A0A077ZGW2_TRITR Loading...

Na Ca ex and CBS and SIS and Hydrolase 3 domain c ontaining protein

AlphaFold DB , UniProt , Accession A0A077ZGW2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 768 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	72.5	Confident	84.4	Confident	166 Å²	166	76 Å²	76	82%	0.818	42%	0.42	S	S	*	.				0	-63.5	0	-63.4	-143.2	81	0	0	112.5	L3 A4 T5 L200	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 2.7Å; M1-A4 WeakPolarHBondContact O-CA 3.24Å; M1-A4 WeakPolarHBondContact O-CB 3.08Å; M1-A4 PolarHBondContact O-N 3.26Å; M1-T5 PolarHBondContact O-N 3.11Å; M1-T5 PolarHBondContact O-OG1 3.4Å; M1-T5 VanDerWaalsContact O-OG1 3.13Å; M1-L200 HydrophobicContact CE-CD2 3.11Å
2	L	80.9	Confident	84.7	Confident	155 Å²	155	75.3 Å²	75.3	81%	0.812	41%	0.414	S	S	*	.	H	α-helix	trans	-51.8	-45.4	-178.4	-119.6	149.7	0	0	0	114.5	T5 A6	L2-T5 PolarHBondContact O-N 3.41Å; L2-A6 WeakPolarHBondContact O-CB 3.35Å; L2-A6 PolarHBondContact O-N 2.95Å
3	L	84.9	Confident	85.2	Confident	127 Å²	127	78.7 Å²	78.7	67%	0.665	43%	0.43	S	S	*	.	H	α-helix	trans	-61.8	-43.5	174.4	179.9	64	0	0	0	112.2	M1 T5 A6 L7	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 2.7Å; L3-T5 VanDerWaalsContact C-N 3.35Å; L3-T5 PolarHBondContact O-N 3.29Å; L3-A6 PolarHBondContact O-N 3.03Å; L3-L7 HydrophobicContact CD1-CD1 4.23Å; L3-L7 HydrophobicContact CD1-CG 4.24Å; L3-L7 HydrophobicContact CG-CD1 4.05Å; L3-L7 HydrophobicContact CG-CG 4.45Å; L3-L7 WeakPolarHBondContact O-CB 3.45Å; L3-L7 WeakPolarHBondContact O-CG 3.16Å; L3-L7 PolarHBondContact O-N 2.72Å
4	A	80.3	Confident	85.8	Confident	11 Å²	11	77.6 Å²	77.6	9%	0.091	42%	0.424	C	S	.	.	H	α-helix	trans	-64.4	-41	179.1	0	0	0	0	0	111.5	M1 L7 L8 N196	M1-A4 WeakPolarHBondContact O-CA 3.24Å; M1-A4 WeakPolarHBondContact O-CB 3.08Å; M1-A4 PolarHBondContact O-N 3.26Å; A4-L7 PolarHBondContact O-N 3.11Å; A4-L8 VanDerWaalsContact O-CB 3.24Å; A4-L8 WeakPolarHBondContact O-CB 3.11Å; A4-L8 PolarHBondContact O-N 2.97Å; A4-N196 WeakPolarHBondContact CA-OD1 3.42Å; A4-N196 HydrophobicContact CB-CB 4.2Å; A4-N196 VanDerWaalsContact CB-OD1 3.3Å; A4-N196 WeakPolarHBondContact CB-OD1 3.29Å; A4-N196 WeakPolarHBondContact O-CB 3.37Å
5	T	79	Confident	86.2	Confident	67 Å²	67	72.6 Å²	72.6	41%	0.411	40%	0.396	S	S	.	.	H	α-helix	trans	-63.6	-42.5	174	-48.7	0	0	0	0	111.8	M1 L2 L3 L8 I9	M1-T5 PolarHBondContact O-N 3.11Å; M1-T5 PolarHBondContact O-OG1 3.4Å; M1-T5 VanDerWaalsContact O-OG1 3.13Å; L2-T5 PolarHBondContact O-N 3.41Å; L3-T5 VanDerWaalsContact C-N 3.35Å; L3-T5 PolarHBondContact O-N 3.29Å; T5-L8 PolarHBondContact O-N 3.48Å; T5-I9 HydrophobicContact CG2-CD1 4.37Å; T5-I9 WeakPolarHBondContact O-CG1 3.48Å; T5-I9 PolarHBondContact O-N 3.43Å
6	A	88	Confident	86.4	Confident	49 Å²	49	73.8 Å²	73.8	41%	0.405	41%	0.406	S	S	.	.	H	α-helix	trans	-63.7	-46.4	177.3	0	0	0	0	0	111.9	L2 L3 L8 I9 V10	L2-A6 WeakPolarHBondContact O-CB 3.35Å; L2-A6 PolarHBondContact O-N 2.95Å; L3-A6 PolarHBondContact O-N 3.03Å; A6-L8 VanDerWaalsContact C-N 3.32Å; A6-L8 PolarHBondContact O-N 3.44Å; A6-I9 PolarHBondContact O-N 3.45Å; A6-V10 WeakPolarHBondContact O-CG2 3.35Å; A6-V10 PolarHBondContact O-N 3.33Å
7	L	88.7	Confident	86.7	Confident	62 Å²	62	75.6 Å²	75.6	33%	0.325	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-38.1	176.5	-69.4	174.4	0	0	0	111.7	L3 A4 I9 V10 G11 M192 N196	L3-L7 HydrophobicContact CD1-CD1 4.23Å; L3-L7 HydrophobicContact CD1-CG 4.24Å; L3-L7 HydrophobicContact CG-CD1 4.05Å; L3-L7 HydrophobicContact CG-CG 4.45Å; L3-L7 WeakPolarHBondContact O-CB 3.45Å; L3-L7 WeakPolarHBondContact O-CG 3.16Å; L3-L7 PolarHBondContact O-N 2.72Å; A4-L7 PolarHBondContact O-N 3.11Å; L7-I9 PolarHBondContact O-N 2.62Å; L7-V10 PolarHBondContact O-N 3.35Å; L7-G11 PolarHBondContact O-N 2.84Å; L7-M192 HydrophobicContact CB-CG 4.03Å; L7-M192 HydrophobicContact CB-SD 4.08Å; L7-M192 HydrophobicContact CD2-SD 3.77Å; L7-M192 HydrophobicContact CG-SD 4.46Å; L7-M192 VanDerWaalsContact O-CE 3.22Å; L7-M192 WeakPolarHBondContact O-CE 3.35Å; L7-N196 WeakPolarHBondContact CB-ND2 3.26Å
8	L	84.4	Confident	86.9	Confident	38 Å²	38	71.5 Å²	71.5	20%	0.199	38%	0.384	C	S	.	.	H	α-helix	trans	-61.2	-43.4	174.9	-175.1	135.7	0	0	0	112	A4 T5 A6 G11 L12 V193 N196 A197	A4-L8 VanDerWaalsContact O-CB 3.24Å; A4-L8 WeakPolarHBondContact O-CB 3.11Å; A4-L8 PolarHBondContact O-N 2.97Å; T5-L8 PolarHBondContact O-N 3.48Å; A6-L8 VanDerWaalsContact C-N 3.32Å; A6-L8 PolarHBondContact O-N 3.44Å; L8-G11 PolarHBondContact O-N 3.15Å; L8-L12 HydrophobicContact CD2-CD1 3.82Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 2.82Å; L8-V193 HydrophobicContact CD1-CG1 4.39Å; L8-V193 HydrophobicContact CG-CG1 4.42Å; L8-N196 HydrophobicContact CB-CB 4.19Å; L8-N196 HydrophobicContact CD1-CB 4.43Å; L8-A197 HydrophobicContact CD1-CB 4.2Å
9	I	86.4	Confident	87.1	Confident	90 Å²	90	67.7 Å²	67.7	46%	0.462	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-46.6	176.4	-67.2	166.6	0	0	0	111.2	T5 A6 L7 G11 L12 L13	T5-I9 HydrophobicContact CG2-CD1 4.37Å; T5-I9 WeakPolarHBondContact O-CG1 3.48Å; T5-I9 PolarHBondContact O-N 3.43Å; A6-I9 PolarHBondContact O-N 3.45Å; L7-I9 PolarHBondContact O-N 2.62Å; I9-G11 VanDerWaalsContact C-N 3.26Å; I9-G11 PolarHBondContact O-N 2.84Å; I9-L12 PolarHBondContact O-N 3.2Å; I9-L13 HydrophobicContact CG2-CD1 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.47Å; I9-L13 PolarHBondContact O-N 2.59Å; I9-L13 VanDerWaalsContact O-N 3.1Å
10	V	92.4	Very high	87.2	Confident	71 Å²	71	66.5 Å²	66.5	43%	0.43	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-39.5	178	176.6	0	0	0	0	110.6	A6 L7 L13 L14 M192	A6-V10 WeakPolarHBondContact O-CG2 3.35Å; A6-V10 PolarHBondContact O-N 3.33Å; L7-V10 PolarHBondContact O-N 3.35Å; V10-L13 PolarHBondContact O-N 3.4Å; V10-L14 HydrophobicContact CG1-CD1 4.08Å; V10-L14 HydrophobicContact CG1-CG 4.45Å; V10-L14 WeakPolarHBondContact O-CG 3.31Å; V10-L14 PolarHBondContact O-N 3.18Å; V10-M192 HydrophobicContact CB-CE 3.97Å; V10-M192 HydrophobicContact CG1-CE 3.89Å
11	G	90.8	Very high	87.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-47.9	178.3	0	0	0	0	0	111.6	L7 L8 I9 L13 L14 V15	L7-G11 PolarHBondContact O-N 2.84Å; L8-G11 PolarHBondContact O-N 3.15Å; I9-G11 VanDerWaalsContact C-N 3.26Å; I9-G11 PolarHBondContact O-N 2.84Å; G11-L13 VanDerWaalsContact C-N 3.34Å; G11-L13 PolarHBondContact O-N 3.34Å; G11-L14 PolarHBondContact O-N 2.87Å; G11-V15 WeakPolarHBondContact O-CG2 2.94Å; G11-V15 PolarHBondContact O-N 2.92Å
12	L	88.4	Confident	88.3	Confident	67 Å²	67	58.8 Å²	58.8	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-57.9	-44.2	176.1	-74.4	166.3	0	0	0	112.4	L8 I9 L14 V15 V16 V193 L222	L8-L12 HydrophobicContact CD2-CD1 3.82Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 2.82Å; I9-L12 PolarHBondContact O-N 3.2Å; L12-L14 PolarHBondContact O-N 2.85Å; L12-V15 PolarHBondContact O-N 3.24Å; L12-V16 WeakPolarHBondContact O-CG2 3.21Å; L12-V16 PolarHBondContact O-N 3.1Å; L12-V16 VanDerWaalsContact O-N 3.07Å; L12-V193 HydrophobicContact CD2-CG2 4.45Å; L12-V193 HydrophobicContact CG-CG2 4.18Å; L12-L222 HydrophobicContact CD2-CD1 3.58Å; L12-L222 HydrophobicContact CD2-CD2 4.11Å; L12-L222 HydrophobicContact CD2-CG 4.48Å
13	L	90.9	Very high	88.6	Confident	120 Å²	120	51.4 Å²	51.4	63%	0.628	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-41.5	177.7	-69.9	173.7	0	0	0	112.2	I9 V10 G11 V16 Y17	I9-L13 HydrophobicContact CG2-CD1 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.47Å; I9-L13 PolarHBondContact O-N 2.59Å; I9-L13 VanDerWaalsContact O-N 3.1Å; V10-L13 PolarHBondContact O-N 3.4Å; G11-L13 VanDerWaalsContact C-N 3.34Å; G11-L13 PolarHBondContact O-N 3.34Å; L13-V16 PolarHBondContact O-N 2.92Å; L13-Y17 WeakPolarHBondContact O-CB 3.46Å; L13-Y17 PolarHBondContact O-N 3.18Å
14	L	93.7	Very high	88.8	Confident	64 Å²	64	47.4 Å²	47.4	34%	0.335	25%	0.253	S	S	.	.	H	α-helix	trans	-67.7	-38.1	177.4	-72.5	174.2	0	0	0	112.3	V10 G11 L12 Y17 S18 I185 A189 M192	V10-L14 HydrophobicContact CG1-CD1 4.08Å; V10-L14 HydrophobicContact CG1-CG 4.45Å; V10-L14 WeakPolarHBondContact O-CG 3.31Å; V10-L14 PolarHBondContact O-N 3.18Å; G11-L14 PolarHBondContact O-N 2.87Å; L12-L14 PolarHBondContact O-N 2.85Å; L14-Y17 PolarHBondContact O-N 2.97Å; L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.07Å; L14-I185 HydrophobicContact CB-CG2 4.21Å; L14-I185 HydrophobicContact CD2-CG2 4.35Å; L14-A189 HydrophobicContact CB-CB 3.55Å; L14-A189 HydrophobicContact CD1-CB 4.49Å; L14-M192 HydrophobicContact CD1-CE 4.39Å
15	V	91.1	Very high	89.2	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-49	174	171.7	0	0	0	0	110.2	G11 L12 Y17 S18 A19 A189 L222 P223 A226	G11-V15 WeakPolarHBondContact O-CG2 2.94Å; G11-V15 PolarHBondContact O-N 2.92Å; L12-V15 PolarHBondContact O-N 3.24Å; V15-Y17 PolarHBondContact O-N 3.23Å; V15-S18 PolarHBondContact O-N 3.33Å; V15-A19 VanDerWaalsContact O-CB 3.28Å; V15-A19 WeakPolarHBondContact O-CB 3.25Å; V15-A19 PolarHBondContact O-N 3.44Å; V15-A189 HydrophobicContact CG2-CB 3.68Å; V15-L222 HydrophobicContact CG1-CB 4.07Å; V15-P223 HydrophobicContact CG1-CB 4.49Å; V15-P223 HydrophobicContact CG1-CG 4.19Å; V15-A226 HydrophobicContact CG1-CB 4.1Å
16	V	89.4	Confident	89.8	Confident	91 Å²	91	43.7 Å²	43.7	55%	0.552	23%	0.229	S	C	*	.	H	α-helix	trans	-62	-44.1	179.5	173.7	0	0	0	0	111.6	L12 L13 A19 D20 A226	L12-V16 WeakPolarHBondContact O-CG2 3.21Å; L12-V16 PolarHBondContact O-N 3.1Å; L12-V16 VanDerWaalsContact O-N 3.07Å; L13-V16 PolarHBondContact O-N 2.92Å; V16-A19 PolarHBondContact O-N 3.17Å; V16-D20 PolarHBondContact O-N 2.93Å; V16-D20 VanDerWaalsContact O-N 3.08Å; V16-A226 HydrophobicContact CG2-CB 4.38Å
17	Y	91.4	Very high	89.8	Confident	105 Å²	105	41.5 Å²	41.5	41%	0.412	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-46.3	177.3	177.4	-99.1	0	0	0	112	L13 L14 V15 A19 D20 R21	L13-Y17 WeakPolarHBondContact O-CB 3.46Å; L13-Y17 PolarHBondContact O-N 3.18Å; L14-Y17 PolarHBondContact O-N 2.97Å; V15-Y17 PolarHBondContact O-N 3.23Å; Y17-A19 VanDerWaalsContact C-N 3.35Å; Y17-A19 PolarHBondContact O-N 3.32Å; Y17-D20 PolarHBondContact O-N 3.38Å; Y17-R21 HydrophobicContact CD1-CG 4.47Å; Y17-R21 HydrophobicContact CE1-CG 4.02Å; Y17-R21 HydrophobicContact CE2-CG 4.44Å; Y17-R21 WeakPolarHBondContact O-CG 3.42Å; Y17-R21 PolarHBondContact O-N 3.21Å
18	S	92	Very high	89.7	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-42.5	179.3	-167.9	0	0	0	0	111.6	L14 V15 D20 R21 L22 A182	L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.07Å; V15-S18 PolarHBondContact O-N 3.33Å; S18-D20 PolarHBondContact O-N 3.16Å; S18-R21 PolarHBondContact O-N 2.65Å; S18-L22 WeakPolarHBondContact O-CB 3.11Å; S18-L22 PolarHBondContact O-N 3.15Å; S18-A182 VanDerWaalsContact OG-CA 3.24Å; S18-A182 WeakPolarHBondContact OG-CA 3.13Å; S18-A182 PolarHBondContact OG-O 2.96Å
19	A	89.3	Confident	89.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-43.9	175.5	0	0	0	0	0	112.7	V15 V16 Y17 R21 L22 V23 M186 A226 T227	V15-A19 VanDerWaalsContact O-CB 3.28Å; V15-A19 WeakPolarHBondContact O-CB 3.25Å; V15-A19 PolarHBondContact O-N 3.44Å; V16-A19 PolarHBondContact O-N 3.17Å; Y17-A19 VanDerWaalsContact C-N 3.35Å; Y17-A19 PolarHBondContact O-N 3.32Å; A19-R21 VanDerWaalsContact C-N 3.32Å; A19-R21 PolarHBondContact O-N 3.22Å; A19-L22 PolarHBondContact O-N 3.4Å; A19-V23 WeakPolarHBondContact O-CG2 3.47Å; A19-V23 PolarHBondContact O-N 3.16Å; A19-M186 HydrophobicContact CB-CE 4.11Å; A19-A226 HydrophobicContact CB-CB 3.45Å; A19-A226 VanDerWaalsContact CB-CB 3.45Å; A19-T227 HydrophobicContact CB-CG2 3.55Å
20	D	88.9	Confident	89.8	Confident	43 Å²	43	33 Å²	33	23%	0.23	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-42.9	176.4	177.7	69.8	0	0	0	112.3	V16 Y17 S18 F24 K234	V16-D20 PolarHBondContact O-N 2.93Å; V16-D20 VanDerWaalsContact O-N 3.08Å; Y17-D20 PolarHBondContact O-N 3.38Å; S18-D20 PolarHBondContact O-N 3.16Å; D20-F24 WeakPolarHBondContact O-CB 3.44Å; D20-F24 PolarHBondContact O-N 2.83Å; D20-F24 VanDerWaalsContact O-N 3.07Å; D20-K234 PolarHBondContact O-NZ 3.17Å; D20-K234 WeakPolarHBondContact OD1-CE 3.45Å; D20-K234 IonicContact OD1-NZ 3.9Å; D20-K234 PolarHBondContact OD1-NZ 3Å; D20-K234 IonicContact OD2-NZ 3.34Å
21	R	90.5	Very high	89.3	Confident	69 Å²	69	33.1 Å²	33.1	26%	0.26	16%	0.16	S	C	.	.	H	α-helix	trans	-69.5	-37.7	177.4	-64.6	-61.5	110.5	162.9	6	112.2	Y17 S18 A19 F24 A25 W178	Y17-R21 HydrophobicContact CD1-CG 4.47Å; Y17-R21 HydrophobicContact CE1-CG 4.02Å; Y17-R21 HydrophobicContact CE2-CG 4.44Å; Y17-R21 WeakPolarHBondContact O-CG 3.42Å; Y17-R21 PolarHBondContact O-N 3.21Å; S18-R21 PolarHBondContact O-N 2.65Å; A19-R21 VanDerWaalsContact C-N 3.32Å; A19-R21 PolarHBondContact O-N 3.22Å; R21-F24 PolarHBondContact O-N 2.89Å; R21-A25 WeakPolarHBondContact O-CB 3.47Å; R21-A25 PolarHBondContact O-N 2.94Å; R21-W178 HydrophobicContact CB-CD2 4.31Å; R21-W178 HydrophobicContact CB-CE3 3.88Å; R21-W178 VanDerWaalsContact CD-CE3 3.46Å; R21-W178 HydrophobicContact CG-CD2 4.23Å; R21-W178 HydrophobicContact CG-CE3 3.62Å; R21-W178 HydrophobicContact CG-CZ3 3.79Å
22	L	92	Very high	88.9	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-48	177.4	-176.2	60.3	0	0	0	111.1	S18 A19 F24 A25 A26 V45 T49 L179 A182 M186 T227	S18-L22 WeakPolarHBondContact O-CB 3.11Å; S18-L22 PolarHBondContact O-N 3.15Å; A19-L22 PolarHBondContact O-N 3.4Å; L22-F24 VanDerWaalsContact C-N 3.33Å; L22-F24 PolarHBondContact O-N 3.26Å; L22-A25 PolarHBondContact O-N 2.98Å; L22-A26 WeakPolarHBondContact O-CB 3.46Å; L22-A26 PolarHBondContact O-N 3.09Å; L22-V45 HydrophobicContact CD2-CG1 4.07Å; L22-V45 HydrophobicContact CG-CG1 4.36Å; L22-T49 HydrophobicContact CD2-CG2 3.94Å; L22-L179 HydrophobicContact CD1-CD1 3.9Å; L22-A182 HydrophobicContact CB-CB 3.86Å; L22-A182 HydrophobicContact CD1-CB 4.04Å; L22-A182 HydrophobicContact CG-CB 4.46Å; L22-M186 HydrophobicContact CB-CE 4.36Å; L22-M186 HydrophobicContact CD2-CE 3.82Å; L22-M186 HydrophobicContact CD2-SD 4.05Å; L22-T227 HydrophobicContact CD2-CG2 4.11Å
23	V	89.2	Confident	88.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-43.8	175.9	170.9	0	0	0	0	110.5	A19 A25 A26 S27 T227 A230 K234 E236	A19-V23 WeakPolarHBondContact O-CG2 3.47Å; A19-V23 PolarHBondContact O-N 3.16Å; V23-A25 PolarHBondContact O-N 3.27Å; V23-A26 WeakPolarHBondContact O-CB 3.43Å; V23-A26 PolarHBondContact O-N 3.18Å; V23-S27 PolarHBondContact O-N 2.9Å; V23-S27 PolarHBondContact O-OG 3.31Å; V23-S27 VanDerWaalsContact O-OG 3.13Å; V23-T227 HydrophobicContact CG2-CG2 4.1Å; V23-A230 HydrophobicContact CG2-CB 4.16Å; V23-K234 HydrophobicContact CG1-CD 4.14Å; V23-E236 WeakPolarHBondContact CG1-OE2 3.37Å
24	F	88	Confident	88	Confident	43 Å²	43	32.4 Å²	32.4	19%	0.189	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-43.1	175.9	-177.4	-105	0	0	0	113.2	D20 R21 L22 S27 I28	D20-F24 WeakPolarHBondContact O-CB 3.44Å; D20-F24 PolarHBondContact O-N 2.83Å; D20-F24 VanDerWaalsContact O-N 3.07Å; R21-F24 PolarHBondContact O-N 2.89Å; L22-F24 VanDerWaalsContact C-N 3.33Å; L22-F24 PolarHBondContact O-N 3.26Å; F24-S27 PolarHBondContact O-N 2.6Å; F24-I28 HydrophobicContact CD1-CD1 4Å; F24-I28 HydrophobicContact CE1-CD1 3.52Å; F24-I28 HydrophobicContact CZ-CD1 3.9Å; F24-I28 PolarHBondContact O-N 2.93Å
25	A	89.8	Confident	87.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-42.6	176.1	0	0	0	0	0	111.6	R21 L22 V23 S27 I28 L29 A175 W178 L179	R21-A25 WeakPolarHBondContact O-CB 3.47Å; R21-A25 PolarHBondContact O-N 2.94Å; L22-A25 PolarHBondContact O-N 2.98Å; V23-A25 PolarHBondContact O-N 3.27Å; A25-S27 VanDerWaalsContact C-N 3.34Å; A25-S27 PolarHBondContact O-N 2.88Å; A25-I28 PolarHBondContact O-N 3.1Å; A25-L29 WeakPolarHBondContact O-CG 3.43Å; A25-L29 PolarHBondContact O-N 3.36Å; A25-A175 WeakPolarHBondContact CB-O 3.49Å; A25-W178 HydrophobicContact CB-CB 3.96Å; A25-L179 HydrophobicContact CB-CB 4.39Å; A25-L179 HydrophobicContact CB-CD1 4.49Å
26	A	90.1	Very high	87	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-45.6	176.6	0	0	0	0	0	111.7	L22 V23 I28 L29 C30 I40 V45 I239	L22-A26 WeakPolarHBondContact O-CB 3.46Å; L22-A26 PolarHBondContact O-N 3.09Å; V23-A26 WeakPolarHBondContact O-CB 3.43Å; V23-A26 PolarHBondContact O-N 3.18Å; A26-I28 VanDerWaalsContact C-N 3.33Å; A26-I28 PolarHBondContact O-N 2.81Å; A26-L29 WeakPolarHBondContact O-CA 3.4Å; A26-L29 WeakPolarHBondContact O-CB 3.44Å; A26-L29 PolarHBondContact O-N 2.97Å; A26-C30 PolarHBondContact O-N 3.27Å; A26-C30 PolarHBondContact O-SG 3.03Å; A26-I40 HydrophobicContact CB-CG2 3.69Å; A26-V45 HydrophobicContact CB-CG2 3.49Å; A26-V45 VanDerWaalsContact CB-CG2 3.49Å; A26-I239 HydrophobicContact CB-CD1 4.3Å
27	S	87.9	Confident	86.7	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-38.9	177.7	-59.4	0	0	0	0	113.5	V23 F24 A25 L29 C30 R31 E236 I239	V23-S27 PolarHBondContact O-N 2.9Å; V23-S27 PolarHBondContact O-OG 3.31Å; V23-S27 VanDerWaalsContact O-OG 3.13Å; F24-S27 PolarHBondContact O-N 2.6Å; A25-S27 VanDerWaalsContact C-N 3.34Å; A25-S27 PolarHBondContact O-N 2.88Å; S27-L29 VanDerWaalsContact C-N 3.32Å; S27-C30 PolarHBondContact O-N 3.35Å; S27-R31 PolarHBondContact O-N 3.44Å; S27-R31 VanDerWaalsContact O-N 3.13Å; S27-E236 WeakPolarHBondContact CB-OE1 3.33Å; S27-E236 PolarHBondContact OG-OE1 3.12Å; S27-E236 PolarHBondContact OG-OE2 3.21Å; S27-I239 WeakPolarHBondContact OG-CD1 3.39Å
28	I	86.8	Confident	86.4	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-39.1	174.1	-61.5	167.6	0	0	0	110.6	F24 A25 A26 R31 T32 A175	F24-I28 HydrophobicContact CD1-CD1 4Å; F24-I28 HydrophobicContact CE1-CD1 3.52Å; F24-I28 HydrophobicContact CZ-CD1 3.9Å; F24-I28 PolarHBondContact O-N 2.93Å; A25-I28 PolarHBondContact O-N 3.1Å; A26-I28 VanDerWaalsContact C-N 3.33Å; A26-I28 PolarHBondContact O-N 2.81Å; I28-R31 PolarHBondContact O-N 2.83Å; I28-T32 WeakPolarHBondContact O-CB 3.36Å; I28-T32 PolarHBondContact O-N 2.7Å; I28-T32 PolarHBondContact O-OG1 2.95Å; I28-A175 HydrophobicContact CB-CB 3.83Å; I28-A175 HydrophobicContact CD1-CB 4.32Å; I28-A175 HydrophobicContact CG2-CB 3.7Å
