 L224 Y230 G231 Y242 N258	F223-N227 WeakPolarHBondContact CE1-ND2 3.2Å; F223-N227 PolarHBondContact O-N 3.27Å; L224-N227 PolarHBondContact O-N 3.27Å; N227-Y230 PolarHBondContact O-N 3.13Å; N227-G231 PolarHBondContact O-N 2.98Å; N227-Y242 WeakPolarHBondContact CA-OH 3.29Å; N227-Y242 PolarHBondContact N-OH 3Å; N227-Y242 WeakPolarHBondContact OD1-CE1 3.04Å; N227-Y242 PolarHBondContact OD1-OH 2.86Å; N227-N258 PolarHBondContact OD1-ND2 3.06Å
228	A	93.1	Very high	87	Confident	52 Å²	52	64.5 Å²	64.5	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-43.9	179.1	0	0	0	0	0	112.5	L224 K225 G226 G231 K232	L224-A228 WeakPolarHBondContact O-CB 3.46Å; L224-A228 PolarHBondContact O-N 3.47Å; K225-A228 PolarHBondContact O-N 3.31Å; G226-A228 VanDerWaalsContact C-N 3.34Å; G226-A228 PolarHBondContact O-N 3.33Å; A228-G231 PolarHBondContact O-N 2.74Å; A228-K232 WeakPolarHBondContact O-CG 3.35Å; A228-K232 PolarHBondContact O-N 3.49Å; A228-K232 VanDerWaalsContact O-N 3.15Å
229	Q	93.2	Very high	88.4	Confident	39 Å²	39	61.6 Å²	61.6	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-68.2	-36.7	175.8	-64.3	-58.6	-19.8	0	0	111.7	K225 G226 G231 K232 K233 E234 K237 A238	K225-Q229 VanDerWaalsContact O-CG 3.31Å; K225-Q229 WeakPolarHBondContact O-CG 3.37Å; K225-Q229 PolarHBondContact O-N 2.99Å; G226-Q229 PolarHBondContact O-N 2.93Å; Q229-G231 VanDerWaalsContact C-N 3.35Å; Q229-G231 PolarHBondContact O-N 3.21Å; Q229-K232 CarbonylContact O-C 3.14Å; Q229-K232 PolarHBondContact O-N 3.24Å; Q229-K233 PolarHBondContact O-N 2.87Å; Q229-E234 HydrophobicContact CB-CB 4.34Å; Q229-E234 PolarHBondContact O-N 2.92Å; Q229-K237 HydrophobicContact CB-CB 4.07Å; Q229-K237 HydrophobicContact CG-CB 3.87Å; Q229-A238 HydrophobicContact CB-CB 4.05Å
230	Y	95.2	Very high	90.1	Very high	61 Å²	61	63.8 Å²	63.8	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-43.7	174.2	-174.4	-87	0	0	0	111.4	G226 N227 K232 K233 Y235 M261 A262 K265	G226-Y230 WeakPolarHBondContact O-CB 3.41Å; G226-Y230 PolarHBondContact O-N 3.15Å; N227-Y230 PolarHBondContact O-N 3.13Å; Y230-K232 VanDerWaalsContact C-N 3.26Å; Y230-K232 PolarHBondContact O-N 3.34Å; Y230-K233 WeakPolarHBondContact O-CA 3.43Å; Y230-K233 PolarHBondContact O-N 2.96Å; Y230-Y235 AromaticContact CD2-CD1 3.71Å; Y230-Y235 HydrophobicContact CD2-CD1 3.71Å; Y230-Y235 AromaticContact CD2-CE1 3.94Å; Y230-Y235 HydrophobicContact CD2-CE1 3.94Å; Y230-Y235 AromaticContact CE2-CD1 3.76Å; Y230-Y235 HydrophobicContact CE2-CD1 3.76Å; Y230-Y235 AromaticContact CE2-CE1 3.71Å; Y230-Y235 HydrophobicContact CE2-CE1 3.71Å; Y230-Y235 HydrophobicContact CG-CD1 4.49Å; Y230-M261 HydrophobicContact CE2-CB 4.45Å; Y230-M261 HydrophobicContact CE2-CG 3.78Å; Y230-M261 WeakPolarHBondContact OH-CG 3.43Å; Y230-A262 HydrophobicContact CD2-CB 3.98Å; Y230-A262 HydrophobicContact CE2-CB 4.29Å; Y230-K265 HydrophobicContact CE2-CG 4.14Å; Y230-K265 WeakPolarHBondContact OH-CE 3.45Å
231	G	93.8	Very high	91	Very high	62 Å²	62	59.9 Å²	59.9	64%	0.639	32%	0.315	S	S	*	.	H	α-helix	trans	-60.5	-33.3	174.3	0	0	0	0	0	113.3	N227 A228 Q229 K233	N227-G231 PolarHBondContact O-N 2.98Å; A228-G231 PolarHBondContact O-N 2.74Å; Q229-G231 VanDerWaalsContact C-N 3.35Å; Q229-G231 PolarHBondContact O-N 3.21Å; G231-K233 PolarHBondContact O-N 3.47Å
232	K	94.8	Very high	91.7	Very high	142 Å²	142	57.6 Å²	57.6	62%	0.617	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	2.1	172.7	-67	177.6	-177.2	-175.8	0	114	A228 Q229 Y230 E234	A228-K232 WeakPolarHBondContact O-CG 3.35Å; A228-K232 PolarHBondContact O-N 3.49Å; A228-K232 VanDerWaalsContact O-N 3.15Å; Q229-K232 CarbonylContact O-C 3.14Å; Q229-K232 PolarHBondContact O-N 3.24Å; Y230-K232 VanDerWaalsContact C-N 3.26Å; Y230-K232 PolarHBondContact O-N 3.34Å; K232-E234 HydrophobicContact CB-CB 4.48Å; K232-E234 HydrophobicContact CB-CG 4.07Å; K232-E234 PolarHBondContact O-N 3.29Å
233	K	93.5	Very high	92.4	Very high	157 Å²	157	57.5 Å²	57.5	68%	0.683	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	17.3	-172.6	-53.9	179.3	179.5	177	0	113.9	Q229 Y230 G231 Y235	Q229-K233 PolarHBondContact O-N 2.87Å; Y230-K233 WeakPolarHBondContact O-CA 3.43Å; Y230-K233 PolarHBondContact O-N 2.96Å; G231-K233 PolarHBondContact O-N 3.47Å; K233-Y235 VanDerWaalsContact C-N 3.26Å; K233-Y235 HydrophobicContact CB-CE1 4.47Å; K233-Y235 HydrophobicContact CB-CE2 4.21Å; K233-Y235 WeakPolarHBondContact O-CD2 3.5Å; K233-Y235 PolarHBondContact O-N 3.04Å; K233-Y235 VanDerWaalsContact O-N 3.07Å
234	E	94.5	Very high	92.5	Very high	86 Å²	86	60 Å²	60	40%	0.402	31%	0.308	S	S	.	.			trans	-86.5	64.6	176.8	-70.1	-77.2	152	0	0	109.7	Q229 K232 A236 K237 A238	Q229-E234 HydrophobicContact CB-CB 4.34Å; Q229-E234 PolarHBondContact O-N 2.92Å; K232-E234 HydrophobicContact CB-CB 4.48Å; K232-E234 HydrophobicContact CB-CG 4.07Å; K232-E234 PolarHBondContact O-N 3.29Å; E234-A236 VanDerWaalsContact C-N 3.31Å; E234-A236 PolarHBondContact O-N 2.86Å; E234-K237 HydrophobicContact CB-CB 4.33Å; E234-K237 HydrophobicContact CB-CD 4.24Å; E234-K237 PolarHBondContact O-N 3.21Å; E234-K237 VanDerWaalsContact O-N 3.1Å; E234-K237 WeakPolarHBondContact OE2-CE 3.38Å; E234-K237 IonicContact OE2-NZ 2.66Å; E234-K237 PolarHBondContact OE2-NZ 3.24Å; E234-A238 PolarHBondContact O-N 3.46Å
235	Y	95.7	Very high	92.2	Very high	46 Å²	46	56.5 Å²	56.5	18%	0.18	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-34.1	-167.3	-53.7	-59.6	0	0	0	113.8	Y230 K233 K237 A238 I239 K265 L266	Y230-Y235 AromaticContact CD2-CD1 3.71Å; Y230-Y235 HydrophobicContact CD2-CD1 3.71Å; Y230-Y235 AromaticContact CD2-CE1 3.94Å; Y230-Y235 HydrophobicContact CD2-CE1 3.94Å; Y230-Y235 AromaticContact CE2-CD1 3.76Å; Y230-Y235 HydrophobicContact CE2-CD1 3.76Å; Y230-Y235 AromaticContact CE2-CE1 3.71Å; Y230-Y235 HydrophobicContact CE2-CE1 3.71Å; Y230-Y235 HydrophobicContact CG-CD1 4.49Å; K233-Y235 VanDerWaalsContact C-N 3.26Å; K233-Y235 HydrophobicContact CB-CE1 4.47Å; K233-Y235 HydrophobicContact CB-CE2 4.21Å; K233-Y235 WeakPolarHBondContact O-CD2 3.5Å; K233-Y235 PolarHBondContact O-N 3.04Å; K233-Y235 VanDerWaalsContact O-N 3.07Å; Y235-K237 PolarHBondContact O-N 3.44Å; Y235-A238 WeakPolarHBondContact O-CB 3.32Å; Y235-A238 PolarHBondContact O-N 2.1Å; Y235-I239 VanDerWaalsContact O-CG1 3.31Å; Y235-I239 WeakPolarHBondContact O-CG1 3.25Å; Y235-I239 PolarHBondContact O-N 3.12Å; Y235-K265 HydrophobicContact CD1-CB 3.75Å; Y235-K265 HydrophobicContact CD1-CG 4.02Å; Y235-K265 HydrophobicContact CD2-CB 3.6Å; Y235-K265 HydrophobicContact CE1-CB 3.77Å; Y235-K265 HydrophobicContact CE1-CD 4.42Å; Y235-K265 HydrophobicContact CE1-CG 3.65Å; Y235-K265 HydrophobicContact CE2-CB 3.62Å; Y235-K265 HydrophobicContact CE2-CG 4.18Å; Y235-K265 HydrophobicContact CG-CB 3.66Å; Y235-K265 HydrophobicContact CG-CG 4.43Å; Y235-L266 HydrophobicContact CD2-CD2 4.16Å
236	A	94.7	Very high	91.9	Very high	67 Å²	67	51.4 Å²	51.4	55%	0.554	27%	0.268	S	S	*	.	H	α-helix	trans	-63	-41.8	176.3	0	0	0	0	0	112	E234 I239 M240 L266	E234-A236 VanDerWaalsContact C-N 3.31Å; E234-A236 PolarHBondContact O-N 2.86Å; A236-I239 PolarHBondContact O-N 3.4Å; A236-M240 PolarHBondContact O-N 3.27Å; A236-M240 VanDerWaalsContact O-N 3.17Å; A236-L266 HydrophobicContact CB-CD1 4.3Å
237	K	92.8	Very high	91.4	Very high	99 Å²	99	57 Å²	57	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-69.9	-36.4	175.1	-64.4	177.8	-176.1	140.4	0	111.3	Q229 E234 Y235 M240 H241	Q229-K237 HydrophobicContact CB-CB 4.07Å; Q229-K237 HydrophobicContact CG-CB 3.87Å; E234-K237 HydrophobicContact CB-CB 4.33Å; E234-K237 HydrophobicContact CB-CD 4.24Å; E234-K237 PolarHBondContact O-N 3.21Å; E234-K237 VanDerWaalsContact O-N 3.1Å; E234-K237 WeakPolarHBondContact OE2-CE 3.38Å; E234-K237 IonicContact OE2-NZ 2.66Å; E234-K237 PolarHBondContact OE2-NZ 3.24Å; Y235-K237 PolarHBondContact O-N 3.44Å; K237-M240 WeakPolarHBondContact O-CB 3.5Å; K237-M240 PolarHBondContact O-N 3.32Å; K237-H241 PolarHBondContact O-CD2 2.92Å; K237-H241 PolarHBondContact O-N 3.32Å; K237-H241 VanDerWaalsContact O-N 3.11Å
238	A	93.8	Very high	90.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-47	173.9	0	0	0	0	0	111.4	Q229 E234 Y235 M240 H241 Y242 A262	Q229-A238 HydrophobicContact CB-CB 4.05Å; E234-A238 PolarHBondContact O-N 3.46Å; Y235-A238 WeakPolarHBondContact O-CB 3.32Å; Y235-A238 PolarHBondContact O-N 2.1Å; A238-M240 VanDerWaalsContact C-N 3.32Å; A238-M240 PolarHBondContact O-N 2.79Å; A238-H241 PolarHBondContact O-N 3.23Å; A238-Y242 HydrophobicContact CB-CD2 4.32Å; A238-Y242 HydrophobicContact CB-CE2 3.94Å; A238-Y242 WeakPolarHBondContact O-CD2 3.44Å; A238-Y242 PolarHBondContact O-N 3.02Å; A238-A262 HydrophobicContact CB-CB 4.24Å
239	I	95.1	Very high	89.2	Confident	14 Å²	14	53.5 Å²	53.5	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-43.2	176.2	-69	161	0	0	0	111.4	Y235 A236 H241 Y242 S243 R259 A262 L263 L266	Y235-I239 VanDerWaalsContact O-CG1 3.31Å; Y235-I239 WeakPolarHBondContact O-CG1 3.25Å; Y235-I239 PolarHBondContact O-N 3.12Å; A236-I239 PolarHBondContact O-N 3.4Å; I239-H241 VanDerWaalsContact C-N 3.33Å; I239-H241 PolarHBondContact O-N 3.47Å; I239-Y242 PolarHBondContact O-N 2.69Å; I239-S243 VanDerWaalsContact O-CB 3.25Å; I239-S243 WeakPolarHBondContact O-CB 3.44Å; I239-S243 PolarHBondContact O-N 3.34Å; I239-S243 PolarHBondContact O-OG 3.27Å; I239-R259 HydrophobicContact CG1-CG 4.48Å; I239-R259 HydrophobicContact CG2-CG 4.22Å; I239-A262 HydrophobicContact CD1-CB 4.28Å; I239-A262 HydrophobicContact CG1-CB 3.61Å; I239-L263 HydrophobicContact CD1-CD2 3.64Å; I239-L263 HydrophobicContact CD1-CG 4.02Å; I239-L263 HydrophobicContact CG1-CD2 4.25Å; I239-L263 HydrophobicContact CG1-CG 4.23Å; I239-L266 HydrophobicContact CD1-CD1 3.48Å; I239-L266 VanDerWaalsContact CD1-CD1 3.48Å; I239-L266 HydrophobicContact CD1-CG 4.42Å
240	M	93.3	Very high	88.4	Confident	61 Å²	61	53.7 Å²	53.7	30%	0.3	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-47.1	176.8	179.6	-167.1	67.3	0	0	111.2	A236 K237 A238 S243 R244	A236-M240 PolarHBondContact O-N 3.27Å; A236-M240 VanDerWaalsContact O-N 3.17Å; K237-M240 WeakPolarHBondContact O-CB 3.5Å; K237-M240 PolarHBondContact O-N 3.32Å; A238-M240 VanDerWaalsContact C-N 3.32Å; A238-M240 PolarHBondContact O-N 2.79Å; M240-S243 PolarHBondContact O-N 3.12Å; M240-R244 PolarHBondContact O-N 2.99Å; M240-R244 VanDerWaalsContact O-N 3.12Å
241	H	89	Confident	87.4	Confident	21 Å²	21	54.4 Å²	54.4	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-70.1	-42.1	-179.5	-75.8	-58.1	0	0	0	113.3	S222 K225 K237 A238 I239 S243 R244 A245	S222-H241 WeakPolarHBondContact O-CB 3.4Å; K225-H241 HydrophobicContact CB-CB 4.29Å; K237-H241 PolarHBondContact O-CD2 2.92Å; K237-H241 PolarHBondContact O-N 3.32Å; K237-H241 VanDerWaalsContact O-N 3.11Å; A238-H241 PolarHBondContact O-N 3.23Å; I239-H241 VanDerWaalsContact C-N 3.33Å; I239-H241 PolarHBondContact O-N 3.47Å; H241-S243 VanDerWaalsContact C-N 3.29Å; H241-S243 PolarHBondContact O-N 3.4Å; H241-R244 WeakPolarHBondContact O-CB 3.48Å; H241-R244 PolarHBondContact O-N 2.97Å; H241-A245 PolarHBondContact O-N 2.88Å
242	Y	91.6	Very high	86.7	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-35.4	173.1	-63	-49.7	0	0	0	111.9	F223 G226 N227 A238 I239 R244 A245 V246 N258 R259 A262	F223-Y242 HydrophobicContact CD2-CD1 4.18Å; F223-Y242 HydrophobicContact CD2-CE1 4.21Å; F223-Y242 HydrophobicContact CE2-CE1 4.31Å; G226-Y242 PolarHBondContact O-OH 2.96Å; N227-Y242 WeakPolarHBondContact CA-OH 3.29Å; N227-Y242 PolarHBondContact N-OH 3Å; N227-Y242 WeakPolarHBondContact OD1-CE1 3.04Å; N227-Y242 PolarHBondContact OD1-OH 2.86Å; A238-Y242 HydrophobicContact CB-CD2 4.32Å; A238-Y242 HydrophobicContact CB-CE2 3.94Å; A238-Y242 WeakPolarHBondContact O-CD2 3.44Å; A238-Y242 PolarHBondContact O-N 3.02Å; I239-Y242 PolarHBondContact O-N 2.69Å; Y242-R244 VanDerWaalsContact C-N 3.29Å; Y242-R244 PolarHBondContact O-N 3.45Å; Y242-A245 WeakPolarHBondContact O-CB 3.47Å; Y242-A245 PolarHBondContact O-N 2.98Å; Y242-A245 VanDerWaalsContact O-N 3.11Å; Y242-V246 WeakPolarHBondContact O-CG2 3.49Å; Y242-V246 PolarHBondContact O-N 3.17Å; Y242-N258 HydrophobicContact CD1-CB 4.18Å; Y242-N258 HydrophobicContact CD2-CB 4.48Å; Y242-N258 HydrophobicContact CE1-CB 3.77Å; Y242-N258 HydrophobicContact CE2-CB 4.09Å; Y242-R259 HydrophobicContact CD2-CB 4.3Å; Y242-R259 HydrophobicContact CG-CB 4.35Å; Y242-A262 HydrophobicContact CD2-CB 4.46Å; Y242-A262 HydrophobicContact CE2-CB 4.3Å
243	S	91.4	Very high	86.2	Confident	10 Å²	10	47 Å²	47	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-36.5	175.2	-60.2	0	0	0	0	111.9	I239 M240 H241 Q247 R259	I239-S243 VanDerWaalsContact O-CB 3.25Å; I239-S243 WeakPolarHBondContact O-CB 3.44Å; I239-S243 PolarHBondContact O-N 3.34Å; I239-S243 PolarHBondContact O-OG 3.27Å; M240-S243 PolarHBondContact O-N 3.12Å; H241-S243 VanDerWaalsContact C-N 3.29Å; H241-S243 PolarHBondContact O-N 3.4Å; S243-Q247 WeakPolarHBondContact O-CB 3.47Å; S243-Q247 VanDerWaalsContact O-CG 3.22Å; S243-Q247 WeakPolarHBondContact O-CG 3.44Å; S243-Q247 PolarHBondContact O-N 3.18Å; S243-R259 VanDerWaalsContact OG-CD 3.24Å; S243-R259 WeakPolarHBondContact OG-CD 3.31Å; S243-R259 PolarHBondContact OG-NH1 3.09Å
244	R	85.5	Confident	86.1	Confident	92 Å²	92	42.5 Å²	42.5	35%	0.347	22%	0.224	S	C	.	.	H	α-helix	trans	-66.1	-38.3	171.5	-70.8	-179.1	-179.5	-175.4	-0.5	112.2	M240 H241 Y242 Q247 A248 Y366	M240-R244 PolarHBondContact O-N 2.99Å; M240-R244 VanDerWaalsContact O-N 3.12Å; H241-R244 WeakPolarHBondContact O-CB 3.48Å; H241-R244 PolarHBondContact O-N 2.97Å; Y242-R244 VanDerWaalsContact C-N 3.29Å; Y242-R244 PolarHBondContact O-N 3.45Å; R244-Q247 PolarHBondContact O-N 3.01Å; R244-A248 WeakPolarHBondContact O-CB 3.31Å; R244-A248 PolarHBondContact O-N 3.35Å; R244-A248 VanDerWaalsContact O-N 3.08Å; R244-Y366 PolarHBondContact NE-OH 3.49Å; R244-Y366 PolarHBondContact NH2-OH 2.99Å
245	A	81.7	Confident	85.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-46.5	175	0	0	0	0	0	111.5	F223 H241 Y242 Q247 A248 D249	F223-A245 HydrophobicContact CB-CB 4.21Å; H241-A245 PolarHBondContact O-N 2.88Å; Y242-A245 WeakPolarHBondContact O-CB 3.47Å; Y242-A245 PolarHBondContact O-N 2.98Å; Y242-A245 VanDerWaalsContact O-N 3.11Å; A245-Q247 PolarHBondContact O-N 3.43Å; A245-A248 CarbonylContact O-C 3.59Å; A245-A248 PolarHBondContact O-N 3.36Å; A245-A248 VanDerWaalsContact O-N 3.14Å; A245-D249 PolarHBondContact O-N 3.01Å
246	V	84.2	Confident	85.7	Confident	10 Å²	10	36.8 Å²	36.8	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-39.5	175.4	169.1	0	0	0	0	112.4	Y242 A248 D249 P250 Y256	Y242-V246 WeakPolarHBondContact O-CG2 3.49Å; Y242-V246 PolarHBondContact O-N 3.17Å; V246-A248 VanDerWaalsContact C-N 3.27Å; V246-A248 PolarHBondContact O-N 3.35Å; V246-D249 CarbonylContact O-C 3.18Å; V246-D249 PolarHBondContact O-N 3.49Å; V246-P250 WeakPolarHBondContact O-CA 3.43Å; V246-P250 VanDerWaalsContact O-N 3.12Å; V246-Y256 HydrophobicContact CG1-CD1 4.17Å; V246-Y256 HydrophobicContact CG1-CE1 3.45Å; V246-Y256 VanDerWaalsContact CG1-CE1 3.45Å; V246-Y256 HydrophobicContact CG1-CE2 3.99Å; V246-Y256 WeakPolarHBondContact CG1-OH 3.32Å; V246-Y256 HydrophobicContact CG2-CD1 4.16Å; V246-Y256 HydrophobicContact CG2-CD2 4.31Å; V246-Y256 HydrophobicContact CG2-CE1 4.26Å; V246-Y256 HydrophobicContact CG2-CE2 4.39Å; V246-Y256 HydrophobicContact CG2-CG 4.19Å
247	Q	80.5	Confident	85.7	Confident	117 Å²	117	33.6 Å²	33.6	55%	0.547	17%	0.172	S	C	.	.	H	α-helix	trans	-65	-34.8	175.9	-78.1	170.9	-0.6	0	0	112	S243 R244 A245	S243-Q247 WeakPolarHBondContact O-CB 3.47Å; S243-Q247 VanDerWaalsContact O-CG 3.22Å; S243-Q247 WeakPolarHBondContact O-CG 3.44Å; S243-Q247 PolarHBondContact O-N 3.18Å; R244-Q247 PolarHBondContact O-N 3.01Å; A245-Q247 PolarHBondContact O-N 3.43Å
248	A	70.2	Confident	85.9	Confident	9 Å²	9	30.2 Å²	30.2	7%	0.074	16%	0.159	C	C	.	.	H	α-helix	trans	-81.3	-30.7	179.1	0	0	0	0	0	112.5	V214 I218 I219 R244 A245 V246	V214-A248 WeakPolarHBondContact CA-O 3.44Å; I218-A248 HydrophobicContact CB-CB 4.06Å; I218-A248 HydrophobicContact CG2-CB 3.83Å; I219-A248 HydrophobicContact CD1-CB 4.34Å; I219-A248 HydrophobicContact CG1-CB 3.44Å; I219-A248 VanDerWaalsContact CG1-CB 3.44Å; R244-A248 WeakPolarHBondContact O-CB 3.31Å; R244-A248 PolarHBondContact O-N 3.35Å; R244-A248 VanDerWaalsContact O-N 3.08Å; A245-A248 CarbonylContact O-C 3.59Å; A245-A248 PolarHBondContact O-N 3.36Å; A245-A248 VanDerWaalsContact O-N 3.14Å; V246-A248 VanDerWaalsContact C-N 3.27Å; V246-A248 PolarHBondContact O-N 3.35Å
249	D	69.5	Low	86	Confident	26 Å²	26	31.6 Å²	31.6	14%	0.139	16%	0.164	C	C	.	.			trans	-137.2	94.4	170	-172.2	-1.4	0	0	0	111.4	V214 I219 A245 V246 S251 D252	V214-D249 HydrophobicContact CG1-CB 4.22Å; I219-D249 HydrophobicContact CD1-CB 3.59Å; I219-D249 HydrophobicContact CG1-CB 3.89Å; I219-D249 HydrophobicContact CG2-CB 4.44Å; A245-D249 PolarHBondContact O-N 3.01Å; V246-D249 CarbonylContact O-C 3.18Å; V246-D249 PolarHBondContact O-N 3.49Å; D249-S251 PolarHBondContact O-N 3.14Å; D249-S251 VanDerWaalsContact O-N 3.16Å; D249-S251 WeakPolarHBondContact OD1-CA 3.11Å; D249-S251 WeakPolarHBondContact OD1-CB 3.26Å; D249-S251 PolarHBondContact OD1-N 3.08Å; D249-S251 PolarHBondContact OD1-OG 3.4Å; D249-D252 HydrophobicContact CB-CB 4.33Å; D249-D252 PolarHBondContact O-N 3.36Å
250	P	75	Confident	86.1	Confident	43 Å²	43	30.9 Å²	30.9	28%	0.279	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-8.1	176.4	-21.1	33.7	0	0	0	114	V212 V246 Y256	V212-P250 HydrophobicContact CG1-CG 4.35Å; V246-P250 WeakPolarHBondContact O-CA 3.43Å; V246-P250 VanDerWaalsContact O-N 3.12Å; P250-Y256 VanDerWaalsContact O-CE2 3.31Å; P250-Y256 WeakPolarHBondContact O-CE2 3.49Å; P250-Y256 PolarHBondContact O-OH 2.98Å
251	S	76.3	Confident	86.3	Confident	76 Å²	76	29.8 Å²	29.8	53%	0.531	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-1.8	-177.8	71.5	0	0	0	0	114.1	D249 P253	D249-S251 PolarHBondContact O-N 3.14Å; D249-S251 VanDerWaalsContact O-N 3.16Å; D249-S251 WeakPolarHBondContact OD1-CA 3.11Å; D249-S251 WeakPolarHBondContact OD1-CB 3.26Å; D249-S251 PolarHBondContact OD1-N 3.08Å; D249-S251 PolarHBondContact OD1-OG 3.4Å; S251-P253 WeakPolarHBondContact O-CD 3.33Å
252	D	77.3	Confident	86.7	Confident	28 Å²	28	28.8 Å²	28.8	15%	0.15	15%	0.15	C	C	.	.			trans	-86	104.8	177.9	174.3	28.8	0	0	0	112.4	D249 I254 S255 Y256	D249-D252 HydrophobicContact CB-CB 4.33Å; D249-D252 PolarHBondContact O-N 3.36Å; D252-I254 PolarHBondContact O-N 2.69Å; D252-I254 VanDerWaalsContact OD1-CB 3.27Å; D252-I254 WeakPolarHBondContact OD1-CB 3.43Å; D252-I254 WeakPolarHBondContact OD1-CG1 3.39Å; D252-I254 PolarHBondContact OD1-N 3.03Å; D252-S255 PolarHBondContact O-N 2.97Å; D252-S255 WeakPolarHBondContact OD2-CB 3.49Å; D252-S255 PolarHBondContact OD2-N 3.33Å; D252-S255 PolarHBondContact OD2-OG 3.3Å; D252-Y256 VanDerWaalsContact O-CD2 3.26Å; D252-Y256 WeakPolarHBondContact O-CD2 3.38Å
253	P	85.1	Confident	87	Confident	22 Å²	22	28.7 Å²	28.7	14%	0.143	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-25.9	177.7	25.7	-34.3	0	0	0	113.1	S251 C257 A279 L282 D283 Y286	S251-P253 WeakPolarHBondContact O-CD 3.33Å; P253-C257 VanDerWaalsContact O-CB 3.28Å; P253-C257 WeakPolarHBondContact O-CB 3.28Å; P253-C257 PolarHBondContact O-N 3.01Å; P253-A279 HydrophobicContact CB-CB 4.19Å; P253-L282 HydrophobicContact CB-CB 3.97Å; P253-L282 HydrophobicContact CB-CD1 4.44Å; P253-L282 HydrophobicContact CG-CB 4.41Å; P253-D283 HydrophobicContact CB-CB 4.27Å; P253-D283 HydrophobicContact CG-CB 4.04Å; P253-Y286 HydrophobicContact CB-CD1 4.05Å; P253-Y286 HydrophobicContact CB-CE1 4.31Å
254	I	90.8	Very high	87.2	Confident	61 Å²	61	29.3 Å²	29.3	31%	0.313	15%	0.153	S	C	.	.	H	α-helix	trans	-69.1	-43.5	-175.7	-54.8	177	0	0	0	110.2	F223 D252 C257 N258	F223-I254 HydrophobicContact CE2-CG2 3.75Å; F223-I254 HydrophobicContact CZ-CG2 3.6Å; D252-I254 PolarHBondContact O-N 2.69Å; D252-I254 VanDerWaalsContact OD1-CB 3.27Å; D252-I254 WeakPolarHBondContact OD1-CB 3.43Å; D252-I254 WeakPolarHBondContact OD1-CG1 3.39Å; D252-I254 PolarHBondContact OD1-N 3.03Å; I254-C257 PolarHBondContact O-N 2.89Å; I254-N258 WeakPolarHBondContact O-CB 3.45Å; I254-N258 PolarHBondContact O-N 3.48Å
255	S	88.2	Confident	87.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.7	-44.6	177.4	-71.8	0	0	0	0	112.5	F223 D252 R259	F223-S255 WeakPolarHBondContact CD2-OG 3Å; D252-S255 PolarHBondContact O-N 2.97Å; D252-S255 WeakPolarHBondContact OD2-CB 3.49Å; D252-S255 PolarHBondContact OD2-N 3.33Å; D252-S255 PolarHBondContact OD2-OG 3.3Å; S255-R259 WeakPolarHBondContact O-CB 3.39Å; S255-R259 PolarHBondContact O-N 3.3Å