29	L	87.3	Confident	86.1	Confident	9 Å²	9	23.7 Å²	23.7	5%	0.047	12%	0.118	C	C	.	.	H	α-helix	trans	-64.6	-44.8	176.9	-66.9	171.1	0	0	0	111.5	A25 A26 S27 R31 T32 F33 V44 A175 L179	A25-L29 WeakPolarHBondContact O-CG 3.43Å; A25-L29 PolarHBondContact O-N 3.36Å; A26-L29 WeakPolarHBondContact O-CA 3.4Å; A26-L29 WeakPolarHBondContact O-CB 3.44Å; A26-L29 PolarHBondContact O-N 2.97Å; S27-L29 VanDerWaalsContact C-N 3.32Å; L29-R31 VanDerWaalsContact C-N 3.31Å; L29-R31 PolarHBondContact O-N 3.38Å; L29-T32 PolarHBondContact O-N 3.38Å; L29-F33 HydrophobicContact CB-CD2 4.47Å; L29-F33 HydrophobicContact CD2-CD2 4.12Å; L29-F33 HydrophobicContact CD2-CE2 3.69Å; L29-F33 WeakPolarHBondContact O-CD2 3.39Å; L29-F33 PolarHBondContact O-N 3.07Å; L29-V44 HydrophobicContact CD1-CG1 4.1Å; L29-A175 HydrophobicContact CD2-CB 4.27Å; L29-A175 HydrophobicContact CG-CB 4.32Å; L29-L179 HydrophobicContact CD1-CD1 4.26Å
30	C	85.8	Confident	86.1	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-52.1	-51.9	174.1	-59.8	0	0	0	0	110.7	A26 S27 T32 G34 I35 P37 I40 L163 L166	A26-C30 PolarHBondContact O-N 3.27Å; A26-C30 PolarHBondContact O-SG 3.03Å; S27-C30 PolarHBondContact O-N 3.35Å; C30-T32 PolarHBondContact O-N 3.14Å; C30-G34 VanDerWaalsContact O-CA 3.32Å; C30-G34 WeakPolarHBondContact O-CA 3.33Å; C30-G34 PolarHBondContact O-N 3.2Å; C30-I35 WeakPolarHBondContact CA-O 3.1Å; C30-I35 PolarHBondContact O-N 3.03Å; C30-P37 HydrophobicContact CB-CG 4.49Å; C30-I40 VanDerWaalsContact SG-CB 3.58Å; C30-I40 VanDerWaalsContact SG-CG1 3.52Å; C30-L163 HydrophobicContact CB-CD2 3.96Å; C30-L163 WeakPolarHBondContact O-CD2 3.31Å; C30-L166 HydrophobicContact CB-CD1 3.79Å
31	R	82.1	Confident	86.2	Confident	74 Å²	74	22 Å²	22	28%	0.279	11%	0.109	S	C	.	.	H	α-helix	trans	-63.6	-42.5	-179	-164.8	-173.5	72.6	-146.4	0.9	113.1	S27 I28 L29 P167 R168 G170	S27-R31 PolarHBondContact O-N 3.44Å; S27-R31 VanDerWaalsContact O-N 3.13Å; I28-R31 PolarHBondContact O-N 2.83Å; L29-R31 VanDerWaalsContact C-N 3.31Å; L29-R31 PolarHBondContact O-N 3.38Å; R31-P167 PolarHBondContact NH1-O 3Å; R31-R168 PolarHBondContact NH1-O 3.42Å; R31-R168 VanDerWaalsContact NH1-O 3.1Å; R31-G170 PolarHBondContact NH2-O 3.19Å
32	T	82.9	Confident	86.1	Confident	66 Å²	66	18.8 Å²	18.8	41%	0.405	10%	0.097	S	C	.	.	H	α-helix	trans	-77.1	-35.5	-172	-49.1	0	0	0	0	112.3	I28 L29 C30 L172	I28-T32 WeakPolarHBondContact O-CB 3.36Å; I28-T32 PolarHBondContact O-N 2.7Å; I28-T32 PolarHBondContact O-OG1 2.95Å; L29-T32 PolarHBondContact O-N 3.38Å; C30-T32 PolarHBondContact O-N 3.14Å; T32-L172 HydrophobicContact CG2-CD1 3.41Å; T32-L172 VanDerWaalsContact CG2-CD1 3.41Å
33	F	81.9	Confident	86	Confident	86 Å²	86	19.7 Å²	19.7	38%	0.377	10%	0.102	S	C	.	.	H	α-helix	trans	-97.9	-3.6	179.7	-66.6	-70.3	0	0	0	113.6	L29 I35 L172	L29-F33 HydrophobicContact CB-CD2 4.47Å; L29-F33 HydrophobicContact CD2-CD2 4.12Å; L29-F33 HydrophobicContact CD2-CE2 3.69Å; L29-F33 WeakPolarHBondContact O-CD2 3.39Å; L29-F33 PolarHBondContact O-N 3.07Å; F33-I35 HydrophobicContact CB-CD1 3.67Å; F33-I35 HydrophobicContact CB-CG1 3.75Å; F33-I35 HydrophobicContact CG-CD1 4.43Å; F33-I35 PolarHBondContact O-N 3.08Å; F33-L172 HydrophobicContact CE2-CD1 3.71Å; F33-L172 HydrophobicContact CZ-CD1 3.79Å
34	G	77.1	Confident	86	Confident	19 Å²	19	21.7 Å²	21.7	20%	0.196	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	25.6	-176.2	0	0	0	0	0	113.2	C30	C30-G34 VanDerWaalsContact O-CA 3.32Å; C30-G34 WeakPolarHBondContact O-CA 3.33Å; C30-G34 PolarHBondContact O-N 3.2Å
35	I	81.9	Confident	86.2	Confident	28 Å²	28	19.7 Å²	19.7	14%	0.144	11%	0.106	C	C	.	.			trans	-88.9	134.6	-178.5	-61.7	173	0	0	0	108.5	C30 F33 I39 I40 A147	C30-I35 WeakPolarHBondContact CA-O 3.1Å; C30-I35 PolarHBondContact O-N 3.03Å; F33-I35 HydrophobicContact CB-CD1 3.67Å; F33-I35 HydrophobicContact CB-CG1 3.75Å; F33-I35 HydrophobicContact CG-CD1 4.43Å; F33-I35 PolarHBondContact O-N 3.08Å; I35-I39 HydrophobicContact CG2-CB 3.87Å; I35-I39 HydrophobicContact CG2-CG2 3.73Å; I35-I40 HydrophobicContact CB-CD1 4.16Å; I35-I40 HydrophobicContact CB-CG1 4.12Å; I35-I40 HydrophobicContact CD1-CD1 4.15Å; I35-I40 HydrophobicContact CG2-CD1 3.9Å; I35-I40 HydrophobicContact CG2-CG1 3.81Å; I35-A147 HydrophobicContact CG2-CB 4.34Å
36	P	82	Confident	86.3	Confident	17 Å²	17	19.7 Å²	19.7	11%	0.11	11%	0.106	C	C	.	.			trans	-52.3	135.9	175.5	-28.4	33.9	0	0	0	112.9	L38 I39 I40 A150 T159	P36-L38 PolarHBondContact O-N 3.41Å; P36-I39 HydrophobicContact CB-CD1 4.3Å; P36-I39 HydrophobicContact CB-CG1 4.28Å; P36-I39 HydrophobicContact CG-CD1 4.05Å; P36-I39 WeakPolarHBondContact O-CB 3.49Å; P36-I39 PolarHBondContact O-N 3.28Å; P36-I40 PolarHBondContact O-N 2.97Å; P36-A150 HydrophobicContact CG-CB 3.79Å; P36-T159 HydrophobicContact CB-CG2 4.47Å; P36-T159 HydrophobicContact CG-CG2 4.04Å
37	P	85	Confident	86.2	Confident	6 Å²	6	23.2 Å²	23.2	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-56.5	-34.9	-178.9	-25.3	33.1	0	0	0	114.3	C30 I39 I40 G41 Q162 D238 I239	C30-P37 HydrophobicContact CB-CG 4.49Å; P37-I39 VanDerWaalsContact C-N 3.3Å; P37-I39 PolarHBondContact O-N 2.9Å; P37-I40 PolarHBondContact O-N 3.06Å; P37-G41 PolarHBondContact O-N 2.84Å; P37-Q162 HydrophobicContact CG-CB 4.43Å; P37-D238 HydrophobicContact CB-CB 4.07Å; P37-I239 HydrophobicContact CB-CD1 4.34Å; P37-I239 HydrophobicContact CB-CG1 3.66Å
38	L	85	Confident	86.3	Confident	20 Å²	20	23.1 Å²	23.1	11%	0.105	12%	0.123	C	C	.	.	H	α-helix	trans	-56.4	-43	174.3	-177.2	70.3	0	0	0	112.4	P36 G41 M42 V100 E104 D238 V241	P36-L38 PolarHBondContact O-N 3.41Å; L38-G41 PolarHBondContact O-N 3.16Å; L38-M42 HydrophobicContact CD2-CE 4.36Å; L38-M42 HydrophobicContact CG-CE 4.02Å; L38-M42 HydrophobicContact CG-SD 4.42Å; L38-M42 WeakPolarHBondContact O-CG 3.47Å; L38-M42 PolarHBondContact O-N 2.83Å; L38-V100 HydrophobicContact CD1-CG2 3.79Å; L38-V100 HydrophobicContact CD2-CG2 3.63Å; L38-V100 HydrophobicContact CG-CG2 4.38Å; L38-E104 HydrophobicContact CD2-CG 4.37Å; L38-D238 WeakPolarHBondContact CA-O 3.41Å; L38-D238 HydrophobicContact CB-CB 4.3Å; L38-V241 HydrophobicContact CD1-CG1 4.31Å
39	I	85.7	Confident	86.6	Confident	11 Å²	11	23 Å²	23	6%	0.056	12%	0.123	C	C	.	.	H	α-helix	trans	-70.4	-41.5	-177.8	-67.7	-178.5	0	0	0	110.9	I35 P36 P37 G41 M42 T43 I143 L146 A147	I35-I39 HydrophobicContact CG2-CB 3.87Å; I35-I39 HydrophobicContact CG2-CG2 3.73Å; P36-I39 HydrophobicContact CB-CD1 4.3Å; P36-I39 HydrophobicContact CB-CG1 4.28Å; P36-I39 HydrophobicContact CG-CD1 4.05Å; P36-I39 WeakPolarHBondContact O-CB 3.49Å; P36-I39 PolarHBondContact O-N 3.28Å; P37-I39 VanDerWaalsContact C-N 3.3Å; P37-I39 PolarHBondContact O-N 2.9Å; I39-G41 VanDerWaalsContact C-N 3.32Å; I39-M42 HydrophobicContact CG1-CE 4.24Å; I39-M42 PolarHBondContact O-N 3.08Å; I39-T43 WeakPolarHBondContact O-CB 3.49Å; I39-T43 WeakPolarHBondContact O-CG2 3.47Å; I39-T43 PolarHBondContact O-N 3.46Å; I39-T43 VanDerWaalsContact O-N 3.07Å; I39-T43 PolarHBondContact O-OG1 3.32Å; I39-I143 HydrophobicContact CG2-CG2 3.75Å; I39-L146 HydrophobicContact CD1-CB 4.33Å; I39-A147 HydrophobicContact CD1-CB 4.28Å; I39-A147 HydrophobicContact CG2-CB 3.83Å
40	I	89.1	Confident	86.8	Confident	8 Å²	8	22.8 Å²	22.8	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-39.6	175.2	-66.6	-62.6	0	0	0	110.6	A26 C30 I35 P36 P37 T43 V44 V45	A26-I40 HydrophobicContact CB-CG2 3.69Å; C30-I40 VanDerWaalsContact SG-CB 3.58Å; C30-I40 VanDerWaalsContact SG-CG1 3.52Å; I35-I40 HydrophobicContact CB-CD1 4.16Å; I35-I40 HydrophobicContact CB-CG1 4.12Å; I35-I40 HydrophobicContact CD1-CD1 4.15Å; I35-I40 HydrophobicContact CG2-CD1 3.9Å; I35-I40 HydrophobicContact CG2-CG1 3.81Å; P36-I40 PolarHBondContact O-N 2.97Å; P37-I40 PolarHBondContact O-N 3.06Å; I40-T43 PolarHBondContact O-N 3.01Å; I40-V44 HydrophobicContact CD1-CG2 4.25Å; I40-V44 HydrophobicContact CG2-CB 4.2Å; I40-V44 PolarHBondContact O-N 3.43Å; I40-V45 HydrophobicContact CG2-CG2 4.47Å; I40-V45 PolarHBondContact O-N 2.79Å; I40-V45 VanDerWaalsContact O-N 3.12Å
41	G	90.2	Very high	87	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.135	C	C	.	.	I	π-helix	trans	-56.2	-53	170.9	0	0	0	0	0	112.2	P37 L38 I39 T43 S46 G242 N243	P37-G41 PolarHBondContact O-N 2.84Å; L38-G41 PolarHBondContact O-N 3.16Å; I39-G41 VanDerWaalsContact C-N 3.32Å; G41-T43 PolarHBondContact O-N 3.02Å; G41-T43 VanDerWaalsContact O-N 3.15Å; G41-S46 PolarHBondContact O-N 3.39Å; G41-S46 PolarHBondContact O-OG 3.09Å; G41-G242 CarbonylContact C-O 3.57Å; G41-N243 WeakPolarHBondContact O-CA 3.45Å
42	M	88.8	Confident	87.4	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.	I	π-helix	trans	-67.9	-8.9	179.6	-69.6	-173.9	-55.3	0	0	114.6	L38 I39 S46 E104 W139 I143 G242 I245	L38-M42 HydrophobicContact CD2-CE 4.36Å; L38-M42 HydrophobicContact CG-CE 4.02Å; L38-M42 HydrophobicContact CG-SD 4.42Å; L38-M42 WeakPolarHBondContact O-CG 3.47Å; L38-M42 PolarHBondContact O-N 2.83Å; I39-M42 HydrophobicContact CG1-CE 4.24Å; I39-M42 PolarHBondContact O-N 3.08Å; M42-S46 PolarHBondContact O-OG 2.83Å; M42-E104 HydrophobicContact CE-CG 4.28Å; M42-E104 HydrophobicContact SD-CB 4.33Å; M42-E104 HydrophobicContact SD-CG 3.99Å; M42-W139 WeakPolarHBondContact O-CH2 3.23Å; M42-I143 HydrophobicContact CB-CD1 4.12Å; M42-I143 HydrophobicContact CE-CD1 4.38Å; M42-G242 WeakPolarHBondContact CA-O 3.41Å; M42-G242 WeakPolarHBondContact CG-O 3.39Å; M42-G242 PolarHBondContact N-O 3.42Å; M42-I245 HydrophobicContact CG-CB 4.45Å; M42-I245 HydrophobicContact SD-CG2 4.13Å
43	T	88.8	Confident	87.8	Confident	20 Å²	20	18.8 Å²	18.8	12%	0.123	10%	0.104	C	C	.	.	I	π-helix	trans	-122.1	-82.5	-178.1	52	0	0	0	0	110.4	I39 I40 G41 V45 S46 I47 I143	I39-T43 WeakPolarHBondContact O-CB 3.49Å; I39-T43 WeakPolarHBondContact O-CG2 3.47Å; I39-T43 PolarHBondContact O-N 3.46Å; I39-T43 VanDerWaalsContact O-N 3.07Å; I39-T43 PolarHBondContact O-OG1 3.32Å; I40-T43 PolarHBondContact O-N 3.01Å; G41-T43 PolarHBondContact O-N 3.02Å; G41-T43 VanDerWaalsContact O-N 3.15Å; T43-V45 PolarHBondContact O-N 2.82Å; T43-S46 PolarHBondContact O-N 3.14Å; T43-S46 PolarHBondContact O-OG 3.1Å; T43-I47 VanDerWaalsContact O-CB 3.28Å; T43-I47 WeakPolarHBondContact O-CB 3.33Å; T43-I47 WeakPolarHBondContact O-CD1 3.27Å; T43-I47 WeakPolarHBondContact O-CG1 3.24Å; T43-I47 PolarHBondContact O-N 3.34Å; T43-I143 HydrophobicContact CG2-CB 4.25Å; T43-I143 HydrophobicContact CG2-CD1 4.34Å; T43-I143 HydrophobicContact CG2-CG2 3.42Å; T43-I143 VanDerWaalsContact CG2-CG2 3.42Å
44	V	89.6	Confident	88.3	Confident	42 Å²	42	16.2 Å²	16.2	26%	0.255	10%	0.095	S	C	.	.	I	π-helix	trans	-61.1	-45.3	-172	179.7	0	0	0	0	111.8	L29 I40 G48 L179	L29-V44 HydrophobicContact CD1-CG1 4.1Å; I40-V44 HydrophobicContact CD1-CG2 4.25Å; I40-V44 HydrophobicContact CG2-CB 4.2Å; I40-V44 PolarHBondContact O-N 3.43Å; V44-G48 PolarHBondContact O-N 3.09Å; V44-L179 HydrophobicContact CG1-CD1 3.35Å
45	V	92.1	Very high	88.9	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.103	C	C	.	.	I	π-helix	trans	-70.9	-51.9	-178.5	-173	0	0	0	0	110.2	L22 A26 I40 T43 I47 G48 T49 T227 I239 N243	L22-V45 HydrophobicContact CD2-CG1 4.07Å; L22-V45 HydrophobicContact CG-CG1 4.36Å; A26-V45 HydrophobicContact CB-CG2 3.49Å; A26-V45 VanDerWaalsContact CB-CG2 3.49Å; I40-V45 HydrophobicContact CG2-CG2 4.47Å; I40-V45 PolarHBondContact O-N 2.79Å; I40-V45 VanDerWaalsContact O-N 3.12Å; T43-V45 PolarHBondContact O-N 2.82Å; V45-I47 PolarHBondContact O-N 3.02Å; V45-G48 CarbonylContact O-C 3.59Å; V45-G48 WeakPolarHBondContact O-CA 3.29Å; V45-G48 PolarHBondContact O-N 2.82Å; V45-T49 HydrophobicContact CG1-CG2 4.2Å; V45-T49 WeakPolarHBondContact O-CG2 3.46Å; V45-T49 PolarHBondContact O-N 3.36Å; V45-T49 PolarHBondContact O-OG1 2.96Å; V45-T227 HydrophobicContact CG1-CG2 4.26Å; V45-I239 HydrophobicContact CG2-CG2 3.84Å; V45-N243 HydrophobicContact CG1-CB 4.08Å; V45-N243 WeakPolarHBondContact CG1-OD1 3.29Å
46	S	91.8	Very high	89.1	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-39.3	-179.9	62.9	0	0	0	0	114.6	G41 M42 T43 G48 T49 S50 N243	G41-S46 PolarHBondContact O-N 3.39Å; G41-S46 PolarHBondContact O-OG 3.09Å; M42-S46 PolarHBondContact O-OG 2.83Å; T43-S46 PolarHBondContact O-N 3.14Å; T43-S46 PolarHBondContact O-OG 3.1Å; S46-G48 VanDerWaalsContact C-N 3.25Å; S46-G48 PolarHBondContact O-N 3.35Å; S46-T49 PolarHBondContact O-N 3.48Å; S46-T49 PolarHBondContact O-OG1 2.94Å; S46-S50 WeakPolarHBondContact O-CB 3.39Å; S46-S50 PolarHBondContact O-N 3.01Å; S46-S50 PolarHBondContact O-OG 3.32Å; S46-S50 VanDerWaalsContact O-OG 3.06Å; S46-N243 WeakPolarHBondContact CA-OD1 3.42Å; S46-N243 PolarHBondContact N-OD1 2.99Å; S46-N243 VanDerWaalsContact N-OD1 3.14Å
47	I	89.5	Confident	89.4	Confident	75 Å²	75	17.7 Å²	17.7	39%	0.385	10%	0.098	S	C	.	.	H	α-helix	trans	-60.7	-41.8	172.4	-68.6	165.7	0	0	0	110.1	T43 V45 L51 F250	T43-I47 VanDerWaalsContact O-CB 3.28Å; T43-I47 WeakPolarHBondContact O-CB 3.33Å; T43-I47 WeakPolarHBondContact O-CD1 3.27Å; T43-I47 WeakPolarHBondContact O-CG1 3.24Å; T43-I47 PolarHBondContact O-N 3.34Å; V45-I47 PolarHBondContact O-N 3.02Å; I47-L51 PolarHBondContact O-N 3.1Å; I47-F250 HydrophobicContact CD1-CE1 4.49Å; I47-F250 HydrophobicContact CD1-CE2 4.12Å; I47-F250 HydrophobicContact CD1-CZ 3.62Å; I47-F250 HydrophobicContact CG1-CD2 4.26Å; I47-F250 HydrophobicContact CG1-CE1 3.85Å; I47-F250 HydrophobicContact CG1-CE2 3.36Å; I47-F250 HydrophobicContact CG1-CZ 3.12Å
48	G	89.3	Confident	89.6	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-44.2	178.8	0	0	0	0	0	112.6	V44 V45 S46	V44-G48 PolarHBondContact O-N 3.09Å; V45-G48 CarbonylContact O-C 3.59Å; V45-G48 WeakPolarHBondContact O-CA 3.29Å; V45-G48 PolarHBondContact O-N 2.82Å; S46-G48 VanDerWaalsContact C-N 3.25Å; S46-G48 PolarHBondContact O-N 3.35Å
49	T	92.1	Very high	89.6	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-77.3	-32.9	-176.6	60.7	0	0	0	0	113.1	L22 V45 S46 L51 P52 M186 P223 E224 T227 N243	L22-T49 HydrophobicContact CD2-CG2 3.94Å; V45-T49 HydrophobicContact CG1-CG2 4.2Å; V45-T49 WeakPolarHBondContact O-CG2 3.46Å; V45-T49 PolarHBondContact O-N 3.36Å; V45-T49 PolarHBondContact O-OG1 2.96Å; S46-T49 PolarHBondContact O-N 3.48Å; S46-T49 PolarHBondContact O-OG1 2.94Å; T49-L51 VanDerWaalsContact C-N 3.35Å; T49-P52 WeakPolarHBondContact O-CD 3.47Å; T49-M186 HydrophobicContact CG2-SD 4.13Å; T49-P223 HydrophobicContact CG2-CB 4.03Å; T49-E224 VanDerWaalsContact CB-CD 3.44Å; T49-E224 WeakPolarHBondContact CB-OE1 3.47Å; T49-E224 VanDerWaalsContact OG1-CD 3.29Å; T49-E224 PolarHBondContact OG1-OE1 3.27Å; T49-T227 HydrophobicContact CG2-CG2 3.6Å; T49-N243 PolarHBondContact OG1-OD1 3.21Å
50	S	92	Very high	89.5	Confident	4 Å²	4	20.3 Å²	20.3	3%	0.028	12%	0.117	C	C	.	.	S	Bend	trans	-88.6	2.8	-177	-51.6	0	0	0	0	114.3	S46 P52 E53 V54 E224 A247	S46-S50 WeakPolarHBondContact O-CB 3.39Å; S46-S50 PolarHBondContact O-N 3.01Å; S46-S50 PolarHBondContact O-OG 3.32Å; S46-S50 VanDerWaalsContact O-OG 3.06Å; S50-P52 VanDerWaalsContact C-CD 3.42Å; S50-E53 WeakPolarHBondContact CA-OE2 3.19Å; S50-E53 PolarHBondContact O-N 3.48Å; S50-V54 WeakPolarHBondContact O-CG2 3.23Å; S50-V54 PolarHBondContact O-N 2.97Å; S50-E224 WeakPolarHBondContact CA-OE1 3.49Å; S50-E224 PolarHBondContact N-OE1 3.27Å; S50-E224 PolarHBondContact OG-OE1 3.07Å; S50-A247 WeakPolarHBondContact OG-CB 3.43Å
51	L	90.8	Very high	89.4	Confident	53 Å²	53	19.9 Å²	19.9	28%	0.277	12%	0.116	S	C	.	.	H	α-helix	trans	-56.4	-42.2	171.6	-100.2	154	0	0	0	114.1	I47 T49 V54 I55 L183 P187	I47-L51 PolarHBondContact O-N 3.1Å; T49-L51 VanDerWaalsContact C-N 3.35Å; L51-V54 PolarHBondContact O-N 3.47Å; L51-I55 WeakPolarHBondContact O-CD1 3.35Å; L51-I55 VanDerWaalsContact O-CG1 3.3Å; L51-I55 WeakPolarHBondContact O-CG1 3.16Å; L51-I55 PolarHBondContact O-N 3.18Å; L51-L183 HydrophobicContact CD1-CD2 3.41Å; L51-L183 VanDerWaalsContact CD1-CD2 3.41Å; L51-P187 HydrophobicContact CB-CG 4.1Å
52	P	90.2	Very high	89.2	Confident	4 Å²	4	25.6 Å²	25.6	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-42.5	175.8	-20.1	33.8	0	0	0	112.8	T49 S50 V54 I55 V56 T190 P223	T49-P52 WeakPolarHBondContact O-CD 3.47Å; S50-P52 VanDerWaalsContact C-CD 3.42Å; P52-V54 VanDerWaalsContact C-N 3.34Å; P52-V54 PolarHBondContact O-N 3.19Å; P52-I55 PolarHBondContact O-N 3.36Å; P52-V56 WeakPolarHBondContact O-CB 2.89Å; P52-V56 WeakPolarHBondContact O-CG2 3.44Å; P52-V56 PolarHBondContact O-N 2.9Å; P52-T190 HydrophobicContact CB-CG2 3.42Å; P52-T190 VanDerWaalsContact CB-CG2 3.42Å; P52-T190 HydrophobicContact CG-CG2 3.88Å; P52-P223 HydrophobicContact CG-CG 4.15Å
53	E	91.6	Very high	88.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.7	-46.8	174.4	-76.7	81.5	167.3	0	0	110.9	S50 I55 V56 S57 T72 S76 S221 V255	S50-E53 WeakPolarHBondContact CA-OE2 3.19Å; S50-E53 PolarHBondContact O-N 3.48Å; E53-I55 PolarHBondContact O-N 3.11Å; E53-V56 PolarHBondContact O-N 2.79Å; E53-S57 WeakPolarHBondContact O-CB 3.46Å; E53-S57 PolarHBondContact O-N 3.08Å; E53-T72 HydrophobicContact CG-CG2 4.49Å; E53-S76 WeakPolarHBondContact CG-OG 3.39Å; E53-S221 WeakPolarHBondContact OE1-CA 3.24Å; E53-S221 PolarHBondContact OE1-N 3.39Å; E53-S221 PolarHBondContact OE1-OG 2.87Å; E53-V255 HydrophobicContact CB-CG1 4.04Å; E53-V255 HydrophobicContact CB-CG2 3.91Å
54	V	91.1	Very high	88.5	Confident	31 Å²	31	38.8 Å²	38.8	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-48.3	175.9	173.1	0	0	0	0	110.8	S50 L51 P52 L58 I254 V255 L258	S50-V54 WeakPolarHBondContact O-CG2 3.23Å; S50-V54 PolarHBondContact O-N 2.97Å; L51-V54 PolarHBondContact O-N 3.47Å; P52-V54 VanDerWaalsContact C-N 3.34Å; P52-V54 PolarHBondContact O-N 3.19Å; V54-L58 HydrophobicContact CG1-CD1 3.65Å; V54-L58 HydrophobicContact CG1-CG 4.34Å; V54-L58 VanDerWaalsContact O-CB 3.23Å; V54-L58 WeakPolarHBondContact O-CB 3.28Å; V54-L58 WeakPolarHBondContact O-CD1 3.49Å; V54-L58 VanDerWaalsContact O-CG 3.22Å; V54-L58 WeakPolarHBondContact O-CG 3.47Å; V54-L58 PolarHBondContact O-N 3.47Å; V54-I254 HydrophobicContact CG2-CG2 4.21Å; V54-V255 HydrophobicContact CG2-CG2 3.66Å; V54-L258 HydrophobicContact CG1-CD1 3.92Å
55	I	89.7	Confident	88.1	Confident	71 Å²	71	39.8 Å²	39.8	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-46.4	-178.2	-70.4	162.6	0	0	0	111.1	L51 P52 E53 A59 P187	L51-I55 WeakPolarHBondContact O-CD1 3.35Å; L51-I55 VanDerWaalsContact O-CG1 3.3Å; L51-I55 WeakPolarHBondContact O-CG1 3.16Å; L51-I55 PolarHBondContact O-N 3.18Å; P52-I55 PolarHBondContact O-N 3.36Å; E53-I55 PolarHBondContact O-N 3.11Å; I55-A59 VanDerWaalsContact O-CB 3.26Å; I55-A59 WeakPolarHBondContact O-CB 3.36Å; I55-A59 PolarHBondContact O-N 3.46Å; I55-P187 HydrophobicContact CD1-CB 3.75Å; I55-P187 HydrophobicContact CD1-CG 4.36Å
56	V	87.3	Confident	87.7	Confident	23 Å²	23	43.7 Å²	43.7	14%	0.139	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-44.1	-178.4	172.7	0	0	0	0	110.9	P52 E53 A59 A60 T72 I216 T220	P52-V56 WeakPolarHBondContact O-CB 2.89Å; P52-V56 WeakPolarHBondContact O-CG2 3.44Å; P52-V56 PolarHBondContact O-N 2.9Å; E53-V56 PolarHBondContact O-N 2.79Å; V56-A59 PolarHBondContact O-N 2.86Å; V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 2.91Å; V56-T72 HydrophobicContact CG1-CG2 4.36Å; V56-I216 HydrophobicContact CG1-CG2 3.6Å; V56-T220 HydrophobicContact CB-CG2 4.13Å; V56-T220 HydrophobicContact CG1-CG2 4.47Å; V56-T220 HydrophobicContact CG2-CG2 3.81Å
57	S	87.7	Confident	87.1	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-40.5	179.7	-167.1	0	0	0	0	112.1	E53 A60 S61 A69 V255 P259	E53-S57 WeakPolarHBondContact O-CB 3.46Å; E53-S57 PolarHBondContact O-N 3.08Å; S57-A60 PolarHBondContact O-N 3.41Å; S57-S61 WeakPolarHBondContact O-CB 3.44Å; S57-S61 PolarHBondContact O-N 3.49Å; S57-A69 WeakPolarHBondContact O-CB 3.45Å; S57-A69 WeakPolarHBondContact OG-CA 3.21Å; S57-A69 WeakPolarHBondContact OG-CB 3.31Å; S57-A69 PolarHBondContact OG-O 3.16Å; S57-V255 PolarHBondContact OG-O 3.17Å; S57-P259 WeakPolarHBondContact OG-CG 3.24Å
58	L	88.7	Confident	86.8	Confident	47 Å²	47	42.9 Å²	42.9	25%	0.246	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-46.1	171.7	-78.6	170.5	0	0	0	112.1	V54 S61 L62 L258 I262	V54-L58 HydrophobicContact CG1-CD1 3.65Å; V54-L58 HydrophobicContact CG1-CG 4.34Å; V54-L58 VanDerWaalsContact O-CB 3.23Å; V54-L58 WeakPolarHBondContact O-CB 3.28Å; V54-L58 WeakPolarHBondContact O-CD1 3.49Å; V54-L58 VanDerWaalsContact O-CG 3.22Å; V54-L58 WeakPolarHBondContact O-CG 3.47Å; V54-L58 PolarHBondContact O-N 3.47Å; L58-S61 PolarHBondContact O-N 2.97Å; L58-L62 WeakPolarHBondContact O-CB 3.36Å; L58-L62 VanDerWaalsContact O-CG 3.3Å; L58-L62 WeakPolarHBondContact O-CG 3.19Å; L58-L62 PolarHBondContact O-N 2.82Å; L58-L258 HydrophobicContact CD1-CD1 4.23Å; L58-L258 HydrophobicContact CD2-CB 3.92Å; L58-L258 HydrophobicContact CD2-CD1 4.26Å; L58-L258 HydrophobicContact CG-CD1 4.33Å; L58-I262 HydrophobicContact CD2-CD1 3.35Å
59	A	86	Confident	86.5	Confident	40 Å²	40	42.8 Å²	42.8	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-44.7	179	0	0	0	0	0	111.4	I55 V56 S61 L62 H63	I55-A59 VanDerWaalsContact O-CB 3.26Å; I55-A59 WeakPolarHBondContact O-CB 3.36Å; I55-A59 PolarHBondContact O-N 3.46Å; V56-A59 PolarHBondContact O-N 2.86Å; A59-S61 VanDerWaalsContact C-N 3.34Å; A59-S61 PolarHBondContact O-N 2.86Å; A59-L62 PolarHBondContact O-N 3.04Å; A59-H63 PolarHBondContact O-CD2 3.15Å; A59-H63 PolarHBondContact O-N 3.11Å; A59-H63 VanDerWaalsContact O-N 3.14Å
60	A	83.9	Confident	86.2	Confident	5 Å²	5	42.9 Å²	42.9	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-45.1	174.9	0	0	0	0	0	111.6	V56 S57 L62 H63 E64 Q65 L68 A69	V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 2.91Å; S57-A60 PolarHBondContact O-N 3.41Å; A60-L62 PolarHBondContact O-N 3.16Å; A60-H63 CarbonylContact O-C 3.55Å; A60-H63 PolarHBondContact O-N 2.96Å; A60-H63 VanDerWaalsContact O-N 3.11Å; A60-E64 PolarHBondContact O-N 3.48Å; A60-Q65 HydrophobicContact CB-CB 4.42Å; A60-Q65 PolarHBondContact O-N 3.28Å; A60-L68 HydrophobicContact CB-CB 4.14Å; A60-L68 HydrophobicContact CB-CD2 3.92Å; A60-L68 HydrophobicContact CB-CG 4.21Å; A60-A69 HydrophobicContact CB-CB 3.98Å
61	S	85.3	Confident	85.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-40.9	177.9	-168.6	0	0	0	0	112.6	S57 L58 A59 H63 E64 P259 T263	S57-S61 WeakPolarHBondContact O-CB 3.44Å; S57-S61 PolarHBondContact O-N 3.49Å; L58-S61 PolarHBondContact O-N 2.97Å; A59-S61 VanDerWaalsContact C-N 3.34Å; A59-S61 PolarHBondContact O-N 2.86Å; S61-H63 PolarHBondContact O-N 3.14Å; S61-E64 PolarHBondContact O-N 2.89Å; S61-P259 WeakPolarHBondContact OG-CA 3.36Å; S61-P259 PolarHBondContact OG-O 3.35Å; S61-T263 PolarHBondContact O-OG1 3.24Å; S61-T263 WeakPolarHBondContact OG-CB 3.42Å; S61-T263 PolarHBondContact OG-OG1 3.07Å; S61-T263 VanDerWaalsContact OG-OG1 3.1Å
62	L	86.6	Confident	85.5	Confident	120 Å²	120	40.2 Å²	40.2	63%	0.628	20%	0.204	S	C	*	.	H	α-helix	trans	-64.9	-24.1	174.9	-72.6	170.1	0	0	0	113.3	L58 A59 A60 E64 I262	L58-L62 WeakPolarHBondContact O-CB 3.36Å; L58-L62 VanDerWaalsContact O-CG 3.3Å; L58-L62 WeakPolarHBondContact O-CG 3.19Å; L58-L62 PolarHBondContact O-N 2.82Å; A59-L62 PolarHBondContact O-N 3.04Å; A60-L62 PolarHBondContact O-N 3.16Å; L62-E64 VanDerWaalsContact C-N 3.33Å; L62-I262 HydrophobicContact CD2-CG2 4.01Å
63	H	83.1	Confident	85.4	Confident	145 Å²	145	40 Å²	40	67%	0.671	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	14	173.3	-72.7	-61.8	0	0	0	113.3	A59 A60 S61 Q65	A59-H63 PolarHBondContact O-CD2 3.15Å; A59-H63 PolarHBondContact O-N 3.11Å; A59-H63 VanDerWaalsContact O-N 3.14Å; A60-H63 CarbonylContact O-C 3.55Å; A60-H63 PolarHBondContact O-N 2.96Å; A60-H63 VanDerWaalsContact O-N 3.11Å; S61-H63 PolarHBondContact O-N 3.14Å; H63-Q65 HydrophobicContact CB-CG 4.49Å; H63-Q65 PolarHBondContact O-N 3.18Å; H63-Q65 VanDerWaalsContact O-N 3.16Å
64	E	80.5	Confident	85.1	Confident	152 Å²	152	42.1 Å²	42.1	71%	0.71	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	16.2	-178	-56	-173.7	173.1	0	0	115	A60 S61 L62 R66 T263	A60-E64 PolarHBondContact O-N 3.48Å; S61-E64 PolarHBondContact O-N 2.89Å; L62-E64 VanDerWaalsContact C-N 3.33Å; E64-R66 PolarHBondContact O-N 3.13Å; E64-R66 VanDerWaalsContact O-N 3.15Å; E64-T263 HydrophobicContact CB-CG2 4.42Å; E64-T263 HydrophobicContact CG-CG2 4.36Å
65	Q	81	Confident	84.9	Confident	62 Å²	62	40.7 Å²	40.7	29%	0.29	21%	0.205	S	C	.	.			trans	-88.9	71.5	176.6	-65.4	-179.7	-41	0	0	110.8	A60 H63 D67 L68 A69 E208	A60-Q65 HydrophobicContact CB-CB 4.42Å; A60-Q65 PolarHBondContact O-N 3.28Å; H63-Q65 HydrophobicContact CB-CG 4.49Å; H63-Q65 PolarHBondContact O-N 3.18Å; H63-Q65 VanDerWaalsContact O-N 3.16Å; Q65-D67 PolarHBondContact O-N 3.23Å; Q65-L68 HydrophobicContact CB-CB 3.93Å; Q65-L68 HydrophobicContact CB-CD2 4.35Å; Q65-L68 WeakPolarHBondContact O-CB 3.25Å; Q65-L68 PolarHBondContact O-N 3.11Å; Q65-A69 PolarHBondContact O-N 3.34Å; Q65-E208 PolarHBondContact NE2-OE1 3.38Å
66	R	83.7	Confident	84.9	Confident	83 Å²	83	37.3 Å²	37.3	31%	0.313	19%	0.187	S	C	.	.	H	α-helix	trans	-59	-48	-176.1	-68	-178.2	-177.8	92	0.6	113	E64 L68 A69 V70 T263 P264	E64-R66 PolarHBondContact O-N 3.13Å; E64-R66 VanDerWaalsContact O-N 3.15Å; R66-L68 PolarHBondContact O-N 2.82Å; R66-A69 WeakPolarHBondContact O-CB 3.02Å; R66-A69 PolarHBondContact O-N 3.34Å; R66-V70 WeakPolarHBondContact O-CG2 3.29Å; R66-V70 PolarHBondContact O-N 3.32Å; R66-T263 VanDerWaalsContact CD-O 3.29Å; R66-T263 WeakPolarHBondContact CD-O 3.41Å; R66-T263 HydrophobicContact CG-CG2 3.86Å; R66-T263 WeakPolarHBondContact CG-O 3.45Å; R66-T263 PolarHBondContact NE-O 3.44Å; R66-T263 VanDerWaalsContact NH2-CG2 3.34Å; R66-P264 VanDerWaalsContact NE-C 3.34Å; R66-P264 PolarHBondContact NE-O 3.36Å; R66-P264 VanDerWaalsContact NE-O 3.08Å; R66-P264 PolarHBondContact NH2-O 3.39Å
67	D	79.4	Confident	85	Confident	42 Å²	42	37 Å²	37	23%	0.225	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-34.9	-177.6	-67	-32.8	0	0	0	111.7	Q65 G71 L209 D268	Q65-D67 PolarHBondContact O-N 3.23Å; D67-G71 WeakPolarHBondContact O-CA 3.33Å; D67-G71 PolarHBondContact O-N 3.5Å; D67-L209 HydrophobicContact CB-CB 4.02Å; D67-L209 HydrophobicContact CB-CD1 4.01Å; D67-L209 WeakPolarHBondContact O-CD1 3.48Å; D67-D268 PolarHBondContact OD1-N 2.98Å; D67-D268 VanDerWaalsContact OD1-N 3.09Å
68	L	82.1	Confident	84.9	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-41.7	174.3	-165.4	72.4	0	0	0	111.4	A60 Q65 R66 T72 E208 M211 I216	A60-L68 HydrophobicContact CB-CB 4.14Å; A60-L68 HydrophobicContact CB-CD2 3.92Å; A60-L68 HydrophobicContact CB-CG 4.21Å; Q65-L68 HydrophobicContact CB-CB 3.93Å; Q65-L68 HydrophobicContact CB-CD2 4.35Å; Q65-L68 WeakPolarHBondContact O-CB 3.25Å; Q65-L68 PolarHBondContact O-N 3.11Å; R66-L68 PolarHBondContact O-N 2.82Å; L68-T72 WeakPolarHBondContact O-CB 3.4Å; L68-T72 PolarHBondContact O-N 3.05Å; L68-T72 PolarHBondContact O-OG1 2.59Å; L68-E208 WeakPolarHBondContact CD1-O 3.48Å; L68-M211 HydrophobicContact CD1-CB 4.3Å; L68-I216 HydrophobicContact CD1-CD1 3.56Å; L68-I216 HydrophobicContact CD2-CD1 4.13Å; L68-I216 HydrophobicContact CG-CD1 3.99Å
69	A	84.8	Confident	84.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-47.3	179.9	0	0	0	0	0	111.9	S57 A60 Q65 R66 T72 A73 P259	S57-A69 WeakPolarHBondContact O-CB 3.45Å; S57-A69 WeakPolarHBondContact OG-CA 3.21Å; S57-A69 WeakPolarHBondContact OG-CB 3.31Å; S57-A69 PolarHBondContact OG-O 3.16Å; A60-A69 HydrophobicContact CB-CB 3.98Å; Q65-A69 PolarHBondContact O-N 3.34Å; R66-A69 WeakPolarHBondContact O-CB 3.02Å; R66-A69 PolarHBondContact O-N 3.34Å; A69-T72 PolarHBondContact O-N 3.14Å; A69-A73 PolarHBondContact O-N 3.03Å; A69-P259 HydrophobicContact CB-CB 3.94Å; A69-P259 HydrophobicContact CB-CG 3.94Å
70	V	85.1	Confident	85.1	Confident	2 Å²	2	36 Å²	36	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-44	176.4	174.5	0	0	0	0	110.7	R66 T72 A73 L74 L124 L256 I267	R66-V70 WeakPolarHBondContact O-CG2 3.29Å; R66-V70 PolarHBondContact O-N 3.32Å; V70-T72 VanDerWaalsContact C-N 3.27Å; V70-T72 PolarHBondContact O-N 3.42Å; V70-A73 PolarHBondContact O-N 2.88Å; V70-A73 VanDerWaalsContact O-N 3.12Å; V70-L74 HydrophobicContact CG1-CD1 3.77Å; V70-L74 HydrophobicContact CG1-CG 4.21Å; V70-L74 PolarHBondContact O-N 2.99Å; V70-L124 HydrophobicContact CG2-CD2 3.96Å; V70-L256 HydrophobicContact CB-CD1 4.31Å; V70-L256 HydrophobicContact CG1-CD1 3.91Å; V70-L256 HydrophobicContact CG2-CD1 4.08Å; V70-I267 HydrophobicContact CG1-CD1 4.12Å; V70-I267 HydrophobicContact CG1-CG2 4.29Å; V70-I267 HydrophobicContact CG2-CD1 3.82Å; V70-I267 HydrophobicContact CG2-CG1 4.17Å
71	G	82.9	Confident	85.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-39.9	176.1	0	0	0	0	0	112	D67 G75 G212 L213	D67-G71 WeakPolarHBondContact O-CA 3.33Å; D67-G71 PolarHBondContact O-N 3.5Å; G71-G75 WeakPolarHBondContact O-CA 3.44Å; G71-G75 PolarHBondContact O-N 3.41Å; G71-G212 VanDerWaalsContact C-C 3.42Å; G71-G212 CarbonylContact C-O 3.33Å; G71-G212 CarbonylContact O-C 3.56Å; G71-L213 VanDerWaalsContact O-CA 3.31Å; G71-L213 WeakPolarHBondContact O-CA 3.03Å; G71-L213 PolarHBondContact O-N 3.35Å
72	T	85.9	Confident	85.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-51.2	173.3	-55.3	0	0	0	0	111	E53 V56 L68 A69 V70 S76 I216 T220	E53-T72 HydrophobicContact CG-CG2 4.49Å; V56-T72 HydrophobicContact CG1-CG2 4.36Å; L68-T72 WeakPolarHBondContact O-CB 3.4Å; L68-T72 PolarHBondContact O-N 3.05Å; L68-T72 PolarHBondContact O-OG1 2.59Å; A69-T72 PolarHBondContact O-N 3.14Å; V70-T72 VanDerWaalsContact C-N 3.27Å; V70-T72 PolarHBondContact O-N 3.42Å; T72-S76 WeakPolarHBondContact O-CB 3.44Å; T72-S76 PolarHBondContact O-N 3.01Å; T72-S76 PolarHBondContact O-OG 3.16Å; T72-I216 HydrophobicContact CG2-CG2 4.04Å; T72-T220 HydrophobicContact CG2-CG2 4.39Å
73	A	86.4	Confident	85.3	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-48.1	-177.9	0	0	0	0	0	113	A69 V70 N77 V255 L256	A69-A73 PolarHBondContact O-N 3.03Å; V70-A73 PolarHBondContact O-N 2.88Å; V70-A73 VanDerWaalsContact O-N 3.12Å; A73-N77 PolarHBondContact O-N 3.08Å; A73-N77 PolarHBondContact O-ND2 2.88Å; A73-V255 HydrophobicContact CB-CB 4.16Å; A73-V255 HydrophobicContact CB-CG1 3.84Å; A73-L256 HydrophobicContact CB-CB 4.12Å; A73-L256 HydrophobicContact CB-CD1 4.27Å
74	L	85.5	Confident	85.6	Confident	44 Å²	44	35.9 Å²	35.9	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-70.4	-41.9	-178.9	-67.1	179.4	0	0	0	111.6	V70 N77 I78 L119 L213 A271	V70-L74 HydrophobicContact CG1-CD1 3.77Å; V70-L74 HydrophobicContact CG1-CG 4.21Å; V70-L74 PolarHBondContact O-N 2.99Å; L74-N77 WeakPolarHBondContact O-CB 3.42Å; L74-N77 PolarHBondContact O-N 2.9Å; L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 2.98Å; L74-L119 HydrophobicContact CD1-CD1 4.39Å; L74-L119 HydrophobicContact CD2-CD1 4.21Å; L74-L213 HydrophobicContact CB-CD2 3.74Å; L74-A271 HydrophobicContact CD1-CB 4.46Å
75	G	86.7	Confident	85.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-45.7	178.9	0	0	0	0	0	112	G71 N77 I78 I79 L213	G71-G75 WeakPolarHBondContact O-CA 3.44Å; G71-G75 PolarHBondContact O-N 3.41Å; G75-N77 VanDerWaalsContact C-N 3.3Å; G75-N77 PolarHBondContact O-N 3.22Å; G75-I78 WeakPolarHBondContact O-CB 3.43Å; G75-I78 PolarHBondContact O-N 3.23Å; G75-I78 VanDerWaalsContact O-N 3.11Å; G75-I79 WeakPolarHBondContact O-CG1 3.26Å; G75-I79 PolarHBondContact O-N 2.78Å; G75-L213 WeakPolarHBondContact CA-O 3.15Å
76	S	90.6	Very high	85.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-38.3	178.4	-65.9	0	0	0	0	112	E53 T72 I78 I79 N80 T220 S221 N251	E53-S76 WeakPolarHBondContact CG-OG 3.39Å; T72-S76 WeakPolarHBondContact O-CB 3.44Å; T72-S76 PolarHBondContact O-N 3.01Å; T72-S76 PolarHBondContact O-OG 3.16Å; S76-I78 PolarHBondContact O-N 3.42Å; S76-I79 PolarHBondContact O-N 3.45Å; S76-N80 WeakPolarHBondContact O-CB 3.44Å; S76-N80 PolarHBondContact O-N 3.03Å; S76-N80 PolarHBondContact O-ND2 3.02Å; S76-N80 PolarHBondContact O-OD1 3.32Å; S76-T220 PolarHBondContact OG-OG1 2.93Å; S76-S221 WeakPolarHBondContact CB-OG 2.97Å; S76-S221 PolarHBondContact OG-OG 3.22Å; S76-S221 VanDerWaalsContact OG-OG 3.1Å; S76-N251 WeakPolarHBondContact CB-ND2 3.24Å
77	N	88.8	Confident	86.1	Confident	17 Å²	17	29.5 Å²	29.5	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-45.6	172.5	-82.2	-73.3	0	0	0	112.7	A73 L74 G75 N80 I81 N248 N251	A73-N77 PolarHBondContact O-N 3.08Å; A73-N77 PolarHBondContact O-ND2 2.88Å; L74-N77 WeakPolarHBondContact O-CB 3.42Å; L74-N77 PolarHBondContact O-N 2.9Å; G75-N77 VanDerWaalsContact C-N 3.3Å; G75-N77 PolarHBondContact O-N 3.22Å; N77-N80 PolarHBondContact O-N 3.11Å; N77-I81 WeakPolarHBondContact O-CG1 3.46Å; N77-I81 PolarHBondContact O-N 3.1Å; N77-N248 WeakPolarHBondContact CA-OD1 3.47Å; N77-N248 PolarHBondContact O-OD1 3.02Å; N77-N248 WeakPolarHBondContact OD1-CA 3.32Å; N77-N248 WeakPolarHBondContact OD1-CB 3.44Å; N77-N248 PolarHBondContact OD1-O 3.45Å; N77-N248 PolarHBondContact OD1-OD1 2.83Å; N77-N248 VanDerWaalsContact OD1-OD1 3.14Å; N77-N251 VanDerWaalsContact ND2-CB 3.32Å; N77-N251 WeakPolarHBondContact ND2-CB 3.43Å
78	I	85.7	Confident	86.3	Confident	48 Å²	48	27.6 Å²	27.6	25%	0.246	15%	0.152	C	C	.	.	H	α-helix	trans	-63.5	-45	179.1	-65.5	168	0	0	0	110.5	L74 G75 S76 I81 L82	L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 2.98Å; G75-I78 WeakPolarHBondContact O-CB 3.43Å; G75-I78 PolarHBondContact O-N 3.23Å; G75-I78 VanDerWaalsContact O-N 3.11Å; S76-I78 PolarHBondContact O-N 3.42Å; I78-I81 PolarHBondContact O-N 2.89Å; I78-L82 HydrophobicContact CG2-CD1 3.82Å; I78-L82 HydrophobicContact CG2-CG 4.43Å; I78-L82 WeakPolarHBondContact O-CB 3.2Å; I78-L82 PolarHBondContact O-N 2.92Å
79	I	89.2	Confident	86.3	Confident	20 Å²	20	28.9 Å²	28.9	10%	0.103	17%	0.165	C	C	.	.	I	π-helix	trans	-63.9	-43.7	179.3	-69.8	-60	0	0	0	111.1	G75 S76 I81 L83 I84 A217 I218	G75-I79 WeakPolarHBondContact O-CG1 3.26Å; G75-I79 PolarHBondContact O-N 2.78Å; S76-I79 PolarHBondContact O-N 3.45Å; I79-I81 VanDerWaalsContact C-N 3.34Å; I79-I81 PolarHBondContact O-N 2.82Å; I79-L83 HydrophobicContact CD1-CB 4.36Å; I79-L83 HydrophobicContact CD1-CD2 4.14Å; I79-L83 HydrophobicContact CG2-CB 4.25Å; I79-L83 HydrophobicContact CG2-CD2 4.19Å; I79-L83 CarbonylContact O-C 3.14Å; I79-L83 WeakPolarHBondContact O-CA 3.49Å; I79-L83 WeakPolarHBondContact O-CB 3.34Å; I79-L83 PolarHBondContact O-N 2.87Å; I79-I84 HydrophobicContact CG2-CD1 4.15Å; I79-I84 HydrophobicContact CG2-CG1 4.05Å; I79-I84 PolarHBondContact O-N 3.18Å; I79-A217 HydrophobicContact CG1-CB 4.29Å; I79-I218 HydrophobicContact CD1-CD1 4.3Å; I79-I218 HydrophobicContact CD1-CG1 3.6Å; I79-I218 HydrophobicContact CG1-CG1 4Å
80	N	89.8	Confident	86.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-57.5	-45.1	178.2	-75.3	-10.4	0	0	0	112.4	S76 N77 I84 L85 N248	S76-N80 WeakPolarHBondContact O-CB 3.44Å; S76-N80 PolarHBondContact O-N 3.03Å; S76-N80 PolarHBondContact O-ND2 3.02Å; S76-N80 PolarHBondContact O-OD1 3.32Å; N77-N80 PolarHBondContact O-N 3.11Å; N80-I84 WeakPolarHBondContact OD1-CD1 3.5Å; N80-L85 PolarHBondContact O-N 3.37Å; N80-L85 VanDerWaalsContact O-N 3.08Å; N80-N248 WeakPolarHBondContact CB-OD1 3.38Å; N80-N248 PolarHBondContact ND2-OD1 3.34Å
81	I	85.3	Confident	86.2	Confident	70 Å²	70	39.1 Å²	39.1	36%	0.359	22%	0.221	S	C	.	.	I	π-helix	trans	-80.1	-47	-175.6	-61.5	172.8	0	0	0	111.8	N77 I78 I79 L85 M108 N248	N77-I81 WeakPolarHBondContact O-CG1 3.46Å; N77-I81 PolarHBondContact O-N 3.1Å; I78-I81 PolarHBondContact O-N 2.89Å; I79-I81 VanDerWaalsContact C-N 3.34Å; I79-I81 PolarHBondContact O-N 2.82Å; I81-L85 WeakPolarHBondContact O-CB 3.48Å; I81-M108 HydrophobicContact CD1-CE 4.23Å; I81-N248 WeakPolarHBondContact CG1-ND2 3.49Å
82	L	86.1	Confident	86	Confident	126 Å²	126	45.4 Å²	45.4	66%	0.66	25%	0.245	S	C	*	.	I	π-helix	trans	-86.9	-42.7	-172.3	-62.6	-177.4	0	0	0	112.7	I78	I78-L82 HydrophobicContact CG2-CD1 3.82Å; I78-L82 HydrophobicContact CG2-CG 4.43Å; I78-L82 WeakPolarHBondContact O-CB 3.2Å; I78-L82 PolarHBondContact O-N 2.92Å