256	Y	93.9	Very high	88.5	Confident	13 Å²	13	33.7 Å²	33.7	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-49.4	173.4	-72.8	-81.6	0	0	0	111.7	V246 P250 D252 N258 R259 A260 V278 L282	V246-Y256 HydrophobicContact CG1-CD1 4.17Å; V246-Y256 HydrophobicContact CG1-CE1 3.45Å; V246-Y256 VanDerWaalsContact CG1-CE1 3.45Å; V246-Y256 HydrophobicContact CG1-CE2 3.99Å; V246-Y256 WeakPolarHBondContact CG1-OH 3.32Å; V246-Y256 HydrophobicContact CG2-CD1 4.16Å; V246-Y256 HydrophobicContact CG2-CD2 4.31Å; V246-Y256 HydrophobicContact CG2-CE1 4.26Å; V246-Y256 HydrophobicContact CG2-CE2 4.39Å; V246-Y256 HydrophobicContact CG2-CG 4.19Å; P250-Y256 VanDerWaalsContact O-CE2 3.31Å; P250-Y256 WeakPolarHBondContact O-CE2 3.49Å; P250-Y256 PolarHBondContact O-OH 2.98Å; D252-Y256 VanDerWaalsContact O-CD2 3.26Å; D252-Y256 WeakPolarHBondContact O-CD2 3.38Å; Y256-N258 VanDerWaalsContact C-N 3.33Å; Y256-N258 PolarHBondContact O-N 3.49Å; Y256-R259 PolarHBondContact O-N 3.29Å; Y256-A260 PolarHBondContact O-N 3.44Å; Y256-V278 HydrophobicContact CD1-CB 4.09Å; Y256-V278 HydrophobicContact CD1-CG1 3.98Å; Y256-V278 HydrophobicContact CD2-CG1 3.98Å; Y256-V278 HydrophobicContact CE1-CB 4.17Å; Y256-V278 HydrophobicContact CE1-CG1 3.71Å; Y256-V278 HydrophobicContact CE2-CG1 3.74Å; Y256-V278 HydrophobicContact CG-CB 4.35Å; Y256-V278 HydrophobicContact CG-CG1 4.1Å; Y256-L282 HydrophobicContact CD2-CD1 3.9Å; Y256-L282 HydrophobicContact CE2-CD1 3.78Å
257	C	95.5	Very high	89	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-42.4	-178.1	-173.4	0	0	0	0	111.5	P253 I254 A260 M261 A279 Y286 R292	P253-C257 VanDerWaalsContact O-CB 3.28Å; P253-C257 WeakPolarHBondContact O-CB 3.28Å; P253-C257 PolarHBondContact O-N 3.01Å; I254-C257 PolarHBondContact O-N 2.89Å; C257-A260 WeakPolarHBondContact O-CB 3.43Å; C257-A260 PolarHBondContact O-N 3.48Å; C257-M261 PolarHBondContact O-N 2.76Å; C257-M261 VanDerWaalsContact O-N 3.09Å; C257-A279 HydrophobicContact CB-CB 4.3Å; C257-Y286 HydrophobicContact CB-CD1 4.17Å; C257-Y286 HydrophobicContact CB-CE1 3.3Å; C257-Y286 VanDerWaalsContact SG-CE1 3.56Å; C257-R292 PolarHBondContact O-NH1 3.27Å; C257-R292 VanDerWaalsContact SG-CD 3.54Å; C257-R292 PolarHBondContact SG-NH1 2.95Å
258	N	95.3	Very high	89.8	Confident	27 Å²	27	35.1 Å²	35.1	14%	0.144	19%	0.189	C	C	.	.	H	α-helix	trans	-69.5	-35.9	177.5	-79	-3.2	0	0	0	112.8	F223 N227 Y242 I254 Y256 A260 M261 A262 R292	F223-N258 HydrophobicContact CE2-CB 4.43Å; F223-N258 VanDerWaalsContact CE2-ND2 3.35Å; F223-N258 WeakPolarHBondContact CE2-ND2 3.43Å; F223-N258 VanDerWaalsContact CZ-ND2 3.27Å; F223-N258 WeakPolarHBondContact CZ-ND2 3.43Å; N227-N258 PolarHBondContact OD1-ND2 3.06Å; Y242-N258 HydrophobicContact CD1-CB 4.18Å; Y242-N258 HydrophobicContact CD2-CB 4.48Å; Y242-N258 HydrophobicContact CE1-CB 3.77Å; Y242-N258 HydrophobicContact CE2-CB 4.09Å; I254-N258 WeakPolarHBondContact O-CB 3.45Å; I254-N258 PolarHBondContact O-N 3.48Å; Y256-N258 VanDerWaalsContact C-N 3.33Å; Y256-N258 PolarHBondContact O-N 3.49Å; N258-A260 VanDerWaalsContact C-N 3.35Å; N258-M261 PolarHBondContact O-N 2.73Å; N258-A262 PolarHBondContact O-N 2.67Å; N258-R292 PolarHBondContact OD1-NH1 2.88Å
259	R	96.8	Very high	91.1	Very high	29 Å²	29	37.5 Å²	37.5	11%	0.109	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-43.9	169.8	-166.5	170.1	69.6	-177.5	-3.2	111.4	I239 Y242 S243 S255 Y256 M261 A262 L263 D275	I239-R259 HydrophobicContact CG1-CG 4.48Å; I239-R259 HydrophobicContact CG2-CG 4.22Å; Y242-R259 HydrophobicContact CD2-CB 4.3Å; Y242-R259 HydrophobicContact CG-CB 4.35Å; S243-R259 VanDerWaalsContact OG-CD 3.24Å; S243-R259 WeakPolarHBondContact OG-CD 3.31Å; S243-R259 PolarHBondContact OG-NH1 3.09Å; S255-R259 WeakPolarHBondContact O-CB 3.39Å; S255-R259 PolarHBondContact O-N 3.3Å; Y256-R259 PolarHBondContact O-N 3.29Å; R259-M261 VanDerWaalsContact C-N 3.3Å; R259-M261 PolarHBondContact O-N 2.85Å; R259-A262 WeakPolarHBondContact O-CB 3.48Å; R259-A262 PolarHBondContact O-N 3.46Å; R259-A262 VanDerWaalsContact O-N 3.09Å; R259-L263 HydrophobicContact CG-CD1 4.15Å; R259-L263 HydrophobicContact CG-CG 4.5Å; R259-L263 WeakPolarHBondContact O-CG 3.42Å; R259-L263 PolarHBondContact O-N 2.81Å; R259-D275 WeakPolarHBondContact CG-OD2 3.32Å; R259-D275 IonicContact CZ-OD1 3.49Å; R259-D275 IonicContact CZ-OD2 3.71Å; R259-D275 IonicContact NE-OD1 3.86Å; R259-D275 IonicContact NE-OD2 2.76Å; R259-D275 PolarHBondContact NE-OD2 3.39Å; R259-D275 IonicContact NH2-OD1 2.67Å; R259-D275 PolarHBondContact NH2-OD1 2.88Å; R259-D275 IonicContact NH2-OD2 3.16Å; R259-D275 PolarHBondContact NH2-OD2 3.46Å
260	A	97.4	Very high	92.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.9	-40.7	176	0	0	0	0	0	112.5	Y256 C257 N258 A262 L263 L264 A272 D275 C276	Y256-A260 PolarHBondContact O-N 3.44Å; C257-A260 WeakPolarHBondContact O-CB 3.43Å; C257-A260 PolarHBondContact O-N 3.48Å; N258-A260 VanDerWaalsContact C-N 3.35Å; A260-A262 PolarHBondContact O-N 2.76Å; A260-L263 WeakPolarHBondContact O-CB 3.21Å; A260-L263 PolarHBondContact O-N 3.29Å; A260-L264 WeakPolarHBondContact O-CG 3.27Å; A260-L264 PolarHBondContact O-N 2.84Å; A260-A272 HydrophobicContact CB-CB 4.22Å; A260-D275 HydrophobicContact CB-CB 3.83Å; A260-C276 WeakPolarHBondContact CB-SG 3.49Å
261	M	97.3	Very high	93.3	Very high	37 Å²	37	41.2 Å²	41.2	18%	0.182	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-40.7	175.6	-177.4	59	88.6	0	0	112.3	Y230 C257 N258 R259 L263 L264 K265 R292	Y230-M261 HydrophobicContact CE2-CB 4.45Å; Y230-M261 HydrophobicContact CE2-CG 3.78Å; Y230-M261 WeakPolarHBondContact OH-CG 3.43Å; C257-M261 PolarHBondContact O-N 2.76Å; C257-M261 VanDerWaalsContact O-N 3.09Å; N258-M261 PolarHBondContact O-N 2.73Å; R259-M261 VanDerWaalsContact C-N 3.3Å; R259-M261 PolarHBondContact O-N 2.85Å; M261-L263 VanDerWaalsContact C-N 3.32Å; M261-L264 PolarHBondContact O-N 3.25Å; M261-L264 HydrophobicContact SD-CD1 4.25Å; M261-K265 WeakPolarHBondContact O-CG 3.29Å; M261-K265 PolarHBondContact O-N 2.99Å; M261-R292 HydrophobicContact CE-CG 3.92Å
262	A	96.6	Very high	94.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-36.1	174.5	0	0	0	0	0	112.1	Y230 A238 I239 Y242 N258 R259 A260 K265 L266	Y230-A262 HydrophobicContact CD2-CB 3.98Å; Y230-A262 HydrophobicContact CE2-CB 4.29Å; A238-A262 HydrophobicContact CB-CB 4.24Å; I239-A262 HydrophobicContact CD1-CB 4.28Å; I239-A262 HydrophobicContact CG1-CB 3.61Å; Y242-A262 HydrophobicContact CD2-CB 4.46Å; Y242-A262 HydrophobicContact CE2-CB 4.3Å; N258-A262 PolarHBondContact O-N 2.67Å; R259-A262 WeakPolarHBondContact O-CB 3.48Å; R259-A262 PolarHBondContact O-N 3.46Å; R259-A262 VanDerWaalsContact O-N 3.09Å; A260-A262 PolarHBondContact O-N 2.76Å; A262-K265 PolarHBondContact O-N 2.77Å; A262-L266 PolarHBondContact O-N 3.47Å
263	L	97.7	Very high	95.2	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-42.5	174.1	-71.5	165.1	0	0	0	112.2	I239 R259 A260 M261 K265 L266 A267 R268 E271 A272 D275	I239-L263 HydrophobicContact CD1-CD2 3.64Å; I239-L263 HydrophobicContact CD1-CG 4.02Å; I239-L263 HydrophobicContact CG1-CD2 4.25Å; I239-L263 HydrophobicContact CG1-CG 4.23Å; R259-L263 HydrophobicContact CG-CD1 4.15Å; R259-L263 HydrophobicContact CG-CG 4.5Å; R259-L263 WeakPolarHBondContact O-CG 3.42Å; R259-L263 PolarHBondContact O-N 2.81Å; A260-L263 WeakPolarHBondContact O-CB 3.21Å; A260-L263 PolarHBondContact O-N 3.29Å; M261-L263 VanDerWaalsContact C-N 3.32Å; L263-K265 VanDerWaalsContact C-N 3.29Å; L263-K265 PolarHBondContact O-N 3.12Å; L263-L266 CarbonylContact O-C 3.6Å; L263-L266 PolarHBondContact O-N 2.94Å; L263-A267 PolarHBondContact O-N 3.25Å; L263-R268 HydrophobicContact CB-CB 4.21Å; L263-R268 HydrophobicContact CD2-CB 3.83Å; L263-R268 HydrophobicContact CD2-CG 4.47Å; L263-R268 PolarHBondContact O-N 2.91Å; L263-E271 HydrophobicContact CD1-CB 3.86Å; L263-E271 HydrophobicContact CD2-CB 4.18Å; L263-A272 HydrophobicContact CB-CB 3.88Å; L263-D275 WeakPolarHBondContact CD1-OD2 2.96Å
264	L	97.1	Very high	95.8	Very high	23 Å²	23	41.8 Å²	41.8	12%	0.12	20%	0.2	C	C	.	.	H	α-helix	trans	-56.1	-43.3	173	-77.1	174.7	0	0	0	111.6	A260 M261 L266 A267 Y269 A272 R292 L295 A296	A260-L264 WeakPolarHBondContact O-CG 3.27Å; A260-L264 PolarHBondContact O-N 2.84Å; M261-L264 PolarHBondContact O-N 3.25Å; M261-L264 HydrophobicContact SD-CD1 4.25Å; L264-L266 PolarHBondContact O-N 3.48Å; L264-A267 PolarHBondContact O-N 3.41Å; L264-Y269 HydrophobicContact CD2-CD1 3.84Å; L264-Y269 HydrophobicContact CD2-CE1 4.35Å; L264-A272 HydrophobicContact CD2-CB 4.05Å; L264-A272 HydrophobicContact CG-CB 3.94Å; L264-R292 HydrophobicContact CD1-CB 4.08Å; L264-R292 HydrophobicContact CD1-CG 4.29Å; L264-L295 HydrophobicContact CD1-CB 4.26Å; L264-L295 HydrophobicContact CD1-CD1 4.46Å; L264-A296 HydrophobicContact CD2-CB 3.73Å
265	K	97.2	Very high	95.9	Very high	112 Å²	112	39.5 Å²	39.5	49%	0.487	19%	0.188	S	C	.	.	H	α-helix	trans	-66.2	-19.3	177.9	-66.6	-62.4	-176	-170.2	0	114.1	Y230 Y235 M261 A262 L263	Y230-K265 HydrophobicContact CE2-CG 4.14Å; Y230-K265 WeakPolarHBondContact OH-CE 3.45Å; Y235-K265 HydrophobicContact CD1-CB 3.75Å; Y235-K265 HydrophobicContact CD1-CG 4.02Å; Y235-K265 HydrophobicContact CD2-CB 3.6Å; Y235-K265 HydrophobicContact CE1-CB 3.77Å; Y235-K265 HydrophobicContact CE1-CD 4.42Å; Y235-K265 HydrophobicContact CE1-CG 3.65Å; Y235-K265 HydrophobicContact CE2-CB 3.62Å; Y235-K265 HydrophobicContact CE2-CG 4.18Å; Y235-K265 HydrophobicContact CG-CB 3.66Å; Y235-K265 HydrophobicContact CG-CG 4.43Å; M261-K265 WeakPolarHBondContact O-CG 3.29Å; M261-K265 PolarHBondContact O-N 2.99Å; A262-K265 PolarHBondContact O-N 2.77Å; L263-K265 VanDerWaalsContact C-N 3.29Å; L263-K265 PolarHBondContact O-N 3.12Å
266	L	96.3	Very high	96.3	Very high	71 Å²	71	39.5 Å²	39.5	37%	0.372	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	12.7	173.5	-65.5	-176.5	0	0	0	113.1	Y235 A236 I239 A262 L263 L264 R268	Y235-L266 HydrophobicContact CD2-CD2 4.16Å; A236-L266 HydrophobicContact CB-CD1 4.3Å; I239-L266 HydrophobicContact CD1-CD1 3.48Å; I239-L266 VanDerWaalsContact CD1-CD1 3.48Å; I239-L266 HydrophobicContact CD1-CG 4.42Å; A262-L266 PolarHBondContact O-N 3.47Å; L263-L266 CarbonylContact O-C 3.6Å; L263-L266 PolarHBondContact O-N 2.94Å; L264-L266 PolarHBondContact O-N 3.48Å; L266-R268 HydrophobicContact CB-CG 4.33Å; L266-R268 PolarHBondContact O-N 3.47Å; L266-R268 VanDerWaalsContact O-N 3.17Å
267	A	96	Very high	96.3	Very high	57 Å²	57	40 Å²	40	47%	0.471	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	25.6	-176.2	0	0	0	0	0	114.5	L263 L264 Y269	L263-A267 PolarHBondContact O-N 3.25Å; L264-A267 PolarHBondContact O-N 3.41Å; A267-Y269 VanDerWaalsContact C-N 3.29Å; A267-Y269 HydrophobicContact CB-CE1 4.33Å; A267-Y269 HydrophobicContact CB-CE2 3.8Å; A267-Y269 WeakPolarHBondContact O-CD2 3.45Å; A267-Y269 PolarHBondContact O-N 3.29Å
268	R	96.2	Very high	96.1	Very high	101 Å²	101	41.7 Å²	41.7	38%	0.381	21%	0.208	S	C	.	.			trans	-90.9	63.5	175.7	-68.5	173.1	67.3	176.3	1.6	110.1	L263 L266 E270 E271 A272	L263-R268 HydrophobicContact CB-CB 4.21Å; L263-R268 HydrophobicContact CD2-CB 3.83Å; L263-R268 HydrophobicContact CD2-CG 4.47Å; L263-R268 PolarHBondContact O-N 2.91Å; L266-R268 HydrophobicContact CB-CG 4.33Å; L266-R268 PolarHBondContact O-N 3.47Å; L266-R268 VanDerWaalsContact O-N 3.17Å; R268-E270 PolarHBondContact O-N 3.48Å; R268-E271 IonicContact CZ-OE1 2.79Å; R268-E271 IonicContact CZ-OE2 3.47Å; R268-E271 IonicContact NE-OE1 3.73Å; R268-E271 PolarHBondContact NE-OE1 3.49Å; R268-E271 IonicContact NE-OE2 2.71Å; R268-E271 IonicContact NH2-OE1 3.27Å; R268-E271 PolarHBondContact NH2-OE1 3.21Å; R268-E271 IonicContact NH2-OE2 3.39Å; R268-E271 PolarHBondContact NH2-OE2 3.43Å; R268-E271 PolarHBondContact O-N 2.95Å; R268-A272 PolarHBondContact O-N 2.86Å; R268-A272 VanDerWaalsContact O-N 3.12Å
269	Y	97.1	Very high	95.8	Very high	58 Å²	58	40.4 Å²	40.4	23%	0.227	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-41	-167.3	-52.1	-62.3	0	0	0	113.9	L264 A267 E271 A272 S273 E299	L264-Y269 HydrophobicContact CD2-CD1 3.84Å; L264-Y269 HydrophobicContact CD2-CE1 4.35Å; A267-Y269 VanDerWaalsContact C-N 3.29Å; A267-Y269 HydrophobicContact CB-CE1 4.33Å; A267-Y269 HydrophobicContact CB-CE2 3.8Å; A267-Y269 WeakPolarHBondContact O-CD2 3.45Å; A267-Y269 PolarHBondContact O-N 3.29Å; Y269-E271 VanDerWaalsContact C-N 3.3Å; Y269-E271 PolarHBondContact O-N 3.34Å; Y269-A272 WeakPolarHBondContact O-CB 3.28Å; Y269-A272 PolarHBondContact O-N 3.3Å; Y269-S273 PolarHBondContact O-N 2.96Å; Y269-S273 PolarHBondContact O-OG 3.45Å; Y269-E299 HydrophobicContact CD1-CB 3.55Å; Y269-E299 HydrophobicContact CD1-CG 3.93Å; Y269-E299 HydrophobicContact CD2-CB 3.8Å; Y269-E299 HydrophobicContact CE1-CB 3.45Å; Y269-E299 VanDerWaalsContact CE1-CB 3.45Å; Y269-E299 HydrophobicContact CE1-CG 3.47Å; Y269-E299 VanDerWaalsContact CE1-CG 3.47Å; Y269-E299 HydrophobicContact CE2-CB 3.68Å; Y269-E299 HydrophobicContact CE2-CG 4.41Å; Y269-E299 HydrophobicContact CG-CB 3.71Å; Y269-E299 VanDerWaalsContact CZ-CB 3.48Å; Y269-E299 PolarHBondContact OH-OE2 3.34Å
270	E	96.3	Very high	95.6	Very high	82 Å²	82	39.9 Å²	39.9	38%	0.383	20%	0.2	S	C	.	.	H	α-helix	trans	-64.4	-33.9	-179.5	-171.7	60.3	-149.8	0	0	112.8	R268 S273 K274 L300	R268-E270 PolarHBondContact O-N 3.48Å; E270-S273 PolarHBondContact O-OG 2.82Å; E270-K274 WeakPolarHBondContact O-CG 3.47Å; E270-K274 PolarHBondContact O-N 2.95Å; E270-K274 WeakPolarHBondContact OE1-CE 3.46Å; E270-K274 IonicContact OE1-NZ 2.65Å; E270-L300 WeakPolarHBondContact OE2-CD1 3.28Å
271	E	95.6	Very high	95.1	Very high	66 Å²	66	42.7 Å²	42.7	31%	0.308	22%	0.22	S	C	.	.	H	α-helix	trans	-76.9	-37.7	175.3	-66.8	177.9	-95.4	0	0	111.1	L263 R268 Y269 S273 K274 D275	L263-E271 HydrophobicContact CD1-CB 3.86Å; L263-E271 HydrophobicContact CD2-CB 4.18Å; R268-E271 IonicContact CZ-OE1 2.79Å; R268-E271 IonicContact CZ-OE2 3.47Å; R268-E271 IonicContact NE-OE1 3.73Å; R268-E271 PolarHBondContact NE-OE1 3.49Å; R268-E271 IonicContact NE-OE2 2.71Å; R268-E271 IonicContact NH2-OE1 3.27Å; R268-E271 PolarHBondContact NH2-OE1 3.21Å; R268-E271 IonicContact NH2-OE2 3.39Å; R268-E271 PolarHBondContact NH2-OE2 3.43Å; R268-E271 PolarHBondContact O-N 2.95Å; Y269-E271 VanDerWaalsContact C-N 3.3Å; Y269-E271 PolarHBondContact O-N 3.34Å; E271-S273 PolarHBondContact O-N 3.27Å; E271-K274 PolarHBondContact O-N 3.48Å; E271-D275 PolarHBondContact O-N 2.92Å
272	A	96.9	Very high	94.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-41.5	175.4	0	0	0	0	0	112.1	A260 L263 L264 R268 Y269 K274 D275 C276 A296	A260-A272 HydrophobicContact CB-CB 4.22Å; L263-A272 HydrophobicContact CB-CB 3.88Å; L264-A272 HydrophobicContact CD2-CB 4.05Å; L264-A272 HydrophobicContact CG-CB 3.94Å; R268-A272 PolarHBondContact O-N 2.86Å; R268-A272 VanDerWaalsContact O-N 3.12Å; Y269-A272 WeakPolarHBondContact O-CB 3.28Å; Y269-A272 PolarHBondContact O-N 3.3Å; A272-K274 VanDerWaalsContact C-N 3.34Å; A272-K274 PolarHBondContact O-N 3.08Å; A272-D275 PolarHBondContact O-N 3.29Å; A272-C276 PolarHBondContact O-N 3.03Å; A272-C276 PolarHBondContact O-SG 3.31Å; A272-A296 HydrophobicContact CB-CB 4.19Å
273	S	97	Very high	93.6	Very high	11 Å²	11	47.1 Å²	47.1	8%	0.077	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-37.6	177.5	56	0	0	0	0	112.2	Y269 E270 E271 G277	Y269-S273 PolarHBondContact O-N 2.96Å; Y269-S273 PolarHBondContact O-OG 3.45Å; E270-S273 PolarHBondContact O-OG 2.82Å; E271-S273 PolarHBondContact O-N 3.27Å; S273-G277 PolarHBondContact O-N 2.98Å
274	K	96.3	Very high	93.2	Very high	127 Å²	127	49.1 Å²	49.1	55%	0.552	26%	0.257	S	S	*	.	H	α-helix	trans	-65.3	-48.1	175.7	-73.3	172.1	-174.5	174	0	111.8	E270 E271 A272 C276 G277 V278	E270-K274 WeakPolarHBondContact O-CG 3.47Å; E270-K274 PolarHBondContact O-N 2.95Å; E270-K274 WeakPolarHBondContact OE1-CE 3.46Å; E270-K274 IonicContact OE1-NZ 2.65Å; E271-K274 PolarHBondContact O-N 3.48Å; A272-K274 VanDerWaalsContact C-N 3.34Å; A272-K274 PolarHBondContact O-N 3.08Å; K274-C276 VanDerWaalsContact C-N 3.32Å; K274-C276 PolarHBondContact O-N 3.36Å; K274-G277 WeakPolarHBondContact O-CA 3.45Å; K274-G277 PolarHBondContact O-N 3.1Å; K274-G277 VanDerWaalsContact O-N 3.1Å; K274-V278 PolarHBondContact O-N 3.22Å
275	D	94.2	Very high	92.8	Very high	13 Å²	13	55.2 Å²	55.2	7%	0.07	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-42.1	176.7	-84.7	-3	0	0	0	112.1	R259 A260 L263 E271 A272 G277 V278 A279	R259-D275 WeakPolarHBondContact CG-OD2 3.32Å; R259-D275 IonicContact CZ-OD1 3.49Å; R259-D275 IonicContact CZ-OD2 3.71Å; R259-D275 IonicContact NE-OD1 3.86Å; R259-D275 IonicContact NE-OD2 2.76Å; R259-D275 PolarHBondContact NE-OD2 3.39Å; R259-D275 IonicContact NH2-OD1 2.67Å; R259-D275 PolarHBondContact NH2-OD1 2.88Å; R259-D275 IonicContact NH2-OD2 3.16Å; R259-D275 PolarHBondContact NH2-OD2 3.46Å; A260-D275 HydrophobicContact CB-CB 3.83Å; L263-D275 WeakPolarHBondContact CD1-OD2 2.96Å; E271-D275 PolarHBondContact O-N 2.92Å; A272-D275 PolarHBondContact O-N 3.29Å; D275-G277 VanDerWaalsContact C-N 3.32Å; D275-G277 PolarHBondContact O-N 2.99Å; D275-V278 PolarHBondContact O-N 2.96Å; D275-A279 PolarHBondContact O-N 3.48Å
276	C	95.4	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-36	175.4	-63.4	0	0	0	0	112	A260 A272 K274 A279 I280 A289 R293	A260-C276 WeakPolarHBondContact CB-SG 3.49Å; A272-C276 PolarHBondContact O-N 3.03Å; A272-C276 PolarHBondContact O-SG 3.31Å; K274-C276 VanDerWaalsContact C-N 3.32Å; K274-C276 PolarHBondContact O-N 3.36Å; C276-A279 PolarHBondContact O-N 3.38Å; C276-I280 WeakPolarHBondContact O-CB 3.22Å; C276-I280 WeakPolarHBondContact O-CD1 3.47Å; C276-I280 VanDerWaalsContact O-CG1 3.24Å; C276-I280 WeakPolarHBondContact O-CG1 3.5Å; C276-I280 PolarHBondContact O-N 3.04Å; C276-A289 WeakPolarHBondContact CB-O 3.19Å; C276-R293 HydrophobicContact CB-CB 3.57Å; C276-R293 HydrophobicContact CB-CG 4.06Å
277	G	94.9	Very high	92.3	Very high	24 Å²	24	49 Å²	49	25%	0.247	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-46	172.7	0	0	0	0	0	112.3	S273 K274 D275 I280 S281	S273-G277 PolarHBondContact O-N 2.98Å; K274-G277 WeakPolarHBondContact O-CA 3.45Å; K274-G277 PolarHBondContact O-N 3.1Å; K274-G277 VanDerWaalsContact O-N 3.1Å; D275-G277 VanDerWaalsContact C-N 3.32Å; D275-G277 PolarHBondContact O-N 2.99Å; G277-I280 PolarHBondContact O-N 2.97Å; G277-S281 PolarHBondContact O-N 2.9Å
278	V	90.6	Very high	92.2	Very high	35 Å²	35	52.3 Å²	52.3	21%	0.212	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-47	174.3	179.5	0	0	0	0	110.6	Y256 K274 D275 I280 S281 L282	Y256-V278 HydrophobicContact CD1-CB 4.09Å; Y256-V278 HydrophobicContact CD1-CG1 3.98Å; Y256-V278 HydrophobicContact CD2-CG1 3.98Å; Y256-V278 HydrophobicContact CE1-CB 4.17Å; Y256-V278 HydrophobicContact CE1-CG1 3.71Å; Y256-V278 HydrophobicContact CE2-CG1 3.74Å; Y256-V278 HydrophobicContact CG-CB 4.35Å; Y256-V278 HydrophobicContact CG-CG1 4.1Å; K274-V278 PolarHBondContact O-N 3.22Å; D275-V278 PolarHBondContact O-N 2.96Å; V278-I280 VanDerWaalsContact C-N 3.31Å; V278-I280 PolarHBondContact O-N 2.9Å; V278-S281 WeakPolarHBondContact CA-OG 3.4Å; V278-S281 PolarHBondContact O-N 3.01Å; V278-S281 VanDerWaalsContact O-N 3.11Å; V278-S281 PolarHBondContact O-OG 3.41Å; V278-L282 HydrophobicContact CG1-CD1 3.96Å; V278-L282 HydrophobicContact CG1-CG 4.41Å; V278-L282 WeakPolarHBondContact O-CG 3.31Å; V278-L282 PolarHBondContact O-N 3.29Å
279	A	89.4	Confident	92.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-39.6	178	0	0	0	0	0	113.3	P253 C257 D275 C276 L282 D283 Y286 A289	P253-A279 HydrophobicContact CB-CB 4.19Å; C257-A279 HydrophobicContact CB-CB 4.3Å; D275-A279 PolarHBondContact O-N 3.48Å; C276-A279 PolarHBondContact O-N 3.38Å; A279-L282 PolarHBondContact O-N 3.48Å; A279-D283 PolarHBondContact O-N 3.04Å; A279-Y286 HydrophobicContact CB-CD1 4.31Å; A279-A289 HydrophobicContact CB-CB 3.87Å