83	L	87.8	Confident	85.5	Confident	69 Å²	69	50.9 Å²	50.9	36%	0.361	28%	0.281	S	S	.	.	I	π-helix	trans	-92.9	-55.1	-174.1	-175.1	64.1	0	0	0	111.3	I79 G86 L87	I79-L83 HydrophobicContact CD1-CB 4.36Å; I79-L83 HydrophobicContact CD1-CD2 4.14Å; I79-L83 HydrophobicContact CG2-CB 4.25Å; I79-L83 HydrophobicContact CG2-CD2 4.19Å; I79-L83 CarbonylContact O-C 3.14Å; I79-L83 WeakPolarHBondContact O-CA 3.49Å; I79-L83 WeakPolarHBondContact O-CB 3.34Å; I79-L83 PolarHBondContact O-N 2.87Å; L83-G86 PolarHBondContact O-N 3.2Å; L83-L87 HydrophobicContact CD1-CD1 3.76Å; L83-L87 HydrophobicContact CD1-CG 4.08Å; L83-L87 HydrophobicContact CG-CD1 3.86Å; L83-L87 HydrophobicContact CG-CG 4.45Å; L83-L87 VanDerWaalsContact O-CB 3.31Å; L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 VanDerWaalsContact O-CG 3.25Å; L83-L87 WeakPolarHBondContact O-CG 3.46Å; L83-L87 PolarHBondContact O-N 2.99Å
84	I	90	Very high	84.8	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	29%	0.287	C	S	.	.	I	π-helix	trans	-69.3	-51	-171	-60.3	-177.2	0	0	0	111.3	I79 N80 G86 L87 A88 S221 E224 L225 A228 I244	I79-I84 HydrophobicContact CG2-CD1 4.15Å; I79-I84 HydrophobicContact CG2-CG1 4.05Å; I79-I84 PolarHBondContact O-N 3.18Å; N80-I84 WeakPolarHBondContact OD1-CD1 3.5Å; I84-G86 VanDerWaalsContact C-N 3.28Å; I84-G86 PolarHBondContact O-N 3.34Å; I84-L87 PolarHBondContact O-N 3.2Å; I84-A88 WeakPolarHBondContact O-CB 3.22Å; I84-A88 PolarHBondContact O-N 3.32Å; I84-S221 VanDerWaalsContact CD1-O 3.28Å; I84-S221 WeakPolarHBondContact CD1-O 3.49Å; I84-E224 HydrophobicContact CD1-CB 3.65Å; I84-L225 HydrophobicContact CB-CD1 4.3Å; I84-L225 HydrophobicContact CD1-CB 3.97Å; I84-L225 HydrophobicContact CG1-CB 4.01Å; I84-L225 HydrophobicContact CG1-CD1 4.19Å; I84-L225 HydrophobicContact CG2-CB 4.29Å; I84-L225 HydrophobicContact CG2-CD1 3.98Å; I84-A228 HydrophobicContact CG2-CB 3.99Å; I84-I244 HydrophobicContact CG2-CD1 4.31Å; I84-I244 HydrophobicContact CG2-CG1 4.46Å
85	L	84.2	Confident	83.9	Confident	64 Å²	64	55.1 Å²	55.1	34%	0.335	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-42.6	177.2	-171.9	71.1	0	0	0	111.3	N80 I81 A89 F94 I244	N80-L85 PolarHBondContact O-N 3.37Å; N80-L85 VanDerWaalsContact O-N 3.08Å; I81-L85 WeakPolarHBondContact O-CB 3.48Å; L85-A89 WeakPolarHBondContact O-CB 2.99Å; L85-A89 PolarHBondContact O-N 3.16Å; L85-F94 HydrophobicContact CD1-CE2 4.39Å; L85-F94 HydrophobicContact CD1-CZ 3.8Å; L85-I244 HydrophobicContact CB-CD1 4.28Å; L85-I244 HydrophobicContact CD1-CD1 3.65Å
86	G	84.2	Confident	83.1	Confident	32 Å²	32	58.1 Å²	58.1	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-48.1	176.4	0	0	0	0	0	112.8	L83 I84 A89 L90	L83-G86 PolarHBondContact O-N 3.2Å; I84-G86 VanDerWaalsContact C-N 3.28Å; I84-G86 PolarHBondContact O-N 3.34Å; G86-A89 PolarHBondContact O-N 2.76Å; G86-L90 WeakPolarHBondContact O-CG 3.47Å; G86-L90 PolarHBondContact O-N 3.27Å
87	L	86.9	Confident	81.8	Confident	67 Å²	67	61.2 Å²	61.2	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-42.5	177.5	-74.8	176.1	0	0	0	112.2	L83 I84 A89 L90 V91 L225	L83-L87 HydrophobicContact CD1-CD1 3.76Å; L83-L87 HydrophobicContact CD1-CG 4.08Å; L83-L87 HydrophobicContact CG-CD1 3.86Å; L83-L87 HydrophobicContact CG-CG 4.45Å; L83-L87 VanDerWaalsContact O-CB 3.31Å; L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 VanDerWaalsContact O-CG 3.25Å; L83-L87 WeakPolarHBondContact O-CG 3.46Å; L83-L87 PolarHBondContact O-N 2.99Å; I84-L87 PolarHBondContact O-N 3.2Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 3Å; L87-L90 HydrophobicContact CD2-CD1 4.4Å; L87-L90 WeakPolarHBondContact O-CB 3.33Å; L87-L90 PolarHBondContact O-N 2.82Å; L87-V91 WeakPolarHBondContact O-CG2 3.4Å; L87-V91 PolarHBondContact O-N 2.78Å; L87-L225 HydrophobicContact CB-CD1 4.12Å; L87-L225 HydrophobicContact CD1-CD1 3.99Å; L87-L225 HydrophobicContact CD1-CD2 4.28Å
88	A	84.8	Confident	80.3	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-42.9	176.9	0	0	0	0	0	111.1	I84 L90 V91 R92 F94 A228	I84-A88 WeakPolarHBondContact O-CB 3.22Å; I84-A88 PolarHBondContact O-N 3.32Å; A88-L90 VanDerWaalsContact C-N 3.33Å; A88-L90 PolarHBondContact O-N 3.44Å; A88-V91 PolarHBondContact O-N 3.34Å; A88-R92 PolarHBondContact O-N 2.97Å; A88-F94 HydrophobicContact CB-CE1 3.97Å; A88-A228 HydrophobicContact CB-CB 4.33Å
89	A	81.7	Confident	79.2	Confident	43 Å²	43	65.7 Å²	65.7	36%	0.355	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-33.2	177.3	0	0	0	0	0	112.6	L85 G86 L87 R92 F94	L85-A89 WeakPolarHBondContact O-CB 2.99Å; L85-A89 PolarHBondContact O-N 3.16Å; G86-A89 PolarHBondContact O-N 2.76Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 3Å; A89-R92 CarbonylContact O-C 3.58Å; A89-F94 HydrophobicContact CB-CE1 4.09Å
90	L	86.2	Confident	77.9	Confident	145 Å²	145	64.9 Å²	64.9	76%	0.759	36%	0.364	S	S	*	.	H	α-helix	trans	-68.3	-36.1	173.7	-75.3	172.1	0	0	0	112.9	G86 L87 A88	G86-L90 WeakPolarHBondContact O-CG 3.47Å; G86-L90 PolarHBondContact O-N 3.27Å; L87-L90 HydrophobicContact CD2-CD1 4.4Å; L87-L90 WeakPolarHBondContact O-CB 3.33Å; L87-L90 PolarHBondContact O-N 2.82Å; A88-L90 VanDerWaalsContact C-N 3.33Å; A88-L90 PolarHBondContact O-N 3.44Å
91	V	82.3	Confident	76.5	Confident	72 Å²	72	69.8 Å²	69.8	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-66.2	-46.1	178	171.5	0	0	0	0	110.8	L87 A88	L87-V91 WeakPolarHBondContact O-CG2 3.4Å; L87-V91 PolarHBondContact O-N 2.78Å; A88-V91 PolarHBondContact O-N 3.34Å
92	R	77.3	Confident	75.7	Confident	132 Å²	132	76.2 Å²	76.2	50%	0.498	41%	0.409	S	S	.	.	S	Bend	trans	-157.6	125.6	173.3	-174.1	-178.2	-178.9	-177.4	1.1	108.7	A88 A89 F94 V232	A88-R92 PolarHBondContact O-N 2.97Å; A89-R92 CarbonylContact O-C 3.58Å; R92-F94 WeakPolarHBondContact O-CD1 3.13Å; R92-F94 PolarHBondContact O-N 2.98Å; R92-V232 HydrophobicContact CB-CG1 3.61Å; R92-V232 HydrophobicContact CG-CG1 4.42Å
93	P	75.6	Confident	75.2	Confident	116 Å²	116	75 Å²	75	75%	0.753	40%	0.396	S	S	*	.			trans	-57.1	124.7	170.7	-22.9	32.8	0	0	0	109.8
94	F	72.6	Confident	74.8	Confident	31 Å²	31	71.7 Å²	71.7	14%	0.136	38%	0.379	C	S	.	.			trans	-116.9	146.2	177.3	55.5	-94.1	0	0	0	110.3	L85 A88 A89 R92 V96 V232 N237 V241	L85-F94 HydrophobicContact CD1-CE2 4.39Å; L85-F94 HydrophobicContact CD1-CZ 3.8Å; A88-F94 HydrophobicContact CB-CE1 3.97Å; A89-F94 HydrophobicContact CB-CE1 4.09Å; R92-F94 WeakPolarHBondContact O-CD1 3.13Å; R92-F94 PolarHBondContact O-N 2.98Å; F94-V96 HydrophobicContact CD2-CG2 4.18Å; F94-V96 HydrophobicContact CE2-CG2 4.02Å; F94-V232 HydrophobicContact CD1-CG1 4.47Å; F94-V232 HydrophobicContact CD1-CG2 3.79Å; F94-V232 HydrophobicContact CE1-CG2 4.27Å; F94-V232 HydrophobicContact CG-CG2 4.35Å; F94-N237 HydrophobicContact CB-CB 3.95Å; F94-N237 VanDerWaalsContact CB-CG 3.44Å; F94-V241 HydrophobicContact CD2-CG2 3.84Å; F94-V241 HydrophobicContact CE2-CG2 3.52Å; F94-V241 HydrophobicContact CZ-CG2 4.47Å
95	T	65.6	Low	74.1	Confident	102 Å²	102	74.2 Å²	74.2	63%	0.626	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-83.8	131.2	-179.9	48.3	0	0	0	0	110.3
96	V	69.7	Low	73.9	Confident	64 Å²	64	74.1 Å²	74.1	39%	0.388	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-100.6	121.4	175.4	-177.4	0	0	0	0	109	F94 V100 L101 V241	F94-V96 HydrophobicContact CD2-CG2 4.18Å; F94-V96 HydrophobicContact CE2-CG2 4.02Å; V96-V100 HydrophobicContact CG1-CB 3.76Å; V96-V100 HydrophobicContact CG1-CG1 3.76Å; V96-V100 HydrophobicContact CG1-CG2 4.37Å; V96-L101 HydrophobicContact CG1-CD1 4.38Å; V96-L101 HydrophobicContact CG1-CG 4.41Å; V96-V241 HydrophobicContact CG2-CG2 4.5Å
97	H	64.2	Low	73.8	Confident	64 Å²	64	74.6 Å²	74.6	30%	0.296	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-67.5	150.6	-179.4	-70.1	97.6	0	0	0	112.5	D99 V100 L101 D238	H97-D99 PolarHBondContact O-N 2.58Å; H97-V100 WeakPolarHBondContact O-CB 3.44Å; H97-V100 PolarHBondContact O-N 2.97Å; H97-V100 VanDerWaalsContact O-N 3.1Å; H97-L101 PolarHBondContact O-N 2.68Å; H97-D238 IonicContact CE1-OD1 2.69Å; H97-D238 PolarHBondContact CE1-OD1 3.1Å; H97-D238 IonicContact CE1-OD2 3.79Å; H97-D238 IonicContact ND1-OD1 3.6Å; H97-D238 PolarHBondContact ND1-OD1 3.14Å; H97-D238 IonicContact ND1-OD2 3.7Å
98	S	57	Low	73.6	Confident	68 Å²	68	72 Å²	72	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-60.2	-28.5	-177	42.9	0	0	0	0	114	V100 L101 R102	S98-V100 VanDerWaalsContact C-N 3.32Å; S98-L101 PolarHBondContact O-N 3.01Å; S98-R102 WeakPolarHBondContact O-CB 3.49Å; S98-R102 WeakPolarHBondContact O-CG 3.33Å; S98-R102 PolarHBondContact O-N 2.89Å
99	D	63.2	Low	73.4	Confident	91 Å²	91	76.8 Å²	76.8	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-68.6	-33.6	178.7	-64.7	-23.4	0	0	0	112.3	H97 R103	H97-D99 PolarHBondContact O-N 2.58Å; D99-R103 WeakPolarHBondContact O-CB 3.43Å; D99-R103 PolarHBondContact O-N 3.12Å
100	V	62	Low	73.5	Confident	3 Å²	3	79.7 Å²	79.7	2%	0.018	41%	0.41	C	S	.	.	I	π-helix	trans	-63.7	-46.4	173.1	179	0	0	0	0	110.1	L38 V96 H97 S98 E104 L105 V241 I245	L38-V100 HydrophobicContact CD1-CG2 3.79Å; L38-V100 HydrophobicContact CD2-CG2 3.63Å; L38-V100 HydrophobicContact CG-CG2 4.38Å; V96-V100 HydrophobicContact CG1-CB 3.76Å; V96-V100 HydrophobicContact CG1-CG1 3.76Å; V96-V100 HydrophobicContact CG1-CG2 4.37Å; H97-V100 WeakPolarHBondContact O-CB 3.44Å; H97-V100 PolarHBondContact O-N 2.97Å; H97-V100 VanDerWaalsContact O-N 3.1Å; S98-V100 VanDerWaalsContact C-N 3.32Å; V100-E104 PolarHBondContact O-N 3.38Å; V100-L105 HydrophobicContact CG1-CD1 4.38Å; V100-L105 HydrophobicContact CG1-CG 4.34Å; V100-L105 PolarHBondContact O-N 3.29Å; V100-V241 HydrophobicContact CG1-CG1 3.87Å; V100-V241 HydrophobicContact CG2-CG1 4.39Å; V100-I245 HydrophobicContact CG1-CD1 3.42Å; V100-I245 VanDerWaalsContact CG1-CD1 3.42Å
101	L	59.6	Low	73.4	Confident	103 Å²	103	73.2 Å²	73.2	54%	0.539	38%	0.376	S	S	.	.	I	π-helix	trans	-66.5	-36.2	179.2	-83.4	150	0	0	0	113.3	V96 H97 S98 L105 P106	V96-L101 HydrophobicContact CG1-CD1 4.38Å; V96-L101 HydrophobicContact CG1-CG 4.41Å; H97-L101 PolarHBondContact O-N 2.68Å; S98-L101 PolarHBondContact O-N 3.01Å; L101-L105 HydrophobicContact CD2-CD1 4.09Å; L101-L105 HydrophobicContact CG-CD1 4.35Å; L101-P106 WeakPolarHBondContact O-CD 3.44Å
102	R	68.7	Low	73.4	Confident	205 Å²	205	71.8 Å²	71.8	77%	0.774	37%	0.37	S	S	*	.	I	π-helix	trans	-89.5	-27.2	-174.1	-72.4	-179.5	179.2	-175.2	1.1	114.4	S98	S98-R102 WeakPolarHBondContact O-CB 3.49Å; S98-R102 WeakPolarHBondContact O-CG 3.33Å; S98-R102 PolarHBondContact O-N 2.89Å
103	R	76.1	Confident	73.6	Confident	100 Å²	100	70.4 Å²	70.4	38%	0.377	38%	0.376	S	S	.	.	I	π-helix	trans	-120.5	-54.2	-173.3	-168.1	177.2	71	-152.2	-1.9	113	D99 L107	D99-R103 WeakPolarHBondContact O-CB 3.43Å; D99-R103 PolarHBondContact O-N 3.12Å; R103-L107 WeakPolarHBondContact O-CB 3.36Å; R103-L107 PolarHBondContact O-N 3.01Å
104	E	79.7	Confident	74	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.35	C	S	.	.	I	π-helix	trans	-78.5	-44	-168.4	-51.8	-55.1	159.2	0	0	112.9	L38 M42 V100 L107 M108 I245	L38-E104 HydrophobicContact CD2-CG 4.37Å; M42-E104 HydrophobicContact CE-CG 4.28Å; M42-E104 HydrophobicContact SD-CB 4.33Å; M42-E104 HydrophobicContact SD-CG 3.99Å; V100-E104 PolarHBondContact O-N 3.38Å; E104-L107 PolarHBondContact O-N 3.42Å; E104-M108 PolarHBondContact O-N 3.08Å; E104-I245 HydrophobicContact CB-CD1 4.11Å; E104-I245 HydrophobicContact CB-CG2 4.29Å
105	L	75.1	Confident	74.3	Confident	55 Å²	55	65.4 Å²	65.4	29%	0.288	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-46.7	176.3	-85.9	169.8	0	0	0	112.9	V100 L101 L107 M108 L109	V100-L105 HydrophobicContact CG1-CD1 4.38Å; V100-L105 HydrophobicContact CG1-CG 4.34Å; V100-L105 PolarHBondContact O-N 3.29Å; L101-L105 HydrophobicContact CD2-CD1 4.09Å; L101-L105 HydrophobicContact CG-CD1 4.35Å; L105-L107 VanDerWaalsContact C-N 3.28Å; L105-L107 PolarHBondContact O-N 3.5Å; L105-M108 HydrophobicContact CD2-CE 3.76Å; L105-M108 PolarHBondContact O-N 2.55Å; L105-L109 WeakPolarHBondContact O-CG 3.27Å; L105-L109 PolarHBondContact O-N 2.85Å
106	P	79.2	Confident	74.9	Confident	62 Å²	62	62 Å²	62	40%	0.403	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-37.7	173.8	-27.4	36.3	0	0	0	113.3	L101 L109 L110	L101-P106 WeakPolarHBondContact O-CD 3.44Å; P106-L109 PolarHBondContact O-N 2.82Å; P106-L110 WeakPolarHBondContact O-CB 3.38Å; P106-L110 PolarHBondContact O-N 3.38Å
107	L	82.5	Confident	75.4	Confident	43 Å²	43	62.7 Å²	62.7	23%	0.225	34%	0.339	C	S	.	.	H	α-helix	trans	-65.9	-45.1	176.8	-176.8	66.3	0	0	0	111.5	R103 E104 L105 L109 L110 V111 F142	R103-L107 WeakPolarHBondContact O-CB 3.36Å; R103-L107 PolarHBondContact O-N 3.01Å; E104-L107 PolarHBondContact O-N 3.42Å; L105-L107 VanDerWaalsContact C-N 3.28Å; L105-L107 PolarHBondContact O-N 3.5Å; L107-L109 PolarHBondContact O-N 3.06Å; L107-L110 WeakPolarHBondContact O-CB 3.34Å; L107-L110 PolarHBondContact O-N 3.27Å; L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 3.12Å; L107-F142 HydrophobicContact CD2-CD1 4.24Å; L107-F142 HydrophobicContact CD2-CE1 4.05Å
108	M	83.4	Confident	76.3	Confident	11 Å²	11	60.3 Å²	60.3	5%	0.054	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-47.9	174.9	-176.2	-170.7	76.7	0	0	111.1	I81 E104 L105 L110 V111 S112 I245 N248 I249	I81-M108 HydrophobicContact CD1-CE 4.23Å; E104-M108 PolarHBondContact O-N 3.08Å; L105-M108 HydrophobicContact CD2-CE 3.76Å; L105-M108 PolarHBondContact O-N 2.55Å; M108-L110 VanDerWaalsContact C-N 3.34Å; M108-L110 PolarHBondContact O-N 2.86Å; M108-V111 PolarHBondContact O-N 2.84Å; M108-S112 PolarHBondContact O-N 3.28Å; M108-S112 PolarHBondContact O-OG 3.01Å; M108-S112 VanDerWaalsContact O-OG 3.11Å; M108-I245 HydrophobicContact CB-CG2 4.41Å; M108-I245 HydrophobicContact SD-CG2 4.49Å; M108-N248 HydrophobicContact CG-CB 4.15Å; M108-N248 HydrophobicContact SD-CB 3.76Å; M108-I249 HydrophobicContact CB-CD1 4.11Å; M108-I249 HydrophobicContact CB-CG1 4.07Å; M108-I249 HydrophobicContact CG-CG1 3.98Å
109	L	79.3	Confident	77.2	Confident	102 Å²	102	57.3 Å²	57.3	53%	0.534	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.2	-72.3	170.9	0	0	0	112.2	L105 P106 L107 V111 S112 V113	L105-L109 WeakPolarHBondContact O-CG 3.27Å; L105-L109 PolarHBondContact O-N 2.85Å; P106-L109 PolarHBondContact O-N 2.82Å; L107-L109 PolarHBondContact O-N 3.06Å; L109-V111 VanDerWaalsContact C-N 3.33Å; L109-V111 PolarHBondContact O-N 3.33Å; L109-S112 WeakPolarHBondContact O-CB 3.47Å; L109-S112 PolarHBondContact O-N 3.5Å; L109-V113 WeakPolarHBondContact O-CG2 3.31Å; L109-V113 PolarHBondContact O-N 3.41Å
110	L	84	Confident	77.9	Confident	105 Å²	105	62.3 Å²	62.3	55%	0.55	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-45.4	175.7	179.5	68	0	0	0	111.2	P106 L107 M108 S112 V113 V114	P106-L110 WeakPolarHBondContact O-CB 3.38Å; P106-L110 PolarHBondContact O-N 3.38Å; L107-L110 WeakPolarHBondContact O-CB 3.34Å; L107-L110 PolarHBondContact O-N 3.27Å; M108-L110 VanDerWaalsContact C-N 3.34Å; M108-L110 PolarHBondContact O-N 2.86Å; L110-S112 VanDerWaalsContact C-N 3.34Å; L110-S112 PolarHBondContact O-N 2.82Å; L110-V113 PolarHBondContact O-N 3.49Å; L110-V114 WeakPolarHBondContact O-CG2 3.22Å; L110-V114 PolarHBondContact O-N 3.03Å
111	V	84.2	Confident	78.7	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.048	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-41	176.8	172.8	0	0	0	0	111.1	L107 M108 L109 V113 V114 A115 L135 I249 I252 V253	L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 3.12Å; M108-V111 PolarHBondContact O-N 2.84Å; L109-V111 VanDerWaalsContact C-N 3.33Å; L109-V111 PolarHBondContact O-N 3.33Å; V111-V113 PolarHBondContact O-N 3.39Å; V111-V114 PolarHBondContact O-N 3.24Å; V111-A115 PolarHBondContact O-N 3.29Å; V111-L135 HydrophobicContact CG1-CD2 4.34Å; V111-L135 HydrophobicContact CG2-CD2 4.36Å; V111-I249 HydrophobicContact CG1-CG2 4.41Å; V111-I252 HydrophobicContact CG1-CB 4.02Å; V111-I252 HydrophobicContact CG1-CD1 4.23Å; V111-I252 HydrophobicContact CG1-CG2 3.61Å; V111-V253 HydrophobicContact CG1-CG1 3.62Å
112	S	82.9	Confident	79.5	Confident	43 Å²	43	63.1 Å²	63.1	30%	0.301	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-42	174.5	-55.9	0	0	0	0	112.7	M108 L109 L110 A115 G116 I252	M108-S112 PolarHBondContact O-N 3.28Å; M108-S112 PolarHBondContact O-OG 3.01Å; M108-S112 VanDerWaalsContact O-OG 3.11Å; L109-S112 WeakPolarHBondContact O-CB 3.47Å; L109-S112 PolarHBondContact O-N 3.5Å; L110-S112 VanDerWaalsContact C-N 3.34Å; L110-S112 PolarHBondContact O-N 2.82Å; S112-A115 PolarHBondContact O-N 2.82Å; S112-G116 PolarHBondContact O-N 3.07Å; S112-I252 VanDerWaalsContact OG-CD1 3.28Å; S112-I252 WeakPolarHBondContact OG-CD1 3.34Å
113	V	81.3	Confident	80.2	Confident	103 Å²	103	57.8 Å²	57.8	62%	0.624	31%	0.314	S	S	*	.	H	α-helix	trans	-64.6	-43.3	176.3	170.9	0	0	0	0	111	L109 L110 V111 A115 G116 S117	L109-V113 WeakPolarHBondContact O-CG2 3.31Å; L109-V113 PolarHBondContact O-N 3.41Å; L110-V113 PolarHBondContact O-N 3.49Å; V111-V113 PolarHBondContact O-N 3.39Å; V113-A115 VanDerWaalsContact C-N 3.33Å; V113-A115 PolarHBondContact O-N 3.33Å; V113-G116 PolarHBondContact O-N 2.93Å; V113-S117 PolarHBondContact O-N 3.4Å
114	V	83.1	Confident	80.6	Confident	35 Å²	35	53.2 Å²	53.2	21%	0.212	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-44.9	176.4	169.8	0	0	0	0	110.7	L110 V111 S117 V118 F131 L135	L110-V114 WeakPolarHBondContact O-CG2 3.22Å; L110-V114 PolarHBondContact O-N 3.03Å; V111-V114 PolarHBondContact O-N 3.24Å; V114-S117 PolarHBondContact O-N 3.28Å; V114-S117 VanDerWaalsContact O-N 3.17Å; V114-S117 PolarHBondContact O-OG 3.32Å; V114-V118 WeakPolarHBondContact O-CG2 3.08Å; V114-V118 PolarHBondContact O-N 3.05Å; V114-F131 HydrophobicContact CG1-CE1 3.58Å; V114-F131 HydrophobicContact CG1-CZ 4.01Å; V114-L135 HydrophobicContact CG1-CD2 4.27Å
115	A	79.3	Confident	81	Confident	6 Å²	6	54.8 Å²	54.8	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-37.2	177.3	0	0	0	0	0	113.5	V111 S112 V113 S117 V118 L119 L132 I252 L256	V111-A115 PolarHBondContact O-N 3.29Å; S112-A115 PolarHBondContact O-N 2.82Å; V113-A115 VanDerWaalsContact C-N 3.33Å; V113-A115 PolarHBondContact O-N 3.33Å; A115-S117 VanDerWaalsContact C-N 3.25Å; A115-S117 PolarHBondContact O-N 3.03Å; A115-V118 PolarHBondContact O-N 3Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.45Å; A115-L132 HydrophobicContact CB-CD2 4.5Å; A115-I252 HydrophobicContact CB-CG2 3.25Å; A115-L256 HydrophobicContact CB-CD2 4.4Å