280	I	92.2	Very high	92.1	Very high	17 Å²	17	46 Å²	46	9%	0.087	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-37	176.2	-69.6	162.6	0	0	0	111.3	C276 G277 V278 L282 D283 C284 A289 Y290 R293	C276-I280 WeakPolarHBondContact O-CB 3.22Å; C276-I280 WeakPolarHBondContact O-CD1 3.47Å; C276-I280 VanDerWaalsContact O-CG1 3.24Å; C276-I280 WeakPolarHBondContact O-CG1 3.5Å; C276-I280 PolarHBondContact O-N 3.04Å; G277-I280 PolarHBondContact O-N 2.97Å; V278-I280 VanDerWaalsContact C-N 3.31Å; V278-I280 PolarHBondContact O-N 2.9Å; I280-L282 VanDerWaalsContact C-N 3.29Å; I280-L282 PolarHBondContact O-N 3.2Å; I280-D283 CarbonylContact O-C 3.53Å; I280-C284 VanDerWaalsContact O-CA 3.25Å; I280-C284 WeakPolarHBondContact O-CA 3.2Å; I280-C284 PolarHBondContact O-N 2.96Å; I280-C284 VanDerWaalsContact O-N 3.09Å; I280-A289 HydrophobicContact CD1-CB 4.34Å; I280-A289 HydrophobicContact CG1-CB 3.7Å; I280-Y290 HydrophobicContact CD1-CD1 3.74Å; I280-Y290 HydrophobicContact CD1-CD2 4.3Å; I280-Y290 HydrophobicContact CD1-CE1 3.9Å; I280-Y290 HydrophobicContact CD1-CE2 4.43Å; I280-Y290 HydrophobicContact CD1-CG 3.97Å; I280-Y290 HydrophobicContact CG1-CD1 4.37Å; I280-Y290 HydrophobicContact CG1-CD2 4.14Å; I280-Y290 HydrophobicContact CG1-CE1 4.26Å; I280-Y290 HydrophobicContact CG1-CE2 4.02Å; I280-Y290 HydrophobicContact CG1-CG 4.32Å; I280-Y290 HydrophobicContact CG2-CE1 3.98Å; I280-Y290 HydrophobicContact CG2-CE2 4.16Å; I280-Y290 WeakPolarHBondContact CG2-OH 3.33Å; I280-R293 VanDerWaalsContact CD1-CZ 3.47Å
281	S	86.8	Confident	92.2	Very high	60 Å²	60	43.6 Å²	43.6	42%	0.42	22%	0.221	S	C	.	.	H	α-helix	trans	-67.4	-30.7	175.6	73.4	0	0	0	0	113	G277 V278	G277-S281 PolarHBondContact O-N 2.9Å; V278-S281 WeakPolarHBondContact CA-OG 3.4Å; V278-S281 PolarHBondContact O-N 3.01Å; V278-S281 VanDerWaalsContact O-N 3.11Å; V278-S281 PolarHBondContact O-OG 3.41Å
282	L	79	Confident	92.3	Very high	67 Å²	67	41.8 Å²	41.8	35%	0.351	21%	0.212	S	C	.	.	H	α-helix	trans	-80.3	-39.8	176	-69.8	171.3	0	0	0	112.3	P253 Y256 V278 A279 I280	P253-L282 HydrophobicContact CB-CB 3.97Å; P253-L282 HydrophobicContact CB-CD1 4.44Å; P253-L282 HydrophobicContact CG-CB 4.41Å; Y256-L282 HydrophobicContact CD2-CD1 3.9Å; Y256-L282 HydrophobicContact CE2-CD1 3.78Å; V278-L282 HydrophobicContact CG1-CD1 3.96Å; V278-L282 HydrophobicContact CG1-CG 4.41Å; V278-L282 WeakPolarHBondContact O-CG 3.31Å; V278-L282 PolarHBondContact O-N 3.29Å; A279-L282 PolarHBondContact O-N 3.48Å; I280-L282 VanDerWaalsContact C-N 3.29Å; I280-L282 PolarHBondContact O-N 3.2Å
283	D	84.2	Confident	92.3	Very high	62 Å²	62	44.9 Å²	44.9	33%	0.332	22%	0.223	S	C	.	.			trans	-139.9	99.1	173.7	178.8	5.5	0	0	0	110.8	P253 A279 I280 K285 Y286	P253-D283 HydrophobicContact CB-CB 4.27Å; P253-D283 HydrophobicContact CG-CB 4.04Å; A279-D283 PolarHBondContact O-N 3.04Å; I280-D283 CarbonylContact O-C 3.53Å; D283-K285 PolarHBondContact O-N 3.34Å; D283-K285 VanDerWaalsContact O-N 3.12Å; D283-K285 PolarHBondContact OD1-N 3.49Å; D283-Y286 VanDerWaalsContact O-CB 3.25Å; D283-Y286 WeakPolarHBondContact O-CB 3.41Å; D283-Y286 PolarHBondContact O-N 3.41Å
284	C	88.2	Confident	92.3	Very high	45 Å²	45	44.3 Å²	44.3	30%	0.304	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.3	-178.7	66.6	0	0	0	0	114.3	I280 Y290	I280-C284 VanDerWaalsContact O-CA 3.25Å; I280-C284 WeakPolarHBondContact O-CA 3.2Å; I280-C284 PolarHBondContact O-N 2.96Å; I280-C284 VanDerWaalsContact O-N 3.09Å; C284-Y290 WeakPolarHBondContact O-CE2 3.46Å; C284-Y290 PolarHBondContact O-OH 2.85Å
285	K	88.6	Confident	92.3	Very high	151 Å²	151	39.9 Å²	39.9	66%	0.657	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	7	175.3	-64.3	-175.7	180	-178.9	0	112.2	D283 V287	D283-K285 PolarHBondContact O-N 3.34Å; D283-K285 VanDerWaalsContact O-N 3.12Å; D283-K285 PolarHBondContact OD1-N 3.49Å; K285-V287 PolarHBondContact O-N 2.93Å
286	Y	89.8	Confident	92.4	Very high	36 Å²	36	39.3 Å²	39.3	14%	0.141	20%	0.199	C	C	.	.			trans	-78.7	85.2	-175.5	-165.7	-155.1	0	0	0	112.6	P253 C257 A279 D283 K288 A289	P253-Y286 HydrophobicContact CB-CD1 4.05Å; P253-Y286 HydrophobicContact CB-CE1 4.31Å; C257-Y286 HydrophobicContact CB-CD1 4.17Å; C257-Y286 HydrophobicContact CB-CE1 3.3Å; C257-Y286 VanDerWaalsContact SG-CE1 3.56Å; A279-Y286 HydrophobicContact CB-CD1 4.31Å; D283-Y286 VanDerWaalsContact O-CB 3.25Å; D283-Y286 WeakPolarHBondContact O-CB 3.41Å; D283-Y286 PolarHBondContact O-N 3.41Å; Y286-K288 VanDerWaalsContact C-N 3.26Å; Y286-K288 HydrophobicContact CE2-CB 4.12Å; Y286-K288 HydrophobicContact CE2-CD 4.41Å; Y286-K288 PolarHBondContact O-N 3.16Å; Y286-K288 VanDerWaalsContact O-N 3.11Å; Y286-A289 HydrophobicContact CD1-CB 3.8Å; Y286-A289 HydrophobicContact CG-CB 4.27Å; Y286-A289 WeakPolarHBondContact O-CB 3.14Å; Y286-A289 PolarHBondContact O-N 3.42Å
287	V	93.5	Very high	92.5	Very high	17 Å²	17	39.6 Å²	39.6	10%	0.103	20%	0.2	C	C	.	.	H	α-helix	trans	-49.7	-42.6	-173.7	-172.5	0	0	0	0	113.6	K285 A289 Y290 F291 V313 L316 E317	K285-V287 PolarHBondContact O-N 2.93Å; V287-A289 PolarHBondContact O-N 3.32Å; V287-Y290 PolarHBondContact O-N 3.48Å; V287-F291 PolarHBondContact O-N 3.12Å; V287-V313 HydrophobicContact CG1-CB 4.31Å; V287-V313 HydrophobicContact CG1-CG1 3.71Å; V287-V313 HydrophobicContact CG1-CG2 4.22Å; V287-L316 HydrophobicContact CG2-CB 3.69Å; V287-L316 HydrophobicContact CG2-CD1 3.95Å; V287-L316 HydrophobicContact CG2-CG 4.45Å; V287-E317 HydrophobicContact CG1-CB 4.47Å; V287-E317 HydrophobicContact CG1-CG 4.16Å; V287-E317 HydrophobicContact CG2-CG 4.03Å
288	K	94.6	Very high	92.5	Very high	126 Å²	126	40.4 Å²	40.4	55%	0.548	20%	0.197	S	C	.	.	H	α-helix	trans	-61	-32	179.6	-68.9	-177.9	-178.4	176.1	0	112.7	Y286 R292	Y286-K288 VanDerWaalsContact C-N 3.26Å; Y286-K288 HydrophobicContact CE2-CB 4.12Å; Y286-K288 HydrophobicContact CE2-CD 4.41Å; Y286-K288 PolarHBondContact O-N 3.16Å; Y286-K288 VanDerWaalsContact O-N 3.11Å; K288-R292 WeakPolarHBondContact O-CB 3.48Å; K288-R292 WeakPolarHBondContact O-CD 3.25Å; K288-R292 WeakPolarHBondContact O-CG 3.34Å; K288-R292 PolarHBondContact O-N 2.98Å
289	A	94.8	Very high	92.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-71.2	-43.9	178.9	0	0	0	0	0	111.3	C276 A279 I280 Y286 V287 R292 R293	C276-A289 WeakPolarHBondContact CB-O 3.19Å; A279-A289 HydrophobicContact CB-CB 3.87Å; I280-A289 HydrophobicContact CD1-CB 4.34Å; I280-A289 HydrophobicContact CG1-CB 3.7Å; Y286-A289 HydrophobicContact CD1-CB 3.8Å; Y286-A289 HydrophobicContact CG-CB 4.27Å; Y286-A289 WeakPolarHBondContact O-CB 3.14Å; Y286-A289 PolarHBondContact O-N 3.42Å; V287-A289 PolarHBondContact O-N 3.32Å; A289-R292 PolarHBondContact O-N 3.44Å; A289-R293 WeakPolarHBondContact O-CB 3.34Å; A289-R293 PolarHBondContact O-N 3.24Å
290	Y	97	Very high	93	Very high	27 Å²	27	46.3 Å²	46.3	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-48.4	172.8	-70.4	-84.6	0	0	0	111.7	I280 C284 V287 R292 R293 G294 L316	I280-Y290 HydrophobicContact CD1-CD1 3.74Å; I280-Y290 HydrophobicContact CD1-CD2 4.3Å; I280-Y290 HydrophobicContact CD1-CE1 3.9Å; I280-Y290 HydrophobicContact CD1-CE2 4.43Å; I280-Y290 HydrophobicContact CD1-CG 3.97Å; I280-Y290 HydrophobicContact CG1-CD1 4.37Å; I280-Y290 HydrophobicContact CG1-CD2 4.14Å; I280-Y290 HydrophobicContact CG1-CE1 4.26Å; I280-Y290 HydrophobicContact CG1-CE2 4.02Å; I280-Y290 HydrophobicContact CG1-CG 4.32Å; I280-Y290 HydrophobicContact CG2-CE1 3.98Å; I280-Y290 HydrophobicContact CG2-CE2 4.16Å; I280-Y290 WeakPolarHBondContact CG2-OH 3.33Å; C284-Y290 WeakPolarHBondContact O-CE2 3.46Å; C284-Y290 PolarHBondContact O-OH 2.85Å; V287-Y290 PolarHBondContact O-N 3.48Å; Y290-R292 VanDerWaalsContact C-N 3.35Å; Y290-R292 PolarHBondContact O-N 2.8Å; Y290-R293 PolarHBondContact O-N 3.22Å; Y290-G294 PolarHBondContact O-N 3.33Å; Y290-L316 HydrophobicContact CD2-CD1 4.03Å; Y290-L316 HydrophobicContact CE2-CD1 3.95Å
291	F	96.8	Very high	93	Very high	31 Å²	31	47.6 Å²	47.6	14%	0.136	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-44.3	-179.9	-172.9	-96.5	0	0	0	112.3	V287 G294 L295 F310 V313 L322 A323 E326	V287-F291 PolarHBondContact O-N 3.12Å; F291-G294 PolarHBondContact O-N 3.26Å; F291-L295 HydrophobicContact CD1-CD1 3.97Å; F291-L295 HydrophobicContact CD1-CG 4.41Å; F291-L295 HydrophobicContact CE1-CD1 3.54Å; F291-L295 HydrophobicContact CE1-CG 4.08Å; F291-L295 HydrophobicContact CZ-CD1 4.28Å; F291-L295 HydrophobicContact CZ-CG 4.47Å; F291-L295 WeakPolarHBondContact O-CG 3.22Å; F291-L295 PolarHBondContact O-N 3.1Å; F291-F310 AromaticContact CD2-CD1 3.95Å; F291-F310 HydrophobicContact CD2-CD1 3.95Å; F291-F310 AromaticContact CD2-CE1 3.86Å; F291-F310 HydrophobicContact CD2-CE1 3.86Å; F291-F310 HydrophobicContact CE2-CD1 4.18Å; F291-F310 AromaticContact CE2-CE1 3.9Å; F291-F310 HydrophobicContact CE2-CE1 3.9Å; F291-F310 HydrophobicContact CG-CE1 4.48Å; F291-V313 HydrophobicContact CB-CG2 3.83Å; F291-V313 HydrophobicContact CD2-CG2 4.43Å; F291-L322 HydrophobicContact CE2-CB 3.73Å; F291-L322 HydrophobicContact CZ-CB 3.72Å; F291-L322 HydrophobicContact CZ-CD1 4.46Å; F291-A323 HydrophobicContact CD2-CB 4.33Å; F291-A323 HydrophobicContact CE2-CB 4.39Å; F291-E326 HydrophobicContact CE2-CG 4.38Å; F291-E326 HydrophobicContact CZ-CG 4.38Å
292	R	97.6	Very high	93.3	Very high	29 Å²	29	49.3 Å²	49.3	11%	0.109	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-36.3	178.5	-71.4	169.2	-169.9	-169.7	-3.9	112.1	C257 N258 M261 L264 K288 A289 Y290 L295 A296	C257-R292 PolarHBondContact O-NH1 3.27Å; C257-R292 VanDerWaalsContact SG-CD 3.54Å; C257-R292 PolarHBondContact SG-NH1 2.95Å; N258-R292 PolarHBondContact OD1-NH1 2.88Å; M261-R292 HydrophobicContact CE-CG 3.92Å; L264-R292 HydrophobicContact CD1-CB 4.08Å; L264-R292 HydrophobicContact CD1-CG 4.29Å; K288-R292 WeakPolarHBondContact O-CB 3.48Å; K288-R292 WeakPolarHBondContact O-CD 3.25Å; K288-R292 WeakPolarHBondContact O-CG 3.34Å; K288-R292 PolarHBondContact O-N 2.98Å; A289-R292 PolarHBondContact O-N 3.44Å; Y290-R292 VanDerWaalsContact C-N 3.35Å; Y290-R292 PolarHBondContact O-N 2.8Å; R292-L295 PolarHBondContact O-N 3.44Å; R292-A296 PolarHBondContact O-N 3.28Å
293	R	97.6	Very high	93.9	Very high	64 Å²	64	49.3 Å²	49.3	24%	0.242	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-44.3	173.7	-164	171.6	70.7	179.6	0.7	111.2	C276 I280 A289 Y290 L295 A296 L297 D309	C276-R293 HydrophobicContact CB-CB 3.57Å; C276-R293 HydrophobicContact CB-CG 4.06Å; I280-R293 VanDerWaalsContact CD1-CZ 3.47Å; A289-R293 WeakPolarHBondContact O-CB 3.34Å; A289-R293 PolarHBondContact O-N 3.24Å; Y290-R293 PolarHBondContact O-N 3.22Å; R293-L295 VanDerWaalsContact C-N 3.32Å; R293-L295 PolarHBondContact O-N 3.2Å; R293-A296 WeakPolarHBondContact O-CB 3.39Å; R293-A296 PolarHBondContact O-N 3.15Å; R293-A296 VanDerWaalsContact O-N 3.09Å; R293-L297 HydrophobicContact CG-CD1 3.93Å; R293-L297 HydrophobicContact CG-CG 4.27Å; R293-L297 WeakPolarHBondContact O-CB 3.24Å; R293-L297 VanDerWaalsContact O-CG 3.27Å; R293-L297 WeakPolarHBondContact O-CG 3.18Å; R293-L297 PolarHBondContact O-N 2.99Å; R293-D309 VanDerWaalsContact CB-OD2 3.26Å; R293-D309 WeakPolarHBondContact CB-OD2 3.3Å; R293-D309 VanDerWaalsContact CG-OD2 3.27Å; R293-D309 WeakPolarHBondContact CG-OD2 3.4Å; R293-D309 IonicContact CZ-OD1 2.69Å; R293-D309 IonicContact CZ-OD2 2.96Å; R293-D309 IonicContact NE-OD1 2.69Å; R293-D309 PolarHBondContact NE-OD1 2.8Å; R293-D309 IonicContact NE-OD2 2.72Å; R293-D309 PolarHBondContact NE-OD2 3.11Å; R293-D309 IonicContact NH2-OD1 3.45Å; R293-D309 PolarHBondContact NH2-OD1 3.38Å; R293-D309 IonicContact NH2-OD2 3.24Å
294	G	96.5	Very high	94.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.3	-42.8	174.3	0	0	0	0	0	112.6	Y290 F291 L297 K298 A306 D309 F310	Y290-G294 PolarHBondContact O-N 3.33Å; F291-G294 PolarHBondContact O-N 3.26Å; G294-L297 PolarHBondContact O-N 3.35Å; G294-K298 WeakPolarHBondContact O-CB 3.15Å; G294-K298 PolarHBondContact O-N 3.14Å; G294-A306 WeakPolarHBondContact O-CB 3.15Å; G294-D309 PolarHBondContact N-OD2 3.5Å; G294-F310 VanDerWaalsContact C-CZ 3.4Å
295	L	96.8	Very high	94.4	Very high	34 Å²	34	55.1 Å²	55.1	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-46.2	172.6	-72.1	177.6	0	0	0	112.4	L264 F291 R292 R293 K298 E299 F310 E326	L264-L295 HydrophobicContact CD1-CB 4.26Å; L264-L295 HydrophobicContact CD1-CD1 4.46Å; F291-L295 HydrophobicContact CD1-CD1 3.97Å; F291-L295 HydrophobicContact CD1-CG 4.41Å; F291-L295 HydrophobicContact CE1-CD1 3.54Å; F291-L295 HydrophobicContact CE1-CG 4.08Å; F291-L295 HydrophobicContact CZ-CD1 4.28Å; F291-L295 HydrophobicContact CZ-CG 4.47Å; F291-L295 WeakPolarHBondContact O-CG 3.22Å; F291-L295 PolarHBondContact O-N 3.1Å; R292-L295 PolarHBondContact O-N 3.44Å; R293-L295 VanDerWaalsContact C-N 3.32Å; R293-L295 PolarHBondContact O-N 3.2Å; L295-K298 PolarHBondContact O-N 3.31Å; L295-E299 VanDerWaalsContact O-CG 3.3Å; L295-E299 WeakPolarHBondContact O-CG 3.23Å; L295-E299 PolarHBondContact O-N 3.02Å; L295-F310 HydrophobicContact CD2-CZ 4.1Å; L295-F310 HydrophobicContact CG-CE1 4.42Å; L295-F310 HydrophobicContact CG-CZ 4.31Å; L295-E326 HydrophobicContact CD2-CG 4.2Å
296	A	97.2	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-45.1	177.9	0	0	0	0	0	111.9	L264 A272 R292 R293 E299 L300	L264-A296 HydrophobicContact CD2-CB 3.73Å; A272-A296 HydrophobicContact CB-CB 4.19Å; R292-A296 PolarHBondContact O-N 3.28Å; R293-A296 WeakPolarHBondContact O-CB 3.39Å; R293-A296 PolarHBondContact O-N 3.15Å; R293-A296 VanDerWaalsContact O-N 3.09Å; A296-E299 PolarHBondContact O-N 3.49Å; A296-L300 WeakPolarHBondContact O-CG 3.34Å; A296-L300 PolarHBondContact O-N 2.99Å
297	L	96.5	Very high	94.8	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-39.3	179.4	-70.6	169.8	0	0	0	112	R293 G294 E299 L300 G301 R302 E305 A306 D309	R293-L297 HydrophobicContact CG-CD1 3.93Å; R293-L297 HydrophobicContact CG-CG 4.27Å; R293-L297 WeakPolarHBondContact O-CB 3.24Å; R293-L297 VanDerWaalsContact O-CG 3.27Å; R293-L297 WeakPolarHBondContact O-CG 3.18Å; R293-L297 PolarHBondContact O-N 2.99Å; G294-L297 PolarHBondContact O-N 3.35Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 2.99Å; L297-L300 CarbonylContact O-C 3.56Å; L297-L300 PolarHBondContact O-N 3.33Å; L297-G301 PolarHBondContact O-N 2.83Å; L297-R302 HydrophobicContact CB-CB 4.21Å; L297-R302 HydrophobicContact CD2-CB 3.96Å; L297-R302 HydrophobicContact CD2-CG 4.47Å; L297-R302 PolarHBondContact O-N 3.27Å; L297-E305 HydrophobicContact CD1-CB 3.8Å; L297-E305 HydrophobicContact CD2-CB 4.47Å; L297-A306 HydrophobicContact CB-CB 3.9Å; L297-D309 WeakPolarHBondContact CD1-OD2 3.26Å
298	K	94.7	Very high	94.8	Very high	42 Å²	42	47.7 Å²	47.7	18%	0.183	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-47.2	173.6	178	-174.3	73.4	169.7	0	111.3	G294 L295 L300 G301 A306 E326 L330	G294-K298 WeakPolarHBondContact O-CB 3.15Å; G294-K298 PolarHBondContact O-N 3.14Å; L295-K298 PolarHBondContact O-N 3.31Å; K298-L300 VanDerWaalsContact C-N 3.29Å; K298-L300 PolarHBondContact O-N 2.87Å; K298-G301 PolarHBondContact O-N 3.4Å; K298-G301 VanDerWaalsContact O-N 3.1Å; K298-A306 HydrophobicContact CB-CB 4.23Å; K298-E326 WeakPolarHBondContact CE-OE2 3.34Å; K298-E326 IonicContact NZ-OE1 3.51Å; K298-E326 IonicContact NZ-OE2 3.61Å; K298-E326 PolarHBondContact NZ-OE2 2.97Å; K298-L330 HydrophobicContact CD-CD2 4.28Å; K298-L330 HydrophobicContact CG-CD2 3.92Å
299	E	95	Very high	94.8	Very high	97 Å²	97	42 Å²	42	45%	0.453	20%	0.196	S	C	.	.	H	α-helix	trans	-70.5	-25.7	-179.6	-61.5	-71.7	134.1	0	0	112.7	Y269 L295 A296 L297 G301	Y269-E299 HydrophobicContact CD1-CB 3.55Å; Y269-E299 HydrophobicContact CD1-CG 3.93Å; Y269-E299 HydrophobicContact CD2-CB 3.8Å; Y269-E299 HydrophobicContact CE1-CB 3.45Å; Y269-E299 VanDerWaalsContact CE1-CB 3.45Å; Y269-E299 HydrophobicContact CE1-CG 3.47Å; Y269-E299 VanDerWaalsContact CE1-CG 3.47Å; Y269-E299 HydrophobicContact CE2-CB 3.68Å; Y269-E299 HydrophobicContact CE2-CG 4.41Å; Y269-E299 HydrophobicContact CG-CB 3.71Å; Y269-E299 VanDerWaalsContact CZ-CB 3.48Å; Y269-E299 PolarHBondContact OH-OE2 3.34Å; L295-E299 VanDerWaalsContact O-CG 3.3Å; L295-E299 WeakPolarHBondContact O-CG 3.23Å; L295-E299 PolarHBondContact O-N 3.02Å; A296-E299 PolarHBondContact O-N 3.49Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 2.99Å; E299-G301 VanDerWaalsContact C-N 3.27Å
300	L	95.1	Very high	94.8	Very high	62 Å²	62	42 Å²	42	33%	0.325	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.1	170.9	-69.9	167.8	0	0	0	113.7	E270 A296 L297 K298 R302	E270-L300 WeakPolarHBondContact OE2-CD1 3.28Å; A296-L300 WeakPolarHBondContact O-CG 3.34Å; A296-L300 PolarHBondContact O-N 2.99Å; L297-L300 CarbonylContact O-C 3.56Å; L297-L300 PolarHBondContact O-N 3.33Å; K298-L300 VanDerWaalsContact C-N 3.29Å; K298-L300 PolarHBondContact O-N 2.87Å; L300-R302 VanDerWaalsContact C-N 3.28Å; L300-R302 HydrophobicContact CB-CG 4.38Å; L300-R302 PolarHBondContact O-N 2.9Å
301	G	92.2	Very high	94.7	Very high	44 Å²	44	43.6 Å²	43.6	45%	0.454	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	7.1	-175.6	0	0	0	0	0	114.7	L297 K298 E299 H303	L297-G301 PolarHBondContact O-N 2.83Å; K298-G301 PolarHBondContact O-N 3.4Å; K298-G301 VanDerWaalsContact O-N 3.1Å; E299-G301 VanDerWaalsContact C-N 3.27Å; G301-H303 PolarHBondContact O-CD2 3.28Å; G301-H303 PolarHBondContact O-N 2.98Å
302	R	92.8	Very high	94.5	Very high	96 Å²	96	42.8 Å²	42.8	36%	0.362	20%	0.203	S	C	.	.			trans	-84.1	59.4	178.1	-65.6	170.8	68.1	176.8	2.2	110.4	L297 L300 R304 E305 A306	L297-R302 HydrophobicContact CB-CB 4.21Å; L297-R302 HydrophobicContact CD2-CB 3.96Å; L297-R302 HydrophobicContact CD2-CG 4.47Å; L297-R302 PolarHBondContact O-N 3.27Å; L300-R302 VanDerWaalsContact C-N 3.28Å; L300-R302 HydrophobicContact CB-CG 4.38Å; L300-R302 PolarHBondContact O-N 2.9Å; R302-R304 PolarHBondContact O-N 3.39Å; R302-E305 IonicContact CZ-OE1 3.55Å; R302-E305 VanDerWaalsContact CZ-OE1 3.24Å; R302-E305 IonicContact CZ-OE2 2.76Å; R302-E305 IonicContact NE-OE1 2.69Å; R302-E305 PolarHBondContact NE-OE1 3.36Å; R302-E305 IonicContact NE-OE2 2.84Å; R302-E305 IonicContact NH2-OE1 2.71Å; R302-E305 PolarHBondContact NH2-OE1 3.49Å; R302-E305 IonicContact NH2-OE2 3.66Å; R302-E305 PolarHBondContact NH2-OE2 3.41Å; R302-E305 PolarHBondContact O-N 3.45Å; R302-A306 PolarHBondContact O-N 3.48Å; R302-A306 VanDerWaalsContact O-N 3.07Å
303	H	92.3	Very high	94.4	Very high	66 Å²	66	41.4 Å²	41.4	31%	0.306	20%	0.198	S	C	.	.	H	α-helix	trans	-60.8	-36.9	-169.4	-60.8	-52.3	0	0	0	114.2	G301 A306 V307 L330 V336	G301-H303 PolarHBondContact O-CD2 3.28Å; G301-H303 PolarHBondContact O-N 2.98Å; H303-A306 PolarHBondContact O-N 3.32Å; H303-V307 WeakPolarHBondContact O-CG2 3.12Å; H303-V307 PolarHBondContact O-N 3.46Å; H303-L330 HydrophobicContact CB-CD2 4.15Å; H303-L330 VanDerWaalsContact ND1-CD2 3.3Å; H303-L330 WeakPolarHBondContact ND1-CD2 3.36Å; H303-V336 HydrophobicContact CB-CG2 4.23Å
304	R	90.6	Very high	94.2	Very high	147 Å²	147	40.4 Å²	40.4	56%	0.555	20%	0.197	S	C	*	.	H	α-helix	trans	-61	-49.3	178.5	-62	-168.2	178.8	167.8	1.4	111.7	R302 A306 V307 D308 V336	R302-R304 PolarHBondContact O-N 3.39Å; R304-A306 VanDerWaalsContact C-N 3.31Å; R304-A306 PolarHBondContact O-N 2.81Å; R304-V307 WeakPolarHBondContact O-CB 2.99Å; R304-V307 PolarHBondContact O-N 3.05Å; R304-D308 PolarHBondContact O-N 3.28Å; R304-D308 VanDerWaalsContact O-N 3.13Å; R304-V336 HydrophobicContact CB-CG1 4.06Å; R304-V336 HydrophobicContact CB-CG2 4.37Å; R304-V336 HydrophobicContact CG-CB 4.23Å; R304-V336 HydrophobicContact CG-CG1 3.84Å; R304-V336 HydrophobicContact CG-CG2 3.84Å
305	E	92.3	Very high	94	Very high	82 Å²	82	44.9 Å²	44.9	38%	0.383	22%	0.22	S	C	.	.	H	α-helix	trans	-68.7	-33	-179.7	-60.1	177.1	-103.9	0	0	111.7	L297 R302 D308 D309	L297-E305 HydrophobicContact CD1-CB 3.8Å; L297-E305 HydrophobicContact CD2-CB 4.47Å; R302-E305 IonicContact CZ-OE1 3.55Å; R302-E305 VanDerWaalsContact CZ-OE1 3.24Å; R302-E305 IonicContact CZ-OE2 2.76Å; R302-E305 IonicContact NE-OE1 2.69Å; R302-E305 PolarHBondContact NE-OE1 3.36Å; R302-E305 IonicContact NE-OE2 2.84Å; R302-E305 IonicContact NH2-OE1 2.71Å; R302-E305 PolarHBondContact NH2-OE1 3.49Å; R302-E305 IonicContact NH2-OE2 3.66Å; R302-E305 PolarHBondContact NH2-OE2 3.41Å; R302-E305 PolarHBondContact O-N 3.45Å; E305-D308 PolarHBondContact O-N 3.17Å; E305-D309 PolarHBondContact O-N 2.92Å; E305-D309 VanDerWaalsContact O-N 3.08Å
306	A	93.8	Very high	93.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-41.3	172	0	0	0	0	0	112.2	G294 L297 K298 R302 H303 R304 D309 F310 L330	G294-A306 WeakPolarHBondContact O-CB 3.15Å; L297-A306 HydrophobicContact CB-CB 3.9Å; K298-A306 HydrophobicContact CB-CB 4.23Å; R302-A306 PolarHBondContact O-N 3.48Å; R302-A306 VanDerWaalsContact O-N 3.07Å; H303-A306 PolarHBondContact O-N 3.32Å; R304-A306 VanDerWaalsContact C-N 3.31Å; R304-A306 PolarHBondContact O-N 2.81Å; A306-D309 PolarHBondContact O-N 3.32Å; A306-F310 HydrophobicContact CB-CE2 4.2Å; A306-F310 WeakPolarHBondContact O-CD2 3.35Å; A306-F310 WeakPolarHBondContact O-CG 3.22Å; A306-F310 PolarHBondContact O-N 2.94Å; A306-L330 HydrophobicContact CB-CD1 4Å