116	G	78.5	Confident	81.8	Confident	31 Å²	31	59.3 Å²	59.3	32%	0.32	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-35.2	171.3	0	0	0	0	0	112.6	S112 V113 Y120 Y272	S112-G116 PolarHBondContact O-N 3.07Å; V113-G116 PolarHBondContact O-N 2.93Å; G116-Y120 PolarHBondContact O-N 3.14Å; G116-Y272 PolarHBondContact O-OH 3.31Å
117	S	80.7	Confident	82.3	Confident	78 Å²	78	60.1 Å²	60.1	55%	0.545	33%	0.328	S	S	.	.	H	α-helix	trans	-71.6	-36.7	174.7	71.6	0	0	0	0	113.2	V113 V114 A115 L119 Y120	V113-S117 PolarHBondContact O-N 3.4Å; V114-S117 PolarHBondContact O-N 3.28Å; V114-S117 VanDerWaalsContact O-N 3.17Å; V114-S117 PolarHBondContact O-OG 3.32Å; A115-S117 VanDerWaalsContact C-N 3.25Å; A115-S117 PolarHBondContact O-N 3.03Å; S117-L119 VanDerWaalsContact C-N 3.31Å; S117-L119 PolarHBondContact O-N 3.37Å; S117-Y120 WeakPolarHBondContact O-CB 3.46Å; S117-Y120 PolarHBondContact O-N 3.38Å
118	V	81.9	Confident	82.6	Confident	14 Å²	14	59.4 Å²	59.4	9%	0.085	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-39.8	177.3	163	0	0	0	0	111.3	V114 A115 Y120 D128 F131 L132	V114-V118 WeakPolarHBondContact O-CG2 3.08Å; V114-V118 PolarHBondContact O-N 3.05Å; A115-V118 PolarHBondContact O-N 3Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; V118-D128 HydrophobicContact CG1-CB 3.48Å; V118-D128 VanDerWaalsContact CG1-CB 3.48Å; V118-F131 HydrophobicContact CG2-CD1 3.91Å; V118-F131 HydrophobicContact CG2-CE1 3.98Å; V118-L132 HydrophobicContact CG1-CD1 4.38Å
119	L	77.4	Confident	83	Confident	6 Å²	6	58.9 Å²	58.9	3%	0.031	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.5	-177.9	-70.4	169.5	0	0	0	112.2	L74 A115 S117 D121 G122 L124 L256 I267 Y272	L74-L119 HydrophobicContact CD1-CD1 4.39Å; L74-L119 HydrophobicContact CD2-CD1 4.21Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.45Å; S117-L119 VanDerWaalsContact C-N 3.31Å; S117-L119 PolarHBondContact O-N 3.37Å; L119-D121 VanDerWaalsContact C-N 3.28Å; L119-D121 PolarHBondContact O-N 2.92Å; L119-G122 PolarHBondContact O-N 3.34Å; L119-L124 HydrophobicContact CD2-CD1 3.5Å; L119-L256 HydrophobicContact CD1-CD1 4.46Å; L119-L256 HydrophobicContact CD1-CD2 3.77Å; L119-L256 HydrophobicContact CD2-CD1 4.35Å; L119-L256 HydrophobicContact CD2-CD2 4.31Å; L119-L256 HydrophobicContact CG-CD2 4.11Å; L119-I267 HydrophobicContact CD2-CD1 3.39Å; L119-Y272 WeakPolarHBondContact CA-OH 3.22Å; L119-Y272 HydrophobicContact CB-CE2 4.19Å; L119-Y272 WeakPolarHBondContact CB-OH 3.28Å; L119-Y272 WeakPolarHBondContact O-CE2 3.43Å; L119-Y272 PolarHBondContact O-OH 2.87Å
120	Y	78.1	Confident	83.6	Confident	196 Å²	196	59.2 Å²	59.2	77%	0.769	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-31	-157.4	172.9	-103.1	0	0	0	114	G116 S117 V118 G122 Y272	G116-Y120 PolarHBondContact O-N 3.14Å; S117-Y120 WeakPolarHBondContact O-CB 3.46Å; S117-Y120 PolarHBondContact O-N 3.38Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; Y120-G122 PolarHBondContact O-N 3.4Å; Y120-Y272 VanDerWaalsContact CA-OH 3.25Å; Y120-Y272 WeakPolarHBondContact CA-OH 3.45Å; Y120-Y272 PolarHBondContact N-OH 3.38Å
121	D	78.5	Confident	84	Confident	106 Å²	106	58.8 Å²	58.8	57%	0.567	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	0.8	178.1	61.3	2.3	0	0	0	113.3	L119 Q123	L119-D121 VanDerWaalsContact C-N 3.28Å; L119-D121 PolarHBondContact O-N 2.92Å; D121-Q123 PolarHBondContact O-N 3.06Å; D121-Q123 PolarHBondContact OD1-N 3.06Å
122	G	75.5	Confident	84.4	Confident	16 Å²	16	58.4 Å²	58.4	17%	0.165	31%	0.314	C	S	.	.	S	Bend	trans	72.4	10.4	-176.9	0	0	0	0	0	113.5	L119 Y120 E266 I267	L119-G122 PolarHBondContact O-N 3.34Å; Y120-G122 PolarHBondContact O-N 3.4Å; G122-E266 WeakPolarHBondContact O-CA 3.44Å; G122-I267 PolarHBondContact O-N 3.32Å
123	Q	83.1	Confident	84.8	Confident	94 Å²	94	58.3 Å²	58.3	44%	0.439	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.8	176.3	-64.6	-164.2	4.3	0	0	110.8	D121 E266	D121-Q123 PolarHBondContact O-N 3.06Å; D121-Q123 PolarHBondContact OD1-N 3.06Å; Q123-E266 HydrophobicContact CG-CG 4.06Å
124	L	84.5	Confident	85.3	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	97.3	171.2	-163.7	75	0	0	0	108.7	V70 L119 L256 A260 P264 G265 I267	V70-L124 HydrophobicContact CG2-CD2 3.96Å; L119-L124 HydrophobicContact CD2-CD1 3.5Å; L124-L256 HydrophobicContact CD1-CG 4.47Å; L124-A260 HydrophobicContact CD1-CB 4.08Å; L124-A260 HydrophobicContact CD2-CB 3.61Å; L124-A260 HydrophobicContact CG-CB 3.51Å; L124-P264 CarbonylContact O-C 3.59Å; L124-P264 WeakPolarHBondContact O-CA 3.27Å; L124-P264 WeakPolarHBondContact O-CB 3.44Å; L124-G265 PolarHBondContact N-O 3Å; L124-G265 PolarHBondContact O-N 2.84Å; L124-I267 HydrophobicContact CB-CD1 3.64Å; L124-I267 HydrophobicContact CB-CG1 4.08Å; L124-I267 HydrophobicContact CD1-CD1 4.25Å; L124-I267 HydrophobicContact CD2-CD1 4.41Å; L124-I267 HydrophobicContact CG-CD1 4.32Å
125	S	89.1	Confident	85.6	Confident	32 Å²	32	59.3 Å²	59.3	22%	0.224	31%	0.305	C	S	.	.			trans	-89.4	164.3	-177.4	78.2	0	0	0	0	112.3	S127 D128 G129	S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 3.25Å; S125-S127 PolarHBondContact OG-N 3.34Å; S125-S127 PolarHBondContact OG-OG 3Å; S125-D128 WeakPolarHBondContact CA-OD2 3.12Å; S125-D128 VanDerWaalsContact CB-OD2 3.23Å; S125-D128 WeakPolarHBondContact CB-OD2 3.38Å; S125-D128 PolarHBondContact N-OD2 3.19Å; S125-D128 WeakPolarHBondContact O-CB 3.5Å; S125-D128 PolarHBondContact O-N 2.98Å; S125-D128 PolarHBondContact OG-N 2.67Å; S125-D128 PolarHBondContact OG-OD1 3.18Å; S125-D128 PolarHBondContact OG-OD2 3.43Å; S125-G129 PolarHBondContact O-N 3.19Å
126	R	90.7	Very high	86.1	Confident	150 Å²	150	59.2 Å²	59.2	57%	0.566	30%	0.304	S	S	*	.	H	α-helix	trans	-63.7	-33.9	172.5	-69.8	-176.2	172.6	157.9	3.1	112.2	D128 G129 I130 L261 P264	R126-D128 VanDerWaalsContact C-N 3.25Å; R126-D128 PolarHBondContact O-N 3.45Å; R126-G129 PolarHBondContact O-N 2.87Å; R126-I130 WeakPolarHBondContact O-CG1 3.43Å; R126-I130 PolarHBondContact O-N 3.47Å; R126-L261 PolarHBondContact NE-O 3.08Å; R126-P264 HydrophobicContact CG-CB 3.97Å; R126-P264 HydrophobicContact CG-CG 3.8Å
127	S	90.2	Very high	86.7	Confident	79 Å²	79	61.6 Å²	61.6	55%	0.552	31%	0.312	S	S	*	.	H	α-helix	trans	-59.7	-40.6	174.8	19.4	0	0	0	0	111.2	S125 I130 F131	S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 3.25Å; S125-S127 PolarHBondContact OG-N 3.34Å; S125-S127 PolarHBondContact OG-OG 3Å; S127-I130 PolarHBondContact O-N 3.16Å; S127-F131 WeakPolarHBondContact O-CB 3.47Å; S127-F131 PolarHBondContact O-N 3.07Å
128	D	89.8	Confident	87.1	Confident	29 Å²	29	61.7 Å²	61.7	16%	0.155	31%	0.306	C	S	.	.	H	α-helix	trans	-64.4	-44.2	177.5	-59.4	-33.3	0	0	0	111.2	V118 S125 R126 I130 F131 L132	V118-D128 HydrophobicContact CG1-CB 3.48Å; V118-D128 VanDerWaalsContact CG1-CB 3.48Å; S125-D128 WeakPolarHBondContact CA-OD2 3.12Å; S125-D128 VanDerWaalsContact CB-OD2 3.23Å; S125-D128 WeakPolarHBondContact CB-OD2 3.38Å; S125-D128 PolarHBondContact N-OD2 3.19Å; S125-D128 WeakPolarHBondContact O-CB 3.5Å; S125-D128 PolarHBondContact O-N 2.98Å; S125-D128 PolarHBondContact OG-N 2.67Å; S125-D128 PolarHBondContact OG-OD1 3.18Å; S125-D128 PolarHBondContact OG-OD2 3.43Å; R126-D128 VanDerWaalsContact C-N 3.25Å; R126-D128 PolarHBondContact O-N 3.45Å; D128-I130 PolarHBondContact O-N 3.43Å; D128-F131 PolarHBondContact O-N 3.47Å; D128-L132 WeakPolarHBondContact O-CB 3.23Å; D128-L132 WeakPolarHBondContact O-CG 3.35Å; D128-L132 PolarHBondContact O-N 3.17Å
129	G	90	Very high	87.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-47.2	173.8	0	0	0	0	0	113.3	S125 R126 F131 L132 L133 G257	S125-G129 PolarHBondContact O-N 3.19Å; R126-G129 PolarHBondContact O-N 2.87Å; G129-F131 VanDerWaalsContact C-N 3.32Å; G129-F131 PolarHBondContact O-N 3.28Å; G129-L132 PolarHBondContact O-N 3.42Å; G129-L133 WeakPolarHBondContact O-CB 3.35Å; G129-L133 VanDerWaalsContact O-CG 3.32Å; G129-L133 WeakPolarHBondContact O-CG 3.02Å; G129-L133 PolarHBondContact O-N 3.19Å; G129-G257 WeakPolarHBondContact CA-O 3.45Å
130	I	92.7	Very high	87.6	Confident	109 Å²	109	64 Å²	64	56%	0.559	32%	0.317	S	S	*	.	H	α-helix	trans	-61.5	-43.6	176.8	-66	173.3	0	0	0	110.5	R126 S127 D128 L133 F134 L261	R126-I130 WeakPolarHBondContact O-CG1 3.43Å; R126-I130 PolarHBondContact O-N 3.47Å; S127-I130 PolarHBondContact O-N 3.16Å; D128-I130 PolarHBondContact O-N 3.43Å; I130-L133 PolarHBondContact O-N 3Å; I130-F134 WeakPolarHBondContact O-CB 3.17Å; I130-F134 PolarHBondContact O-N 3.46Å; I130-L261 HydrophobicContact CG1-CD2 3.67Å
131	F	93	Very high	88	Confident	95 Å²	95	60 Å²	60	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-46.3	-179.9	174	-107.3	0	0	0	112.1	V114 V118 S127 D128 G129 F134 L135	V114-F131 HydrophobicContact CG1-CE1 3.58Å; V114-F131 HydrophobicContact CG1-CZ 4.01Å; V118-F131 HydrophobicContact CG2-CD1 3.91Å; V118-F131 HydrophobicContact CG2-CE1 3.98Å; S127-F131 WeakPolarHBondContact O-CB 3.47Å; S127-F131 PolarHBondContact O-N 3.07Å; D128-F131 PolarHBondContact O-N 3.47Å; G129-F131 VanDerWaalsContact C-N 3.32Å; G129-F131 PolarHBondContact O-N 3.28Å; F131-F134 PolarHBondContact O-N 2.91Å; F131-L135 PolarHBondContact O-N 3.26Å
132	L	91.5	Very high	88.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-43	176.9	-70.9	174.1	0	0	0	111.7	A115 V118 D128 G129 F134 L135 A136 V253 L256	A115-L132 HydrophobicContact CB-CD2 4.5Å; V118-L132 HydrophobicContact CG1-CD1 4.38Å; D128-L132 WeakPolarHBondContact O-CB 3.23Å; D128-L132 WeakPolarHBondContact O-CG 3.35Å; D128-L132 PolarHBondContact O-N 3.17Å; G129-L132 PolarHBondContact O-N 3.42Å; L132-F134 PolarHBondContact O-N 3.36Å; L132-L135 WeakPolarHBondContact O-CB 3.4Å; L132-L135 PolarHBondContact O-N 3.49Å; L132-A136 PolarHBondContact O-N 3.19Å; L132-V253 CarbonylContact C-O 3.56Å; L132-L256 HydrophobicContact CD1-CB 4.31Å; L132-L256 HydrophobicContact CD1-CD2 3.93Å; L132-L256 HydrophobicContact CD1-CG 4.09Å
133	L	91.6	Very high	88.6	Confident	41 Å²	41	58.2 Å²	58.2	22%	0.215	29%	0.291	C	S	.	.	H	α-helix	trans	-68.8	-34.3	177	-69.4	172.5	0	0	0	112.7	G129 I130 L135 A136 V137 I254 L258 L261	G129-L133 WeakPolarHBondContact O-CB 3.35Å; G129-L133 VanDerWaalsContact O-CG 3.32Å; G129-L133 WeakPolarHBondContact O-CG 3.02Å; G129-L133 PolarHBondContact O-N 3.19Å; I130-L133 PolarHBondContact O-N 3Å; L133-L135 VanDerWaalsContact C-N 3.31Å; L133-A136 VanDerWaalsContact O-CB 3.25Å; L133-A136 WeakPolarHBondContact O-CB 3.46Å; L133-A136 PolarHBondContact O-N 2.98Å; L133-V137 WeakPolarHBondContact O-CG2 3.43Å; L133-V137 PolarHBondContact O-N 3.43Å; L133-I254 HydrophobicContact CD2-CG1 4.47Å; L133-L258 HydrophobicContact CD1-CD2 4.24Å; L133-L258 HydrophobicContact CD2-CD2 4.36Å; L133-L258 HydrophobicContact CD2-CG 4.3Å; L133-L261 HydrophobicContact CD1-CD1 3.41Å; L133-L261 VanDerWaalsContact CD1-CD1 3.41Å; L133-L261 HydrophobicContact CD1-CG 4.22Å
134	F	92.2	Very high	88.4	Confident	121 Å²	121	56.7 Å²	56.7	53%	0.531	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-42.1	171.3	175.7	-105.1	0	0	0	111.2	I130 F131 L132 A136 V137 L138	I130-F134 WeakPolarHBondContact O-CB 3.17Å; I130-F134 PolarHBondContact O-N 3.46Å; F131-F134 PolarHBondContact O-N 2.91Å; L132-F134 PolarHBondContact O-N 3.36Å; F134-A136 VanDerWaalsContact C-N 3.29Å; F134-A136 PolarHBondContact O-N 2.81Å; F134-V137 PolarHBondContact O-N 3.08Å; F134-L138 HydrophobicContact CD1-CD1 4Å; F134-L138 HydrophobicContact CD1-CG 4.49Å; F134-L138 HydrophobicContact CE1-CD1 3.4Å; F134-L138 VanDerWaalsContact CE1-CD1 3.4Å; F134-L138 HydrophobicContact CE1-CG 4.04Å; F134-L138 HydrophobicContact CE2-CG 4.45Å; F134-L138 HydrophobicContact CZ-CD1 3.77Å; F134-L138 HydrophobicContact CZ-CD2 4.24Å; F134-L138 HydrophobicContact CZ-CG 4.01Å; F134-L138 PolarHBondContact O-N 3.05Å
135	L	90.1	Very high	88.4	Confident	39 Å²	39	62.6 Å²	62.6	20%	0.204	31%	0.314	C	S	.	.	H	α-helix	trans	-61.3	-37.9	173.4	-169.2	65.8	0	0	0	111.6	V111 V114 F131 L132 L133 V137 L138 W139 V253	V111-L135 HydrophobicContact CG1-CD2 4.34Å; V111-L135 HydrophobicContact CG2-CD2 4.36Å; V114-L135 HydrophobicContact CG1-CD2 4.27Å; F131-L135 PolarHBondContact O-N 3.26Å; L132-L135 WeakPolarHBondContact O-CB 3.4Å; L132-L135 PolarHBondContact O-N 3.49Å; L133-L135 VanDerWaalsContact C-N 3.31Å; L135-V137 PolarHBondContact O-N 3.28Å; L135-L138 PolarHBondContact O-N 3.43Å; L135-W139 WeakPolarHBondContact O-CB 3.04Å; L135-W139 PolarHBondContact O-N 3.01Å; L135-V253 HydrophobicContact CB-CG1 4.45Å; L135-V253 HydrophobicContact CD2-CG1 4.02Å; L135-V253 HydrophobicContact CG-CG1 4.25Å
136	A	89.5	Confident	87.8	Confident	3 Å²	3	62 Å²	62	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-58.7	-46.3	173.7	0	0	0	0	0	112.4	L132 L133 F134 W139 L140 V253 I254	L132-A136 PolarHBondContact O-N 3.19Å; L133-A136 VanDerWaalsContact O-CB 3.25Å; L133-A136 WeakPolarHBondContact O-CB 3.46Å; L133-A136 PolarHBondContact O-N 2.98Å; F134-A136 VanDerWaalsContact C-N 3.29Å; F134-A136 PolarHBondContact O-N 2.81Å; A136-W139 PolarHBondContact O-N 3.2Å; A136-L140 PolarHBondContact O-N 3Å; A136-V253 HydrophobicContact CB-CB 3.8Å; A136-V253 HydrophobicContact CB-CG2 3.41Å; A136-V253 VanDerWaalsContact CB-CG2 3.41Å; A136-I254 HydrophobicContact CB-CD1 4.26Å; A136-I254 HydrophobicContact CB-CG1 3.85Å
137	V	90.5	Very high	86.8	Confident	81 Å²	81	55.4 Å²	55.4	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-44.5	178.1	174.2	0	0	0	0	110.8	L133 F134 L135 W139 L140 L141	L133-V137 WeakPolarHBondContact O-CG2 3.43Å; L133-V137 PolarHBondContact O-N 3.43Å; F134-V137 PolarHBondContact O-N 3.08Å; L135-V137 PolarHBondContact O-N 3.28Å; V137-W139 VanDerWaalsContact C-N 3.32Å; V137-W139 PolarHBondContact O-N 3.08Å; V137-L140 PolarHBondContact O-N 2.99Å; V137-L141 HydrophobicContact CG1-CD1 4.03Å; V137-L141 HydrophobicContact CG1-CG 4.41Å; V137-L141 WeakPolarHBondContact O-CB 3.33Å; V137-L141 VanDerWaalsContact O-CG 3.29Å; V137-L141 WeakPolarHBondContact O-CG 3.33Å; V137-L141 PolarHBondContact O-N 2.71Å
138	L	88.8	Confident	86.2	Confident	80 Å²	80	58.9 Å²	58.9	42%	0.419	29%	0.287	S	S	.	.	H	α-helix	trans	-59.8	-43.2	176.1	-75	-180	0	0	0	111.9	F134 L135 L141 F142	F134-L138 HydrophobicContact CD1-CD1 4Å; F134-L138 HydrophobicContact CD1-CG 4.49Å; F134-L138 HydrophobicContact CE1-CD1 3.4Å; F134-L138 VanDerWaalsContact CE1-CD1 3.4Å; F134-L138 HydrophobicContact CE1-CG 4.04Å; F134-L138 HydrophobicContact CE2-CG 4.45Å; F134-L138 HydrophobicContact CZ-CD1 3.77Å; F134-L138 HydrophobicContact CZ-CD2 4.24Å; F134-L138 HydrophobicContact CZ-CG 4.01Å; F134-L138 PolarHBondContact O-N 3.05Å; L135-L138 PolarHBondContact O-N 3.43Å; L138-L141 PolarHBondContact O-N 2.95Å; L138-F142 WeakPolarHBondContact O-CB 3.41Å; L138-F142 PolarHBondContact O-N 3.19Å
139	W	85.8	Confident	85.4	Confident	12 Å²	12	62 Å²	62	5%	0.045	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-43.8	178.7	177.8	85.1	0	0	0	112.2	M42 L135 A136 V137 L141 F142 I143 I249 F250	M42-W139 WeakPolarHBondContact O-CH2 3.23Å; L135-W139 WeakPolarHBondContact O-CB 3.04Å; L135-W139 PolarHBondContact O-N 3.01Å; A136-W139 PolarHBondContact O-N 3.2Å; V137-W139 VanDerWaalsContact C-N 3.32Å; V137-W139 PolarHBondContact O-N 3.08Å; W139-L141 PolarHBondContact O-N 3.12Å; W139-F142 WeakPolarHBondContact O-CB 3.17Å; W139-F142 PolarHBondContact O-N 3.03Å; W139-I143 HydrophobicContact CD2-CD1 3.91Å; W139-I143 HydrophobicContact CD2-CG1 4.45Å; W139-I143 HydrophobicContact CE3-CD1 4.29Å; W139-I143 HydrophobicContact CH2-CD1 3.63Å; W139-I143 HydrophobicContact CZ2-CD1 3.14Å; W139-I143 HydrophobicContact CZ2-CG1 4.41Å; W139-I143 HydrophobicContact CZ3-CD1 4.12Å; W139-I143 PolarHBondContact O-N 3.36Å; W139-I249 HydrophobicContact CD2-CG2 3.79Å; W139-I249 HydrophobicContact CE3-CG2 4.44Å; W139-I249 HydrophobicContact CG-CG2 3.94Å; W139-I249 HydrophobicContact CZ2-CB 4.04Å; W139-I249 HydrophobicContact CZ2-CD1 4.01Å; W139-I249 HydrophobicContact CZ2-CG2 3.98Å; W139-I249 VanDerWaalsContact NE1-CD1 3.29Å; W139-F250 HydrophobicContact CE3-CE2 4.45Å; W139-F250 HydrophobicContact CE3-CZ 4.39Å; W139-F250 AromaticContact CH2-CD2 3.7Å; W139-F250 HydrophobicContact CH2-CD2 3.7Å; W139-F250 AromaticContact CH2-CE2 3.34Å; W139-F250 HydrophobicContact CH2-CE2 3.34Å; W139-F250 HydrophobicContact CH2-CZ 4.04Å; W139-F250 AromaticContact CZ3-CD2 3.84Å; W139-F250 HydrophobicContact CZ3-CD2 3.84Å; W139-F250 HydrophobicContact CZ3-CE1 4.18Å; W139-F250 AromaticContact CZ3-CE2 3.21Å; W139-F250 HydrophobicContact CZ3-CE2 3.21Å; W139-F250 AromaticContact CZ3-CZ 3.4Å; W139-F250 HydrophobicContact CZ3-CZ 3.4Å; W139-F250 VanDerWaalsContact CZ3-CZ 3.4Å
140	L	84.2	Confident	84.2	Confident	58 Å²	58	63.4 Å²	63.4	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-45.6	174.1	-80.9	173.5	0	0	0	111.9	A136 V137 F142 I143 V144 F250	A136-L140 PolarHBondContact O-N 3Å; V137-L140 PolarHBondContact O-N 2.99Å; L140-F142 VanDerWaalsContact C-N 3.3Å; L140-F142 PolarHBondContact O-N 2.75Å; L140-I143 PolarHBondContact O-N 3.41Å; L140-V144 WeakPolarHBondContact O-CB 3.42Å; L140-V144 VanDerWaalsContact O-CG2 3.29Å; L140-V144 WeakPolarHBondContact O-CG2 2.97Å; L140-V144 PolarHBondContact O-N 3.31Å; L140-F250 HydrophobicContact CD2-CZ 3.94Å
141	L	87.4	Confident	82.9	Confident	111 Å²	111	63.3 Å²	63.3	58%	0.581	31%	0.309	S	S	*	.	H	α-helix	trans	-62.4	-39	176.5	-71	174	0	0	0	111.8	V137 L138 W139 K145	V137-L141 HydrophobicContact CG1-CD1 4.03Å; V137-L141 HydrophobicContact CG1-CG 4.41Å; V137-L141 WeakPolarHBondContact O-CB 3.33Å; V137-L141 VanDerWaalsContact O-CG 3.29Å; V137-L141 WeakPolarHBondContact O-CG 3.33Å; V137-L141 PolarHBondContact O-N 2.71Å; L138-L141 PolarHBondContact O-N 2.95Å; W139-L141 PolarHBondContact O-N 3.12Å; L141-K145 VanDerWaalsContact O-CB 3.3Å; L141-K145 WeakPolarHBondContact O-CB 3.17Å; L141-K145 PolarHBondContact O-N 3Å