307	V	94	Very high	93.4	Very high	14 Å²	14	50.9 Å²	50.9	9%	0.085	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-46.1	174.9	167.7	0	0	0	0	110.8	H303 R304 D309 F310 Q311 L327 L330 V336	H303-V307 WeakPolarHBondContact O-CG2 3.12Å; H303-V307 PolarHBondContact O-N 3.46Å; R304-V307 WeakPolarHBondContact O-CB 2.99Å; R304-V307 PolarHBondContact O-N 3.05Å; V307-D309 VanDerWaalsContact C-N 3.3Å; V307-D309 PolarHBondContact O-N 2.81Å; V307-F310 PolarHBondContact O-N 3.41Å; V307-Q311 HydrophobicContact CG1-CG 4.33Å; V307-Q311 WeakPolarHBondContact O-CB 3.4Å; V307-Q311 WeakPolarHBondContact O-CG 3.26Å; V307-Q311 PolarHBondContact O-N 3.19Å; V307-L327 HydrophobicContact CB-CD2 4.11Å; V307-L327 HydrophobicContact CG1-CD2 3.83Å; V307-L327 HydrophobicContact CG2-CD2 4.04Å; V307-L330 HydrophobicContact CG2-CB 4.24Å; V307-L330 HydrophobicContact CG2-CD1 3.86Å; V307-V336 HydrophobicContact CB-CG1 4.26Å; V307-V336 HydrophobicContact CG1-CG1 4.33Å; V307-V336 HydrophobicContact CG2-CB 4.36Å; V307-V336 HydrophobicContact CG2-CG1 4.32Å; V307-V336 HydrophobicContact CG2-CG2 3.98Å
308	D	93.2	Very high	93.1	Very high	35 Å²	35	55.2 Å²	55.2	19%	0.187	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-39.7	178.8	-63.6	-20.3	0	0	0	111.6	R304 E305 S312	R304-D308 PolarHBondContact O-N 3.28Å; R304-D308 VanDerWaalsContact O-N 3.13Å; E305-D308 PolarHBondContact O-N 3.17Å; D308-S312 WeakPolarHBondContact O-CB 3.36Å; D308-S312 PolarHBondContact O-N 3.18Å; D308-S312 PolarHBondContact O-OG 3.18Å
309	D	94.5	Very high	93	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.027	31%	0.305	C	S	.	.	H	α-helix	trans	-67.4	-44	175.8	-86.1	-13.3	0	0	0	112.8	R293 G294 L297 E305 A306 V307 Q311 S312 V313	R293-D309 VanDerWaalsContact CB-OD2 3.26Å; R293-D309 WeakPolarHBondContact CB-OD2 3.3Å; R293-D309 VanDerWaalsContact CG-OD2 3.27Å; R293-D309 WeakPolarHBondContact CG-OD2 3.4Å; R293-D309 IonicContact CZ-OD1 2.69Å; R293-D309 IonicContact CZ-OD2 2.96Å; R293-D309 IonicContact NE-OD1 2.69Å; R293-D309 PolarHBondContact NE-OD1 2.8Å; R293-D309 IonicContact NE-OD2 2.72Å; R293-D309 PolarHBondContact NE-OD2 3.11Å; R293-D309 IonicContact NH2-OD1 3.45Å; R293-D309 PolarHBondContact NH2-OD1 3.38Å; R293-D309 IonicContact NH2-OD2 3.24Å; G294-D309 PolarHBondContact N-OD2 3.5Å; L297-D309 WeakPolarHBondContact CD1-OD2 3.26Å; E305-D309 PolarHBondContact O-N 2.92Å; E305-D309 VanDerWaalsContact O-N 3.08Å; A306-D309 PolarHBondContact O-N 3.32Å; V307-D309 VanDerWaalsContact C-N 3.3Å; V307-D309 PolarHBondContact O-N 2.81Å; D309-Q311 VanDerWaalsContact C-N 3.34Å; D309-S312 WeakPolarHBondContact O-CB 2.83Å; D309-S312 PolarHBondContact O-N 3.06Å; D309-V313 WeakPolarHBondContact O-CG2 3.45Å; D309-V313 PolarHBondContact O-N 3.12Å
310	F	95.3	Very high	92.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.3	-33.9	177.2	-66.3	-50.4	0	0	0	112.5	F291 G294 L295 A306 V307 S312 V313 L314 A323 E326 L327 L330	F291-F310 AromaticContact CD2-CD1 3.95Å; F291-F310 HydrophobicContact CD2-CD1 3.95Å; F291-F310 AromaticContact CD2-CE1 3.86Å; F291-F310 HydrophobicContact CD2-CE1 3.86Å; F291-F310 HydrophobicContact CE2-CD1 4.18Å; F291-F310 AromaticContact CE2-CE1 3.9Å; F291-F310 HydrophobicContact CE2-CE1 3.9Å; F291-F310 HydrophobicContact CG-CE1 4.48Å; G294-F310 VanDerWaalsContact C-CZ 3.4Å; L295-F310 HydrophobicContact CD2-CZ 4.1Å; L295-F310 HydrophobicContact CG-CE1 4.42Å; L295-F310 HydrophobicContact CG-CZ 4.31Å; A306-F310 HydrophobicContact CB-CE2 4.2Å; A306-F310 WeakPolarHBondContact O-CD2 3.35Å; A306-F310 WeakPolarHBondContact O-CG 3.22Å; A306-F310 PolarHBondContact O-N 2.94Å; V307-F310 PolarHBondContact O-N 3.41Å; F310-S312 VanDerWaalsContact C-N 3.33Å; F310-V313 WeakPolarHBondContact O-CB 3.47Å; F310-V313 PolarHBondContact O-N 3.37Å; F310-L314 PolarHBondContact O-N 2.94Å; F310-A323 HydrophobicContact CB-CB 4.45Å; F310-A323 HydrophobicContact CD1-CB 4.46Å; F310-E326 HydrophobicContact CD1-CB 4.22Å; F310-E326 HydrophobicContact CD2-CB 3.99Å; F310-E326 HydrophobicContact CE1-CB 3.93Å; F310-E326 HydrophobicContact CE1-CG 4.13Å; F310-E326 HydrophobicContact CE2-CB 3.69Å; F310-E326 HydrophobicContact CE2-CG 4.46Å; F310-E326 HydrophobicContact CG-CB 4.26Å; F310-E326 HydrophobicContact CZ-CB 3.65Å; F310-E326 HydrophobicContact CZ-CG 3.96Å; F310-L327 HydrophobicContact CB-CD1 4.06Å; F310-L327 HydrophobicContact CB-CD2 3.76Å; F310-L327 HydrophobicContact CB-CG 3.66Å; F310-L327 HydrophobicContact CD2-CD2 4.4Å; F310-L327 HydrophobicContact CG-CG 4.47Å; F310-L330 HydrophobicContact CD2-CD1 3.87Å; F310-L330 HydrophobicContact CE2-CD1 3.78Å
311	Q	94.3	Very high	92.8	Very high	62 Å²	62	60.6 Å²	60.6	29%	0.29	31%	0.307	S	S	.	.	H	α-helix	trans	-65.8	-37.8	170.3	-73.7	178.2	-10.2	0	0	111.8	V307 D309 V313 L314 L315 L327 C338	V307-Q311 HydrophobicContact CG1-CG 4.33Å; V307-Q311 WeakPolarHBondContact O-CB 3.4Å; V307-Q311 WeakPolarHBondContact O-CG 3.26Å; V307-Q311 PolarHBondContact O-N 3.19Å; D309-Q311 VanDerWaalsContact C-N 3.34Å; Q311-V313 VanDerWaalsContact C-N 3.27Å; Q311-V313 PolarHBondContact O-N 3.2Å; Q311-L314 PolarHBondContact O-N 2.77Å; Q311-L315 PolarHBondContact O-N 2.89Å; Q311-L327 HydrophobicContact CG-CD1 4.24Å; Q311-L327 HydrophobicContact CG-CD2 4.43Å; Q311-C338 VanDerWaalsContact CD-SG 3.6Å; Q311-C338 PolarHBondContact NE2-SG 3.41Å; Q311-C338 PolarHBondContact OE1-SG 3.36Å
312	S	93	Very high	92.8	Very high	14 Å²	14	63.2 Å²	63.2	10%	0.098	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-36.4	173.2	-58.3	0	0	0	0	111.6	D308 D309 F310 L315 L316	D308-S312 WeakPolarHBondContact O-CB 3.36Å; D308-S312 PolarHBondContact O-N 3.18Å; D308-S312 PolarHBondContact O-OG 3.18Å; D309-S312 WeakPolarHBondContact O-CB 2.83Å; D309-S312 PolarHBondContact O-N 3.06Å; F310-S312 VanDerWaalsContact C-N 3.33Å; S312-L315 PolarHBondContact O-N 3.45Å; S312-L316 WeakPolarHBondContact O-CG 3.43Å; S312-L316 PolarHBondContact O-N 2.91Å; S312-L316 VanDerWaalsContact O-N 3.14Å
313	V	94.1	Very high	92.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-48.2	171.7	172.6	0	0	0	0	111.1	V287 F291 D309 F310 Q311 L315 L316 E317 N320 A323	V287-V313 HydrophobicContact CG1-CB 4.31Å; V287-V313 HydrophobicContact CG1-CG1 3.71Å; V287-V313 HydrophobicContact CG1-CG2 4.22Å; F291-V313 HydrophobicContact CB-CG2 3.83Å; F291-V313 HydrophobicContact CD2-CG2 4.43Å; D309-V313 WeakPolarHBondContact O-CG2 3.45Å; D309-V313 PolarHBondContact O-N 3.12Å; F310-V313 WeakPolarHBondContact O-CB 3.47Å; F310-V313 PolarHBondContact O-N 3.37Å; Q311-V313 VanDerWaalsContact C-N 3.27Å; Q311-V313 PolarHBondContact O-N 3.2Å; V313-L315 VanDerWaalsContact C-N 3.26Å; V313-L315 PolarHBondContact O-N 2.87Å; V313-L316 PolarHBondContact O-N 2.76Å; V313-E317 PolarHBondContact O-N 3.37Å; V313-N320 HydrophobicContact CG1-CB 3.95Å; V313-A323 HydrophobicContact CB-CB 3.95Å; V313-A323 HydrophobicContact CG1-CB 3.6Å
314	L	93.2	Very high	92.9	Very high	43 Å²	43	58.3 Å²	58.3	23%	0.225	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-25.3	178	-68.5	178.1	0	0	0	113.3	F310 Q311 E317 P318 N320 A323 D324 L327	F310-L314 PolarHBondContact O-N 2.94Å; Q311-L314 PolarHBondContact O-N 2.77Å; L314-E317 CarbonylContact O-C 3.48Å; L314-P318 WeakPolarHBondContact O-CA 3.35Å; L314-N320 HydrophobicContact CD2-CB 4.29Å; L314-N320 WeakPolarHBondContact CD2-O 3.41Å; L314-A323 HydrophobicContact CD2-CB 3.99Å; L314-A323 HydrophobicContact CG-CB 3.99Å; L314-D324 HydrophobicContact CD2-CB 4.5Å; L314-L327 HydrophobicContact CD1-CD1 3.55Å
315	L	92.8	Very high	93	Very high	93 Å²	93	55.7 Å²	55.7	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-71	-37.9	172.9	-173.5	68.3	0	0	0	111.8	Q311 S312 V313 V341 L345	Q311-L315 PolarHBondContact O-N 2.89Å; S312-L315 PolarHBondContact O-N 3.45Å; V313-L315 VanDerWaalsContact C-N 3.26Å; V313-L315 PolarHBondContact O-N 2.87Å; L315-V341 HydrophobicContact CD2-CG1 4.42Å; L315-L345 HydrophobicContact CD2-CD1 4.22Å; L315-L345 HydrophobicContact CD2-CG 4.26Å
316	L	90.3	Very high	93.1	Very high	67 Å²	67	52.7 Å²	52.7	35%	0.351	27%	0.273	S	S	.	.	H	α-helix	trans	-83.5	-36.1	179.6	-65.9	171.9	0	0	0	112.7	V287 Y290 S312 V313	V287-L316 HydrophobicContact CG2-CB 3.69Å; V287-L316 HydrophobicContact CG2-CD1 3.95Å; V287-L316 HydrophobicContact CG2-CG 4.45Å; Y290-L316 HydrophobicContact CD2-CD1 4.03Å; Y290-L316 HydrophobicContact CE2-CD1 3.95Å; S312-L316 WeakPolarHBondContact O-CG 3.43Å; S312-L316 PolarHBondContact O-N 2.91Å; S312-L316 VanDerWaalsContact O-N 3.14Å; V313-L316 PolarHBondContact O-N 2.76Å
317	E	91.4	Very high	93.1	Very high	93 Å²	93	54 Å²	54	44%	0.435	28%	0.28	S	S	.	.			trans	-133.6	88.4	177.6	-75.2	177	-175	0	0	109.7	V287 V313 L314 D319 N320	V287-E317 HydrophobicContact CG1-CB 4.47Å; V287-E317 HydrophobicContact CG1-CG 4.16Å; V287-E317 HydrophobicContact CG2-CG 4.03Å; V313-E317 PolarHBondContact O-N 3.37Å; L314-E317 CarbonylContact O-C 3.48Å; E317-D319 PolarHBondContact O-N 3.2Å; E317-N320 HydrophobicContact CB-CB 3.98Å; E317-N320 WeakPolarHBondContact O-CB 3.26Å; E317-N320 PolarHBondContact O-N 3.49Å; E317-N320 VanDerWaalsContact O-N 3.09Å; E317-N320 PolarHBondContact OE2-ND2 3.07Å
318	P	91.2	Very high	92.9	Very high	98 Å²	98	58.6 Å²	58.6	64%	0.636	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.4	-177.4	-27.7	36.2	0	0	0	114.9	L314 N320	L314-P318 WeakPolarHBondContact O-CA 3.35Å; P318-N320 VanDerWaalsContact C-N 3.27Å; P318-N320 PolarHBondContact O-N 3.12Å
319	D	92	Very high	92.8	Very high	139 Å²	139	61.3 Å²	61.3	74%	0.743	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	12.4	-179.4	-60.2	-39.9	0	0	0	113.2	E317 H321	E317-D319 PolarHBondContact O-N 3.2Å; D319-H321 PolarHBondContact O-N 2.75Å
320	N	91.4	Very high	92.5	Very high	27 Å²	27	61.5 Å²	61.5	14%	0.144	31%	0.31	C	S	.	.			trans	-76.1	86.8	-178.1	-164.3	-49.6	0	0	0	111.9	V313 L314 E317 P318 L322 A323 D324	V313-N320 HydrophobicContact CG1-CB 3.95Å; L314-N320 HydrophobicContact CD2-CB 4.29Å; L314-N320 WeakPolarHBondContact CD2-O 3.41Å; E317-N320 HydrophobicContact CB-CB 3.98Å; E317-N320 WeakPolarHBondContact O-CB 3.26Å; E317-N320 PolarHBondContact O-N 3.49Å; E317-N320 VanDerWaalsContact O-N 3.09Å; E317-N320 PolarHBondContact OE2-ND2 3.07Å; P318-N320 VanDerWaalsContact C-N 3.27Å; P318-N320 PolarHBondContact O-N 3.12Å; N320-L322 PolarHBondContact O-N 3.11Å; N320-L322 VanDerWaalsContact O-N 3.14Å; N320-L322 WeakPolarHBondContact OD1-CB 3.45Å; N320-L322 PolarHBondContact OD1-N 2.97Å; N320-A323 HydrophobicContact CB-CB 4.42Å; N320-A323 PolarHBondContact O-N 2.97Å; N320-A323 VanDerWaalsContact O-N 3.16Å; N320-A323 PolarHBondContact OD1-N 3.09Å; N320-D324 PolarHBondContact O-N 2.72Å
321	H	93.8	Very high	91.7	Very high	147 Å²	147	65.6 Å²	65.6	68%	0.681	34%	0.339	S	S	*	.	H	α-helix	trans	-57.3	-28.6	-179.7	-59.1	-55	0	0	0	114.2	D319 E325	D319-H321 PolarHBondContact O-N 2.75Å; H321-E325 WeakPolarHBondContact O-CB 3.23Å; H321-E325 PolarHBondContact O-N 2.8Å
322	L	93.6	Very high	90.6	Very high	99 Å²	99	71.3 Å²	71.3	52%	0.518	36%	0.363	S	S	.	.	H	α-helix	trans	-68.7	-41.1	179.5	-63.2	174.2	0	0	0	111.3	F291 N320 E325 E326	F291-L322 HydrophobicContact CE2-CB 3.73Å; F291-L322 HydrophobicContact CZ-CB 3.72Å; F291-L322 HydrophobicContact CZ-CD1 4.46Å; N320-L322 PolarHBondContact O-N 3.11Å; N320-L322 VanDerWaalsContact O-N 3.14Å; N320-L322 WeakPolarHBondContact OD1-CB 3.45Å; N320-L322 PolarHBondContact OD1-N 2.97Å; L322-E325 PolarHBondContact O-N 3.26Å; L322-E326 WeakPolarHBondContact O-CG 3.24Å; L322-E326 PolarHBondContact O-N 3Å; L322-E326 VanDerWaalsContact O-N 3.08Å
323	A	92.7	Very high	89.2	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-66.4	-41.1	177.1	0	0	0	0	0	111.7	F291 F310 V313 L314 N320 E326 L327	F291-A323 HydrophobicContact CD2-CB 4.33Å; F291-A323 HydrophobicContact CE2-CB 4.39Å; F310-A323 HydrophobicContact CB-CB 4.45Å; F310-A323 HydrophobicContact CD1-CB 4.46Å; V313-A323 HydrophobicContact CB-CB 3.95Å; V313-A323 HydrophobicContact CG1-CB 3.6Å; L314-A323 HydrophobicContact CD2-CB 3.99Å; L314-A323 HydrophobicContact CG-CB 3.99Å; N320-A323 HydrophobicContact CB-CB 4.42Å; N320-A323 PolarHBondContact O-N 2.97Å; N320-A323 VanDerWaalsContact O-N 3.16Å; N320-A323 PolarHBondContact OD1-N 3.09Å; A323-E326 PolarHBondContact O-N 3.47Å; A323-L327 WeakPolarHBondContact O-CG 3.39Å; A323-L327 PolarHBondContact O-N 2.95Å
324	D	93.2	Very high	87.1	Confident	59 Å²	59	81.7 Å²	81.7	32%	0.316	42%	0.417	S	S	.	.	H	α-helix	trans	-62	-41.4	174.4	-178.7	41.8	0	0	0	112	L314 N320 E326 L327 K328	L314-D324 HydrophobicContact CD2-CB 4.5Å; N320-D324 PolarHBondContact O-N 2.72Å; D324-E326 PolarHBondContact O-N 2.99Å; D324-L327 PolarHBondContact O-N 3.39Å; D324-K328 WeakPolarHBondContact O-CB 3.36Å; D324-K328 WeakPolarHBondContact O-CG 3.42Å; D324-K328 PolarHBondContact O-N 2.99Å; D324-K328 WeakPolarHBondContact OD1-CE 3.35Å; D324-K328 IonicContact OD1-NZ 3.35Å; D324-K328 WeakPolarHBondContact OD2-CE 3.41Å; D324-K328 IonicContact OD2-NZ 3.7Å; D324-K328 PolarHBondContact OD2-NZ 3.39Å
325	E	94	Very high	85.2	Confident	93 Å²	93	85.8 Å²	85.8	44%	0.435	44%	0.438	S	S	.	.	H	α-helix	trans	-61.9	-42.9	175.2	-163.1	-164.8	145.3	0	0	112.2	H321 L322 K328 K329	H321-E325 WeakPolarHBondContact O-CB 3.23Å; H321-E325 PolarHBondContact O-N 2.8Å; L322-E325 PolarHBondContact O-N 3.26Å; E325-K328 PolarHBondContact O-N 2.72Å; E325-K329 WeakPolarHBondContact O-CG 3.49Å; E325-K329 PolarHBondContact O-N 3.23Å; E325-K329 WeakPolarHBondContact OE1-CE 3.45Å; E325-K329 IonicContact OE1-NZ 3.87Å; E325-K329 PolarHBondContact OE1-NZ 3.13Å
326	E	93.8	Very high	83.3	Confident	18 Å²	18	83.8 Å²	83.8	8%	0.084	43%	0.43	C	S	.	.	H	α-helix	trans	-67.5	-38.2	177.9	-69.6	-58.9	134.3	0	0	112.5	F291 L295 K298 F310 L322 A323 D324 K329 L330	F291-E326 HydrophobicContact CE2-CG 4.38Å; F291-E326 HydrophobicContact CZ-CG 4.38Å; L295-E326 HydrophobicContact CD2-CG 4.2Å; K298-E326 WeakPolarHBondContact CE-OE2 3.34Å; K298-E326 IonicContact NZ-OE1 3.51Å; K298-E326 IonicContact NZ-OE2 3.61Å; K298-E326 PolarHBondContact NZ-OE2 2.97Å; F310-E326 HydrophobicContact CD1-CB 4.22Å; F310-E326 HydrophobicContact CD2-CB 3.99Å; F310-E326 HydrophobicContact CE1-CB 3.93Å; F310-E326 HydrophobicContact CE1-CG 4.13Å; F310-E326 HydrophobicContact CE2-CB 3.69Å; F310-E326 HydrophobicContact CE2-CG 4.46Å; F310-E326 HydrophobicContact CG-CB 4.26Å; F310-E326 HydrophobicContact CZ-CB 3.65Å; F310-E326 HydrophobicContact CZ-CG 3.96Å; L322-E326 WeakPolarHBondContact O-CG 3.24Å; L322-E326 PolarHBondContact O-N 3Å; L322-E326 VanDerWaalsContact O-N 3.08Å; A323-E326 PolarHBondContact O-N 3.47Å; D324-E326 PolarHBondContact O-N 2.99Å; E326-K329 WeakPolarHBondContact O-CB 3.4Å; E326-K329 PolarHBondContact O-N 3.12Å; E326-K329 IonicContact OE1-NZ 3.58Å; E326-K329 PolarHBondContact OE1-NZ 3.38Å; E326-L330 WeakPolarHBondContact O-CG 3.23Å; E326-L330 PolarHBondContact O-N 2.93Å
327	L	92.6	Very high	81.2	Confident	27 Å²	27	87 Å²	87	14%	0.141	45%	0.452	C	S	.	.	H	α-helix	trans	-63.8	-39.3	172	-74.2	171.6	0	0	0	112.3	V307 F310 Q311 L314 A323 D324 K329 L330 S331	V307-L327 HydrophobicContact CB-CD2 4.11Å; V307-L327 HydrophobicContact CG1-CD2 3.83Å; V307-L327 HydrophobicContact CG2-CD2 4.04Å; F310-L327 HydrophobicContact CB-CD1 4.06Å; F310-L327 HydrophobicContact CB-CD2 3.76Å; F310-L327 HydrophobicContact CB-CG 3.66Å; F310-L327 HydrophobicContact CD2-CD2 4.4Å; F310-L327 HydrophobicContact CG-CG 4.47Å; Q311-L327 HydrophobicContact CG-CD1 4.24Å; Q311-L327 HydrophobicContact CG-CD2 4.43Å; L314-L327 HydrophobicContact CD1-CD1 3.55Å; A323-L327 WeakPolarHBondContact O-CG 3.39Å; A323-L327 PolarHBondContact O-N 2.95Å; D324-L327 PolarHBondContact O-N 3.39Å; L327-K329 VanDerWaalsContact C-N 3.31Å; L327-K329 PolarHBondContact O-N 3.42Å; L327-L330 PolarHBondContact O-N 3.28Å; L327-S331 WeakPolarHBondContact O-CB 3.16Å; L327-S331 PolarHBondContact O-N 3.29Å; L327-S331 PolarHBondContact O-OG 3.4Å
328	K	91	Very high	78.9	Confident	111 Å²	111	85.4 Å²	85.4	48%	0.483	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-33.1	173.4	-75.8	167.6	179.1	163.9	0	112.7	D324 E325 S331 K332	D324-K328 WeakPolarHBondContact O-CB 3.36Å; D324-K328 WeakPolarHBondContact O-CG 3.42Å; D324-K328 PolarHBondContact O-N 2.99Å; D324-K328 WeakPolarHBondContact OD1-CE 3.35Å; D324-K328 IonicContact OD1-NZ 3.35Å; D324-K328 WeakPolarHBondContact OD2-CE 3.41Å; D324-K328 IonicContact OD2-NZ 3.7Å; D324-K328 PolarHBondContact OD2-NZ 3.39Å; E325-K328 PolarHBondContact O-N 2.72Å; K328-S331 WeakPolarHBondContact CA-OG 3.48Å; K328-S331 PolarHBondContact O-OG 3.4Å; K328-S331 VanDerWaalsContact O-OG 3.07Å; K328-K332 WeakPolarHBondContact O-CG 3.31Å
329	K	90.6	Very high	76.8	Confident	92 Å²	92	84 Å²	84	40%	0.4	44%	0.443	S	S	.	.	H	α-helix	trans	-69.8	-43.1	173.8	-70.8	169.5	-170.2	162.6	0	111.5	E325 E326 L327	E325-K329 WeakPolarHBondContact O-CG 3.49Å; E325-K329 PolarHBondContact O-N 3.23Å; E325-K329 WeakPolarHBondContact OE1-CE 3.45Å; E325-K329 IonicContact OE1-NZ 3.87Å; E325-K329 PolarHBondContact OE1-NZ 3.13Å; E326-K329 WeakPolarHBondContact O-CB 3.4Å; E326-K329 PolarHBondContact O-N 3.12Å; E326-K329 IonicContact OE1-NZ 3.58Å; E326-K329 PolarHBondContact OE1-NZ 3.38Å; L327-K329 VanDerWaalsContact C-N 3.31Å; L327-K329 PolarHBondContact O-N 3.42Å
330	L	87.8	Confident	74.7	Confident	9 Å²	9	81.4 Å²	81.4	5%	0.047	44%	0.435	C	S	.	.	H	α-helix	trans	-71.9	-34.9	179.8	-75.2	174.3	0	0	0	113.7	K298 H303 A306 V307 F310 E326 L327 K332 S333	K298-L330 HydrophobicContact CD-CD2 4.28Å; K298-L330 HydrophobicContact CG-CD2 3.92Å; H303-L330 HydrophobicContact CB-CD2 4.15Å; H303-L330 VanDerWaalsContact ND1-CD2 3.3Å; H303-L330 WeakPolarHBondContact ND1-CD2 3.36Å; A306-L330 HydrophobicContact CB-CD1 4Å; V307-L330 HydrophobicContact CG2-CB 4.24Å; V307-L330 HydrophobicContact CG2-CD1 3.86Å; F310-L330 HydrophobicContact CD2-CD1 3.87Å; F310-L330 HydrophobicContact CE2-CD1 3.78Å; E326-L330 WeakPolarHBondContact O-CG 3.23Å; E326-L330 PolarHBondContact O-N 2.93Å; L327-L330 PolarHBondContact O-N 3.28Å; L330-K332 VanDerWaalsContact C-N 3.28Å; L330-K332 PolarHBondContact O-N 3.06Å; L330-S333 PolarHBondContact O-N 3.23Å; L330-S333 VanDerWaalsContact O-N 3.17Å; L330-S333 PolarHBondContact O-OG 3.28Å
331	S	78.7	Confident	72.4	Confident	87 Å²	87	83.6 Å²	83.6	61%	0.608	45%	0.45	S	S	*	.	H	α-helix	trans	-66.3	-31.1	176.7	51.1	0	0	0	0	112.8	L327 K328 S333	L327-S331 WeakPolarHBondContact O-CB 3.16Å; L327-S331 PolarHBondContact O-N 3.29Å; L327-S331 PolarHBondContact O-OG 3.4Å; K328-S331 WeakPolarHBondContact CA-OG 3.48Å; K328-S331 PolarHBondContact O-OG 3.4Å; K328-S331 VanDerWaalsContact O-OG 3.07Å; S331-S333 PolarHBondContact O-N 3.1Å
332	K	71.3	Confident	69.9	Low	181 Å²	181	84.4 Å²	84.4	79%	0.787	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.2	174.3	-71.9	176.2	-178.2	-177.9	0	113.6	K328 L330	K328-K332 WeakPolarHBondContact O-CG 3.31Å; L330-K332 VanDerWaalsContact C-N 3.28Å; L330-K332 PolarHBondContact O-N 3.06Å
333	S	63.3	Low	67.9	Low	63 Å²	63	81.8 Å²	81.8	44%	0.441	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	21.1	-177.6	69.2	0	0	0	0	114.4	L330 S331	L330-S333 PolarHBondContact O-N 3.23Å; L330-S333 VanDerWaalsContact O-N 3.17Å; L330-S333 PolarHBondContact O-OG 3.28Å; S331-S333 PolarHBondContact O-N 3.1Å
334	E	51.5	Low	65.7	Low	170 Å²	170	83.7 Å²	83.7	79%	0.794	45%	0.454	S	S	*	.			trans	37.9	81.3	171.2	-71.5	-174	162.1	0	0	115.9
335	L	52.8	Low	63.4	Low	128 Å²	128	86 Å²	86	67%	0.67	47%	0.466	S	S	*	.			trans	-178.3	47.9	159	-104.5	151.3	0	0	0	117.6
336	V	51.7	Low	61.1	Low	52 Å²	52	84.6 Å²	84.6	32%	0.315	47%	0.47	S	S	.	.			trans	-143.5	110.5	171.5	-171.7	0	0	0	0	114.1	H303 R304 V307	H303-V336 HydrophobicContact CB-CG2 4.23Å; R304-V336 HydrophobicContact CB-CG1 4.06Å; R304-V336 HydrophobicContact CB-CG2 4.37Å; R304-V336 HydrophobicContact CG-CB 4.23Å; R304-V336 HydrophobicContact CG-CG1 3.84Å; R304-V336 HydrophobicContact CG-CG2 3.84Å; V307-V336 HydrophobicContact CB-CG1 4.26Å; V307-V336 HydrophobicContact CG1-CG1 4.33Å; V307-V336 HydrophobicContact CG2-CB 4.36Å; V307-V336 HydrophobicContact CG2-CG1 4.32Å; V307-V336 HydrophobicContact CG2-CG2 3.98Å
337	V	47.2	Very low	59	Low	135 Å²	135	92.4 Å²	92.4	82%	0.818	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-86.1	122.7	157.1	178.5	0	0	0	0	106.8