142	F	85.3	Confident	81.5	Confident	83 Å²	83	69 Å²	69	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-47.1	176.9	178.8	-106.8	0	0	0	111.7	L107 L138 W139 L140 K145 L146	L107-F142 HydrophobicContact CD2-CD1 4.24Å; L107-F142 HydrophobicContact CD2-CE1 4.05Å; L138-F142 WeakPolarHBondContact O-CB 3.41Å; L138-F142 PolarHBondContact O-N 3.19Å; W139-F142 WeakPolarHBondContact O-CB 3.17Å; W139-F142 PolarHBondContact O-N 3.03Å; L140-F142 VanDerWaalsContact C-N 3.3Å; L140-F142 PolarHBondContact O-N 2.75Å; F142-K145 WeakPolarHBondContact O-CB 3.4Å; F142-K145 PolarHBondContact O-N 3.47Å; F142-L146 HydrophobicContact CD1-CD1 3.87Å; F142-L146 HydrophobicContact CE1-CD1 3.38Å; F142-L146 HydrophobicContact CE1-CG 4.36Å; F142-L146 HydrophobicContact CE2-CD1 4.41Å; F142-L146 HydrophobicContact CZ-CD1 3.7Å; F142-L146 HydrophobicContact CZ-CG 4.3Å; F142-L146 PolarHBondContact O-N 3.4Å
143	I	80.1	Confident	79.9	Confident	1 Å²	1	77 Å²	77	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-66.8	-42.3	177.8	-66.9	-173.1	0	0	0	111.6	I39 M42 T43 W139 L140 K145 L146 A147	I39-I143 HydrophobicContact CG2-CG2 3.75Å; M42-I143 HydrophobicContact CB-CD1 4.12Å; M42-I143 HydrophobicContact CE-CD1 4.38Å; T43-I143 HydrophobicContact CG2-CB 4.25Å; T43-I143 HydrophobicContact CG2-CD1 4.34Å; T43-I143 HydrophobicContact CG2-CG2 3.42Å; T43-I143 VanDerWaalsContact CG2-CG2 3.42Å; W139-I143 HydrophobicContact CD2-CD1 3.91Å; W139-I143 HydrophobicContact CD2-CG1 4.45Å; W139-I143 HydrophobicContact CE3-CD1 4.29Å; W139-I143 HydrophobicContact CH2-CD1 3.63Å; W139-I143 HydrophobicContact CZ2-CD1 3.14Å; W139-I143 HydrophobicContact CZ2-CG1 4.41Å; W139-I143 HydrophobicContact CZ3-CD1 4.12Å; W139-I143 PolarHBondContact O-N 3.36Å; L140-I143 PolarHBondContact O-N 3.41Å; I143-K145 PolarHBondContact O-N 3.37Å; I143-L146 WeakPolarHBondContact O-CB 3.38Å; I143-L146 PolarHBondContact O-N 3.33Å; I143-L146 VanDerWaalsContact O-N 3.13Å; I143-A147 WeakPolarHBondContact O-CB 3.48Å; I143-A147 PolarHBondContact O-N 3.13Å
144	V	79.4	Confident	77.9	Confident	62 Å²	62	77.3 Å²	77.3	38%	0.376	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-37.6	176.1	170.8	0	0	0	0	111	L140 A147 R148	L140-V144 WeakPolarHBondContact O-CB 3.42Å; L140-V144 VanDerWaalsContact O-CG2 3.29Å; L140-V144 WeakPolarHBondContact O-CG2 2.97Å; L140-V144 PolarHBondContact O-N 3.31Å; V144-A147 PolarHBondContact O-N 3.13Å; V144-R148 WeakPolarHBondContact O-CB 3.39Å; V144-R148 WeakPolarHBondContact O-CG 3.3Å; V144-R148 PolarHBondContact O-N 2.83Å
145	K	84.4	Confident	76	Confident	128 Å²	128	73.3 Å²	73.3	56%	0.557	36%	0.364	S	S	*	.	H	α-helix	trans	-63.6	-43.9	174.3	-175.6	-176.8	177.1	-175.1	0	111.4	L141 F142 I143 R148 Q149	L141-K145 VanDerWaalsContact O-CB 3.3Å; L141-K145 WeakPolarHBondContact O-CB 3.17Å; L141-K145 PolarHBondContact O-N 3Å; F142-K145 WeakPolarHBondContact O-CB 3.4Å; F142-K145 PolarHBondContact O-N 3.47Å; I143-K145 PolarHBondContact O-N 3.37Å; K145-R148 PolarHBondContact O-N 3.19Å; K145-Q149 WeakPolarHBondContact O-CB 3.31Å; K145-Q149 WeakPolarHBondContact O-CG 3.18Å; K145-Q149 PolarHBondContact O-N 3.06Å
146	L	76.1	Confident	74.2	Confident	20 Å²	20	76.7 Å²	76.7	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-44.9	174.5	-78.8	168.6	0	0	0	111.8	I39 F142 I143 R148 Q149 A150	I39-L146 HydrophobicContact CD1-CB 4.33Å; F142-L146 HydrophobicContact CD1-CD1 3.87Å; F142-L146 HydrophobicContact CE1-CD1 3.38Å; F142-L146 HydrophobicContact CE1-CG 4.36Å; F142-L146 HydrophobicContact CE2-CD1 4.41Å; F142-L146 HydrophobicContact CZ-CD1 3.7Å; F142-L146 HydrophobicContact CZ-CG 4.3Å; F142-L146 PolarHBondContact O-N 3.4Å; I143-L146 WeakPolarHBondContact O-CB 3.38Å; I143-L146 PolarHBondContact O-N 3.33Å; I143-L146 VanDerWaalsContact O-N 3.13Å; L146-R148 PolarHBondContact O-N 2.69Å; L146-Q149 PolarHBondContact O-N 3.21Å; L146-A150 PolarHBondContact O-N 3.41Å
147	A	70.7	Confident	72.6	Confident	12 Å²	12	80.3 Å²	80.3	10%	0.099	41%	0.407	C	S	.	.	H	α-helix	trans	-57.7	-48.5	177	0	0	0	0	0	111.4	I35 I39 I143 V144 Q149 A150 E151	I35-A147 HydrophobicContact CG2-CB 4.34Å; I39-A147 HydrophobicContact CD1-CB 4.28Å; I39-A147 HydrophobicContact CG2-CB 3.83Å; I143-A147 WeakPolarHBondContact O-CB 3.48Å; I143-A147 PolarHBondContact O-N 3.13Å; V144-A147 PolarHBondContact O-N 3.13Å; A147-Q149 VanDerWaalsContact C-N 3.34Å; A147-Q149 PolarHBondContact O-N 3.42Å; A147-A150 PolarHBondContact O-N 2.99Å; A147-E151 PolarHBondContact O-N 3.41Å
148	R	76.5	Confident	70.8	Confident	152 Å²	152	80.2 Å²	80.2	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-66.4	-33.6	177.7	-74	177.8	178.2	173.8	1.4	112.9	V144 K145 L146 R152	V144-R148 WeakPolarHBondContact O-CB 3.39Å; V144-R148 WeakPolarHBondContact O-CG 3.3Å; V144-R148 PolarHBondContact O-N 2.83Å; K145-R148 PolarHBondContact O-N 3.19Å; L146-R148 PolarHBondContact O-N 2.69Å; R148-R152 WeakPolarHBondContact O-CB 3.44Å; R148-R152 VanDerWaalsContact O-CG 3.23Å; R148-R152 WeakPolarHBondContact O-CG 3.45Å; R148-R152 PolarHBondContact O-N 3.36Å
149	Q	74.1	Confident	69.5	Low	95 Å²	95	77.3 Å²	77.3	44%	0.444	39%	0.389	S	S	.	.	H	α-helix	trans	-68.9	-41.9	175.1	-80.9	-179.3	-36.5	0	0	111.3	K145 L146 A147 E151 R152 Q153	K145-Q149 WeakPolarHBondContact O-CB 3.31Å; K145-Q149 WeakPolarHBondContact O-CG 3.18Å; K145-Q149 PolarHBondContact O-N 3.06Å; L146-Q149 PolarHBondContact O-N 3.21Å; A147-Q149 VanDerWaalsContact C-N 3.34Å; A147-Q149 PolarHBondContact O-N 3.42Å; Q149-E151 VanDerWaalsContact C-N 3.33Å; Q149-E151 PolarHBondContact O-N 2.95Å; Q149-R152 PolarHBondContact O-N 3.17Å; Q149-Q153 WeakPolarHBondContact O-CB 3.26Å; Q149-Q153 PolarHBondContact O-N 3.35Å
150	A	64.4	Low	68.3	Low	28 Å²	28	84.5 Å²	84.5	23%	0.231	42%	0.416	C	S	.	.	H	α-helix	trans	-61.9	-41.1	174.8	0	0	0	0	0	111.8	P36 L146 A147	P36-A150 HydrophobicContact CG-CB 3.79Å; L146-A150 PolarHBondContact O-N 3.41Å; A147-A150 PolarHBondContact O-N 2.99Å
151	E	64.7	Low	67	Low	107 Å²	107	88 Å²	88	50%	0.5	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.4	-166.7	-177	-175	0	0	111.5	A147 Q149 G154	A147-E151 PolarHBondContact O-N 3.41Å; Q149-E151 VanDerWaalsContact C-N 3.33Å; Q149-E151 PolarHBondContact O-N 2.95Å; E151-G154 PolarHBondContact O-N 3Å
152	R	64.9	Low	65.7	Low	216 Å²	216	84.4 Å²	84.4	82%	0.815	41%	0.411	S	S	*	.	H	α-helix	trans	-72	-30.6	-178.9	-77.3	177.7	-178.9	-169.6	-0.1	114.6	R148 Q149 G154	R148-R152 WeakPolarHBondContact O-CB 3.44Å; R148-R152 VanDerWaalsContact O-CG 3.23Å; R148-R152 WeakPolarHBondContact O-CG 3.45Å; R148-R152 PolarHBondContact O-N 3.36Å; Q149-R152 PolarHBondContact O-N 3.17Å; R152-G154 PolarHBondContact O-N 3.01Å
153	Q	58.2	Low	64.7	Low	167 Å²	167	81.7 Å²	81.7	78%	0.78	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	2.4	178.3	-81.1	-176.4	-27.6	0	0	113.3	Q149	Q149-Q153 WeakPolarHBondContact O-CB 3.26Å; Q149-Q153 PolarHBondContact O-N 3.35Å
154	G	48.8	Very low	63.8	Low	48 Å²	48	84.8 Å²	84.8	50%	0.495	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	68.8	171.5	0	0	0	0	0	111.1	E151 R152	E151-G154 PolarHBondContact O-N 3Å; R152-G154 PolarHBondContact O-N 3.01Å
155	T	51.1	Low	63.1	Low	36 Å²	36	89.6 Å²	89.6	22%	0.221	45%	0.445	C	S	.	.			trans	29.9	89.1	174.9	33.8	0	0	0	0	113.9	T159 R160 L163	T155-T159 HydrophobicContact CG2-CG2 4.29Å; T155-R160 HydrophobicContact CG2-CG 4.28Å; T155-R160 PolarHBondContact OG1-NE 2.93Å; T155-L163 HydrophobicContact CG2-CD1 4.08Å
156	D	54.2	Low	62.1	Low	110 Å²	110	84.3 Å²	84.3	59%	0.588	42%	0.422	S	S	*	.			trans	-42	145.4	163	-160.9	-5.4	0	0	0	109.8	L158 T159 R160	D156-L158 PolarHBondContact O-N 3.03Å; D156-T159 PolarHBondContact O-N 2.87Å; D156-R160 PolarHBondContact O-N 3.08Å
157	S	54.9	Low	61.4	Low	80 Å²	80	85.9 Å²	85.9	56%	0.559	43%	0.434	S	S	*	.	H	α-helix	trans	-52.9	-34.9	-173.7	53.3	0	0	0	0	111.3	R160 E161	S157-R160 PolarHBondContact O-N 2.81Å; S157-E161 PolarHBondContact O-N 3.09Å
158	L	53.7	Low	60.9	Low	78 Å²	78	95.3 Å²	95.3	41%	0.408	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-47.3	175.2	-134.8	87.8	0	0	0	113.2	D156 R160 E161 Q162	D156-L158 PolarHBondContact O-N 3.03Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 3.29Å; L158-E161 PolarHBondContact O-N 2.99Å; L158-Q162 WeakPolarHBondContact O-CG 3.27Å; L158-Q162 PolarHBondContact O-N 3.13Å
159	T	59.6	Low	60.3	Low	20 Å²	20	94 Å²	94	12%	0.123	47%	0.472	C	S	.	.	H	α-helix	trans	-68.9	-32.7	179.6	-46.8	0	0	0	0	111	P36 T155 D156 L163	P36-T159 HydrophobicContact CB-CG2 4.47Å; P36-T159 HydrophobicContact CG-CG2 4.04Å; T155-T159 HydrophobicContact CG2-CG2 4.29Å; D156-T159 PolarHBondContact O-N 2.87Å; T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.41Å; T159-L163 WeakPolarHBondContact O-CB 3.3Å; T159-L163 WeakPolarHBondContact O-CG 3.32Å; T159-L163 PolarHBondContact O-N 3.12Å
160	R	60.6	Low	59.9	Low	163 Å²	163	91.1 Å²	91.1	62%	0.615	47%	0.467	S	S	*	.	H	α-helix	trans	-65	-43.5	173.7	-110.8	164.6	-164.3	-159.1	5.1	112.5	T155 D156 S157 L158 A164	T155-R160 HydrophobicContact CG2-CG 4.28Å; T155-R160 PolarHBondContact OG1-NE 2.93Å; D156-R160 PolarHBondContact O-N 3.08Å; S157-R160 PolarHBondContact O-N 2.81Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 3.29Å; R160-A164 WeakPolarHBondContact O-CB 3.41Å; R160-A164 PolarHBondContact O-N 3.35Å; R160-A164 VanDerWaalsContact O-N 3.13Å
161	E	58.5	Low	60.7	Low	130 Å²	130	91.4 Å²	91.4	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-62.2	-47.7	174.3	-77.1	178.6	170.4	0	0	111	S157 L158 L163 A164 E165	S157-E161 PolarHBondContact O-N 3.09Å; L158-E161 PolarHBondContact O-N 2.99Å; E161-L163 VanDerWaalsContact C-N 3.34Å; E161-L163 PolarHBondContact O-N 2.93Å; E161-A164 WeakPolarHBondContact O-CB 3.35Å; E161-A164 PolarHBondContact O-N 3.41Å; E161-E165 PolarHBondContact O-N 2.98Å
162	Q	59.8	Low	61.7	Low	37 Å²	37	89.2 Å²	89.2	17%	0.173	46%	0.464	C	S	.	.	H	α-helix	trans	-57.5	-43.2	177.3	-74.4	172	-32.9	0	0	113	P37 L158 A164 D238	P37-Q162 HydrophobicContact CG-CB 4.43Å; L158-Q162 WeakPolarHBondContact O-CG 3.27Å; L158-Q162 PolarHBondContact O-N 3.13Å; Q162-A164 VanDerWaalsContact C-N 3.29Å; Q162-A164 PolarHBondContact O-N 2.65Å; Q162-D238 PolarHBondContact NE2-OD2 2.93Å
163	L	63.8	Low	62.8	Low	25 Å²	25	83.9 Å²	83.9	13%	0.131	46%	0.457	C	S	.	.	H	α-helix	trans	-72.1	-23.5	179.2	-68.2	170.5	0	0	0	112.8	C30 T155 T159 E161 L166	C30-L163 HydrophobicContact CB-CD2 3.96Å; C30-L163 WeakPolarHBondContact O-CD2 3.31Å; T155-L163 HydrophobicContact CG2-CD1 4.08Å; T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.41Å; T159-L163 WeakPolarHBondContact O-CB 3.3Å; T159-L163 WeakPolarHBondContact O-CG 3.32Å; T159-L163 PolarHBondContact O-N 3.12Å; E161-L163 VanDerWaalsContact C-N 3.34Å; E161-L163 PolarHBondContact O-N 2.93Å; L163-L166 HydrophobicContact CD2-CD1 4.05Å
164	A	61.5	Low	64.2	Low	67 Å²	67	78.5 Å²	78.5	55%	0.554	44%	0.436	S	S	*	.	H	α-helix	trans	-76	-25	179.2	0	0	0	0	0	113.2	R160 E161 Q162	R160-A164 WeakPolarHBondContact O-CB 3.41Å; R160-A164 PolarHBondContact O-N 3.35Å; R160-A164 VanDerWaalsContact O-N 3.13Å; E161-A164 WeakPolarHBondContact O-CB 3.35Å; E161-A164 PolarHBondContact O-N 3.41Å; Q162-A164 VanDerWaalsContact C-N 3.29Å; Q162-A164 PolarHBondContact O-N 2.65Å
165	E	63.6	Low	66	Low	163 Å²	163	76.2 Å²	76.2	76%	0.762	41%	0.412	S	S	*	.	S	Bend	trans	-80.4	-13.8	178	-66.1	-171.5	163	0	0	113.7	E161	E161-E165 PolarHBondContact O-N 2.98Å
166	L	64.1	Low	67.9	Low	16 Å²	16	79.5 Å²	79.5	8%	0.084	42%	0.424	C	S	.	.	S	Bend	trans	-74.9	147.6	-178.4	-64.3	174.7	0	0	0	112.4	C30 L163 R168 E236	C30-L166 HydrophobicContact CB-CD1 3.79Å; L163-L166 HydrophobicContact CD2-CD1 4.05Å; L166-R168 PolarHBondContact O-N 3.1Å; L166-E236 HydrophobicContact CD2-CG 3.85Å
167	P	61.1	Low	69.7	Low	54 Å²	54	79.2 Å²	79.2	35%	0.351	42%	0.421	S	S	.	.			trans	-54.6	137.1	178.2	-21.1	30.1	0	0	0	111.6	R31	R31-P167 PolarHBondContact NH1-O 3Å
168	R	60.3	Low	71.3	Confident	210 Å²	210	77.8 Å²	77.8	79%	0.792	40%	0.404	S	S	*	.			trans	-83.8	-8.7	-179.3	-71.9	-170.9	179.1	-179.1	1	114.6	R31 L166	R31-R168 PolarHBondContact NH1-O 3.42Å; R31-R168 VanDerWaalsContact NH1-O 3.1Å; L166-R168 PolarHBondContact O-N 3.1Å
169	D	65	Low	73	Confident	125 Å²	125	75.4 Å²	75.4	67%	0.668	39%	0.391	S	S	*	.			trans	-81.5	143.1	-174.3	-63.6	-34.2	0	0	0	112.7
170	G	64	Low	74.4	Confident	33 Å²	33	75.9 Å²	75.9	34%	0.34	40%	0.401	S	S	.	.			trans	91.6	138.1	175	0	0	0	0	0	114.6	R31	R31-G170 PolarHBondContact NH2-O 3.19Å
171	G	81.4	Confident	75.8	Confident	35 Å²	35	70.6 Å²	70.6	36%	0.361	38%	0.384	S	S	.	.			trans	-97.8	173.5	175.1	0	0	0	0	0	113.1	P173 V174 A175	G171-P173 VanDerWaalsContact C-N 3.31Å; G171-V174 WeakPolarHBondContact O-CB 3.35Å; G171-V174 PolarHBondContact O-N 2.85Å; G171-A175 PolarHBondContact O-N 3.4Å
172	L	86.1	Confident	77.2	Confident	61 Å²	61	64.4 Å²	64.4	32%	0.319	36%	0.355	S	S	.	.	H	α-helix	trans	-48.7	-40.6	178.2	-158.8	90.6	0	0	0	114.3	T32 F33 V174 A175 F176	T32-L172 HydrophobicContact CG2-CD1 3.41Å; T32-L172 VanDerWaalsContact CG2-CD1 3.41Å; F33-L172 HydrophobicContact CE2-CD1 3.71Å; F33-L172 HydrophobicContact CZ-CD1 3.79Å; L172-V174 VanDerWaalsContact C-N 3.29Å; L172-V174 PolarHBondContact O-N 3.44Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.02Å; L172-F176 HydrophobicContact CD1-CE2 4.28Å; L172-F176 HydrophobicContact CD2-CD2 4.23Å; L172-F176 HydrophobicContact CD2-CE2 3.7Å; L172-F176 HydrophobicContact CG-CD2 3.99Å; L172-F176 HydrophobicContact CG-CE2 3.7Å; L172-F176 WeakPolarHBondContact O-CD2 3.33Å; L172-F176 PolarHBondContact O-N 3.23Å; L172-F176 VanDerWaalsContact O-N 3.12Å
173	P	88.6	Confident	78.5	Confident	103 Å²	103	65.5 Å²	65.5	67%	0.669	36%	0.362	S	S	*	.	H	α-helix	trans	-63	-34.6	177.3	-23	34.8	0	0	0	113.3	G171 L177	G171-P173 VanDerWaalsContact C-N 3.31Å; P173-L177 WeakPolarHBondContact O-CB 3.49Å; P173-L177 PolarHBondContact O-N 3.42Å
174	V	86.7	Confident	79.7	Confident	54 Å²	54	70 Å²	70	33%	0.327	39%	0.385	S	S	.	.	H	α-helix	trans	-70.5	-37.5	178.5	178.8	0	0	0	0	110.3	G171 L172 L177 W178	G171-V174 WeakPolarHBondContact O-CB 3.35Å; G171-V174 PolarHBondContact O-N 2.85Å; L172-V174 VanDerWaalsContact C-N 3.29Å; L172-V174 PolarHBondContact O-N 3.44Å; V174-L177 PolarHBondContact O-N 2.63Å; V174-W178 VanDerWaalsContact O-CD1 3.22Å; V174-W178 PolarHBondContact O-N 2.66Å
175	A	87.5	Confident	81.1	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-50.6	174.6	0	0	0	0	0	111.4	A25 I28 L29 G171 L172 L177 W178 L179	A25-A175 WeakPolarHBondContact CB-O 3.49Å; I28-A175 HydrophobicContact CB-CB 3.83Å; I28-A175 HydrophobicContact CD1-CB 4.32Å; I28-A175 HydrophobicContact CG2-CB 3.7Å; L29-A175 HydrophobicContact CD2-CB 4.27Å; L29-A175 HydrophobicContact CG-CB 4.32Å; G171-A175 PolarHBondContact O-N 3.4Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.02Å; A175-L177 VanDerWaalsContact C-N 3.33Å; A175-L177 PolarHBondContact O-N 3Å; A175-W178 PolarHBondContact O-N 3Å; A175-L179 VanDerWaalsContact O-CB 3.29Å; A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 PolarHBondContact O-N 2.82Å
176	F	90.6	Very high	82.4	Confident	106 Å²	106	61.4 Å²	61.4	47%	0.465	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-36.1	178.3	-78.2	-64.5	0	0	0	113.1	L172 L179 G180	L172-F176 HydrophobicContact CD1-CE2 4.28Å; L172-F176 HydrophobicContact CD2-CD2 4.23Å; L172-F176 HydrophobicContact CD2-CE2 3.7Å; L172-F176 HydrophobicContact CG-CD2 3.99Å; L172-F176 HydrophobicContact CG-CE2 3.7Å; L172-F176 WeakPolarHBondContact O-CD2 3.33Å; L172-F176 PolarHBondContact O-N 3.23Å; L172-F176 VanDerWaalsContact O-N 3.12Å; F176-L179 PolarHBondContact O-N 3Å; F176-G180 PolarHBondContact O-N 2.95Å
177	L	91.3	Very high	83.6	Confident	103 Å²	103	61.5 Å²	61.5	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-52.2	174.2	178	65.7	0	0	0	111	P173 V174 A175 L179 G180 I181	P173-L177 WeakPolarHBondContact O-CB 3.49Å; P173-L177 PolarHBondContact O-N 3.42Å; V174-L177 PolarHBondContact O-N 2.63Å; A175-L177 VanDerWaalsContact C-N 3.33Å; A175-L177 PolarHBondContact O-N 3Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.42Å; L177-G180 PolarHBondContact O-N 2.88Å; L177-I181 HydrophobicContact CD1-CD1 4.02Å; L177-I181 HydrophobicContact CD1-CG1 4.45Å; L177-I181 HydrophobicContact CG-CD1 3.94Å; L177-I181 VanDerWaalsContact O-CG1 3.3Å; L177-I181 WeakPolarHBondContact O-CG1 3.35Å; L177-I181 PolarHBondContact O-N 3.22Å
178	W	89.9	Confident	85	Confident	51 Å²	51	63.5 Å²	63.5	19%	0.193	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-35.8	179.8	-75.9	125.4	0	0	0	112.7	R21 A25 V174 A175 I181 A182	R21-W178 HydrophobicContact CB-CD2 4.31Å; R21-W178 HydrophobicContact CB-CE3 3.88Å; R21-W178 VanDerWaalsContact CD-CE3 3.46Å; R21-W178 HydrophobicContact CG-CD2 4.23Å; R21-W178 HydrophobicContact CG-CE3 3.62Å; R21-W178 HydrophobicContact CG-CZ3 3.79Å; A25-W178 HydrophobicContact CB-CB 3.96Å; V174-W178 VanDerWaalsContact O-CD1 3.22Å; V174-W178 PolarHBondContact O-N 2.66Å; A175-W178 PolarHBondContact O-N 3Å; W178-I181 HydrophobicContact CE3-CB 4.29Å; W178-I181 HydrophobicContact CE3-CD1 3.8Å; W178-I181 HydrophobicContact CE3-CG2 4.27Å; W178-I181 HydrophobicContact CZ3-CD1 3.82Å; W178-I181 HydrophobicContact CZ3-CG2 4.31Å; W178-I181 PolarHBondContact O-N 3.43Å; W178-A182 VanDerWaalsContact O-CB 3.27Å; W178-A182 WeakPolarHBondContact O-CB 3.47Å; W178-A182 PolarHBondContact O-N 3.21Å
179	L	88.6	Confident	86.4	Confident	27 Å²	27	53.5 Å²	53.5	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-48.8	172.9	-164.4	94.8	0	0	0	110.9	L22 A25 L29 V44 A175 F176 L177 A182 L183	L22-L179 HydrophobicContact CD1-CD1 3.9Å; A25-L179 HydrophobicContact CB-CB 4.39Å; A25-L179 HydrophobicContact CB-CD1 4.49Å; L29-L179 HydrophobicContact CD1-CD1 4.26Å; V44-L179 HydrophobicContact CG1-CD1 3.35Å; A175-L179 VanDerWaalsContact O-CB 3.29Å; A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 PolarHBondContact O-N 2.82Å; F176-L179 PolarHBondContact O-N 3Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.42Å; L179-A182 PolarHBondContact O-N 3.31Å; L179-L183 HydrophobicContact CD2-CD1 3.95Å; L179-L183 HydrophobicContact CG-CD1 4.02Å; L179-L183 WeakPolarHBondContact O-CB 3.18Å; L179-L183 VanDerWaalsContact O-CG 3.25Å; L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 2.9Å