338	C	42.5	Very low	56.5	Low	58 Å²	58	93.7 Å²	93.7	39%	0.392	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-81.1	142.1	-173.1	-165.9	0	0	0	0	111.6	Q311	Q311-C338 VanDerWaalsContact CD-SG 3.6Å; Q311-C338 PolarHBondContact NE2-SG 3.41Å; Q311-C338 PolarHBondContact OE1-SG 3.36Å
339	S	48.3	Very low	53.8	Low	69 Å²	69	97 Å²	97	48%	0.483	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-92.7	149.5	173.4	71.7	0	0	0	0	110.6	V341	S339-V341 PolarHBondContact O-N 3.21Å
340	S	46.3	Very low	51.1	Low	84 Å²	84	98.8 Å²	98.8	59%	0.587	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-61.9	131.2	-166.9	59	0	0	0	0	114.2	E342 S343	S340-E342 PolarHBondContact O-N 2.92Å; S340-E342 VanDerWaalsContact O-N 3.13Å; S340-S343 PolarHBondContact O-N 3.35Å; S340-S343 PolarHBondContact O-OG 3.21Å
341	V	43.9	Very low	48.4	Very low	73 Å²	73	104.2 Å²	104.2	44%	0.442	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.2	-25.2	-176	-172.5	0	0	0	0	114.5	L315 S339 S343 L344	L315-V341 HydrophobicContact CD2-CG1 4.42Å; S339-V341 PolarHBondContact O-N 3.21Å; V341-S343 VanDerWaalsContact C-N 3.27Å; V341-S343 PolarHBondContact O-N 2.64Å; V341-L344 PolarHBondContact O-N 3.38Å
342	E	42.1	Very low	46.2	Very low	164 Å²	164	108.4 Å²	108.4	77%	0.766	58%	0.575	S	S	*	*	H	α-helix	trans	-64.2	-28.5	-179.9	-73.1	173.4	160.3	0	0	113.6	S340 L344 A346	S340-E342 PolarHBondContact O-N 2.92Å; S340-E342 VanDerWaalsContact O-N 3.13Å; E342-L344 VanDerWaalsContact C-N 3.27Å; E342-L344 PolarHBondContact O-N 3.28Å; E342-A346 PolarHBondContact O-N 3.3Å
343	S	49.8	Very low	44.5	Very low	45 Å²	45	108 Å²	108	32%	0.315	57%	0.574	S	S	.	*	H	α-helix	trans	-69.2	-23.7	-179.6	64.2	0	0	0	0	113.6	S340 V341 R347	S340-S343 PolarHBondContact O-N 3.35Å; S340-S343 PolarHBondContact O-OG 3.21Å; V341-S343 VanDerWaalsContact C-N 3.27Å; V341-S343 PolarHBondContact O-N 2.64Å; S343-R347 WeakPolarHBondContact O-CG 3.38Å
344	L	47.7	Very low	43.1	Very low	40 Å²	40	113.7 Å²	113.7	21%	0.209	59%	0.593	C	S	.	*	H	α-helix	trans	-83.3	-37.6	-175.3	-69	168.8	0	0	0	112.4	V341 E342 A346 R347	V341-L344 PolarHBondContact O-N 3.38Å; E342-L344 VanDerWaalsContact C-N 3.27Å; E342-L344 PolarHBondContact O-N 3.28Å; L344-A346 VanDerWaalsContact C-N 3.29Å; L344-A346 PolarHBondContact O-N 2.99Å; L344-R347 PolarHBondContact O-N 3.14Å
345	L	43.8	Very low	42.1	Very low	107 Å²	107	112.1 Å²	112.1	56%	0.56	58%	0.584	S	S	*	*	H	α-helix	trans	-69.2	-26.8	172.6	-78.8	162.2	0	0	0	112.5	L315 R347 C348	L315-L345 HydrophobicContact CD2-CD1 4.22Å; L315-L345 HydrophobicContact CD2-CG 4.26Å; L345-R347 VanDerWaalsContact C-N 3.35Å; L345-C348 WeakPolarHBondContact O-CB 3.47Å; L345-C348 PolarHBondContact O-N 2.99Å
346	A	47.2	Very low	41	Very low	63 Å²	63	112 Å²	112	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-68.3	-33.1	173.9	0	0	0	0	0	112.5	E342 L344 C348 K349	E342-A346 PolarHBondContact O-N 3.3Å; L344-A346 VanDerWaalsContact C-N 3.29Å; L344-A346 PolarHBondContact O-N 2.99Å; A346-C348 PolarHBondContact O-N 3.34Å; A346-K349 PolarHBondContact O-N 2.91Å; A346-K349 VanDerWaalsContact O-N 3.14Å
347	R	48.7	Very low	39.8	Very low	183 Å²	183	118 Å²	118	69%	0.691	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-14.9	175	-66.2	175.1	-168.6	175	4	113.3	S343 L344 L345 K349	S343-R347 WeakPolarHBondContact O-CG 3.38Å; L344-R347 PolarHBondContact O-N 3.14Å; L345-R347 VanDerWaalsContact C-N 3.35Å; R347-K349 PolarHBondContact O-N 3.35Å
348	C	40.8	Very low	38.9	Very low	54 Å²	54	117 Å²	117	37%	0.365	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.9	-6.5	173.4	-63.6	0	0	0	0	113.4	L345 A346	L345-C348 WeakPolarHBondContact O-CB 3.47Å; L345-C348 PolarHBondContact O-N 2.99Å; A346-C348 PolarHBondContact O-N 3.34Å
349	K	34.4	Very low	38.3	Very low	181 Å²	181	120 Å²	120	79%	0.787	62%	0.616	S	S	*	*	S	Bend	trans	-91.8	101.7	167.3	-65	-173.2	-179.1	-178.5	0	107.8	A346 R347 D351	A346-K349 PolarHBondContact O-N 2.91Å; A346-K349 VanDerWaalsContact O-N 3.14Å; R347-K349 PolarHBondContact O-N 3.35Å; K349-D351 PolarHBondContact O-N 3.27Å; K349-D351 VanDerWaalsContact O-N 3.09Å
350	I	34.2	Very low	37.2	Very low	128 Å²	128	128 Å²	128	66%	0.656	64%	0.636	S	S	*	*			trans	-55.9	113.5	-179.5	-62.1	168.8	0	0	0	109.1	E352	I350-E352 HydrophobicContact CG2-CG 4.3Å; I350-E352 PolarHBondContact O-N 2.93Å
351	D	29.4	Very low	36.3	Very low	123 Å²	123	132.2 Å²	132.2	66%	0.658	65%	0.646	S	S	*	*			trans	-77.3	107.4	156.8	-137.9	-23.5	0	0	0	105.1	K349 K353	K349-D351 PolarHBondContact O-N 3.27Å; K349-D351 VanDerWaalsContact O-N 3.09Å; D351-K353 PolarHBondContact O-N 2.86Å
352	E	33	Very low	35.4	Very low	175 Å²	175	133.9 Å²	133.9	82%	0.818	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	4.3	-172.9	-66.9	-177.5	153.4	0	0	114.3	I350	I350-E352 HydrophobicContact CG2-CG 4.3Å; I350-E352 PolarHBondContact O-N 2.93Å
353	K	35.4	Very low	34.6	Very low	174 Å²	174	131.4 Å²	131.4	76%	0.757	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-3.7	-167.2	-67.6	-178.2	178.3	174.8	0	115.7	D351	D351-K353 PolarHBondContact O-N 2.86Å
354	E	33.7	Very low	33.5	Very low	182 Å²	182	132.5 Å²	132.5	85%	0.85	65%	0.651	S	S	*	*	S	Bend	trans	-102.4	4.9	-172.8	-132.7	173	-170.5	0	0	114.7
355	F	31.2	Very low	32.4	Very low	136 Å²	136	142.2 Å²	142.2	60%	0.596	69%	0.685	S	S	*	*			trans	-101.2	16.7	-175.6	-83.8	-84.9	0	0	0	115.4	E357	F355-E357 PolarHBondContact O-N 3.36Å
356	D	28.5	Very low	31.6	Very low	127 Å²	127	142.9 Å²	142.9	68%	0.679	68%	0.681	S	S	*	*			trans	-84.2	1.7	-175.2	-85.2	-20.8	0	0	0	115.4
357	E	27.6	Very low	30.6	Very low	177 Å²	177	145 Å²	145	83%	0.827	70%	0.699	S	S	*	*	S	Bend	trans	-103	123.8	-179.5	-139.2	171.8	-166.4	0	0	112.2	F355 L359	F355-E357 PolarHBondContact O-N 3.36Å; E357-L359 PolarHBondContact O-N 3.27Å
358	P	27.3	Very low	29.5	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	71%	0.706	S	S	*	*			trans	-64	125.2	-178.5	24	-31.8	0	0	0	110.7	R360	P358-R360 PolarHBondContact O-N 2.89Å
359	L	30.4	Very low	28.9	Very low	119 Å²	119	149.5 Å²	149.5	62%	0.623	73%	0.732	S	S	*	*			trans	-47.2	114.9	172.4	-70.4	167	0	0	0	109.6	E357 Q361	E357-L359 PolarHBondContact O-N 3.27Å; L359-Q361 PolarHBondContact O-N 3.45Å
360	R	26.2	Very low	28.5	Very low	239 Å²	239	145.2 Å²	145.2	90%	0.902	73%	0.73	S	S	*	*			trans	-54.7	116.1	177.7	-78.5	-176.3	-179.1	-148.5	1.1	109.9	P358 I362	P358-R360 PolarHBondContact O-N 2.89Å; R360-I362 PolarHBondContact O-N 3.46Å
361	Q	26.7	Very low	28.3	Very low	171 Å²	171	147.7 Å²	147.7	80%	0.799	74%	0.739	S	S	*	*			trans	-58.5	117.4	163.1	-81.6	179.9	-10.1	0	0	109.1	L359 P363	L359-Q361 PolarHBondContact O-N 3.45Å; Q361-P363 WeakPolarHBondContact O-CD 3.25Å
362	I	25.4	Very low	28.3	Very low	108 Å²	108	146.5 Å²	146.5	55%	0.554	74%	0.74	S	S	*	*			trans	-81.3	114.8	165.6	-59.6	171.8	0	0	0	106.6	R360 I364	R360-I362 PolarHBondContact O-N 3.46Å; I362-I364 PolarHBondContact O-N 2.94Å
363	P	25.5	Very low	28.1	Very low	113 Å²	113	143.9 Å²	143.9	73%	0.734	74%	0.736	S	S	*	*			trans	-70.8	116.7	-179.2	-10.3	25.3	0	0	0	109.9	Q361	Q361-P363 WeakPolarHBondContact O-CD 3.25Å
364	I	25.1	Very low	27.7	Very low	67 Å²	67	141.6 Å²	141.6	34%	0.344	73%	0.732	S	S	.	*			trans	-90.2	107.3	167.2	-58	176.2	0	0	0	107	I362 Y366	I362-I364 PolarHBondContact O-N 2.94Å; I364-Y366 HydrophobicContact CB-CE2 4.36Å; I364-Y366 HydrophobicContact CG2-CD2 4.4Å; I364-Y366 HydrophobicContact CG2-CE1 4.28Å; I364-Y366 HydrophobicContact CG2-CE2 4.05Å; I364-Y366 PolarHBondContact O-N 2.9Å
365	R	25.7	Very low	27.6	Very low	245 Å²	245	140.1 Å²	140.1	93%	0.925	73%	0.725	S	S	*	*			trans	-73.5	108.4	171.4	-66.8	-177.7	-179.1	-178.2	0.1	108.7
366	Y	27.6	Very low	27.4	Very low	121 Å²	121	140.9 Å²	140.9	48%	0.475	73%	0.734	S	S	.	*	P	Polyproline II helix	trans	-81.9	131.2	166.5	-67.4	-79.5	0	0	0	109.1	R244 I364 T368	R244-Y366 PolarHBondContact NE-OH 3.49Å; R244-Y366 PolarHBondContact NH2-OH 2.99Å; I364-Y366 HydrophobicContact CB-CE2 4.36Å; I364-Y366 HydrophobicContact CG2-CD2 4.4Å; I364-Y366 HydrophobicContact CG2-CE1 4.28Å; I364-Y366 HydrophobicContact CG2-CE2 4.05Å; I364-Y366 PolarHBondContact O-N 2.9Å; Y366-T368 PolarHBondContact O-N 3.35Å
367	A	24.7	Very low	27.3	Very low	108 Å²	108	137.9 Å²	137.9	89%	0.893	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-70	123.9	169.5	0	0	0	0	0	109.1
368	T	25.6	Very low	27.4	Very low	136 Å²	136	136.6 Å²	136.6	83%	0.834	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-91.6	131.1	175.7	48.5	0	0	0	0	110.4	Y366	Y366-T368 PolarHBondContact O-N 3.35Å
369	E	29.8	Very low	27.4	Very low	195 Å²	195	140.6 Å²	140.6	91%	0.911	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-102.5	135.5	159.6	-74.4	178.3	173.5	0	0	109.3
370	A	25.3	Very low	27.3	Very low	91 Å²	91	139 Å²	139	75%	0.752	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-70.3	154.8	178.6	0	0	0	0	0	111.4
371	E	30.6	Very low	27.4	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	74%	0.74	S	S	*	*				-176.3	120.4	102.3	-89.8	168.8	-172.9	0	0	108.4
372	S	28.6	Very low	27.4	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	74%	0.74	S	S	*	*				46.1	134	104.7	58.2	0	0	0	0	115.9
373	T	28.1	Very low	27.5	Very low	120 Å²	120	140.4 Å²	140.4	74%	0.736	75%	0.748	S	S	*	*			cis	-176.1	147.9	18.3	13.1	0	0	0	0	110.3
374	N	28.4	Very low	27.6	Very low	126 Å²	126	142.9 Å²	142.9	67%	0.674	75%	0.749	S	S	*	*			trans	39.6	129.9	141.3	-59.3	-18.3	0	0	0	123.5
375	H	30.2	Very low	27.7	Very low	152 Å²	152	145.7 Å²	145.7	70%	0.704	77%	0.77	S	S	*	*				172.1	129.4	91.8	-93.2	-67.5	0	0	0	114
376	I	27.7	Very low	27.8	Very low	152 Å²	152	138.9 Å²	138.9	78%	0.779	76%	0.76	S	S	*	*				37	135.8	127.4	-48.8	174.9	0	0	0	118.1
377	G	27.4	Very low	27.8	Very low	64 Å²	64	142.9 Å²	142.9	66%	0.66	78%	0.779	S	S	*	*			cis	161.8	173	9	0	0	0	0	0	111.2
378	N	29.9	Very low	27.8	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	77%	0.773	S	S	*	*			trans	82.9	99.1	157.6	-66.2	-20.5	0	0	0	123.4
379	K	27.5	Very low	27.9	Very low	199 Å²	199	145.3 Å²	145.3	87%	0.865	78%	0.779	S	S	*	*				42.8	120.1	109.8	-86.3	-173.9	-177.7	178.6	0	121.2
380	A	27.4	Very low	27.6	Very low	84 Å²	84	142.7 Å²	142.7	69%	0.694	78%	0.776	S	S	*	*				128.9	143.2	101.2	0	0	0	0	0	119.3
381	K	28.5	Very low	27.8	Very low	205 Å²	205	143 Å²	143	89%	0.891	78%	0.779	S	S	*	*			trans	80	150.1	153.5	-70.8	172.5	-177.7	179.7	0	118.7
382	R	25.4	Very low	27.6	Very low	210 Å²	210	143.5 Å²	143.5	79%	0.792	78%	0.781	S	S	*	*			cis	176.2	161.5	-24.6	-155	-179	-173.2	176.2	3	106.3
383	N	28.5	Very low	27.3	Very low	134 Å²	134	147.4 Å²	147.4	72%	0.717	79%	0.789	S	S	*	*			trans	101	109.6	161.1	-54.8	-7	0	0	0	115
384	E	26.6	Very low	27.4	Very low	165 Å²	165	147.9 Å²	147.9	77%	0.771	79%	0.794	S	S	*	*				70.8	117.9	60.8	-77.7	-173	-173.1	0	0	116
385	T	27.7	Very low	27.3	Very low	126 Å²	126	146.7 Å²	146.7	77%	0.773	80%	0.795	S	S	*	*				155.8	116.8	122	39.8	0	0	0	0	112.2
386	S	27.5	Very low	27.3	Very low	102 Å²	102	147.7 Å²	147.7	71%	0.713	81%	0.805	S	S	*	*				81.9	142.7	109	85.1	0	0	0	0	114.4
387	K	28.7	Very low	27.5	Very low	204 Å²	204	148.1 Å²	148.1	89%	0.887	81%	0.808	S	S	*	*			cis	-167.8	163.7	22.1	-121.3	163.4	-175.4	-175.2	0	108.6
388	A	24.4	Very low	27.5	Very low	92 Å²	92	150.5 Å²	150.5	76%	0.76	82%	0.815	S	S	*	*			trans	-89.3	160.6	-178.4	0	0	0	0	0	114
389	E	27.7	Very low	27.6	Very low	203 Å²	203	146.4 Å²	146.4	95%	0.949	81%	0.809	S	S	*	*			trans	-158.8	145.1	153	-117.8	165.1	-161.2	0	0	113
390	V	23.7	Very low	27.8	Very low	140 Å²	140	143.1 Å²	143.1	85%	0.848	81%	0.807	S	S	*	*			trans	-112	140.7	-171.9	168.7	0	0	0	0	108.5
391	A	29.5	Very low	28	Very low	99 Å²	99	143.5 Å²	143.5	82%	0.818	81%	0.811	S	S	*	*			trans	-157	147.1	162.2	0	0	0	0	0	113
392	Q	25.7	Very low	28.7	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	81%	0.808	S	S	*	*			trans	-77.2	157.2	-165.5	-67.7	149.3	-43.4	0	0	115.4
393	E	23.7	Very low	30	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	81%	0.808	S	S	*	*			trans	-93.7	151.3	165.9	-70.2	-174.7	171.1	0	0	112.1
394	P	30.1	Very low	31.4	Very low	130 Å²	130	135.1 Å²	135.1	84%	0.844	79%	0.787	S	S	*	*			trans	-124.2	162.9	153.5	30.8	-13.8	0	0	0	114.3
395	S	26.1	Very low	33.5	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	78%	0.779	S	S	*	*			trans	-84.9	152	-157.8	51.4	0	0	0	0	118.9
396	L	30.7	Very low	35.9	Very low	173 Å²	173	129.5 Å²	129.5	91%	0.906	76%	0.762	S	S	*	*			trans	46.3	120	138.1	-66.4	159.7	0	0	0	121.1
397	D	29.9	Very low	38.5	Very low	160 Å²	160	124.7 Å²	124.7	86%	0.856	73%	0.728	S	S	*	*				-164.3	148.8	119.3	-149.7	-6.7	0	0	0	112.6
398	S	28.6	Very low	40.7	Very low	114 Å²	114	118.6 Å²	118.6	80%	0.797	71%	0.711	S	S	*	*			trans	-90.1	133.8	-167.5	46	0	0	0	0	115.2
399	G	31.1	Very low	43.3	Very low	65 Å²	65	117.8 Å²	117.8	67%	0.67	69%	0.694	S	S	*	*			trans	-142.4	162.1	170.2	0	0	0	0	0	111.8
400	P	31.5	Very low	45.9	Very low	129 Å²	129	110.7 Å²	110.7	84%	0.838	66%	0.662	S	S	*	*			trans	-68.2	138.3	-168.1	29.1	-33.5	0	0	0	112	E402	P400-E402 PolarHBondContact O-N 3.27Å
401	A	33.4	Very low	48.7	Very low	92 Å²	92	113.8 Å²	113.8	76%	0.76	66%	0.658	S	S	*	*			trans	-52.5	97.2	-167.9	0	0	0	0	0	114.4
402	E	42.2	Very low	51.2	Low	178 Å²	178	112.8 Å²	112.8	83%	0.832	64%	0.637	S	S	*	*			trans	-60.7	132.3	161.7	-88.3	-179.3	151.8	0	0	109.4	P400 C404	P400-E402 PolarHBondContact O-N 3.27Å; E402-C404 PolarHBondContact O-N 3.28Å
403	I	52.3	Low	54.1	Low	154 Å²	154	103.8 Å²	103.8	79%	0.79	60%	0.595	S	S	*	*			trans	-61.1	103.7	174.8	-59.6	169.6	0	0	0	107.6
404	C	57.5	Low	56.9	Low	42 Å²	42	97.4 Å²	97.4	28%	0.284	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-60.8	128.2	-179.9	-63.5	0	0	0	0	110.2	E402 Y430	E402-C404 PolarHBondContact O-N 3.28Å; C404-Y430 HydrophobicContact CB-CD2 3.51Å; C404-Y430 HydrophobicContact CB-CE2 3.95Å
405	P	70.8	Confident	59.5	Low	94 Å²	94	95.6 Å²	95.6	61%	0.61	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-65.1	147.8	-178.7	26	-33.4	0	0	0	111.3
406	I	78.4	Confident	62.3	Low	79 Å²	79	91.7 Å²	91.7	41%	0.405	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-62.3	124.3	177.1	-60.2	171.5	0	0	0	108.8	S408	I406-S408 PolarHBondContact O-N 2.98Å
407	P	81.8	Confident	65	Low	1 Å²	1	83.6 Å²	83.6	1%	0.006	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-62.9	130.8	-174	23.3	-33.3	0	0	0	111.4	Q412 M413 Y430 I434 R438 L442	P407-Q412 HydrophobicContact CB-CB 4.32Å; P407-Q412 HydrophobicContact CB-CG 4.4Å; P407-M413 HydrophobicContact CB-CB 3.79Å; P407-M413 HydrophobicContact CB-CG 4.49Å; P407-M413 HydrophobicContact CG-CB 4.03Å; P407-M413 HydrophobicContact CG-CG 4.2Å; P407-Y430 WeakPolarHBondContact CB-OH 3.48Å; P407-Y430 WeakPolarHBondContact CD-OH 3.35Å; P407-Y430 VanDerWaalsContact CG-OH 3.25Å; P407-Y430 WeakPolarHBondContact CG-OH 3.45Å; P407-I434 HydrophobicContact CG-CD1 3.84Å; P407-I434 HydrophobicContact CG-CG1 4.22Å; P407-R438 PolarHBondContact O-NE 3.37Å; P407-R438 VanDerWaalsContact O-NE 3.11Å; P407-R438 PolarHBondContact O-NH2 3.47Å; P407-L442 HydrophobicContact CG-CD1 4.09Å
408	S	75.8	Confident	67.6	Low	75 Å²	75	82.6 Å²	82.6	52%	0.524	47%	0.469	S	S	.	.	S	Bend	trans	-71.8	-34.5	-179.6	55.5	0	0	0	0	112.2	I406 R438	I406-S408 PolarHBondContact O-N 2.98Å; S408-R438 VanDerWaalsContact C-NH2 3.32Å; S408-R438 PolarHBondContact O-NH2 2.98Å
409	N	79.3	Confident	70.4	Confident	75 Å²	75	81.6 Å²	81.6	40%	0.401	46%	0.462	S	S	.	.	S	Bend	trans	-149.5	172.6	-178.8	61.7	62	0	0	0	110.4	R411 Q412 M413	N409-R411 VanDerWaalsContact C-N 3.27Å; N409-R411 PolarHBondContact O-N 3.36Å; N409-R411 WeakPolarHBondContact OD1-CA 3.35Å; N409-R411 WeakPolarHBondContact OD1-CB 3.38Å; N409-R411 PolarHBondContact OD1-N 2.93Å; N409-Q412 PolarHBondContact O-N 3.5Å; N409-Q412 PolarHBondContact OD1-N 2.94Å; N409-M413 PolarHBondContact O-N 3.42Å; N409-M413 VanDerWaalsContact O-N 3.14Å
410	I	81.6	Confident	73	Confident	55 Å²	55	79.5 Å²	79.5	28%	0.282	44%	0.435	S	S	.	.	H	α-helix	trans	-61.4	-32.7	-178.6	-164	176.6	0	0	0	113.4	M413 L414 L442 F446	I410-M413 HydrophobicContact CG1-CE 4.15Å; I410-M413 WeakPolarHBondContact O-CB 3.32Å; I410-M413 PolarHBondContact O-N 2.98Å; I410-L414 HydrophobicContact CG1-CD1 4.29Å; I410-L414 HydrophobicContact CG1-CG 4.38Å; I410-L414 VanDerWaalsContact O-CG 3.27Å; I410-L414 WeakPolarHBondContact O-CG 3.23Å; I410-L414 PolarHBondContact O-N 2.87Å; I410-L442 HydrophobicContact CB-CD2 4.33Å; I410-L442 WeakPolarHBondContact CD1-O 3.35Å; I410-F446 HydrophobicContact CD1-CB 3.3Å; I410-F446 HydrophobicContact CD1-CD1 4.09Å; I410-F446 HydrophobicContact CD1-CD2 4.27Å; I410-F446 HydrophobicContact CD1-CG 3.62Å
411	R	82.2	Confident	75.4	Confident	204 Å²	204	77.4 Å²	77.4	77%	0.77	41%	0.411	S	S	*	.	H	α-helix	trans	-67.1	-43.4	-179.6	-62.9	-179	-178.9	164.6	-0.3	110.9	N409 M413 L414 V415	N409-R411 VanDerWaalsContact C-N 3.27Å; N409-R411 PolarHBondContact O-N 3.36Å; N409-R411 WeakPolarHBondContact OD1-CA 3.35Å; N409-R411 WeakPolarHBondContact OD1-CB 3.38Å; N409-R411 PolarHBondContact OD1-N 2.93Å; R411-M413 VanDerWaalsContact C-N 3.32Å; R411-L414 PolarHBondContact O-N 3.38Å; R411-V415 WeakPolarHBondContact O-CG2 3.21Å; R411-V415 PolarHBondContact O-N 3.03Å; R411-V415 VanDerWaalsContact O-N 3.08Å
412	Q	83.2	Confident	77.7	Confident	79 Å²	79	80.5 Å²	80.5	37%	0.369	42%	0.415	S	S	.	.	H	α-helix	trans	-60.4	-46	173.9	-171.6	61.8	44.6	0	0	110.5	P407 N409 L414 V415 D416	P407-Q412 HydrophobicContact CB-CB 4.32Å; P407-Q412 HydrophobicContact CB-CG 4.4Å; N409-Q412 PolarHBondContact O-N 3.5Å; N409-Q412 PolarHBondContact OD1-N 2.94Å; Q412-L414 VanDerWaalsContact C-N 3.28Å; Q412-L414 PolarHBondContact O-N 3.3Å; Q412-V415 PolarHBondContact O-N 3.02Å; Q412-V415 VanDerWaalsContact O-N 3.11Å; Q412-D416 PolarHBondContact NE2-OD1 3.32Å; Q412-D416 PolarHBondContact O-N 2.7Å
413	M	85.5	Confident	79.7	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-55.9	-43	176.8	-171.8	-171.1	80.1	0	0	111.9	P407 N409 I410 R411 D416 W417 Y430 L442 F443	P407-M413 HydrophobicContact CB-CB 3.79Å; P407-M413 HydrophobicContact CB-CG 4.49Å; P407-M413 HydrophobicContact CG-CB 4.03Å; P407-M413 HydrophobicContact CG-CG 4.2Å; N409-M413 PolarHBondContact O-N 3.42Å; N409-M413 VanDerWaalsContact O-N 3.14Å; I410-M413 HydrophobicContact CG1-CE 4.15Å; I410-M413 WeakPolarHBondContact O-CB 3.32Å; I410-M413 PolarHBondContact O-N 2.98Å; R411-M413 VanDerWaalsContact C-N 3.32Å; M413-D416 PolarHBondContact O-N 3.12Å; M413-W417 HydrophobicContact CG-CE3 4.39Å; M413-W417 WeakPolarHBondContact O-CB 3.35Å; M413-W417 PolarHBondContact O-N 3.09Å; M413-Y430 WeakPolarHBondContact CA-OH 3.36Å; M413-Y430 HydrophobicContact CG-CE1 4.22Å; M413-L442 HydrophobicContact CE-CB 4.49Å; M413-L442 HydrophobicContact SD-CB 3.89Å; M413-L442 HydrophobicContact SD-CD1 3.88Å; M413-L442 HydrophobicContact SD-CG 4.34Å; M413-F443 HydrophobicContact CE-CE1 4.01Å; M413-F443 HydrophobicContact CE-CE2 3.91Å; M413-F443 HydrophobicContact CE-CZ 3.59Å; M413-F443 HydrophobicContact SD-CE2 3.77Å; M413-F443 HydrophobicContact SD-CZ 3.94Å
414	L	83.4	Confident	81.2	Confident	45 Å²	45	69.2 Å²	69.2	24%	0.236	36%	0.364	C	S	.	.	H	α-helix	trans	-70.7	-29.9	179.8	-66.8	174	0	0	0	113.7	I410 R411 Q412 K418 F446	I410-L414 HydrophobicContact CG1-CD1 4.29Å; I410-L414 HydrophobicContact CG1-CG 4.38Å; I410-L414 VanDerWaalsContact O-CG 3.27Å; I410-L414 WeakPolarHBondContact O-CG 3.23Å; I410-L414 PolarHBondContact O-N 2.87Å; R411-L414 PolarHBondContact O-N 3.38Å; Q412-L414 VanDerWaalsContact C-N 3.28Å; Q412-L414 PolarHBondContact O-N 3.3Å; L414-K418 WeakPolarHBondContact O-CB 3.43Å; L414-K418 WeakPolarHBondContact O-CG 3.43Å; L414-K418 PolarHBondContact O-N 2.81Å; L414-K418 VanDerWaalsContact O-N 3.08Å; L414-F446 HydrophobicContact CD1-CD2 4.37Å; L414-F446 HydrophobicContact CD1-CE1 4.48Å; L414-F446 HydrophobicContact CD1-CE2 3.92Å; L414-F446 HydrophobicContact CD1-CZ 4Å; L414-F446 HydrophobicContact CD2-CD1 4.09Å; L414-F446 HydrophobicContact CD2-CE1 3.29Å; L414-F446 HydrophobicContact CD2-CE2 4.05Å; L414-F446 HydrophobicContact CD2-CZ 3.26Å; L414-F446 HydrophobicContact CG-CE1 4.41Å; L414-F446 HydrophobicContact CG-CZ 4.26Å
415	V	85	Confident	82.4	Confident	92 Å²	92	70 Å²	70	56%	0.558	36%	0.363	S	S	*	.	H	α-helix	trans	-68.4	-50.8	173	172.5	0	0	0	0	109.6	R411 Q412 W417 K418 S419	R411-V415 WeakPolarHBondContact O-CG2 3.21Å; R411-V415 PolarHBondContact O-N 3.03Å; R411-V415 VanDerWaalsContact O-N 3.08Å; Q412-V415 PolarHBondContact O-N 3.02Å; Q412-V415 VanDerWaalsContact O-N 3.11Å; V415-W417 VanDerWaalsContact C-N 3.27Å; V415-W417 PolarHBondContact O-N 3.49Å; V415-K418 PolarHBondContact O-N 2.79Å; V415-S419 PolarHBondContact O-N 3.27Å
416	D	85.1	Confident	83.2	Confident	20 Å²	20	67.2 Å²	67.2	11%	0.107	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-38.2	176.3	-55.5	-16.2	0	0	0	110.8	Q412 M413 K418 S419 L420 Y430	Q412-D416 PolarHBondContact NE2-OD1 3.32Å; Q412-D416 PolarHBondContact O-N 2.7Å; M413-D416 PolarHBondContact O-N 3.12Å; D416-K418 PolarHBondContact O-N 2.78Å; D416-S419 PolarHBondContact O-N 2.82Å; D416-S419 PolarHBondContact O-OG 2.82Å; D416-L420 WeakPolarHBondContact O-CB 3.3Å; D416-L420 WeakPolarHBondContact O-CG 3.29Å; D416-L420 PolarHBondContact O-N 3.24Å; D416-Y430 HydrophobicContact CB-CE1 4.15Å; D416-Y430 HydrophobicContact CB-CE2 3.95Å; D416-Y430 VanDerWaalsContact CB-OH 3.32Å; D416-Y430 WeakPolarHBondContact CB-OH 3.34Å; D416-Y430 PolarHBondContact OD2-OH 3.05Å
417	W	87.1	Confident	83.6	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-44	177.9	-163.4	-69.8	0	0	0	112.4	M413 V415 S419 L420 R421 L427 I431 F443 E451 D454 L455	M413-W417 HydrophobicContact CG-CE3 4.39Å; M413-W417 WeakPolarHBondContact O-CB 3.35Å; M413-W417 PolarHBondContact O-N 3.09Å; V415-W417 VanDerWaalsContact C-N 3.27Å; V415-W417 PolarHBondContact O-N 3.49Å; W417-S419 VanDerWaalsContact C-N 3.32Å; W417-S419 PolarHBondContact O-N 3.24Å; W417-L420 PolarHBondContact O-N 3.47Å; W417-R421 WeakPolarHBondContact O-CB 3.38Å; W417-R421 PolarHBondContact O-N 3.26Å; W417-L427 HydrophobicContact CD2-CD1 3.9Å; W417-L427 HydrophobicContact CE3-CD1 4.1Å; W417-L427 HydrophobicContact CG-CD1 4.28Å; W417-L427 HydrophobicContact CZ2-CD1 4.43Å; W417-L427 HydrophobicContact CZ2-CD2 4.44Å; W417-L427 HydrophobicContact CZ3-CD1 4.44Å; W417-I431 HydrophobicContact CH2-CD1 3.78Å; W417-I431 HydrophobicContact CH2-CG1 4.2Å; W417-I431 HydrophobicContact CZ2-CD1 4.47Å; W417-I431 HydrophobicContact CZ3-CD1 3.93Å; W417-I431 HydrophobicContact CZ3-CG1 3.86Å; W417-F443 HydrophobicContact CH2-CE1 4.28Å; W417-F443 AromaticContact CH2-CZ 3.77Å; W417-F443 HydrophobicContact CH2-CZ 3.77Å; W417-F443 HydrophobicContact CZ3-CE1 4.4Å; W417-F443 HydrophobicContact CZ3-CE2 4.49Å; W417-F443 AromaticContact CZ3-CZ 3.58Å; W417-F443 HydrophobicContact CZ3-CZ 3.58Å; W417-E451 HydrophobicContact CZ2-CB 3.92Å; W417-E451 HydrophobicContact CZ2-CG 4.37Å; W417-D454 HydrophobicContact CZ2-CB 4.16Å; W417-D454 PolarHBondContact NE1-OD2 3.32Å; W417-L455 HydrophobicContact CH2-CD1 3.76Å; W417-L455 HydrophobicContact CH2-CD2 3.75Å; W417-L455 HydrophobicContact CH2-CG 3.45Å; W417-L455 VanDerWaalsContact CH2-CG 3.45Å; W417-L455 HydrophobicContact CZ2-CD1 4.2Å; W417-L455 HydrophobicContact CZ2-CD2 4.44Å; W417-L455 HydrophobicContact CZ2-CG 3.75Å
418	K	84.2	Confident	83.9	Confident	140 Å²	140	63.5 Å²	63.5	61%	0.609	33%	0.327	S	S	*	.	H	α-helix	trans	-64.2	-38.8	179.4	-80.4	-177.9	177.7	-168.4	0	111.4	L414 V415 D416	L414-K418 WeakPolarHBondContact O-CB 3.43Å; L414-K418 WeakPolarHBondContact O-CG 3.43Å; L414-K418 PolarHBondContact O-N 2.81Å; L414-K418 VanDerWaalsContact O-N 3.08Å; V415-K418 PolarHBondContact O-N 2.79Å; D416-K418 PolarHBondContact O-N 2.78Å
419	S	86	Confident	84.4	Confident	92 Å²	92	63.4 Å²	63.4	64%	0.643	32%	0.32	S	S	*	.	H	α-helix	trans	-70	-32.9	176	61.4	0	0	0	0	112.5	V415 D416 W417	V415-S419 PolarHBondContact O-N 3.27Å; D416-S419 PolarHBondContact O-N 2.82Å; D416-S419 PolarHBondContact O-OG 2.82Å; W417-S419 VanDerWaalsContact C-N 3.32Å; W417-S419 PolarHBondContact O-N 3.24Å
420	L	86.9	Confident	84.8	Confident	21 Å²	21	60.1 Å²	60.1	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-89.1	-10.5	-178.6	-64.5	173.6	0	0	0	114.6	D416 W417 N422 D423 L427 Y430	D416-L420 WeakPolarHBondContact O-CB 3.3Å; D416-L420 WeakPolarHBondContact O-CG 3.29Å; D416-L420 PolarHBondContact O-N 3.24Å; W417-L420 PolarHBondContact O-N 3.47Å; L420-N422 PolarHBondContact O-N 2.82Å; L420-N422 VanDerWaalsContact O-N 3.08Å; L420-D423 CarbonylContact O-C 3.5Å; L420-D423 PolarHBondContact O-N 2.84Å; L420-L427 HydrophobicContact CB-CB 4.22Å; L420-L427 HydrophobicContact CB-CD1 4.09Å; L420-Y430 HydrophobicContact CD1-CD1 3.98Å; L420-Y430 HydrophobicContact CD1-CD2 4.05Å; L420-Y430 HydrophobicContact CD1-CG 3.6Å
421	R	82.1	Confident	85.1	Confident	85 Å²	85	57.5 Å²	57.5	32%	0.321	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.2	-172	-176.7	177.5	-68.2	-157.9	-4.6	114.1	W417 E451 D454	W417-R421 WeakPolarHBondContact O-CB 3.38Å; W417-R421 PolarHBondContact O-N 3.26Å; R421-E451 IonicContact NH2-OE1 3.31Å; R421-D454 IonicContact CZ-OD2 3.12Å; R421-D454 IonicContact NE-OD2 3.77Å; R421-D454 PolarHBondContact NE-OD2 3.28Å; R421-D454 VanDerWaalsContact NE-OD2 3.12Å; R421-D454 IonicContact NH2-OD2 3.8Å
422	N	81	Confident	85.4	Confident	158 Å²	158	49.4 Å²	49.4	85%	0.845	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.2	-177	-65	-24.2	0	0	0	113.5	L420	L420-N422 PolarHBondContact O-N 2.82Å; L420-N422 VanDerWaalsContact O-N 3.08Å
423	D	85.1	Confident	85.6	Confident	69 Å²	69	49.1 Å²	49.1	37%	0.369	26%	0.262	S	S	.	.			trans	-116.1	92.8	175.4	-179.5	8.3	0	0	0	110.5	L420 Q425 S426 L427	L420-D423 CarbonylContact O-C 3.5Å; L420-D423 PolarHBondContact O-N 2.84Å; D423-Q425 PolarHBondContact O-N 3.47Å; D423-Q425 VanDerWaalsContact O-N 3.11Å; D423-Q425 PolarHBondContact OD1-N 3.18Å; D423-Q425 VanDerWaalsContact OD1-N 3.09Å; D423-S426 PolarHBondContact O-N 3.43Å; D423-S426 PolarHBondContact OD1-N 2.93Å; D423-S426 WeakPolarHBondContact OD2-CB 3.45Å; D423-S426 PolarHBondContact OD2-OG 3.45Å; D423-L427 WeakPolarHBondContact O-CB 3.32Å; D423-L427 PolarHBondContact O-N 3.27Å
424	S	82.6	Confident	85.7	Confident	26 Å²	26	49.2 Å²	49.2	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-55	-30.8	-179.7	-46.1	0	0	0	0	113.1	C428	S424-C428 VanDerWaalsContact O-CB 3.32Å; S424-C428 WeakPolarHBondContact O-CB 3.29Å; S424-C428 PolarHBondContact O-N 3.45Å
425	Q	84	Confident	85.9	Confident	59 Å²	59	49.9 Å²	49.9	28%	0.276	27%	0.269	S	S	.	.	H	α-helix	trans	-74.7	-47.2	-178.8	-171.3	63.1	46.5	0	0	111.4	D423 L427 C428 N429	D423-Q425 PolarHBondContact O-N 3.47Å; D423-Q425 VanDerWaalsContact O-N 3.11Å; D423-Q425 PolarHBondContact OD1-N 3.18Å; D423-Q425 VanDerWaalsContact OD1-N 3.09Å; Q425-L427 VanDerWaalsContact C-N 3.33Å; Q425-C428 PolarHBondContact O-N 3.09Å; Q425-N429 PolarHBondContact O-N 2.86Å; Q425-N429 PolarHBondContact O-ND2 3.12Å
426	S	86.7	Confident	85.9	Confident	34 Å²	34	48.9 Å²	48.9	24%	0.238	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-37.1	177.2	-64.6	0	0	0	0	111.5	D423 N429 Y430	D423-S426 PolarHBondContact O-N 3.43Å; D423-S426 PolarHBondContact OD1-N 2.93Å; D423-S426 WeakPolarHBondContact OD2-CB 3.45Å; D423-S426 PolarHBondContact OD2-OG 3.45Å; S426-N429 PolarHBondContact O-N 3.07Å; S426-Y430 WeakPolarHBondContact O-CB 3.38Å; S426-Y430 PolarHBondContact O-N 2.63Å
427	L	87.8	Confident	85.8	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-46.2	172.2	-176.5	60.1	0	0	0	111.5	W417 L420 D423 Q425 N429 Y430 I431 D454 A458	W417-L427 HydrophobicContact CD2-CD1 3.9Å; W417-L427 HydrophobicContact CE3-CD1 4.1Å; W417-L427 HydrophobicContact CG-CD1 4.28Å; W417-L427 HydrophobicContact CZ2-CD1 4.43Å; W417-L427 HydrophobicContact CZ2-CD2 4.44Å; W417-L427 HydrophobicContact CZ3-CD1 4.44Å; L420-L427 HydrophobicContact CB-CB 4.22Å; L420-L427 HydrophobicContact CB-CD1 4.09Å; D423-L427 WeakPolarHBondContact O-CB 3.32Å; D423-L427 PolarHBondContact O-N 3.27Å; Q425-L427 VanDerWaalsContact C-N 3.33Å; L427-N429 PolarHBondContact O-N 3.38Å; L427-Y430 PolarHBondContact O-N 3.04Å; L427-I431 HydrophobicContact CD1-CD1 3.9Å; L427-I431 HydrophobicContact CD1-CG1 4.36Å; L427-I431 HydrophobicContact CG-CD1 3.77Å; L427-I431 WeakPolarHBondContact O-CD1 3Å; L427-I431 VanDerWaalsContact O-CG1 3.32Å; L427-I431 WeakPolarHBondContact O-CG1 3.49Å; L427-I431 PolarHBondContact O-N 2.9Å; L427-D454 HydrophobicContact CD2-CB 3.95Å; L427-A458 HydrophobicContact CB-CB 4.38Å; L427-A458 HydrophobicContact CD2-CB 4.18Å; L427-A458 HydrophobicContact CG-CB 4.21Å
428	C	86.8	Confident	85.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-49.1	175.9	-172.5	0	0	0	0	111.4	S424 Q425 Y430 I431 L432 A458	S424-C428 VanDerWaalsContact O-CB 3.32Å; S424-C428 WeakPolarHBondContact O-CB 3.29Å; S424-C428 PolarHBondContact O-N 3.45Å; Q425-C428 PolarHBondContact O-N 3.09Å; C428-Y430 VanDerWaalsContact C-N 3.33Å; C428-Y430 PolarHBondContact O-N 3.28Å; C428-I431 PolarHBondContact O-N 3.08Å; C428-L432 WeakPolarHBondContact O-CB 3.43Å; C428-L432 VanDerWaalsContact O-CG 3.26Å; C428-L432 WeakPolarHBondContact O-CG 3.34Å; C428-L432 PolarHBondContact O-N 3.15Å; C428-A458 HydrophobicContact CB-CB 4.05Å; C428-A458 WeakPolarHBondContact CB-O 3.4Å
429	N	86.3	Confident	85.8	Confident	73 Å²	73	50 Å²	50	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-40.6	179.4	-70.2	-22.3	0	0	0	111.8	Q425 S426 L427 L432 N433	Q425-N429 PolarHBondContact O-N 2.86Å; Q425-N429 PolarHBondContact O-ND2 3.12Å; S426-N429 PolarHBondContact O-N 3.07Å; L427-N429 PolarHBondContact O-N 3.38Å; N429-L432 PolarHBondContact O-N 3.42Å; N429-N433 WeakPolarHBondContact O-CB 3.41Å; N429-N433 PolarHBondContact O-N 2.47Å
430	Y	88.9	Confident	85.5	Confident	7 Å²	7	49.8 Å²	49.8	3%	0.027	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-49.4	175.2	174.6	-105.2	0	0	0	112	C404 P407 M413 D416 L420 S426 L427 C428 L432 N433 I434	C404-Y430 HydrophobicContact CB-CD2 3.51Å; C404-Y430 HydrophobicContact CB-CE2 3.95Å; P407-Y430 WeakPolarHBondContact CB-OH 3.48Å; P407-Y430 WeakPolarHBondContact CD-OH 3.35Å; P407-Y430 VanDerWaalsContact CG-OH 3.25Å; P407-Y430 WeakPolarHBondContact CG-OH 3.45Å; M413-Y430 WeakPolarHBondContact CA-OH 3.36Å; M413-Y430 HydrophobicContact CG-CE1 4.22Å; D416-Y430 HydrophobicContact CB-CE1 4.15Å; D416-Y430 HydrophobicContact CB-CE2 3.95Å; D416-Y430 VanDerWaalsContact CB-OH 3.32Å; D416-Y430 WeakPolarHBondContact CB-OH 3.34Å; D416-Y430 PolarHBondContact OD2-OH 3.05Å; L420-Y430 HydrophobicContact CD1-CD1 3.98Å; L420-Y430 HydrophobicContact CD1-CD2 4.05Å; L420-Y430 HydrophobicContact CD1-CG 3.6Å; S426-Y430 WeakPolarHBondContact O-CB 3.38Å; S426-Y430 PolarHBondContact O-N 2.63Å; L427-Y430 PolarHBondContact O-N 3.04Å; C428-Y430 VanDerWaalsContact C-N 3.33Å; C428-Y430 PolarHBondContact O-N 3.28Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.83Å; Y430-N433 WeakPolarHBondContact O-CB 3.45Å; Y430-N433 PolarHBondContact O-N 3.21Å; Y430-N433 VanDerWaalsContact O-N 3.13Å; Y430-I434 HydrophobicContact CE1-CD1 4.15Å; Y430-I434 PolarHBondContact O-N 3.47Å
431	I	87.5	Confident	85.3	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-38.9	178.7	-68.9	156.5	0	0	0	111.5	W417 L427 C428 N433 I434 F439 L455 F459 R475	W417-I431 HydrophobicContact CH2-CD1 3.78Å; W417-I431 HydrophobicContact CH2-CG1 4.2Å; W417-I431 HydrophobicContact CZ2-CD1 4.47Å; W417-I431 HydrophobicContact CZ3-CD1 3.93Å; W417-I431 HydrophobicContact CZ3-CG1 3.86Å; L427-I431 HydrophobicContact CD1-CD1 3.9Å; L427-I431 HydrophobicContact CD1-CG1 4.36Å; L427-I431 HydrophobicContact CG-CD1 3.77Å; L427-I431 WeakPolarHBondContact O-CD1 3Å; L427-I431 VanDerWaalsContact O-CG1 3.32Å; L427-I431 WeakPolarHBondContact O-CG1 3.49Å; L427-I431 PolarHBondContact O-N 2.9Å; C428-I431 PolarHBondContact O-N 3.08Å; I431-N433 VanDerWaalsContact C-N 3.26Å; I431-N433 PolarHBondContact O-N 3.16Å; I431-I434 PolarHBondContact O-N 2.65Å; I431-F439 HydrophobicContact CG2-CD2 4.33Å; I431-F439 HydrophobicContact CG2-CE2 3.72Å; I431-L455 HydrophobicContact CD1-CD2 3.44Å; I431-L455 VanDerWaalsContact CD1-CD2 3.44Å; I431-L455 HydrophobicContact CD1-CG 4.35Å; I431-L455 HydrophobicContact CG1-CD2 4.29Å; I431-L455 HydrophobicContact CG2-CD2 4.21Å; I431-F459 HydrophobicContact CB-CE1 4.42Å; I431-F459 HydrophobicContact CD1-CE1 4.42Å; I431-F459 HydrophobicContact CG2-CE1 3.82Å; I431-F459 HydrophobicContact CG2-CZ 3.81Å; I431-R475 PolarHBondContact O-NE 3.47Å
432	L	87.6	Confident	85.4	Confident	34 Å²	34	53.7 Å²	53.7	18%	0.178	28%	0.281	C	S	.	.	H	α-helix	trans	-68.9	-24	176.4	-69.8	-177.6	0	0	0	112.7	C428 N429 Y430 I434 K468 H471 R475	C428-L432 WeakPolarHBondContact O-CB 3.43Å; C428-L432 VanDerWaalsContact O-CG 3.26Å; C428-L432 WeakPolarHBondContact O-CG 3.34Å; C428-L432 PolarHBondContact O-N 3.15Å; N429-L432 PolarHBondContact O-N 3.42Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.83Å; L432-I434 VanDerWaalsContact C-N 3.32Å; L432-K468 HydrophobicContact CD1-CB 4.1Å; L432-K468 HydrophobicContact CD1-CD 4.33Å; L432-K468 HydrophobicContact CD1-CG 4.07Å; L432-H471 HydrophobicContact CD2-CB 3.72Å; L432-R475 PolarHBondContact O-NH2 3.3Å
433	N	88.3	Confident	85.4	Confident	73 Å²	73	46.2 Å²	46.2	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-76.5	-17	174.1	-160.3	21.8	0	0	0	113.2	N429 Y430 I431 P435	N429-N433 WeakPolarHBondContact O-CB 3.41Å; N429-N433 PolarHBondContact O-N 2.47Å; Y430-N433 WeakPolarHBondContact O-CB 3.45Å; Y430-N433 PolarHBondContact O-N 3.21Å; Y430-N433 VanDerWaalsContact O-N 3.13Å; I431-N433 VanDerWaalsContact C-N 3.26Å; I431-N433 PolarHBondContact O-N 3.16Å; N433-P435 WeakPolarHBondContact O-CD 3.47Å
434	I	87.7	Confident	84.7	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.238	C	C	.	.	S	Bend	trans	-77.3	125.2	176.9	-55.5	176.2	0	0	0	109.4	P407 Y430 I431 L432 R438 F439 L442 R475	P407-I434 HydrophobicContact CG-CD1 3.84Å; P407-I434 HydrophobicContact CG-CG1 4.22Å; Y430-I434 HydrophobicContact CE1-CD1 4.15Å; Y430-I434 PolarHBondContact O-N 3.47Å; I431-I434 PolarHBondContact O-N 2.65Å; L432-I434 VanDerWaalsContact C-N 3.32Å; I434-R438 HydrophobicContact CG2-CB 4.29Å; I434-F439 HydrophobicContact CG2-CB 3.96Å; I434-L442 HydrophobicContact CD1-CD1 4.38Å; I434-L442 HydrophobicContact CG2-CD1 4.08Å; I434-R475 PolarHBondContact O-NH2 3.14Å
435	P	86.7	Confident	84.1	Confident	59 Å²	59	49.4 Å²	49.4	38%	0.383	26%	0.256	S	S	.	.			trans	-60.2	138.1	173.9	-23.6	33.8	0	0	0	111.9	N433 S437 R438 F439	N433-P435 WeakPolarHBondContact O-CD 3.47Å; P435-S437 VanDerWaalsContact C-N 3.26Å; P435-S437 PolarHBondContact O-N 2.94Å; P435-S437 VanDerWaalsContact O-N 3.16Å; P435-R438 WeakPolarHBondContact O-CA 3.25Å; P435-R438 WeakPolarHBondContact O-CB 3.35Å; P435-R438 PolarHBondContact O-N 3.41Å; P435-F439 PolarHBondContact O-N 2.68Å
436	L	85.7	Confident	83.6	Confident	70 Å²	70	48.7 Å²	48.7	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-55.4	-38.6	-173.6	-169.7	67.1	0	0	0	113.4	R438 F439 Q440 E474 R475 A478	L436-R438 VanDerWaalsContact C-N 3.25Å; L436-R438 PolarHBondContact O-N 3.13Å; L436-F439 PolarHBondContact O-N 3.4Å; L436-Q440 PolarHBondContact O-N 3.28Å; L436-E474 HydrophobicContact CD1-CB 4.37Å; L436-E474 HydrophobicContact CD2-CB 4.34Å; L436-R475 HydrophobicContact CD1-CG 3.98Å; L436-A478 HydrophobicContact CD1-CB 3.96Å
437	S	82.4	Confident	83.2	Confident	91 Å²	91	47.1 Å²	47.1	64%	0.636	24%	0.241	S	C	*	.	H	α-helix	trans	-63.2	-29.3	177.5	60.1	0	0	0	0	113.7	P435	P435-S437 VanDerWaalsContact C-N 3.26Å; P435-S437 PolarHBondContact O-N 2.94Å; P435-S437 VanDerWaalsContact O-N 3.16Å
438	R	84.6	Confident	82.8	Confident	94 Å²	94	49.1 Å²	49.1	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-88.1	-38.2	176.6	-163.8	178.5	-165.5	154.4	11.5	111.2	P407 S408 I434 P435 L436 Q440 K441 L442	P407-R438 PolarHBondContact O-NE 3.37Å; P407-R438 VanDerWaalsContact O-NE 3.11Å; P407-R438 PolarHBondContact O-NH2 3.47Å; S408-R438 VanDerWaalsContact C-NH2 3.32Å; S408-R438 PolarHBondContact O-NH2 2.98Å; I434-R438 HydrophobicContact CG2-CB 4.29Å; P435-R438 WeakPolarHBondContact O-CA 3.25Å; P435-R438 WeakPolarHBondContact O-CB 3.35Å; P435-R438 PolarHBondContact O-N 3.41Å; L436-R438 VanDerWaalsContact C-N 3.25Å; L436-R438 PolarHBondContact O-N 3.13Å; R438-Q440 VanDerWaalsContact C-N 3.35Å; R438-Q440 PolarHBondContact O-N 3.26Å; R438-K441 PolarHBondContact O-N 3.43Å; R438-K441 VanDerWaalsContact O-N 3.16Å; R438-L442 HydrophobicContact CG-CD1 4.19Å; R438-L442 HydrophobicContact CG-CG 4.41Å; R438-L442 WeakPolarHBondContact O-CG 3.45Å; R438-L442 PolarHBondContact O-N 3.05Å
439	F	86.2	Confident	82.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-53.3	-50.3	177.7	-179.5	-94	0	0	0	111.4	I431 I434 P435 L436 K441 L442 F443 R475 A478 L479	I431-F439 HydrophobicContact CG2-CD2 4.33Å; I431-F439 HydrophobicContact CG2-CE2 3.72Å; I434-F439 HydrophobicContact CG2-CB 3.96Å; P435-F439 PolarHBondContact O-N 2.68Å; L436-F439 PolarHBondContact O-N 3.4Å; F439-K441 VanDerWaalsContact C-N 3.32Å; F439-K441 PolarHBondContact O-N 3.38Å; F439-L442 PolarHBondContact O-N 2.88Å; F439-L442 VanDerWaalsContact O-N 3.12Å; F439-F443 HydrophobicContact CD1-CD2 4.46Å; F439-F443 HydrophobicContact CD2-CD2 4.07Å; F439-F443 AromaticContact CD2-CE2 3.81Å; F439-F443 HydrophobicContact CD2-CE2 3.81Å; F439-F443 HydrophobicContact CE1-CD2 4.22Å; F439-F443 AromaticContact CE2-CD2 3.8Å; F439-F443 HydrophobicContact CE2-CD2 3.8Å; F439-F443 AromaticContact CE2-CE2 3.36Å; F439-F443 HydrophobicContact CE2-CE2 3.36Å; F439-F443 HydrophobicContact CE2-CZ 4.23Å; F439-F443 HydrophobicContact CG-CD2 4.39Å; F439-F443 AromaticContact CZ-CD2 3.88Å; F439-F443 HydrophobicContact CZ-CD2 3.88Å; F439-F443 AromaticContact CZ-CE2 3.79Å; F439-F443 HydrophobicContact CZ-CE2 3.79Å; F439-F443 WeakPolarHBondContact O-CD2 3.21Å; F439-F443 PolarHBondContact O-N 2.91Å; F439-R475 HydrophobicContact CD1-CB 4.31Å; F439-R475 HydrophobicContact CD1-CG 4.2Å; F439-R475 HydrophobicContact CE1-CB 3.8Å; F439-R475 HydrophobicContact CE1-CG 4.15Å; F439-R475 WeakPolarHBondContact CE1-O 3.32Å; F439-R475 HydrophobicContact CE2-CG 4.5Å; F439-R475 HydrophobicContact CG-CG 4.39Å; F439-R475 HydrophobicContact CZ-CB 3.93Å; F439-R475 HydrophobicContact CZ-CG 4.31Å; F439-A478 HydrophobicContact CD1-CB 4.17Å; F439-A478 HydrophobicContact CE1-CB 4.38Å; F439-L479 HydrophobicContact CE1-CD1 4.47Å; F439-L479 HydrophobicContact CE1-CD2 3.65Å; F439-L479 HydrophobicContact CE1-CG 3.72Å; F439-L479 HydrophobicContact CZ-CD1 4.18Å; F439-L479 HydrophobicContact CZ-CD2 3.73Å; F439-L479 HydrophobicContact CZ-CG 3.89Å
440	Q	81.3	Confident	82.2	Confident	89 Å²	89	49.8 Å²	49.8	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-58.2	-43.1	178.5	-167.1	-177.9	12.3	0	0	112.5	L436 R438 L442 F443 D444 T481	L436-Q440 PolarHBondContact O-N 3.28Å; R438-Q440 VanDerWaalsContact C-N 3.35Å; R438-Q440 PolarHBondContact O-N 3.26Å; Q440-L442 VanDerWaalsContact C-N 3.32Å; Q440-L442 PolarHBondContact O-N 3.29Å; Q440-F443 PolarHBondContact O-N 3.19Å; Q440-D444 PolarHBondContact O-N 3.48Å; Q440-D444 VanDerWaalsContact O-N 3.12Å; Q440-T481 PolarHBondContact NE2-OG1 2.54Å
441	K	81.8	Confident	82	Confident	173 Å²	173	50.4 Å²	50.4	75%	0.752	27%	0.267	S	S	*	.	H	α-helix	trans	-66.1	-31.7	178.6	-68.9	-177.4	180	-179.8	0	113.2	R438 F439	R438-K441 PolarHBondContact O-N 3.43Å; R438-K441 VanDerWaalsContact O-N 3.16Å; F439-K441 VanDerWaalsContact C-N 3.32Å; F439-K441 PolarHBondContact O-N 3.38Å
442	L	84.1	Confident	81.8	Confident	14 Å²	14	50.7 Å²	50.7	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-70.6	-33.9	178.3	-69.6	167.9	0	0	0	111.7	P407 I410 M413 I434 R438 F439 Q440	P407-L442 HydrophobicContact CG-CD1 4.09Å; I410-L442 HydrophobicContact CB-CD2 4.33Å; I410-L442 WeakPolarHBondContact CD1-O 3.35Å; M413-L442 HydrophobicContact CE-CB 4.49Å; M413-L442 HydrophobicContact SD-CB 3.89Å; M413-L442 HydrophobicContact SD-CD1 3.88Å; M413-L442 HydrophobicContact SD-CG 4.34Å; I434-L442 HydrophobicContact CD1-CD1 4.38Å; I434-L442 HydrophobicContact CG2-CD1 4.08Å; R438-L442 HydrophobicContact CG-CD1 4.19Å; R438-L442 HydrophobicContact CG-CG 4.41Å; R438-L442 WeakPolarHBondContact O-CG 3.45Å; R438-L442 PolarHBondContact O-N 3.05Å; F439-L442 PolarHBondContact O-N 2.88Å; F439-L442 VanDerWaalsContact O-N 3.12Å; Q440-L442 VanDerWaalsContact C-N 3.32Å; Q440-L442 PolarHBondContact O-N 3.29Å