180	G	89.4	Confident	87.5	Confident	31 Å²	31	47.6 Å²	47.6	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178.4	0	0	0	0	0	112.7	F176 L177 L183 I184	F176-G180 PolarHBondContact O-N 2.95Å; L177-G180 PolarHBondContact O-N 2.88Å; G180-L183 PolarHBondContact O-N 3.3Å; G180-I184 WeakPolarHBondContact O-CG1 3.46Å; G180-I184 PolarHBondContact O-N 3Å
181	I	89.7	Confident	88.6	Confident	51 Å²	51	53.1 Å²	53.1	26%	0.262	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-46.3	174.8	-70.6	169.9	0	0	0	110.3	L177 W178 I184 I185	L177-I181 HydrophobicContact CD1-CD1 4.02Å; L177-I181 HydrophobicContact CD1-CG1 4.45Å; L177-I181 HydrophobicContact CG-CD1 3.94Å; L177-I181 VanDerWaalsContact O-CG1 3.3Å; L177-I181 WeakPolarHBondContact O-CG1 3.35Å; L177-I181 PolarHBondContact O-N 3.22Å; W178-I181 HydrophobicContact CE3-CB 4.29Å; W178-I181 HydrophobicContact CE3-CD1 3.8Å; W178-I181 HydrophobicContact CE3-CG2 4.27Å; W178-I181 HydrophobicContact CZ3-CD1 3.82Å; W178-I181 HydrophobicContact CZ3-CG2 4.31Å; W178-I181 PolarHBondContact O-N 3.43Å; I181-I184 PolarHBondContact O-N 3.47Å; I181-I185 HydrophobicContact CG2-CD1 3.48Å; I181-I185 VanDerWaalsContact CG2-CD1 3.48Å; I181-I185 HydrophobicContact CG2-CG1 4.15Å; I181-I185 WeakPolarHBondContact O-CB 3.47Å; I181-I185 WeakPolarHBondContact O-CG1 3.38Å; I181-I185 PolarHBondContact O-N 3.44Å
182	A	88.2	Confident	89	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-44.7	-178.3	0	0	0	0	0	111.9	S18 L22 W178 L179 I184 I185 M186	S18-A182 VanDerWaalsContact OG-CA 3.24Å; S18-A182 WeakPolarHBondContact OG-CA 3.13Å; S18-A182 PolarHBondContact OG-O 2.96Å; L22-A182 HydrophobicContact CB-CB 3.86Å; L22-A182 HydrophobicContact CD1-CB 4.04Å; L22-A182 HydrophobicContact CG-CB 4.46Å; W178-A182 VanDerWaalsContact O-CB 3.27Å; W178-A182 WeakPolarHBondContact O-CB 3.47Å; W178-A182 PolarHBondContact O-N 3.21Å; L179-A182 PolarHBondContact O-N 3.31Å; A182-I184 PolarHBondContact O-N 2.86Å; A182-I184 VanDerWaalsContact O-N 3.17Å; A182-I185 PolarHBondContact O-N 3.4Å; A182-M186 WeakPolarHBondContact O-CB 3.39Å; A182-M186 PolarHBondContact O-N 3.32Å
183	L	86.2	Confident	89	Confident	59 Å²	59	50.9 Å²	50.9	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-21.2	177.9	-73.8	168	0	0	0	113.8	L51 L179 G180 P187	L51-L183 HydrophobicContact CD1-CD2 3.41Å; L51-L183 VanDerWaalsContact CD1-CD2 3.41Å; L179-L183 HydrophobicContact CD2-CD1 3.95Å; L179-L183 HydrophobicContact CG-CD1 4.02Å; L179-L183 WeakPolarHBondContact O-CB 3.18Å; L179-L183 VanDerWaalsContact O-CG 3.25Å; L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 2.9Å; G180-L183 PolarHBondContact O-N 3.3Å; L183-P187 WeakPolarHBondContact O-CD 3.42Å; L183-P187 WeakPolarHBondContact O-CG 3.47Å
184	I	89.6	Confident	88.7	Confident	119 Å²	119	46.3 Å²	46.3	61%	0.61	24%	0.238	S	C	*	.	H	α-helix	trans	-94.2	-50.1	176.1	-64.6	169.9	0	0	0	110.9	G180 I181 A182 M186 V188	G180-I184 WeakPolarHBondContact O-CG1 3.46Å; G180-I184 PolarHBondContact O-N 3Å; I181-I184 PolarHBondContact O-N 3.47Å; A182-I184 PolarHBondContact O-N 2.86Å; A182-I184 VanDerWaalsContact O-N 3.17Å; I184-M186 VanDerWaalsContact C-N 3.35Å; I184-M186 PolarHBondContact O-N 2.94Å; I184-V188 WeakPolarHBondContact O-CG2 3.42Å
185	I	91.2	Very high	88.6	Confident	49 Å²	49	47.4 Å²	47.4	25%	0.251	24%	0.242	S	C	.	.	H	α-helix	trans	-67.4	-38.9	-174.7	-66.8	-178	0	0	0	110.8	L14 I181 A182 V188 A189	L14-I185 HydrophobicContact CB-CG2 4.21Å; L14-I185 HydrophobicContact CD2-CG2 4.35Å; I181-I185 HydrophobicContact CG2-CD1 3.48Å; I181-I185 VanDerWaalsContact CG2-CD1 3.48Å; I181-I185 HydrophobicContact CG2-CG1 4.15Å; I181-I185 WeakPolarHBondContact O-CB 3.47Å; I181-I185 WeakPolarHBondContact O-CG1 3.38Å; I181-I185 PolarHBondContact O-N 3.44Å; A182-I185 PolarHBondContact O-N 3.4Å; I185-V188 PolarHBondContact O-N 3.09Å; I185-A189 WeakPolarHBondContact O-CB 3.42Å; I185-A189 PolarHBondContact O-N 3.09Å
186	M	90.3	Very high	88.4	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-53	-173.7	-175.4	172.5	-77.4	0	0	112.2	A19 L22 T49 A182 I184 V188 A189 T190 P223 T227	A19-M186 HydrophobicContact CB-CE 4.11Å; L22-M186 HydrophobicContact CB-CE 4.36Å; L22-M186 HydrophobicContact CD2-CE 3.82Å; L22-M186 HydrophobicContact CD2-SD 4.05Å; T49-M186 HydrophobicContact CG2-SD 4.13Å; A182-M186 WeakPolarHBondContact O-CB 3.39Å; A182-M186 PolarHBondContact O-N 3.32Å; I184-M186 VanDerWaalsContact C-N 3.35Å; I184-M186 PolarHBondContact O-N 2.94Å; M186-V188 VanDerWaalsContact C-N 3.34Å; M186-V188 PolarHBondContact O-N 2.94Å; M186-A189 PolarHBondContact O-N 2.89Å; M186-T190 WeakPolarHBondContact O-CB 3.41Å; M186-T190 PolarHBondContact O-N 3.08Å; M186-T190 PolarHBondContact O-OG1 2.93Å; M186-P223 HydrophobicContact CE-CB 4.15Å; M186-P223 HydrophobicContact CG-CB 3.71Å; M186-P223 HydrophobicContact CG-CG 3.68Å; M186-P223 HydrophobicContact SD-CB 3.55Å; M186-P223 VanDerWaalsContact SD-CB 3.55Å; M186-P223 HydrophobicContact SD-CG 4.21Å; M186-T227 HydrophobicContact CE-CG2 4.36Å
187	P	88.8	Confident	87.5	Confident	19 Å²	19	44.5 Å²	44.5	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-39.4	176.1	-25.7	36.7	0	0	0	114.2	L51 I55 L183 R191	L51-P187 HydrophobicContact CB-CG 4.1Å; I55-P187 HydrophobicContact CD1-CB 3.75Å; I55-P187 HydrophobicContact CD1-CG 4.36Å; L183-P187 WeakPolarHBondContact O-CD 3.42Å; L183-P187 WeakPolarHBondContact O-CG 3.47Å; P187-R191 VanDerWaalsContact O-CB 3.32Å; P187-R191 WeakPolarHBondContact O-CB 3.41Å; P187-R191 PolarHBondContact O-N 3.46Å
188	V	90.8	Very high	86.7	Confident	95 Å²	95	40.8 Å²	40.8	58%	0.576	22%	0.216	S	C	*	.	H	α-helix	trans	-65.1	-45.3	178.9	173.6	0	0	0	0	110.8	I184 I185 M186 M192	I184-V188 WeakPolarHBondContact O-CG2 3.42Å; I185-V188 PolarHBondContact O-N 3.09Å; M186-V188 VanDerWaalsContact C-N 3.34Å; M186-V188 PolarHBondContact O-N 2.94Å; V188-M192 PolarHBondContact O-N 3.24Å
189	A	91.3	Very high	86	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-45.1	178.6	0	0	0	0	0	111.5	L14 V15 I185 M186 M192 V193	L14-A189 HydrophobicContact CB-CB 3.55Å; L14-A189 HydrophobicContact CD1-CB 4.49Å; V15-A189 HydrophobicContact CG2-CB 3.68Å; I185-A189 WeakPolarHBondContact O-CB 3.42Å; I185-A189 PolarHBondContact O-N 3.09Å; M186-A189 PolarHBondContact O-N 2.89Å; A189-M192 WeakPolarHBondContact O-CB 3.5Å; A189-M192 PolarHBondContact O-N 3.11Å; A189-V193 PolarHBondContact O-N 3.2Å
190	T	87.6	Confident	85	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-44.8	177.5	-60.5	0	0	0	0	111.8	P52 M186 M192 V193 V194 G219 P223	P52-T190 HydrophobicContact CB-CG2 3.42Å; P52-T190 VanDerWaalsContact CB-CG2 3.42Å; P52-T190 HydrophobicContact CG-CG2 3.88Å; M186-T190 WeakPolarHBondContact O-CB 3.41Å; M186-T190 PolarHBondContact O-N 3.08Å; M186-T190 PolarHBondContact O-OG1 2.93Å; T190-M192 VanDerWaalsContact C-N 3.28Å; T190-M192 PolarHBondContact O-N 3.09Å; T190-V193 WeakPolarHBondContact O-CA 3.41Å; T190-V193 WeakPolarHBondContact O-CB 3.36Å; T190-V193 PolarHBondContact O-N 3.45Å; T190-V194 HydrophobicContact CG2-CG2 4.23Å; T190-V194 WeakPolarHBondContact O-CG2 3.48Å; T190-V194 PolarHBondContact O-N 3.45Å; T190-G219 WeakPolarHBondContact CG2-O 3.39Å; T190-P223 VanDerWaalsContact OG1-CG 3.29Å; T190-P223 WeakPolarHBondContact OG1-CG 3.32Å
191	R	87.5	Confident	83.8	Confident	149 Å²	149	43.3 Å²	43.3	56%	0.562	23%	0.23	S	C	*	.	H	α-helix	trans	-59.2	-42.1	175.8	-171.3	176.7	-176.4	-175	6.8	111.5	P187 V193 V194 D195	P187-R191 VanDerWaalsContact O-CB 3.32Å; P187-R191 WeakPolarHBondContact O-CB 3.41Å; P187-R191 PolarHBondContact O-N 3.46Å; R191-V193 VanDerWaalsContact C-N 3.27Å; R191-V193 PolarHBondContact O-N 3.23Å; R191-V194 PolarHBondContact O-N 2.96Å; R191-D195 IonicContact NE-OD2 3.44Å; R191-D195 WeakPolarHBondContact O-CB 3.48Å; R191-D195 VanDerWaalsContact O-CG 3.24Å; R191-D195 PolarHBondContact O-N 3.49Å
192	M	88.6	Confident	82.6	Confident	42 Å²	42	45.8 Å²	45.8	21%	0.207	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-35.6	175	-167.3	170.5	63.1	0	0	112.1	L7 V10 L14 V188 A189 T190 N196	L7-M192 HydrophobicContact CB-CG 4.03Å; L7-M192 HydrophobicContact CB-SD 4.08Å; L7-M192 HydrophobicContact CD2-SD 3.77Å; L7-M192 HydrophobicContact CG-SD 4.46Å; L7-M192 VanDerWaalsContact O-CE 3.22Å; L7-M192 WeakPolarHBondContact O-CE 3.35Å; V10-M192 HydrophobicContact CB-CE 3.97Å; V10-M192 HydrophobicContact CG1-CE 3.89Å; L14-M192 HydrophobicContact CD1-CE 4.39Å; V188-M192 PolarHBondContact O-N 3.24Å; A189-M192 WeakPolarHBondContact O-CB 3.5Å; A189-M192 PolarHBondContact O-N 3.11Å; T190-M192 VanDerWaalsContact C-N 3.28Å; T190-M192 PolarHBondContact O-N 3.09Å; M192-N196 WeakPolarHBondContact O-CB 3.33Å; M192-N196 PolarHBondContact O-N 3.46Å; M192-N196 PolarHBondContact O-ND2 3.02Å
193	V	85.5	Confident	81.6	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-69.4	-48.3	173.6	178.4	0	0	0	0	111.4	L8 L12 A189 T190 R191 N196 A197 L222	L8-V193 HydrophobicContact CD1-CG1 4.39Å; L8-V193 HydrophobicContact CG-CG1 4.42Å; L12-V193 HydrophobicContact CD2-CG2 4.45Å; L12-V193 HydrophobicContact CG-CG2 4.18Å; A189-V193 PolarHBondContact O-N 3.2Å; T190-V193 WeakPolarHBondContact O-CA 3.41Å; T190-V193 WeakPolarHBondContact O-CB 3.36Å; T190-V193 PolarHBondContact O-N 3.45Å; R191-V193 VanDerWaalsContact C-N 3.27Å; R191-V193 PolarHBondContact O-N 3.23Å; V193-N196 PolarHBondContact O-N 3.24Å; V193-A197 VanDerWaalsContact O-CB 3.23Å; V193-A197 WeakPolarHBondContact O-CB 3.43Å; V193-A197 PolarHBondContact O-N 2.98Å; V193-L222 HydrophobicContact CB-CD1 4.2Å; V193-L222 HydrophobicContact CG1-CD1 3.62Å; V193-L222 HydrophobicContact CG2-CD1 4.28Å
194	V	83.9	Confident	80.3	Confident	7 Å²	7	60 Å²	60	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-47.1	-177	173.9	0	0	0	0	111.7	T190 R191 N196 A197 T198 I216 T220	T190-V194 HydrophobicContact CG2-CG2 4.23Å; T190-V194 WeakPolarHBondContact O-CG2 3.48Å; T190-V194 PolarHBondContact O-N 3.45Å; R191-V194 PolarHBondContact O-N 2.96Å; V194-N196 VanDerWaalsContact C-N 3.29Å; V194-N196 PolarHBondContact O-N 2.92Å; V194-A197 PolarHBondContact O-N 3.3Å; V194-T198 HydrophobicContact CG1-CG2 4.25Å; V194-T198 WeakPolarHBondContact O-CB 3.39Å; V194-T198 WeakPolarHBondContact O-CG2 3.5Å; V194-T198 PolarHBondContact O-N 2.85Å; V194-T198 PolarHBondContact O-OG1 2.91Å; V194-I216 HydrophobicContact CG1-CG1 4.15Å; V194-I216 HydrophobicContact CG1-CG2 4.27Å; V194-T220 HydrophobicContact CG2-CG2 3.97Å
195	D	84.4	Confident	79.1	Confident	76 Å²	76	59 Å²	59	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-40.2	-179.7	-68.9	-11.3	0	0	0	111	R191 T198 V199	R191-D195 IonicContact NE-OD2 3.44Å; R191-D195 WeakPolarHBondContact O-CB 3.48Å; R191-D195 VanDerWaalsContact O-CG 3.24Å; R191-D195 PolarHBondContact O-N 3.49Å; D195-T198 WeakPolarHBondContact CA-OG1 3.28Å; D195-T198 PolarHBondContact O-OG1 3.29Å; D195-V199 VanDerWaalsContact O-CG2 3.29Å; D195-V199 WeakPolarHBondContact O-CG2 3.49Å; D195-V199 PolarHBondContact O-N 3.18Å
196	N	82.4	Confident	77.9	Confident	21 Å²	21	60 Å²	60	11%	0.112	31%	0.314	C	S	.	.	H	α-helix	trans	-79.9	-26.5	179.9	-70.5	-69.5	0	0	0	112.9	A4 L7 L8 M192 V193 V194	A4-N196 WeakPolarHBondContact CA-OD1 3.42Å; A4-N196 HydrophobicContact CB-CB 4.2Å; A4-N196 VanDerWaalsContact CB-OD1 3.3Å; A4-N196 WeakPolarHBondContact CB-OD1 3.29Å; A4-N196 WeakPolarHBondContact O-CB 3.37Å; L7-N196 WeakPolarHBondContact CB-ND2 3.26Å; L8-N196 HydrophobicContact CB-CB 4.19Å; L8-N196 HydrophobicContact CD1-CB 4.43Å; M192-N196 WeakPolarHBondContact O-CB 3.33Å; M192-N196 PolarHBondContact O-N 3.46Å; M192-N196 PolarHBondContact O-ND2 3.02Å; V193-N196 PolarHBondContact O-N 3.24Å; V194-N196 VanDerWaalsContact C-N 3.29Å; V194-N196 PolarHBondContact O-N 2.92Å
197	A	73	Confident	76.9	Confident	25 Å²	25	62.9 Å²	62.9	21%	0.207	34%	0.335	C	S	.	.	H	α-helix	trans	-74.6	-38.4	173.3	0	0	0	0	0	112.3	L8 V193 V194 L200 A201	L8-A197 HydrophobicContact CD1-CB 4.2Å; V193-A197 VanDerWaalsContact O-CB 3.23Å; V193-A197 WeakPolarHBondContact O-CB 3.43Å; V193-A197 PolarHBondContact O-N 2.98Å; V194-A197 PolarHBondContact O-N 3.3Å; A197-L200 WeakPolarHBondContact O-CB 3.41Å; A197-L200 PolarHBondContact O-N 3.43Å; A197-L200 VanDerWaalsContact O-N 3.1Å; A197-A201 PolarHBondContact O-N 3.39Å
198	T	73.8	Confident	76	Confident	24 Å²	24	66.2 Å²	66.2	15%	0.147	35%	0.348	C	S	.	.	H	α-helix	trans	-67.2	-35.5	177	47.6	0	0	0	0	112.1	V194 D195 L200 A201 N202 M211 I216	V194-T198 HydrophobicContact CG1-CG2 4.25Å; V194-T198 WeakPolarHBondContact O-CB 3.39Å; V194-T198 WeakPolarHBondContact O-CG2 3.5Å; V194-T198 PolarHBondContact O-N 2.85Å; V194-T198 PolarHBondContact O-OG1 2.91Å; D195-T198 WeakPolarHBondContact CA-OG1 3.28Å; D195-T198 PolarHBondContact O-OG1 3.29Å; T198-L200 PolarHBondContact O-N 2.95Å; T198-A201 PolarHBondContact O-N 3.27Å; T198-A201 VanDerWaalsContact O-N 3.11Å; T198-N202 PolarHBondContact O-N 2.87Å; T198-M211 HydrophobicContact CG2-CG 4.49Å; T198-M211 HydrophobicContact CG2-SD 3.99Å; T198-I216 HydrophobicContact CG2-CD1 4.09Å; T198-I216 HydrophobicContact CG2-CG1 3.82Å
199	V	75.2	Confident	75	Confident	89 Å²	89	62 Å²	62	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-57.4	-35.3	170	170.1	0	0	0	0	111.9	D195	D195-V199 VanDerWaalsContact O-CG2 3.29Å; D195-V199 WeakPolarHBondContact O-CG2 3.49Å; D195-V199 PolarHBondContact O-N 3.18Å
200	L	68.2	Low	74.1	Confident	62 Å²	62	65 Å²	65	33%	0.325	34%	0.341	S	S	.	.	H	α-helix	trans	-74.2	-39.8	174.8	-62.8	169.7	0	0	0	111.8	M1 A197 T198 Y203 F204	M1-L200 HydrophobicContact CE-CD2 3.11Å; A197-L200 WeakPolarHBondContact O-CB 3.41Å; A197-L200 PolarHBondContact O-N 3.43Å; A197-L200 VanDerWaalsContact O-N 3.1Å; T198-L200 PolarHBondContact O-N 2.95Å; L200-Y203 WeakPolarHBondContact O-CB 3.21Å; L200-Y203 PolarHBondContact O-N 2.93Å; L200-F204 WeakPolarHBondContact O-CD2 3.49Å
201	A	64	Low	73.6	Confident	11 Å²	11	65.8 Å²	65.8	9%	0.091	35%	0.345	C	S	.	.	H	α-helix	trans	-70.6	-36.6	-177.9	0	0	0	0	0	113.4	A197 T198 Y203 F204	A197-A201 PolarHBondContact O-N 3.39Å; T198-A201 PolarHBondContact O-N 3.27Å; T198-A201 VanDerWaalsContact O-N 3.11Å; A201-Y203 PolarHBondContact O-N 2.99Å; A201-Y203 VanDerWaalsContact O-N 3.14Å; A201-F204 PolarHBondContact O-N 3.49Å
202	N	65.2	Low	73	Confident	104 Å²	104	58.7 Å²	58.7	56%	0.556	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-62	-20.8	177	-81.9	-22.2	0	0	0	113.2	T198 F204 M211	T198-N202 PolarHBondContact O-N 2.87Å; N202-F204 PolarHBondContact O-N 3.37Å; N202-M211 WeakPolarHBondContact OD1-CE 3.4Å
203	Y	66	Low	72.5	Confident	204 Å²	204	57.5 Å²	57.5	80%	0.8	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-65.6	-21.4	172.4	-163.5	-96	0	0	0	112.8	L200 A201	L200-Y203 WeakPolarHBondContact O-CB 3.21Å; L200-Y203 PolarHBondContact O-N 2.93Å; A201-Y203 PolarHBondContact O-N 2.99Å; A201-Y203 VanDerWaalsContact O-N 3.14Å
204	F	58.6	Low	72.3	Confident	154 Å²	154	59.9 Å²	59.9	68%	0.675	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-104.3	9.9	-175.1	-67.7	-79.7	0	0	0	114.7	L200 A201 N202 I206	L200-F204 WeakPolarHBondContact O-CD2 3.49Å; A201-F204 PolarHBondContact O-N 3.49Å; N202-F204 PolarHBondContact O-N 3.37Å; F204-I206 VanDerWaalsContact C-N 3.29Å; F204-I206 HydrophobicContact CB-CD1 4.13Å; F204-I206 HydrophobicContact CB-CG1 4.04Å; F204-I206 PolarHBondContact O-N 3.28Å
205	A	64.3	Low	72.2	Confident	99 Å²	99	61 Å²	61	82%	0.818	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	41.6	176.1	0	0	0	0	0	114.8
206	I	66.9	Low	72.2	Confident	69 Å²	69	57.7 Å²	57.7	35%	0.354	32%	0.32	S	S	.	.			trans	-79.6	141.5	179.3	-58.2	174.2	0	0	0	109.6	F204 T210	F204-I206 VanDerWaalsContact C-N 3.29Å; F204-I206 HydrophobicContact CB-CD1 4.13Å; F204-I206 HydrophobicContact CB-CG1 4.04Å; F204-I206 PolarHBondContact O-N 3.28Å; I206-T210 VanDerWaalsContact CG2-CB 3.49Å; I206-T210 HydrophobicContact CG2-CG2 3.5Å; I206-T210 VanDerWaalsContact CG2-CG2 3.5Å
207	S	69.1	Low	72.4	Confident	61 Å²	61	56.7 Å²	56.7	43%	0.427	31%	0.314	S	S	.	.			trans	-61.7	151.5	177.8	71.8	0	0	0	0	112.4	L209 T210 M211	S207-L209 VanDerWaalsContact C-N 3.3Å; S207-L209 PolarHBondContact O-N 2.89Å; S207-T210 PolarHBondContact O-N 3.42Å; S207-T210 VanDerWaalsContact O-N 3.1Å; S207-T210 WeakPolarHBondContact OG-CB 3.35Å; S207-T210 PolarHBondContact OG-N 3.49Å; S207-T210 PolarHBondContact OG-OG1 2.9Å; S207-M211 WeakPolarHBondContact O-CB 3.43Å; S207-M211 PolarHBondContact O-N 3.16Å
208	E	69.7	Low	73.1	Confident	89 Å²	89	58.9 Å²	58.9	42%	0.416	32%	0.322	S	S	.	.	H	α-helix	trans	-57	-43.4	179.8	-65.1	-167.7	162.4	0	0	111.7	Q65 L68 T210 M211 G212	Q65-E208 PolarHBondContact NE2-OE1 3.38Å; L68-E208 WeakPolarHBondContact CD1-O 3.48Å; E208-T210 PolarHBondContact O-N 2.78Å; E208-M211 WeakPolarHBondContact O-CB 3.4Å; E208-M211 PolarHBondContact O-N 3.44Å; E208-G212 PolarHBondContact O-N 2.94Å
209	L	70.2	Confident	73.7	Confident	6 Å²	6	58 Å²	58	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-46	174.9	-175.5	66.6	0	0	0	112.4	D67 S207 M211 G212 L213 D268 L270 A271	D67-L209 HydrophobicContact CB-CB 4.02Å; D67-L209 HydrophobicContact CB-CD1 4.01Å; D67-L209 WeakPolarHBondContact O-CD1 3.48Å; S207-L209 VanDerWaalsContact C-N 3.3Å; S207-L209 PolarHBondContact O-N 2.89Å; L209-M211 VanDerWaalsContact C-N 3.31Å; L209-M211 PolarHBondContact O-N 3.24Å; L209-G212 PolarHBondContact O-N 3.04Å; L209-L213 HydrophobicContact CD1-CD1 4.02Å; L209-L213 HydrophobicContact CD1-CG 4.25Å; L209-L213 HydrophobicContact CD2-CD1 4.22Å; L209-L213 HydrophobicContact CG-CD1 3.73Å; L209-L213 HydrophobicContact CG-CG 4.33Å; L209-L213 WeakPolarHBondContact O-CB 3.13Å; L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 3.04Å; L209-D268 HydrophobicContact CD2-CB 4.05Å; L209-L270 HydrophobicContact CD2-CB 3.87Å; L209-A271 HydrophobicContact CD1-CB 4.14Å; L209-A271 HydrophobicContact CD2-CB 4.18Å