443	F	80.6	Confident	81.7	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-98.2	-5.1	-176.5	-75	-85.4	0	0	0	115.3	M413 W417 F439 Q440 N445 F446 L447 L455 L479 S482	M413-F443 HydrophobicContact CE-CE1 4.01Å; M413-F443 HydrophobicContact CE-CE2 3.91Å; M413-F443 HydrophobicContact CE-CZ 3.59Å; M413-F443 HydrophobicContact SD-CE2 3.77Å; M413-F443 HydrophobicContact SD-CZ 3.94Å; W417-F443 HydrophobicContact CH2-CE1 4.28Å; W417-F443 AromaticContact CH2-CZ 3.77Å; W417-F443 HydrophobicContact CH2-CZ 3.77Å; W417-F443 HydrophobicContact CZ3-CE1 4.4Å; W417-F443 HydrophobicContact CZ3-CE2 4.49Å; W417-F443 AromaticContact CZ3-CZ 3.58Å; W417-F443 HydrophobicContact CZ3-CZ 3.58Å; F439-F443 HydrophobicContact CD1-CD2 4.46Å; F439-F443 HydrophobicContact CD2-CD2 4.07Å; F439-F443 AromaticContact CD2-CE2 3.81Å; F439-F443 HydrophobicContact CD2-CE2 3.81Å; F439-F443 HydrophobicContact CE1-CD2 4.22Å; F439-F443 AromaticContact CE2-CD2 3.8Å; F439-F443 HydrophobicContact CE2-CD2 3.8Å; F439-F443 AromaticContact CE2-CE2 3.36Å; F439-F443 HydrophobicContact CE2-CE2 3.36Å; F439-F443 HydrophobicContact CE2-CZ 4.23Å; F439-F443 HydrophobicContact CG-CD2 4.39Å; F439-F443 AromaticContact CZ-CD2 3.88Å; F439-F443 HydrophobicContact CZ-CD2 3.88Å; F439-F443 AromaticContact CZ-CE2 3.79Å; F439-F443 HydrophobicContact CZ-CE2 3.79Å; F439-F443 WeakPolarHBondContact O-CD2 3.21Å; F439-F443 PolarHBondContact O-N 2.91Å; Q440-F443 PolarHBondContact O-N 3.19Å; F443-N445 PolarHBondContact O-N 3.06Å; F443-N445 VanDerWaalsContact O-N 3.13Å; F443-F446 CarbonylContact C-O 3.59Å; F443-F446 WeakPolarHBondContact CA-O 3.36Å; F443-F446 WeakPolarHBondContact CD1-O 3.47Å; F443-F446 CarbonylContact O-C 3.55Å; F443-F446 PolarHBondContact O-N 2.85Å; F443-F446 VanDerWaalsContact O-N 3.16Å; F443-L447 HydrophobicContact CD1-CB 4.48Å; F443-L447 HydrophobicContact CD1-CD1 3.91Å; F443-L447 HydrophobicContact CE1-CD1 4.12Å; F443-L455 HydrophobicContact CE1-CD1 4.22Å; F443-L455 HydrophobicContact CZ-CD1 4.37Å; F443-L479 HydrophobicContact CB-CD2 3.63Å; F443-L479 HydrophobicContact CD1-CD2 3.82Å; F443-L479 HydrophobicContact CD2-CD2 3.93Å; F443-L479 HydrophobicContact CE1-CD2 4.5Å; F443-L479 HydrophobicContact CG-CD2 3.51Å; F443-S482 PolarHBondContact O-OG 3.23Å
444	D	72.2	Confident	81.6	Confident	56 Å²	56	48.3 Å²	48.3	30%	0.299	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-35.9	-172.2	-164	25.5	0	0	0	113.6	Q440 S482 R483	Q440-D444 PolarHBondContact O-N 3.48Å; Q440-D444 VanDerWaalsContact O-N 3.12Å; D444-S482 PolarHBondContact O-OG 3.31Å; D444-R483 PolarHBondContact O-N 3.44Å
445	N	68.2	Low	81.5	Confident	107 Å²	107	48.2 Å²	48.2	57%	0.572	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	4.5	178.2	-66.3	-53.9	0	0	0	114	F443 R484	F443-N445 PolarHBondContact O-N 3.06Å; F443-N445 VanDerWaalsContact O-N 3.13Å; N445-R484 WeakPolarHBondContact O-CD 3.39Å
446	F	74.5	Confident	81.5	Confident	43 Å²	43	48.6 Å²	48.6	19%	0.189	26%	0.256	C	S	.	.			trans	-143.8	112.9	-172.9	179.6	-87.1	0	0	0	110.1	I410 L414 F443 E451	I410-F446 HydrophobicContact CD1-CB 3.3Å; I410-F446 HydrophobicContact CD1-CD1 4.09Å; I410-F446 HydrophobicContact CD1-CD2 4.27Å; I410-F446 HydrophobicContact CD1-CG 3.62Å; L414-F446 HydrophobicContact CD1-CD2 4.37Å; L414-F446 HydrophobicContact CD1-CE1 4.48Å; L414-F446 HydrophobicContact CD1-CE2 3.92Å; L414-F446 HydrophobicContact CD1-CZ 4Å; L414-F446 HydrophobicContact CD2-CD1 4.09Å; L414-F446 HydrophobicContact CD2-CE1 3.29Å; L414-F446 HydrophobicContact CD2-CE2 4.05Å; L414-F446 HydrophobicContact CD2-CZ 3.26Å; L414-F446 HydrophobicContact CG-CE1 4.41Å; L414-F446 HydrophobicContact CG-CZ 4.26Å; F443-F446 CarbonylContact C-O 3.59Å; F443-F446 WeakPolarHBondContact CA-O 3.36Å; F443-F446 WeakPolarHBondContact CD1-O 3.47Å; F443-F446 CarbonylContact O-C 3.55Å; F443-F446 PolarHBondContact O-N 2.85Å; F443-F446 VanDerWaalsContact O-N 3.16Å; F446-E451 HydrophobicContact CE1-CB 4.47Å; F446-E451 HydrophobicContact CE1-CG 3.8Å; F446-E451 VanDerWaalsContact CZ-CD 3.45Å; F446-E451 HydrophobicContact CZ-CG 4.07Å
447	L	78.7	Confident	81.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.254	C	S	.	.			trans	-163.7	104.8	166.2	-176.2	62.4	0	0	0	105.7	F443 L452 L455 L479 R484 F485 A488	F443-L447 HydrophobicContact CD1-CB 4.48Å; F443-L447 HydrophobicContact CD1-CD1 3.91Å; F443-L447 HydrophobicContact CE1-CD1 4.12Å; L447-L452 HydrophobicContact CD1-CB 4.1Å; L447-L452 HydrophobicContact CD1-CD1 4.47Å; L447-L452 HydrophobicContact CD2-CD1 4.42Å; L447-L452 HydrophobicContact CG-CB 4.42Å; L447-L455 HydrophobicContact CD1-CD1 4.17Å; L447-L479 HydrophobicContact CD2-CD2 4.4Å; L447-R484 HydrophobicContact CB-CB 4.18Å; L447-F485 HydrophobicContact CD2-CB 3.96Å; L447-F485 HydrophobicContact CD2-CD2 3.66Å; L447-F485 HydrophobicContact CD2-CG 4.29Å; L447-A488 HydrophobicContact CD2-CB 4.34Å; L447-A488 HydrophobicContact CG-CB 4.01Å
448	S	79.4	Confident	81.6	Confident	44 Å²	44	43.8 Å²	43.8	31%	0.308	22%	0.224	S	C	.	.			trans	-94.5	176.3	171.8	96.4	0	0	0	0	110.4	A450 E451 L452	S448-A450 VanDerWaalsContact C-N 3.28Å; S448-A450 PolarHBondContact O-N 3.3Å; S448-A450 PolarHBondContact OG-N 3.19Å; S448-E451 WeakPolarHBondContact CA-OE2 3.25Å; S448-E451 WeakPolarHBondContact CB-OE2 3.49Å; S448-E451 PolarHBondContact N-OE2 3.12Å; S448-E451 PolarHBondContact OG-OE2 3.07Å; S448-L452 WeakPolarHBondContact O-CB 3.39Å; S448-L452 PolarHBondContact O-N 2.93Å; S448-L452 VanDerWaalsContact O-N 3.09Å
449	I	78.9	Confident	81.7	Confident	51 Å²	51	39.9 Å²	39.9	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-42	178.8	-52.3	158.8	0	0	0	110.1	L452 S453 F491 L492	I449-L452 PolarHBondContact O-N 3.46Å; I449-S453 WeakPolarHBondContact O-CB 3.33Å; I449-S453 PolarHBondContact O-N 3.48Å; I449-F491 HydrophobicContact CD1-CB 3.26Å; I449-F491 HydrophobicContact CD1-CD1 4.08Å; I449-F491 HydrophobicContact CD1-CD2 4.16Å; I449-F491 HydrophobicContact CD1-CG 3.62Å; I449-F491 HydrophobicContact CG1-CB 3.41Å; I449-F491 VanDerWaalsContact CG1-CB 3.41Å; I449-F491 HydrophobicContact CG1-CD2 4.49Å; I449-F491 HydrophobicContact CG1-CG 4.15Å; I449-F491 HydrophobicContact CG2-CB 4.35Å; I449-L492 HydrophobicContact CG2-CB 4.21Å; I449-L492 HydrophobicContact CG2-CD1 4.42Å
450	A	80.3	Confident	81.5	Confident	37 Å²	37	44 Å²	44	31%	0.306	23%	0.228	S	C	.	.	H	α-helix	trans	-63.9	-49.2	-178	0	0	0	0	0	111	S448 L452 S453 D454	S448-A450 VanDerWaalsContact C-N 3.28Å; S448-A450 PolarHBondContact O-N 3.3Å; S448-A450 PolarHBondContact OG-N 3.19Å; A450-L452 PolarHBondContact O-N 2.89Å; A450-S453 WeakPolarHBondContact O-CB 3.43Å; A450-S453 PolarHBondContact O-N 2.94Å; A450-D454 PolarHBondContact O-N 3.25Å
451	E	85	Confident	81.4	Confident	20 Å²	20	46.2 Å²	46.2	9%	0.093	23%	0.233	C	C	.	.	H	α-helix	trans	-69.7	-33.8	-179.2	-62.2	85.1	-159.6	0	0	112.5	W417 R421 F446 S448 S453 D454 L455	W417-E451 HydrophobicContact CZ2-CB 3.92Å; W417-E451 HydrophobicContact CZ2-CG 4.37Å; R421-E451 IonicContact NH2-OE1 3.31Å; F446-E451 HydrophobicContact CE1-CB 4.47Å; F446-E451 HydrophobicContact CE1-CG 3.8Å; F446-E451 VanDerWaalsContact CZ-CD 3.45Å; F446-E451 HydrophobicContact CZ-CG 4.07Å; S448-E451 WeakPolarHBondContact CA-OE2 3.25Å; S448-E451 WeakPolarHBondContact CB-OE2 3.49Å; S448-E451 PolarHBondContact N-OE2 3.12Å; S448-E451 PolarHBondContact OG-OE2 3.07Å; E451-S453 VanDerWaalsContact C-N 3.32Å; E451-D454 PolarHBondContact O-N 3.12Å; E451-L455 WeakPolarHBondContact O-CB 3.41Å; E451-L455 WeakPolarHBondContact O-CD1 3.42Å; E451-L455 VanDerWaalsContact O-CG 3.32Å; E451-L455 WeakPolarHBondContact O-CG 3.45Å; E451-L455 PolarHBondContact O-N 3.41Å
452	L	84.4	Confident	81.2	Confident	5 Å²	5	38 Å²	38	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-39.2	172.5	-174.8	62	0	0	0	111.3	L447 S448 I449 A450 L455 L456 L479 F485 A488 L492	L447-L452 HydrophobicContact CD1-CB 4.1Å; L447-L452 HydrophobicContact CD1-CD1 4.47Å; L447-L452 HydrophobicContact CD2-CD1 4.42Å; L447-L452 HydrophobicContact CG-CB 4.42Å; S448-L452 WeakPolarHBondContact O-CB 3.39Å; S448-L452 PolarHBondContact O-N 2.93Å; S448-L452 VanDerWaalsContact O-N 3.09Å; I449-L452 PolarHBondContact O-N 3.46Å; A450-L452 PolarHBondContact O-N 2.89Å; L452-L455 WeakPolarHBondContact O-CB 3.32Å; L452-L455 PolarHBondContact O-N 3.17Å; L452-L456 HydrophobicContact CG-CD1 4.3Å; L452-L456 VanDerWaalsContact O-CG 3.29Å; L452-L456 WeakPolarHBondContact O-CG 3.45Å; L452-L456 PolarHBondContact O-N 3.31Å; L452-L479 HydrophobicContact CD1-CD1 4.47Å; L452-F485 HydrophobicContact CD1-CE2 4.11Å; L452-A488 HydrophobicContact CB-CB 4.2Å; L452-A488 HydrophobicContact CD2-CB 3.77Å; L452-L492 HydrophobicContact CB-CD1 4.29Å; L452-L492 HydrophobicContact CG-CD1 4.26Å
453	S	84.3	Confident	80.7	Confident	34 Å²	34	42.2 Å²	42.2	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-46.6	174.7	-163.4	0	0	0	0	112	I449 A450 E451 L455 L456 N457 L492	I449-S453 WeakPolarHBondContact O-CB 3.33Å; I449-S453 PolarHBondContact O-N 3.48Å; A450-S453 WeakPolarHBondContact O-CB 3.43Å; A450-S453 PolarHBondContact O-N 2.94Å; E451-S453 VanDerWaalsContact C-N 3.32Å; S453-L455 VanDerWaalsContact C-N 3.26Å; S453-L455 PolarHBondContact O-N 3.2Å; S453-L456 PolarHBondContact O-N 3.41Å; S453-N457 WeakPolarHBondContact O-CB 3.49Å; S453-N457 VanDerWaalsContact O-CG 3.24Å; S453-N457 PolarHBondContact O-N 3.38Å; S453-N457 PolarHBondContact O-ND2 3.34Å; S453-L492 VanDerWaalsContact CA-CD1 3.41Å; S453-L492 VanDerWaalsContact CB-CD1 3.48Å
454	D	86.3	Confident	80.6	Confident	24 Å²	24	50 Å²	50	13%	0.128	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-41.2	177.4	-64.3	-18.8	0	0	0	110.7	W417 R421 L427 A450 E451 A458	W417-D454 HydrophobicContact CZ2-CB 4.16Å; W417-D454 PolarHBondContact NE1-OD2 3.32Å; R421-D454 IonicContact CZ-OD2 3.12Å; R421-D454 IonicContact NE-OD2 3.77Å; R421-D454 PolarHBondContact NE-OD2 3.28Å; R421-D454 VanDerWaalsContact NE-OD2 3.12Å; R421-D454 IonicContact NH2-OD2 3.8Å; L427-D454 HydrophobicContact CD2-CB 3.95Å; A450-D454 PolarHBondContact O-N 3.25Å; E451-D454 PolarHBondContact O-N 3.12Å; D454-A458 VanDerWaalsContact O-CB 3.25Å; D454-A458 WeakPolarHBondContact O-CB 3.19Å; D454-A458 PolarHBondContact O-N 3.19Å
455	L	87.1	Confident	81.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-49.3	176	-87.4	159.3	0	0	0	112.7	W417 I431 F443 L447 E451 L452 S453 A458 F459 L479	W417-L455 HydrophobicContact CH2-CD1 3.76Å; W417-L455 HydrophobicContact CH2-CD2 3.75Å; W417-L455 HydrophobicContact CH2-CG 3.45Å; W417-L455 VanDerWaalsContact CH2-CG 3.45Å; W417-L455 HydrophobicContact CZ2-CD1 4.2Å; W417-L455 HydrophobicContact CZ2-CD2 4.44Å; W417-L455 HydrophobicContact CZ2-CG 3.75Å; I431-L455 HydrophobicContact CD1-CD2 3.44Å; I431-L455 VanDerWaalsContact CD1-CD2 3.44Å; I431-L455 HydrophobicContact CD1-CG 4.35Å; I431-L455 HydrophobicContact CG1-CD2 4.29Å; I431-L455 HydrophobicContact CG2-CD2 4.21Å; F443-L455 HydrophobicContact CE1-CD1 4.22Å; F443-L455 HydrophobicContact CZ-CD1 4.37Å; L447-L455 HydrophobicContact CD1-CD1 4.17Å; E451-L455 WeakPolarHBondContact O-CB 3.41Å; E451-L455 WeakPolarHBondContact O-CD1 3.42Å; E451-L455 VanDerWaalsContact O-CG 3.32Å; E451-L455 WeakPolarHBondContact O-CG 3.45Å; E451-L455 PolarHBondContact O-N 3.41Å; L452-L455 WeakPolarHBondContact O-CB 3.32Å; L452-L455 PolarHBondContact O-N 3.17Å; S453-L455 VanDerWaalsContact C-N 3.26Å; S453-L455 PolarHBondContact O-N 3.2Å; L455-A458 PolarHBondContact O-N 3.12Å; L455-F459 HydrophobicContact CD2-CE1 4.11Å; L455-F459 HydrophobicContact CD2-CE2 4.07Å; L455-F459 HydrophobicContact CD2-CZ 3.65Å; L455-F459 WeakPolarHBondContact O-CB 3.27Å; L455-F459 VanDerWaalsContact O-CG 3.25Å; L455-F459 WeakPolarHBondContact O-CG 3.4Å; L455-F459 PolarHBondContact O-N 3.03Å; L455-L479 HydrophobicContact CD1-CD1 3.69Å
456	L	85.8	Confident	81.5	Confident	66 Å²	66	52.6 Å²	52.6	35%	0.346	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-44.3	-179.1	-69.5	171.2	0	0	0	110.6	L452 S453 A458 F459 E460 L476 L492	L452-L456 HydrophobicContact CG-CD1 4.3Å; L452-L456 VanDerWaalsContact O-CG 3.29Å; L452-L456 WeakPolarHBondContact O-CG 3.45Å; L452-L456 PolarHBondContact O-N 3.31Å; S453-L456 PolarHBondContact O-N 3.41Å; L456-A458 VanDerWaalsContact C-N 3.33Å; L456-A458 PolarHBondContact O-N 3.16Å; L456-F459 PolarHBondContact O-N 3.3Å; L456-E460 PolarHBondContact O-N 3.19Å; L456-L476 HydrophobicContact CD2-CD2 4.12Å; L456-L492 HydrophobicContact CD1-CD1 4.32Å; L456-L492 HydrophobicContact CD1-CD2 3.67Å
457	N	85.1	Confident	81.9	Confident	61 Å²	61	55.2 Å²	55.2	33%	0.326	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-37.3	175.5	-68.1	-17	0	0	0	112.2	S453	S453-N457 WeakPolarHBondContact O-CB 3.49Å; S453-N457 VanDerWaalsContact O-CG 3.24Å; S453-N457 PolarHBondContact O-N 3.38Å; S453-N457 PolarHBondContact O-ND2 3.34Å
458	A	85.3	Confident	82.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-41.2	175.2	0	0	0	0	0	112.1	L427 C428 D454 L455 L456 E460 R461	L427-A458 HydrophobicContact CB-CB 4.38Å; L427-A458 HydrophobicContact CD2-CB 4.18Å; L427-A458 HydrophobicContact CG-CB 4.21Å; C428-A458 HydrophobicContact CB-CB 4.05Å; C428-A458 WeakPolarHBondContact CB-O 3.4Å; D454-A458 VanDerWaalsContact O-CB 3.25Å; D454-A458 WeakPolarHBondContact O-CB 3.19Å; D454-A458 PolarHBondContact O-N 3.19Å; L455-A458 PolarHBondContact O-N 3.12Å; L456-A458 VanDerWaalsContact C-N 3.33Å; L456-A458 PolarHBondContact O-N 3.16Å; A458-E460 VanDerWaalsContact C-N 3.35Å; A458-R461 PolarHBondContact O-N 2.99Å
459	F	86.6	Confident	82.3	Confident	11 Å²	11	58.2 Å²	58.2	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-74.5	-24.6	-179.9	-68	-7.6	0	0	0	113.1	I431 L455 L456 R461 A462 C472 R475 L476	I431-F459 HydrophobicContact CB-CE1 4.42Å; I431-F459 HydrophobicContact CD1-CE1 4.42Å; I431-F459 HydrophobicContact CG2-CE1 3.82Å; I431-F459 HydrophobicContact CG2-CZ 3.81Å; L455-F459 HydrophobicContact CD2-CE1 4.11Å; L455-F459 HydrophobicContact CD2-CE2 4.07Å; L455-F459 HydrophobicContact CD2-CZ 3.65Å; L455-F459 WeakPolarHBondContact O-CB 3.27Å; L455-F459 VanDerWaalsContact O-CG 3.25Å; L455-F459 WeakPolarHBondContact O-CG 3.4Å; L455-F459 PolarHBondContact O-N 3.03Å; L456-F459 PolarHBondContact O-N 3.3Å; F459-R461 PolarHBondContact O-N 3.14Å; F459-A462 WeakPolarHBondContact O-CB 3.32Å; F459-A462 PolarHBondContact O-N 3.4Å; F459-C472 HydrophobicContact CB-CB 4.25Å; F459-C472 HydrophobicContact CD1-CB 4.14Å; F459-C472 WeakPolarHBondContact CD1-SG 3.2Å; F459-C472 HydrophobicContact CD2-CB 3.93Å; F459-C472 HydrophobicContact CE1-CB 4.47Å; F459-C472 HydrophobicContact CE2-CB 4.27Å; F459-C472 HydrophobicContact CG-CB 3.86Å; F459-R475 HydrophobicContact CE2-CB 4.33Å; F459-R475 HydrophobicContact CZ-CB 4.12Å; F459-L476 HydrophobicContact CD2-CD1 4.1Å; F459-L476 HydrophobicContact CD2-CD2 3.87Å; F459-L476 HydrophobicContact CD2-CG 3.8Å; F459-L476 HydrophobicContact CE2-CD2 3.83Å; F459-L476 HydrophobicContact CE2-CG 3.79Å
460	E	82.7	Confident	82.4	Confident	86 Å²	86	60.7 Å²	60.7	40%	0.402	31%	0.309	S	S	.	.	H	α-helix	trans	-56.5	-39.2	171	-167.6	-166.9	162.9	0	0	111.6	L456 A458 A462 L463 W501	L456-E460 PolarHBondContact O-N 3.19Å; A458-E460 VanDerWaalsContact C-N 3.35Å; E460-A462 PolarHBondContact O-N 2.92Å; E460-L463 HydrophobicContact CB-CD1 4.44Å; E460-L463 HydrophobicContact CG-CD1 3.84Å; E460-L463 WeakPolarHBondContact O-CB 3.43Å; E460-L463 WeakPolarHBondContact O-CD1 3.44Å; E460-L463 WeakPolarHBondContact O-CG 3.4Å; E460-L463 PolarHBondContact O-N 2.86Å; E460-W501 HydrophobicContact CG-CH2 4.12Å; E460-W501 WeakPolarHBondContact OE1-CH2 3.44Å; E460-W501 VanDerWaalsContact OE2-CH2 3.23Å; E460-W501 WeakPolarHBondContact OE2-CH2 3.25Å; E460-W501 WeakPolarHBondContact OE2-CZ2 3.36Å
461	R	78.7	Confident	82.7	Confident	136 Å²	136	62.8 Å²	62.8	51%	0.513	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17	176.3	-64.9	-81	-178	87.9	2.8	113.5	A458 F459	A458-R461 PolarHBondContact O-N 2.99Å; F459-R461 PolarHBondContact O-N 3.14Å
462	A	77.2	Confident	82.8	Confident	2 Å²	2	62 Å²	62	2%	0.017	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	1.5	178.9	0	0	0	0	0	113.3	F459 E460 D464 D465 K468	F459-A462 WeakPolarHBondContact O-CB 3.32Å; F459-A462 PolarHBondContact O-N 3.4Å; E460-A462 PolarHBondContact O-N 2.92Å; A462-D464 PolarHBondContact O-N 3.46Å; A462-D465 PolarHBondContact O-N 3.2Å; A462-K468 HydrophobicContact CB-CB 4.04Å
463	L	74.3	Confident	82.7	Confident	102 Å²	102	64 Å²	64	53%	0.534	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.2	-178.5	-72.6	169.5	0	0	0	113.6	E460 L469	E460-L463 HydrophobicContact CB-CD1 4.44Å; E460-L463 HydrophobicContact CG-CD1 3.84Å; E460-L463 WeakPolarHBondContact O-CB 3.43Å; E460-L463 WeakPolarHBondContact O-CD1 3.44Å; E460-L463 WeakPolarHBondContact O-CG 3.4Å; E460-L463 PolarHBondContact O-N 2.86Å; L463-L469 HydrophobicContact CD2-CD1 3.89Å
464	D	78	Confident	82.9	Confident	165 Å²	165	65.6 Å²	65.6	88%	0.882	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.6	-177.6	-64.7	-31.1	0	0	0	113.9	A462	A462-D464 PolarHBondContact O-N 3.46Å
465	D	81.5	Confident	83	Confident	60 Å²	60	65 Å²	65	32%	0.321	32%	0.319	S	S	.	.			trans	-114.3	104.1	-178.3	-179.5	-21	0	0	0	109.7	A462 V467 K468 L469	A462-D465 PolarHBondContact O-N 3.2Å; D465-V467 PolarHBondContact O-N 3.4Å; D465-V467 VanDerWaalsContact O-N 3.15Å; D465-V467 PolarHBondContact OD1-N 2.89Å; D465-V467 VanDerWaalsContact OD1-N 3.09Å; D465-K468 HydrophobicContact CB-CB 4.04Å; D465-K468 HydrophobicContact CB-CD 4.07Å; D465-K468 HydrophobicContact CB-CG 4.18Å; D465-K468 PolarHBondContact O-N 2.9Å; D465-K468 VanDerWaalsContact O-N 3.09Å; D465-K468 PolarHBondContact OD1-N 3.43Å; D465-K468 VanDerWaalsContact OD2-CD 3.23Å; D465-K468 WeakPolarHBondContact OD2-CD 3.44Å; D465-K468 WeakPolarHBondContact OD2-CE 3.47Å; D465-K468 WeakPolarHBondContact OD2-CG 3.32Å; D465-K468 IonicContact OD2-NZ 3.63Å; D465-L469 WeakPolarHBondContact O-CB 3.44Å; D465-L469 PolarHBondContact O-N 2.84Å
466	E	78.1	Confident	82.9	Confident	156 Å²	156	67.4 Å²	67.4	73%	0.729	33%	0.332	S	S	*	.	H	α-helix	trans	-54.3	-36.8	-176.3	-71.3	-165.7	151.2	0	0	113	Q470	E466-Q470 PolarHBondContact O-N 2.98Å
467	V	81.3	Confident	82.8	Confident	99 Å²	99	69.5 Å²	69.5	60%	0.6	34%	0.341	S	S	*	.	H	α-helix	trans	-69.9	-46.4	-179.2	-178.9	0	0	0	0	109.5	D465 L469 Q470 H471	D465-V467 PolarHBondContact O-N 3.4Å; D465-V467 VanDerWaalsContact O-N 3.15Å; D465-V467 PolarHBondContact OD1-N 2.89Å; D465-V467 VanDerWaalsContact OD1-N 3.09Å; V467-L469 VanDerWaalsContact C-N 3.35Å; V467-Q470 PolarHBondContact O-N 3.07Å; V467-H471 PolarHBondContact O-N 3Å; V467-H471 PolarHBondContact O-ND1 3.34Å
468	K	83.8	Confident	82.8	Confident	69 Å²	69	67.2 Å²	67.2	30%	0.3	33%	0.33	S	S	.	.	H	α-helix	trans	-65.7	-38.6	177.4	-70	-179.9	-171.9	172.7	0	112.2	L432 A462 D465 Q470 H471 C472	L432-K468 HydrophobicContact CD1-CB 4.1Å; L432-K468 HydrophobicContact CD1-CD 4.33Å; L432-K468 HydrophobicContact CD1-CG 4.07Å; A462-K468 HydrophobicContact CB-CB 4.04Å; D465-K468 HydrophobicContact CB-CB 4.04Å; D465-K468 HydrophobicContact CB-CD 4.07Å; D465-K468 HydrophobicContact CB-CG 4.18Å; D465-K468 PolarHBondContact O-N 2.9Å; D465-K468 VanDerWaalsContact O-N 3.09Å; D465-K468 PolarHBondContact OD1-N 3.43Å; D465-K468 VanDerWaalsContact OD2-CD 3.23Å; D465-K468 WeakPolarHBondContact OD2-CD 3.44Å; D465-K468 WeakPolarHBondContact OD2-CE 3.47Å; D465-K468 WeakPolarHBondContact OD2-CG 3.32Å; D465-K468 IonicContact OD2-NZ 3.63Å; K468-Q470 VanDerWaalsContact C-N 3.33Å; K468-Q470 PolarHBondContact O-N 3.26Å; K468-H471 WeakPolarHBondContact O-CB 3.25Å; K468-H471 PolarHBondContact O-N 3.14Å; K468-H471 VanDerWaalsContact O-N 3.14Å; K468-C472 PolarHBondContact O-N 3.28Å; K468-C472 PolarHBondContact O-SG 3.31Å; K468-C472 VanDerWaalsContact O-SG 3.34Å
469	L	82.7	Confident	82.8	Confident	39 Å²	39	67.3 Å²	67.3	20%	0.204	33%	0.331	C	S	.	.	H	α-helix	trans	-58.2	-44.7	178.3	-179.3	58.1	0	0	0	111.8	L463 D465 V467 H471 C472 I473	L463-L469 HydrophobicContact CD2-CD1 3.89Å; D465-L469 WeakPolarHBondContact O-CB 3.44Å; D465-L469 PolarHBondContact O-N 2.84Å; V467-L469 VanDerWaalsContact C-N 3.35Å; L469-H471 VanDerWaalsContact C-N 3.31Å; L469-H471 PolarHBondContact O-N 3.34Å; L469-C472 WeakPolarHBondContact O-CB 3.47Å; L469-C472 PolarHBondContact O-N 3.08Å; L469-C472 VanDerWaalsContact O-N 3.14Å; L469-I473 HydrophobicContact CD1-CD1 4.36Å; L469-I473 HydrophobicContact CD1-CG1 4.42Å; L469-I473 HydrophobicContact CG-CD1 4.13Å; L469-I473 WeakPolarHBondContact O-CG1 3.45Å; L469-I473 PolarHBondContact O-N 2.88Å
470	Q	82.3	Confident	82.4	Confident	103 Å²	103	70.4 Å²	70.4	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-58.4	-44.9	176.4	-173.6	64.6	11.3	0	0	111.6	E466 V467 K468 C472 I473 E474	E466-Q470 PolarHBondContact O-N 2.98Å; V467-Q470 PolarHBondContact O-N 3.07Å; K468-Q470 VanDerWaalsContact C-N 3.33Å; K468-Q470 PolarHBondContact O-N 3.26Å; Q470-C472 VanDerWaalsContact C-N 3.32Å; Q470-C472 PolarHBondContact O-N 3.49Å; Q470-I473 PolarHBondContact O-N 3.31Å; Q470-E474 WeakPolarHBondContact O-CG 3.34Å; Q470-E474 PolarHBondContact O-N 3.08Å
471	H	87	Confident	82.2	Confident	80 Å²	80	69.9 Å²	69.9	37%	0.37	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-33.4	177	-72.3	89.6	0	0	0	112.8	L432 V467 K468 L469 R475	L432-H471 HydrophobicContact CD2-CB 3.72Å; V467-H471 PolarHBondContact O-N 3Å; V467-H471 PolarHBondContact O-ND1 3.34Å; K468-H471 WeakPolarHBondContact O-CB 3.25Å; K468-H471 PolarHBondContact O-N 3.14Å; K468-H471 VanDerWaalsContact O-N 3.14Å; L469-H471 VanDerWaalsContact C-N 3.31Å; L469-H471 PolarHBondContact O-N 3.34Å; H471-R475 WeakPolarHBondContact O-CD 3.39Å; H471-R475 WeakPolarHBondContact O-CG 3.36Å; H471-R475 PolarHBondContact O-N 3.08Å; H471-R475 PolarHBondContact O-NH1 3.5Å
472	C	86.4	Confident	82	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.02	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-44	172.6	-70.4	0	0	0	0	111.6	F459 K468 L469 Q470 E474 R475 L476	F459-C472 HydrophobicContact CB-CB 4.25Å; F459-C472 HydrophobicContact CD1-CB 4.14Å; F459-C472 WeakPolarHBondContact CD1-SG 3.2Å; F459-C472 HydrophobicContact CD2-CB 3.93Å; F459-C472 HydrophobicContact CE1-CB 4.47Å; F459-C472 HydrophobicContact CE2-CB 4.27Å; F459-C472 HydrophobicContact CG-CB 3.86Å; K468-C472 PolarHBondContact O-N 3.28Å; K468-C472 PolarHBondContact O-SG 3.31Å; K468-C472 VanDerWaalsContact O-SG 3.34Å; L469-C472 WeakPolarHBondContact O-CB 3.47Å; L469-C472 PolarHBondContact O-N 3.08Å; L469-C472 VanDerWaalsContact O-N 3.14Å; Q470-C472 VanDerWaalsContact C-N 3.32Å; Q470-C472 PolarHBondContact O-N 3.49Å; C472-E474 PolarHBondContact O-N 2.77Å; C472-R475 PolarHBondContact O-N 3.38Å; C472-L476 WeakPolarHBondContact O-CG 3.5Å; C472-L476 PolarHBondContact O-N 3.16Å
473	I	83.1	Confident	81.9	Confident	48 Å²	48	73.1 Å²	73.1	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-45.5	178.2	-68	167.4	0	0	0	110.7	L469 Q470 R475 L476 M477	L469-I473 HydrophobicContact CD1-CD1 4.36Å; L469-I473 HydrophobicContact CD1-CG1 4.42Å; L469-I473 HydrophobicContact CG-CD1 4.13Å; L469-I473 WeakPolarHBondContact O-CG1 3.45Å; L469-I473 PolarHBondContact O-N 2.88Å; Q470-I473 PolarHBondContact O-N 3.31Å; I473-R475 VanDerWaalsContact C-N 3.26Å; I473-R475 PolarHBondContact O-N 2.91Å; I473-L476 PolarHBondContact O-N 2.92Å; I473-M477 HydrophobicContact CG2-CE 4.3Å; I473-M477 HydrophobicContact CG2-CG 4.4Å; I473-M477 WeakPolarHBondContact O-CG 3.32Å; I473-M477 PolarHBondContact O-N 3.11Å
474	E	87.2	Confident	81.7	Confident	67 Å²	67	74.2 Å²	74.2	31%	0.313	36%	0.364	S	S	.	.	H	α-helix	trans	-57.1	-39.6	176.2	-72.8	174.7	-176.2	0	0	112.5	L436 Q470 C472 M477 A478	L436-E474 HydrophobicContact CD1-CB 4.37Å; L436-E474 HydrophobicContact CD2-CB 4.34Å; Q470-E474 WeakPolarHBondContact O-CG 3.34Å; Q470-E474 PolarHBondContact O-N 3.08Å; C472-E474 PolarHBondContact O-N 2.77Å; E474-M477 HydrophobicContact CG-CE 4.46Å; E474-A478 WeakPolarHBondContact O-CB 3.41Å; E474-A478 PolarHBondContact O-N 3.34Å
475	R	88.2	Confident	81.6	Confident	11 Å²	11	68.6 Å²	68.6	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-70.4	-42.5	176.6	-73.2	162.7	174.9	74.6	2	112	I431 L432 I434 L436 F439 F459 H471 C472 I473 M477 A478 L479	I431-R475 PolarHBondContact O-NE 3.47Å; L432-R475 PolarHBondContact O-NH2 3.3Å; I434-R475 PolarHBondContact O-NH2 3.14Å; L436-R475 HydrophobicContact CD1-CG 3.98Å; F439-R475 HydrophobicContact CD1-CB 4.31Å; F439-R475 HydrophobicContact CD1-CG 4.2Å; F439-R475 HydrophobicContact CE1-CB 3.8Å; F439-R475 HydrophobicContact CE1-CG 4.15Å; F439-R475 WeakPolarHBondContact CE1-O 3.32Å; F439-R475 HydrophobicContact CE2-CG 4.5Å; F439-R475 HydrophobicContact CG-CG 4.39Å; F439-R475 HydrophobicContact CZ-CB 3.93Å; F439-R475 HydrophobicContact CZ-CG 4.31Å; F459-R475 HydrophobicContact CE2-CB 4.33Å; F459-R475 HydrophobicContact CZ-CB 4.12Å; H471-R475 WeakPolarHBondContact O-CD 3.39Å; H471-R475 WeakPolarHBondContact O-CG 3.36Å; H471-R475 PolarHBondContact O-N 3.08Å; H471-R475 PolarHBondContact O-NH1 3.5Å; C472-R475 PolarHBondContact O-N 3.38Å; I473-R475 VanDerWaalsContact C-N 3.26Å; I473-R475 PolarHBondContact O-N 2.91Å; R475-M477 VanDerWaalsContact C-N 3.33Å; R475-M477 PolarHBondContact O-N 3.28Å; R475-A478 WeakPolarHBondContact O-CB 3.16Å; R475-A478 PolarHBondContact O-N 3.26Å; R475-L479 WeakPolarHBondContact O-CG 3.5Å; R475-L479 PolarHBondContact O-N 2.93Å
476	L	85.9	Confident	80.8	Confident	52 Å²	52	67.9 Å²	67.9	27%	0.272	34%	0.339	S	S	.	.	H	α-helix	trans	-59.8	-44.7	173.5	-71.9	175.9	0	0	0	111.1	L456 F459 C472 I473 A478 L479 T480	L456-L476 HydrophobicContact CD2-CD2 4.12Å; F459-L476 HydrophobicContact CD2-CD1 4.1Å; F459-L476 HydrophobicContact CD2-CD2 3.87Å; F459-L476 HydrophobicContact CD2-CG 3.8Å; F459-L476 HydrophobicContact CE2-CD2 3.83Å; F459-L476 HydrophobicContact CE2-CG 3.79Å; C472-L476 WeakPolarHBondContact O-CG 3.5Å; C472-L476 PolarHBondContact O-N 3.16Å; I473-L476 PolarHBondContact O-N 2.92Å; L476-A478 VanDerWaalsContact C-N 3.32Å; L476-A478 PolarHBondContact O-N 2.98Å; L476-L479 HydrophobicContact CD2-CD1 4.32Å; L476-L479 WeakPolarHBondContact O-CB 3.49Å; L476-L479 PolarHBondContact O-N 3.32Å; L476-L479 VanDerWaalsContact O-N 3.12Å; L476-T480 WeakPolarHBondContact O-CG2 3.49Å; L476-T480 PolarHBondContact O-N 2.93Å; L476-T480 VanDerWaalsContact O-N 3.07Å
477	M	83.5	Confident	80.3	Confident	109 Å²	109	62.6 Å²	62.6	54%	0.537	32%	0.319	S	S	.	.	H	α-helix	trans	-58.8	-43.7	173.8	-70.8	-163.5	-62.3	0	0	111.3	I473 E474 R475 L479 T480	I473-M477 HydrophobicContact CG2-CE 4.3Å; I473-M477 HydrophobicContact CG2-CG 4.4Å; I473-M477 WeakPolarHBondContact O-CG 3.32Å; I473-M477 PolarHBondContact O-N 3.11Å; E474-M477 HydrophobicContact CG-CE 4.46Å; R475-M477 VanDerWaalsContact C-N 3.33Å; R475-M477 PolarHBondContact O-N 3.28Å; M477-L479 VanDerWaalsContact C-N 3.33Å; M477-L479 PolarHBondContact O-N 3.3Å; M477-T480 WeakPolarHBondContact O-CB 3.45Å; M477-T480 PolarHBondContact O-N 3.09Å; M477-T480 VanDerWaalsContact O-N 3.15Å; M477-T480 PolarHBondContact O-OG1 2.74Å
478	A	85.2	Confident	79.7	Confident	13 Å²	13	57.9 Å²	57.9	11%	0.107	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-39.6	174.4	0	0	0	0	0	112.5	L436 F439 E474 R475 L476 T480 T481	L436-A478 HydrophobicContact CD1-CB 3.96Å; F439-A478 HydrophobicContact CD1-CB 4.17Å; F439-A478 HydrophobicContact CE1-CB 4.38Å; E474-A478 WeakPolarHBondContact O-CB 3.41Å; E474-A478 PolarHBondContact O-N 3.34Å; R475-A478 WeakPolarHBondContact O-CB 3.16Å; R475-A478 PolarHBondContact O-N 3.26Å; L476-A478 VanDerWaalsContact C-N 3.32Å; L476-A478 PolarHBondContact O-N 2.98Å; A478-T480 VanDerWaalsContact C-N 3.29Å; A478-T480 PolarHBondContact O-N 3.15Å; A478-T481 PolarHBondContact O-N 3.41Å; A478-T481 PolarHBondContact O-OG1 3.47Å
479	L	84.6	Confident	78.9	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-33.2	175.1	-67.2	175	0	0	0	112.4	F439 F443 L447 L452 L455 R475 L476 M477 T481 S482 F485	F439-L479 HydrophobicContact CE1-CD1 4.47Å; F439-L479 HydrophobicContact CE1-CD2 3.65Å; F439-L479 HydrophobicContact CE1-CG 3.72Å; F439-L479 HydrophobicContact CZ-CD1 4.18Å; F439-L479 HydrophobicContact CZ-CD2 3.73Å; F439-L479 HydrophobicContact CZ-CG 3.89Å; F443-L479 HydrophobicContact CB-CD2 3.63Å; F443-L479 HydrophobicContact CD1-CD2 3.82Å; F443-L479 HydrophobicContact CD2-CD2 3.93Å; F443-L479 HydrophobicContact CE1-CD2 4.5Å; F443-L479 HydrophobicContact CG-CD2 3.51Å; L447-L479 HydrophobicContact CD2-CD2 4.4Å; L452-L479 HydrophobicContact CD1-CD1 4.47Å; L455-L479 HydrophobicContact CD1-CD1 3.69Å; R475-L479 WeakPolarHBondContact O-CG 3.5Å; R475-L479 PolarHBondContact O-N 2.93Å; L476-L479 HydrophobicContact CD2-CD1 4.32Å; L476-L479 WeakPolarHBondContact O-CB 3.49Å; L476-L479 PolarHBondContact O-N 3.32Å; L476-L479 VanDerWaalsContact O-N 3.12Å; M477-L479 VanDerWaalsContact C-N 3.33Å; M477-L479 PolarHBondContact O-N 3.3Å; L479-T481 PolarHBondContact O-N 3.25Å; L479-T481 VanDerWaalsContact O-N 3.08Å; L479-S482 VanDerWaalsContact O-CB 3.25Å; L479-S482 WeakPolarHBondContact O-CB 3.36Å; L479-S482 PolarHBondContact O-N 3.09Å; L479-F485 HydrophobicContact CB-CD2 3.8Å; L479-F485 HydrophobicContact CB-CE2 4.09Å; L479-F485 WeakPolarHBondContact O-CB 3.33Å; L479-F485 WeakPolarHBondContact O-CG 3.43Å
480	T	79	Confident	77.8	Confident	76 Å²	76	56.4 Å²	56.4	47%	0.466	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-22.2	178	71	0	0	0	0	113.6	L476 M477 A478 F485	L476-T480 WeakPolarHBondContact O-CG2 3.49Å; L476-T480 PolarHBondContact O-N 2.93Å; L476-T480 VanDerWaalsContact O-N 3.07Å; M477-T480 WeakPolarHBondContact O-CB 3.45Å; M477-T480 PolarHBondContact O-N 3.09Å; M477-T480 VanDerWaalsContact O-N 3.15Å; M477-T480 PolarHBondContact O-OG1 2.74Å; A478-T480 VanDerWaalsContact C-N 3.29Å; A478-T480 PolarHBondContact O-N 3.15Å; T480-F485 HydrophobicContact CG2-CD1 4.39Å; T480-F485 HydrophobicContact CG2-CE1 3.85Å; T480-F485 HydrophobicContact CG2-CE2 4.45Å; T480-F485 HydrophobicContact CG2-CZ 3.9Å
481	T	77.9	Confident	76.6	Confident	76 Å²	76	54.9 Å²	54.9	47%	0.466	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.2	175.8	70.5	0	0	0	0	113.7	Q440 A478 L479	Q440-T481 PolarHBondContact NE2-OG1 2.54Å; A478-T481 PolarHBondContact O-N 3.41Å; A478-T481 PolarHBondContact O-OG1 3.47Å; L479-T481 PolarHBondContact O-N 3.25Å; L479-T481 VanDerWaalsContact O-N 3.08Å
482	S	75.8	Confident	75.3	Confident	10 Å²	10	52.1 Å²	52.1	7%	0.07	27%	0.27	C	S	.	.	S	Bend	trans	-70.4	140.9	178.3	168.8	0	0	0	0	111.6	F443 D444 L479 R484 F485	F443-S482 PolarHBondContact O-OG 3.23Å; D444-S482 PolarHBondContact O-OG 3.31Å; L479-S482 VanDerWaalsContact O-CB 3.25Å; L479-S482 WeakPolarHBondContact O-CB 3.36Å; L479-S482 PolarHBondContact O-N 3.09Å; S482-R484 PolarHBondContact O-N 3.09Å; S482-R484 VanDerWaalsContact O-N 3.12Å; S482-R484 PolarHBondContact OG-N 2.97Å; S482-F485 PolarHBondContact O-N 2.93Å
483	R	74.1	Confident	73.6	Confident	196 Å²	196	56.4 Å²	56.4	74%	0.74	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.8	179.7	-63.6	179.9	179.6	-171.8	-2.5	113.6	D444	D444-R483 PolarHBondContact O-N 3.44Å
484	R	71	Confident	71.6	Confident	124 Å²	124	60.7 Å²	60.7	47%	0.468	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-4.9	-175.2	-56.3	-161.5	84.7	179.2	5.9	114.4	N445 L447 S482 G486 S487 A488	N445-R484 WeakPolarHBondContact O-CD 3.39Å; L447-R484 HydrophobicContact CB-CB 4.18Å; S482-R484 PolarHBondContact O-N 3.09Å; S482-R484 VanDerWaalsContact O-N 3.12Å; S482-R484 PolarHBondContact OG-N 2.97Å; R484-G486 VanDerWaalsContact C-N 3.35Å; R484-G486 PolarHBondContact O-N 3.11Å; R484-S487 PolarHBondContact O-N 2.89Å; R484-S487 VanDerWaalsContact O-N 3.12Å; R484-S487 PolarHBondContact O-OG 3.3Å; R484-A488 PolarHBondContact O-N 2.97Å
485	F	76.1	Confident	69.5	Low	47 Å²	47	63.3 Å²	63.3	21%	0.206	32%	0.316	C	S	.	.	H	α-helix	trans	-60	-42.7	-179.6	-177.4	-93.8	0	0	0	113.1	L447 L452 L479 T480 S482 S487 A488 S489	L447-F485 HydrophobicContact CD2-CB 3.96Å; L447-F485 HydrophobicContact CD2-CD2 3.66Å; L447-F485 HydrophobicContact CD2-CG 4.29Å; L452-F485 HydrophobicContact CD1-CE2 4.11Å; L479-F485 HydrophobicContact CB-CD2 3.8Å; L479-F485 HydrophobicContact CB-CE2 4.09Å; L479-F485 WeakPolarHBondContact O-CB 3.33Å; L479-F485 WeakPolarHBondContact O-CG 3.43Å; T480-F485 HydrophobicContact CG2-CD1 4.39Å; T480-F485 HydrophobicContact CG2-CE1 3.85Å; T480-F485 HydrophobicContact CG2-CE2 4.45Å; T480-F485 HydrophobicContact CG2-CZ 3.9Å; S482-F485 PolarHBondContact O-N 2.93Å; F485-S487 VanDerWaalsContact C-N 3.27Å; F485-S487 PolarHBondContact O-N 3.37Å; F485-A488 PolarHBondContact O-N 3.41Å; F485-S489 WeakPolarHBondContact O-CB 3.23Å; F485-S489 PolarHBondContact O-N 3.33Å; F485-S489 PolarHBondContact O-OG 3.4Å
486	G	64.5	Low	67.2	Low	45 Å²	45	64.2 Å²	64.2	46%	0.464	32%	0.323	S	S	.	.	H	α-helix	trans	-58.8	-38.3	175.9	0	0	0	0	0	112.7	R484 S489 V490	R484-G486 VanDerWaalsContact C-N 3.35Å; R484-G486 PolarHBondContact O-N 3.11Å; G486-S489 PolarHBondContact O-OG 3.49Å; G486-V490 WeakPolarHBondContact O-CG2 3.32Å
487	S	67.4	Low	64.6	Low	45 Å²	45	69.6 Å²	69.6	32%	0.315	34%	0.341	S	S	.	.	H	α-helix	trans	-71.4	-47.4	175.2	54	0	0	0	0	112.6	R484 F485 S489 V490 F491	R484-S487 PolarHBondContact O-N 2.89Å; R484-S487 VanDerWaalsContact O-N 3.12Å; R484-S487 PolarHBondContact O-OG 3.3Å; F485-S487 VanDerWaalsContact C-N 3.27Å; F485-S487 PolarHBondContact O-N 3.37Å; S487-S489 PolarHBondContact O-N 2.98Å; S487-V490 PolarHBondContact O-N 2.9Å; S487-F491 VanDerWaalsContact O-CD2 3.24Å; S487-F491 WeakPolarHBondContact O-CD2 3.15Å; S487-F491 PolarHBondContact O-N 2.77Å
488	A	67.9	Low	62.1	Low	1 Å²	1	72.3 Å²	72.3	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-42.8	-174.6	0	0	0	0	0	112.4	L447 L452 R484 F485 F491 L492	L447-A488 HydrophobicContact CD2-CB 4.34Å; L447-A488 HydrophobicContact CG-CB 4.01Å; L452-A488 HydrophobicContact CB-CB 4.2Å; L452-A488 HydrophobicContact CD2-CB 3.77Å; R484-A488 PolarHBondContact O-N 2.97Å; F485-A488 PolarHBondContact O-N 3.41Å; A488-F491 PolarHBondContact O-N 3.01Å; A488-L492 WeakPolarHBondContact O-CB 3.26Å; A488-L492 PolarHBondContact O-N 3.44Å
489	S	67.7	Low	59.3	Low	35 Å²	35	79.9 Å²	79.9	25%	0.245	38%	0.383	C	S	.	.	H	α-helix	trans	-63.3	-41.8	-179.9	54	0	0	0	0	113.4	F485 G486 S487 L492 M493	F485-S489 WeakPolarHBondContact O-CB 3.23Å; F485-S489 PolarHBondContact O-N 3.33Å; F485-S489 PolarHBondContact O-OG 3.4Å; G486-S489 PolarHBondContact O-OG 3.49Å; S487-S489 PolarHBondContact O-N 2.98Å; S489-L492 PolarHBondContact O-N 3.13Å; S489-M493 WeakPolarHBondContact O-CG 3.44Å; S489-M493 PolarHBondContact O-N 3.44Å; S489-M493 VanDerWaalsContact O-N 3.09Å
490	V	58.1	Low	56.4	Low	41 Å²	41	88.7 Å²	88.7	25%	0.248	42%	0.424	C	S	.	.	H	α-helix	trans	-66	-40.2	179.7	172.2	0	0	0	0	111.9	K122 G486 S487 R494	K122-V490 HydrophobicContact CB-CG1 4.48Å; G486-V490 WeakPolarHBondContact O-CG2 3.32Å; S487-V490 PolarHBondContact O-N 2.9Å; V490-R494 PolarHBondContact O-N 3.01Å
491	F	57.9	Low	53.9	Low	71 Å²	71	93.4 Å²	93.4	31%	0.311	43%	0.433	S	S	.	.	H	α-helix	trans	-75.1	-33	178	-82.9	-74.9	0	0	0	112.5	I449 S487 A488 R494 Q495	I449-F491 HydrophobicContact CD1-CB 3.26Å; I449-F491 HydrophobicContact CD1-CD1 4.08Å; I449-F491 HydrophobicContact CD1-CD2 4.16Å; I449-F491 HydrophobicContact CD1-CG 3.62Å; I449-F491 HydrophobicContact CG1-CB 3.41Å; I449-F491 VanDerWaalsContact CG1-CB 3.41Å; I449-F491 HydrophobicContact CG1-CD2 4.49Å; I449-F491 HydrophobicContact CG1-CG 4.15Å; I449-F491 HydrophobicContact CG2-CB 4.35Å; S487-F491 VanDerWaalsContact O-CD2 3.24Å; S487-F491 WeakPolarHBondContact O-CD2 3.15Å; S487-F491 PolarHBondContact O-N 2.77Å; A488-F491 PolarHBondContact O-N 3.01Å; F491-R494 WeakPolarHBondContact O-CB 3.38Å; F491-R494 PolarHBondContact O-N 2.85Å; F491-R494 VanDerWaalsContact O-N 3.1Å; F491-Q495 PolarHBondContact O-N 3.39Å
492	L	60.8	Low	52.7	Low	22 Å²	22	94.3 Å²	94.3	12%	0.115	43%	0.432	C	S	.	.	H	α-helix	trans	-61.5	-46.9	174.3	-166.3	123.2	0	0	0	110.9	I449 L452 S453 L456 A488 S489 R494 Q495 V496	I449-L492 HydrophobicContact CG2-CB 4.21Å; I449-L492 HydrophobicContact CG2-CD1 4.42Å; L452-L492 HydrophobicContact CB-CD1 4.29Å; L452-L492 HydrophobicContact CG-CD1 4.26Å; S453-L492 VanDerWaalsContact CA-CD1 3.41Å; S453-L492 VanDerWaalsContact CB-CD1 3.48Å; L456-L492 HydrophobicContact CD1-CD1 4.32Å; L456-L492 HydrophobicContact CD1-CD2 3.67Å; A488-L492 WeakPolarHBondContact O-CB 3.26Å; A488-L492 PolarHBondContact O-N 3.44Å; S489-L492 PolarHBondContact O-N 3.13Å; L492-R494 PolarHBondContact O-N 3.21Å; L492-R494 VanDerWaalsContact O-N 3.14Å; L492-Q495 PolarHBondContact O-N 3.44Å; L492-Q495 VanDerWaalsContact O-N 3.11Å; L492-V496 HydrophobicContact CD2-CG2 4.13Å; L492-V496 HydrophobicContact CG-CG2 4.48Å; L492-V496 WeakPolarHBondContact O-CB 3.18Å; L492-V496 VanDerWaalsContact O-CG2 3.26Å; L492-V496 WeakPolarHBondContact O-CG2 3.34Å; L492-V496 PolarHBondContact O-N 2.64Å
493	M	49.6	Very low	51.5	Low	94 Å²	94	98.7 Å²	98.7	46%	0.463	45%	0.451	S	S	.	.	H	α-helix	trans	-50.3	-39.7	171.4	-77.3	-95	-140.5	0	0	111.7	S489 V496 Y497	S489-M493 WeakPolarHBondContact O-CG 3.44Å; S489-M493 PolarHBondContact O-N 3.44Å; S489-M493 VanDerWaalsContact O-N 3.09Å; M493-V496 WeakPolarHBondContact O-CB 3.33Å; M493-V496 PolarHBondContact O-N 3.23Å; M493-Y497 HydrophobicContact CB-CE2 4.42Å; M493-Y497 WeakPolarHBondContact O-CD2 3.4Å; M493-Y497 PolarHBondContact O-N 2.8Å
494	R	41.7	Very low	50.2	Low	137 Å²	137	93.3 Å²	93.3	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-70	-32.7	-177.9	-139	177.4	-175.2	-175.9	-0.3	114	V490 F491 L492	V490-R494 PolarHBondContact O-N 3.01Å; F491-R494 WeakPolarHBondContact O-CB 3.38Å; F491-R494 PolarHBondContact O-N 2.85Å; F491-R494 VanDerWaalsContact O-N 3.1Å; L492-R494 PolarHBondContact O-N 3.21Å; L492-R494 VanDerWaalsContact O-N 3.14Å
495	Q	42.3	Very low	49	Very low	122 Å²	122	91.5 Å²	91.5	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-76.9	-33.6	171.2	-80	-167.9	-20	0	0	111.7	F491 L492 Y497 Q498 F499	F491-Q495 PolarHBondContact O-N 3.39Å; L492-Q495 PolarHBondContact O-N 3.44Å; L492-Q495 VanDerWaalsContact O-N 3.11Å; Q495-Y497 VanDerWaalsContact C-N 3.32Å; Q495-Y497 PolarHBondContact O-N 2.94Å; Q495-Q498 CarbonylContact O-C 3.06Å; Q495-Q498 WeakPolarHBondContact O-CA 3.43Å; Q495-Q498 PolarHBondContact O-N 3.11Å; Q495-F499 PolarHBondContact O-N 2.8Å
496	V	40	Very low	47.3	Very low	31 Å²	31	94.3 Å²	94.3	19%	0.188	45%	0.447	C	S	.	.	H	α-helix	trans	-66.2	-32.3	174.7	169.3	0	0	0	0	112.1	L492 M493 Q498 F499 H500 W501	L492-V496 HydrophobicContact CD2-CG2 4.13Å; L492-V496 HydrophobicContact CG-CG2 4.48Å; L492-V496 WeakPolarHBondContact O-CB 3.18Å; L492-V496 VanDerWaalsContact O-CG2 3.26Å; L492-V496 WeakPolarHBondContact O-CG2 3.34Å; L492-V496 PolarHBondContact O-N 2.64Å; M493-V496 WeakPolarHBondContact O-CB 3.33Å; M493-V496 PolarHBondContact O-N 3.23Å; V496-Q498 PolarHBondContact O-N 3.32Å; V496-F499 CarbonylContact C-O 3.6Å; V496-F499 WeakPolarHBondContact CA-O 3.32Å; V496-F499 CarbonylContact O-C 3.53Å; V496-F499 PolarHBondContact O-N 2.91Å; V496-F499 VanDerWaalsContact O-N 3.11Å; V496-H500 PolarHBondContact O-N 2.92Å; V496-W501 HydrophobicContact CB-CB 4.39Å; V496-W501 HydrophobicContact CG1-CB 3.59Å; V496-W501 WeakPolarHBondContact CG1-OXT 3.15Å; V496-W501 HydrophobicContact CG2-CB 3.96Å
497	Y	31.9	Very low	46.1	Very low	164 Å²	164	97.5 Å²	97.5	64%	0.643	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.2	168	-80.1	-71.4	0	0	0	114.1	M493 Q495	M493-Y497 HydrophobicContact CB-CE2 4.42Å; M493-Y497 WeakPolarHBondContact O-CD2 3.4Å; M493-Y497 PolarHBondContact O-N 2.8Å; Q495-Y497 VanDerWaalsContact C-N 3.32Å; Q495-Y497 PolarHBondContact O-N 2.94Å
498	Q	30.5	Very low	44.6	Very low	167 Å²	167	101.3 Å²	101.3	78%	0.78	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-14	169.4	-80.5	-175.8	-31.9	0	0	113.2	Q495 V496	Q495-Q498 CarbonylContact O-C 3.06Å; Q495-Q498 WeakPolarHBondContact O-CA 3.43Å; Q495-Q498 PolarHBondContact O-N 3.11Å; V496-Q498 PolarHBondContact O-N 3.32Å
499	F	26.2	Very low	42.8	Very low	172 Å²	172	109 Å²	109	75%	0.754	49%	0.489	S	S	*	.	S	Bend	trans	-145.1	98.8	179.7	-87.6	-90.3	0	0	0	109.8	Q495 V496 W501	Q495-F499 PolarHBondContact O-N 2.8Å; V496-F499 CarbonylContact C-O 3.6Å; V496-F499 WeakPolarHBondContact CA-O 3.32Å; V496-F499 CarbonylContact O-C 3.53Å; V496-F499 PolarHBondContact O-N 2.91Å; V496-F499 VanDerWaalsContact O-N 3.11Å; F499-W501 PolarHBondContact O-N 3.34Å; F499-W501 VanDerWaalsContact O-N 3.12Å
500	H	23.8	Very low	40.8	Very low	187 Å²	187	115.2 Å²	115.2	87%	0.866	51%	0.51	S	S	*	.			trans	-29.8	103.5	179.9	-82.2	-70.2	0	0	0	117	V496	V496-H500 PolarHBondContact O-N 2.92Å
501	W	26.3	Very low	39.2	Very low	174 Å²	174	121.9 Å²	121.9	66%	0.659	53%	0.533	S	S	*	.			trans	-149.5	0	163.8	-96.1	93.6	0	0	0	109.3	R27 E460 V496 F499	R27-W501 PolarHBondContact NH2-O 3.24Å; E460-W501 HydrophobicContact CG-CH2 4.12Å; E460-W501 WeakPolarHBondContact OE1-CH2 3.44Å; E460-W501 VanDerWaalsContact OE2-CH2 3.23Å; E460-W501 WeakPolarHBondContact OE2-CH2 3.25Å; E460-W501 WeakPolarHBondContact OE2-CZ2 3.36Å; V496-W501 HydrophobicContact CB-CB 4.39Å; V496-W501 HydrophobicContact CG1-CB 3.59Å; V496-W501 WeakPolarHBondContact CG1-OXT 3.15Å; V496-W501 HydrophobicContact CG2-CB 3.96Å; F499-W501 PolarHBondContact O-N 3.34Å; F499-W501 VanDerWaalsContact O-N 3.12Å

Retrieved 501 of 501 residues in 638 ms (Link to these results)

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