210	T	71.9	Confident	74.4	Confident	64 Å²	64	53.8 Å²	53.8	39%	0.393	29%	0.292	S	S	.	.	H	α-helix	trans	-67.9	-35.7	-179.5	-55.5	0	0	0	0	111.3	I206 S207 E208 T214	I206-T210 VanDerWaalsContact CG2-CB 3.49Å; I206-T210 HydrophobicContact CG2-CG2 3.5Å; I206-T210 VanDerWaalsContact CG2-CG2 3.5Å; S207-T210 PolarHBondContact O-N 3.42Å; S207-T210 VanDerWaalsContact O-N 3.1Å; S207-T210 WeakPolarHBondContact OG-CB 3.35Å; S207-T210 PolarHBondContact OG-N 3.49Å; S207-T210 PolarHBondContact OG-OG1 2.9Å; E208-T210 PolarHBondContact O-N 2.78Å; T210-T214 VanDerWaalsContact O-CB 3.32Å; T210-T214 WeakPolarHBondContact O-CB 3.13Å; T210-T214 PolarHBondContact O-N 2.86Å; T210-T214 VanDerWaalsContact O-N 3.1Å; T210-T214 PolarHBondContact O-OG1 2.94Å; T210-T214 VanDerWaalsContact O-OG1 3.09Å
211	M	76.3	Confident	75.6	Confident	18 Å²	18	50.9 Å²	50.9	9%	0.089	28%	0.276	C	S	.	.	I	π-helix	trans	-63	-44.8	173.6	-168	-170.4	-53.6	0	0	110.8	L68 T198 N202 S207 E208 L209 A215 I216	L68-M211 HydrophobicContact CD1-CB 4.3Å; T198-M211 HydrophobicContact CG2-CG 4.49Å; T198-M211 HydrophobicContact CG2-SD 3.99Å; N202-M211 WeakPolarHBondContact OD1-CE 3.4Å; S207-M211 WeakPolarHBondContact O-CB 3.43Å; S207-M211 PolarHBondContact O-N 3.16Å; E208-M211 WeakPolarHBondContact O-CB 3.4Å; E208-M211 PolarHBondContact O-N 3.44Å; L209-M211 VanDerWaalsContact C-N 3.31Å; L209-M211 PolarHBondContact O-N 3.24Å; M211-A215 HydrophobicContact CG-CB 4.5Å; M211-A215 PolarHBondContact O-N 3.13Å; M211-I216 HydrophobicContact CG-CD1 4.31Å; M211-I216 HydrophobicContact CG-CG1 4.26Å; M211-I216 PolarHBondContact O-N 3.12Å; M211-I216 HydrophobicContact SD-CD1 4.44Å
212	G	75.4	Confident	76.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	I	π-helix	trans	-61	-54.6	174.3	0	0	0	0	0	112.5	G71 E208 L209 T214 A217	G71-G212 VanDerWaalsContact C-C 3.42Å; G71-G212 CarbonylContact C-O 3.33Å; G71-G212 CarbonylContact O-C 3.56Å; E208-G212 PolarHBondContact O-N 2.94Å; L209-G212 PolarHBondContact O-N 3.04Å; G212-T214 PolarHBondContact O-N 3.31Å; G212-A217 WeakPolarHBondContact O-CB 3.4Å; G212-A217 PolarHBondContact O-N 3.18Å; G212-A217 VanDerWaalsContact O-N 3.13Å
213	L	78.5	Confident	78.2	Confident	17 Å²	17	46.7 Å²	46.7	9%	0.089	25%	0.253	C	S	.	.	I	π-helix	trans	-64.3	-19.2	-177.6	-76.1	170.9	0	0	0	114.7	G71 L74 G75 L209	G71-L213 VanDerWaalsContact O-CA 3.31Å; G71-L213 WeakPolarHBondContact O-CA 3.03Å; G71-L213 PolarHBondContact O-N 3.35Å; L74-L213 HydrophobicContact CB-CD2 3.74Å; G75-L213 WeakPolarHBondContact CA-O 3.15Å; L209-L213 HydrophobicContact CD1-CD1 4.02Å; L209-L213 HydrophobicContact CD1-CG 4.25Å; L209-L213 HydrophobicContact CD2-CD1 4.22Å; L209-L213 HydrophobicContact CG-CD1 3.73Å; L209-L213 HydrophobicContact CG-CG 4.33Å; L209-L213 WeakPolarHBondContact O-CB 3.13Å; L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 3.04Å
214	T	81.3	Confident	79.5	Confident	58 Å²	58	37 Å²	37	36%	0.356	21%	0.214	S	C	.	.	I	π-helix	trans	-127.6	-71.5	-171.5	-42.8	0	0	0	0	112.8	T210 G212 I218	T210-T214 VanDerWaalsContact O-CB 3.32Å; T210-T214 WeakPolarHBondContact O-CB 3.13Å; T210-T214 PolarHBondContact O-N 2.86Å; T210-T214 VanDerWaalsContact O-N 3.1Å; T210-T214 PolarHBondContact O-OG1 2.94Å; T210-T214 VanDerWaalsContact O-OG1 3.09Å; G212-T214 PolarHBondContact O-N 3.31Å; T214-I218 HydrophobicContact CG2-CD1 4.17Å; T214-I218 WeakPolarHBondContact O-CB 3.44Å; T214-I218 WeakPolarHBondContact O-CD1 3.34Å; T214-I218 WeakPolarHBondContact O-CG1 3.5Å; T214-I218 PolarHBondContact O-N 2.95Å
215	A	81.2	Confident	81.1	Confident	31 Å²	31	31.2 Å²	31.2	26%	0.256	19%	0.191	S	C	.	.	I	π-helix	trans	-69.8	-47.4	-170	0	0	0	0	0	111.5	M211 G219	M211-A215 HydrophobicContact CG-CB 4.5Å; M211-A215 PolarHBondContact O-N 3.13Å; A215-G219 PolarHBondContact O-N 3.1Å; A215-G219 VanDerWaalsContact O-N 3.1Å
216	I	84.5	Confident	82.4	Confident	6 Å²	6	27.2 Å²	27.2	3%	0.031	16%	0.157	C	C	.	.	I	π-helix	trans	-69.2	-44.4	177	-64.1	-175.8	0	0	0	110.1	V56 L68 T72 V194 T198 M211 I218 G219 T220	V56-I216 HydrophobicContact CG1-CG2 3.6Å; L68-I216 HydrophobicContact CD1-CD1 3.56Å; L68-I216 HydrophobicContact CD2-CD1 4.13Å; L68-I216 HydrophobicContact CG-CD1 3.99Å; T72-I216 HydrophobicContact CG2-CG2 4.04Å; V194-I216 HydrophobicContact CG1-CG1 4.15Å; V194-I216 HydrophobicContact CG1-CG2 4.27Å; T198-I216 HydrophobicContact CG2-CD1 4.09Å; T198-I216 HydrophobicContact CG2-CG1 3.82Å; M211-I216 HydrophobicContact CG-CD1 4.31Å; M211-I216 HydrophobicContact CG-CG1 4.26Å; M211-I216 PolarHBondContact O-N 3.12Å; M211-I216 HydrophobicContact SD-CD1 4.44Å; I216-I218 PolarHBondContact O-N 2.99Å; I216-G219 PolarHBondContact O-N 3.2Å; I216-G219 VanDerWaalsContact O-N 3.17Å; I216-T220 HydrophobicContact CG2-CG2 3.93Å; I216-T220 WeakPolarHBondContact O-CB 3.35Å; I216-T220 WeakPolarHBondContact O-CG2 3.46Å; I216-T220 PolarHBondContact O-N 3.44Å; I216-T220 PolarHBondContact O-OG1 3.01Å
217	A	88.1	Confident	83.6	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-54.4	-47.2	174.7	0	0	0	0	0	113	I79 G212 G219 T220 S221	I79-A217 HydrophobicContact CG1-CB 4.29Å; G212-A217 WeakPolarHBondContact O-CB 3.4Å; G212-A217 PolarHBondContact O-N 3.18Å; G212-A217 VanDerWaalsContact O-N 3.13Å; A217-G219 PolarHBondContact O-N 3.41Å; A217-T220 WeakPolarHBondContact CA-OG1 3.48Å; A217-T220 PolarHBondContact O-OG1 3.25Å; A217-S221 WeakPolarHBondContact O-CB 3.48Å; A217-S221 PolarHBondContact O-N 3.26Å; A217-S221 PolarHBondContact O-OG 3.46Å
218	I	87.1	Confident	84.6	Confident	71 Å²	71	21.1 Å²	21.1	36%	0.364	12%	0.12	S	C	.	.	H	α-helix	trans	-60.9	-46.8	176.2	-71.7	164.9	0	0	0	110.7	I79 T214 I216 L222	I79-I218 HydrophobicContact CD1-CD1 4.3Å; I79-I218 HydrophobicContact CD1-CG1 3.6Å; I79-I218 HydrophobicContact CG1-CG1 4Å; T214-I218 HydrophobicContact CG2-CD1 4.17Å; T214-I218 WeakPolarHBondContact O-CB 3.44Å; T214-I218 WeakPolarHBondContact O-CD1 3.34Å; T214-I218 WeakPolarHBondContact O-CG1 3.5Å; T214-I218 PolarHBondContact O-N 2.95Å; I216-I218 PolarHBondContact O-N 2.99Å; I218-L222 WeakPolarHBondContact O-CG 3.49Å; I218-L222 PolarHBondContact O-N 3.2Å
219	G	87.1	Confident	85.5	Confident	5 Å²	5	18.9 Å²	18.9	5%	0.052	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-45.3	-177.9	0	0	0	0	0	112.6	T190 A215 I216 A217 S221 L222	T190-G219 WeakPolarHBondContact CG2-O 3.39Å; A215-G219 PolarHBondContact O-N 3.1Å; A215-G219 VanDerWaalsContact O-N 3.1Å; I216-G219 PolarHBondContact O-N 3.2Å; I216-G219 VanDerWaalsContact O-N 3.17Å; A217-G219 PolarHBondContact O-N 3.41Å; G219-S221 VanDerWaalsContact C-N 3.35Å; G219-L222 WeakPolarHBondContact O-CB 3.41Å; G219-L222 WeakPolarHBondContact O-CD1 3.49Å; G219-L222 WeakPolarHBondContact O-CG 3.4Å; G219-L222 PolarHBondContact O-N 3.48Å
220	T	89.9	Confident	86.3	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.8	-36.5	-179.9	48.8	0	0	0	0	112.2	V56 T72 S76 V194 I216 A217 L222 P223	V56-T220 HydrophobicContact CB-CG2 4.13Å; V56-T220 HydrophobicContact CG1-CG2 4.47Å; V56-T220 HydrophobicContact CG2-CG2 3.81Å; T72-T220 HydrophobicContact CG2-CG2 4.39Å; S76-T220 PolarHBondContact OG-OG1 2.93Å; V194-T220 HydrophobicContact CG2-CG2 3.97Å; I216-T220 HydrophobicContact CG2-CG2 3.93Å; I216-T220 WeakPolarHBondContact O-CB 3.35Å; I216-T220 WeakPolarHBondContact O-CG2 3.46Å; I216-T220 PolarHBondContact O-N 3.44Å; I216-T220 PolarHBondContact O-OG1 3.01Å; A217-T220 WeakPolarHBondContact CA-OG1 3.48Å; A217-T220 PolarHBondContact O-OG1 3.25Å; T220-L222 VanDerWaalsContact C-N 3.32Å; T220-L222 PolarHBondContact O-N 3.36Å; T220-P223 WeakPolarHBondContact O-CD 3.41Å
221	S	92.7	Very high	87	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.007	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	12.2	179.5	-51.6	0	0	0	0	114.9	E53 S76 I84 A217 G219 P223 E224 L225	E53-S221 WeakPolarHBondContact OE1-CA 3.24Å; E53-S221 PolarHBondContact OE1-N 3.39Å; E53-S221 PolarHBondContact OE1-OG 2.87Å; S76-S221 WeakPolarHBondContact CB-OG 2.97Å; S76-S221 PolarHBondContact OG-OG 3.22Å; S76-S221 VanDerWaalsContact OG-OG 3.1Å; I84-S221 VanDerWaalsContact CD1-O 3.28Å; I84-S221 WeakPolarHBondContact CD1-O 3.49Å; A217-S221 WeakPolarHBondContact O-CB 3.48Å; A217-S221 PolarHBondContact O-N 3.26Å; A217-S221 PolarHBondContact O-OG 3.46Å; G219-S221 VanDerWaalsContact C-N 3.35Å; S221-P223 VanDerWaalsContact C-CD 3.44Å; S221-E224 WeakPolarHBondContact CA-OE2 3.49Å; S221-E224 PolarHBondContact O-N 3.47Å; S221-L225 PolarHBondContact O-N 3.33Å; S221-L225 VanDerWaalsContact O-N 3.16Å
222	L	91	Very high	87.4	Confident	28 Å²	28	15.2 Å²	15.2	15%	0.147	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-38.3	170.3	-75.7	171.7	0	0	0	113.8	L12 V15 V193 I218 G219 T220 L225 A226	L12-L222 HydrophobicContact CD2-CD1 3.58Å; L12-L222 HydrophobicContact CD2-CD2 4.11Å; L12-L222 HydrophobicContact CD2-CG 4.48Å; V15-L222 HydrophobicContact CG1-CB 4.07Å; V193-L222 HydrophobicContact CB-CD1 4.2Å; V193-L222 HydrophobicContact CG1-CD1 3.62Å; V193-L222 HydrophobicContact CG2-CD1 4.28Å; I218-L222 WeakPolarHBondContact O-CG 3.49Å; I218-L222 PolarHBondContact O-N 3.2Å; G219-L222 WeakPolarHBondContact O-CB 3.41Å; G219-L222 WeakPolarHBondContact O-CD1 3.49Å; G219-L222 WeakPolarHBondContact O-CG 3.4Å; G219-L222 PolarHBondContact O-N 3.48Å; T220-L222 VanDerWaalsContact C-N 3.32Å; T220-L222 PolarHBondContact O-N 3.36Å; L222-L225 PolarHBondContact O-N 3.4Å; L222-A226 WeakPolarHBondContact O-CB 3.39Å; L222-A226 PolarHBondContact O-N 3.1Å
223	P	92.2	Very high	87.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-41.4	174.3	-25.5	38.6	0	0	0	113.3	V15 T49 P52 M186 T190 T220 S221 L225 A226 T227	V15-P223 HydrophobicContact CG1-CB 4.49Å; V15-P223 HydrophobicContact CG1-CG 4.19Å; T49-P223 HydrophobicContact CG2-CB 4.03Å; P52-P223 HydrophobicContact CG-CG 4.15Å; M186-P223 HydrophobicContact CE-CB 4.15Å; M186-P223 HydrophobicContact CG-CB 3.71Å; M186-P223 HydrophobicContact CG-CG 3.68Å; M186-P223 HydrophobicContact SD-CB 3.55Å; M186-P223 VanDerWaalsContact SD-CB 3.55Å; M186-P223 HydrophobicContact SD-CG 4.21Å; T190-P223 VanDerWaalsContact OG1-CG 3.29Å; T190-P223 WeakPolarHBondContact OG1-CG 3.32Å; T220-P223 WeakPolarHBondContact O-CD 3.41Å; S221-P223 VanDerWaalsContact C-CD 3.44Å; P223-L225 VanDerWaalsContact C-N 3.31Å; P223-L225 PolarHBondContact O-N 3.27Å; P223-A226 PolarHBondContact O-N 2.99Å; P223-T227 WeakPolarHBondContact O-CB 3.47Å; P223-T227 VanDerWaalsContact O-CG2 3.29Å; P223-T227 WeakPolarHBondContact O-CG2 3.42Å; P223-T227 PolarHBondContact O-N 3Å; P223-T227 PolarHBondContact O-OG1 3.03Å
224	E	93.6	Very high	88	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-44.2	174.5	-77	72	-168.9	0	0	110.3	T49 S50 I84 S221 T227 A228 A247	T49-E224 VanDerWaalsContact CB-CD 3.44Å; T49-E224 WeakPolarHBondContact CB-OE1 3.47Å; T49-E224 VanDerWaalsContact OG1-CD 3.29Å; T49-E224 PolarHBondContact OG1-OE1 3.27Å; S50-E224 WeakPolarHBondContact CA-OE1 3.49Å; S50-E224 PolarHBondContact N-OE1 3.27Å; S50-E224 PolarHBondContact OG-OE1 3.07Å; I84-E224 HydrophobicContact CD1-CB 3.65Å; S221-E224 WeakPolarHBondContact CA-OE2 3.49Å; S221-E224 PolarHBondContact O-N 3.47Å; E224-T227 WeakPolarHBondContact CA-OG1 3.33Å; E224-T227 PolarHBondContact O-OG1 2.8Å; E224-A228 WeakPolarHBondContact O-CB 3.34Å; E224-A228 PolarHBondContact O-N 3.24Å; E224-A247 HydrophobicContact CG-CB 3.78Å
225	L	92.2	Very high	87.7	Confident	33 Å²	33	26 Å²	26	17%	0.173	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-48.4	177.7	179.3	60.7	0	0	0	111.3	I84 L87 S221 L222 P223 A228 I229	I84-L225 HydrophobicContact CB-CD1 4.3Å; I84-L225 HydrophobicContact CD1-CB 3.97Å; I84-L225 HydrophobicContact CG1-CB 4.01Å; I84-L225 HydrophobicContact CG1-CD1 4.19Å; I84-L225 HydrophobicContact CG2-CB 4.29Å; I84-L225 HydrophobicContact CG2-CD1 3.98Å; L87-L225 HydrophobicContact CB-CD1 4.12Å; L87-L225 HydrophobicContact CD1-CD1 3.99Å; L87-L225 HydrophobicContact CD1-CD2 4.28Å; S221-L225 PolarHBondContact O-N 3.33Å; S221-L225 VanDerWaalsContact O-N 3.16Å; L222-L225 PolarHBondContact O-N 3.4Å; P223-L225 VanDerWaalsContact C-N 3.31Å; P223-L225 PolarHBondContact O-N 3.27Å; L225-A228 PolarHBondContact O-N 2.83Å; L225-I229 HydrophobicContact CD1-CD1 3.74Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CD1 3.96Å; L225-I229 WeakPolarHBondContact O-CB 3.2Å; L225-I229 VanDerWaalsContact O-CG1 3.3Å; L225-I229 WeakPolarHBondContact O-CG1 3.06Å; L225-I229 PolarHBondContact O-N 2.81Å
226	A	91.7	Very high	87.8	Confident	14 Å²	14	25.2 Å²	25.2	12%	0.116	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-41.1	-177.9	0	0	0	0	0	111.7	V15 V16 A19 L222 P223 A230	V15-A226 HydrophobicContact CG1-CB 4.1Å; V16-A226 HydrophobicContact CG2-CB 4.38Å; A19-A226 HydrophobicContact CB-CB 3.45Å; A19-A226 VanDerWaalsContact CB-CB 3.45Å; L222-A226 WeakPolarHBondContact O-CB 3.39Å; L222-A226 PolarHBondContact O-N 3.1Å; P223-A226 PolarHBondContact O-N 2.99Å; A226-A230 WeakPolarHBondContact O-CB 3.23Å; A226-A230 PolarHBondContact O-N 2.79Å
227	T	91.3	Very high	87.7	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-71	-38.9	176.9	51.2	0	0	0	0	112	A19 L22 V23 V45 T49 M186 P223 E224 A230 G231 N243	A19-T227 HydrophobicContact CB-CG2 3.55Å; L22-T227 HydrophobicContact CD2-CG2 4.11Å; V23-T227 HydrophobicContact CG2-CG2 4.1Å; V45-T227 HydrophobicContact CG1-CG2 4.26Å; T49-T227 HydrophobicContact CG2-CG2 3.6Å; M186-T227 HydrophobicContact CE-CG2 4.36Å; P223-T227 WeakPolarHBondContact O-CB 3.47Å; P223-T227 VanDerWaalsContact O-CG2 3.29Å; P223-T227 WeakPolarHBondContact O-CG2 3.42Å; P223-T227 PolarHBondContact O-N 3Å; P223-T227 PolarHBondContact O-OG1 3.03Å; E224-T227 WeakPolarHBondContact CA-OG1 3.33Å; E224-T227 PolarHBondContact O-OG1 2.8Å; T227-A230 PolarHBondContact O-N 3.33Å; T227-G231 PolarHBondContact O-N 3.15Å; T227-N243 PolarHBondContact OG1-ND2 3.03Å
228	A	90	Very high	87.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-47.3	174.2	0	0	0	0	0	111.1	I84 A88 E224 L225 G231 V232 A240 I244	I84-A228 HydrophobicContact CG2-CB 3.99Å; A88-A228 HydrophobicContact CB-CB 4.33Å; E224-A228 WeakPolarHBondContact O-CB 3.34Å; E224-A228 PolarHBondContact O-N 3.24Å; L225-A228 PolarHBondContact O-N 2.83Å; A228-G231 PolarHBondContact O-N 3.06Å; A228-V232 WeakPolarHBondContact O-CB 3.42Å; A228-V232 VanDerWaalsContact O-CG2 3.27Å; A228-V232 WeakPolarHBondContact O-CG2 3.32Å; A228-V232 PolarHBondContact O-N 3.42Å; A228-A240 HydrophobicContact CB-CB 4.42Å; A228-I244 HydrophobicContact CB-CD1 4.33Å
229	I	89	Confident	87.5	Confident	42 Å²	42	23.9 Å²	23.9	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-42.4	176.3	-67.2	170.8	0	0	0	111.1	L225 R233	L225-I229 HydrophobicContact CD1-CD1 3.74Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CD1 3.96Å; L225-I229 WeakPolarHBondContact O-CB 3.2Å; L225-I229 VanDerWaalsContact O-CG1 3.3Å; L225-I229 WeakPolarHBondContact O-CG1 3.06Å; L225-I229 PolarHBondContact O-N 2.81Å; I229-R233 HydrophobicContact CG2-CG 4.38Å; I229-R233 VanDerWaalsContact O-CB 3.31Å; I229-R233 WeakPolarHBondContact O-CB 3.21Å; I229-R233 WeakPolarHBondContact O-CG 3.4Å; I229-R233 PolarHBondContact O-N 3.5Å
230	A	87.9	Confident	87.5	Confident	12 Å²	12	23.8 Å²	23.8	10%	0.099	12%	0.12	C	C	.	.	H	α-helix	trans	-63.7	-44.6	178.9	0	0	0	0	0	112	V23 A226 T227 R233 K234	V23-A230 HydrophobicContact CG2-CB 4.16Å; A226-A230 WeakPolarHBondContact O-CB 3.23Å; A226-A230 PolarHBondContact O-N 2.79Å; T227-A230 PolarHBondContact O-N 3.33Å; A230-R233 PolarHBondContact O-N 2.86Å; A230-K234 WeakPolarHBondContact O-CB 3.29Å; A230-K234 WeakPolarHBondContact O-CG 3.25Å; A230-K234 PolarHBondContact O-N 2.88Å
231	G	86.5	Confident	87.3	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-51.1	175.9	0	0	0	0	0	111.5	T227 A228 R233 K234 G235 E236	T227-G231 PolarHBondContact O-N 3.15Å; A228-G231 PolarHBondContact O-N 3.06Å; G231-R233 VanDerWaalsContact C-N 3.33Å; G231-R233 PolarHBondContact O-N 3.35Å; G231-K234 CarbonylContact O-C 3.55Å; G231-K234 PolarHBondContact O-N 2.81Å; G231-K234 VanDerWaalsContact O-N 3.11Å; G231-G235 PolarHBondContact O-N 3.14Å; G231-G235 VanDerWaalsContact O-N 3.1Å; G231-E236 WeakPolarHBondContact O-CA 3.36Å; G231-E236 PolarHBondContact O-N 3.35Å
232	V	84.8	Confident	87.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.7	-39.6	178.4	171.1	0	0	0	0	112.3	R92 F94 A228 K234 G235 A240	R92-V232 HydrophobicContact CB-CG1 3.61Å; R92-V232 HydrophobicContact CG-CG1 4.42Å; F94-V232 HydrophobicContact CD1-CG1 4.47Å; F94-V232 HydrophobicContact CD1-CG2 3.79Å; F94-V232 HydrophobicContact CE1-CG2 4.27Å; F94-V232 HydrophobicContact CG-CG2 4.35Å; A228-V232 WeakPolarHBondContact O-CB 3.42Å; A228-V232 VanDerWaalsContact O-CG2 3.27Å; A228-V232 WeakPolarHBondContact O-CG2 3.32Å; A228-V232 PolarHBondContact O-N 3.42Å; V232-K234 VanDerWaalsContact C-N 3.34Å; V232-K234 PolarHBondContact O-N 2.89Å; V232-G235 PolarHBondContact O-N 3.28Å; V232-A240 HydrophobicContact CG2-CB 3.99Å
233	R	83.9	Confident	87.1	Confident	190 Å²	190	22.9 Å²	22.9	72%	0.717	12%	0.116	S	C	*	.	H	α-helix	trans	-65.6	-35.2	175.8	-82.1	-176.3	165	-178.4	-3.1	113	I229 A230 G231 G235	I229-R233 HydrophobicContact CG2-CG 4.38Å; I229-R233 VanDerWaalsContact O-CB 3.31Å; I229-R233 WeakPolarHBondContact O-CB 3.21Å; I229-R233 WeakPolarHBondContact O-CG 3.4Å; I229-R233 PolarHBondContact O-N 3.5Å; A230-R233 PolarHBondContact O-N 2.86Å; G231-R233 VanDerWaalsContact C-N 3.33Å; G231-R233 PolarHBondContact O-N 3.35Å; R233-G235 VanDerWaalsContact C-N 3.28Å
234	K	81.4	Confident	87	Confident	77 Å²	77	23.3 Å²	23.3	34%	0.335	12%	0.118	S	C	.	.	H	α-helix	trans	-81.4	-4.4	177	-70.8	179.5	-179.1	178.4	0	113.6	D20 V23 A230 G231 V232 E236	D20-K234 PolarHBondContact O-NZ 3.17Å; D20-K234 WeakPolarHBondContact OD1-CE 3.45Å; D20-K234 IonicContact OD1-NZ 3.9Å; D20-K234 PolarHBondContact OD1-NZ 3Å; D20-K234 IonicContact OD2-NZ 3.34Å; V23-K234 HydrophobicContact CG1-CD 4.14Å; A230-K234 WeakPolarHBondContact O-CB 3.29Å; A230-K234 WeakPolarHBondContact O-CG 3.25Å; A230-K234 PolarHBondContact O-N 2.88Å; G231-K234 CarbonylContact O-C 3.55Å; G231-K234 PolarHBondContact O-N 2.81Å; G231-K234 VanDerWaalsContact O-N 3.11Å; V232-K234 VanDerWaalsContact C-N 3.34Å; V232-K234 PolarHBondContact O-N 2.89Å; K234-E236 VanDerWaalsContact C-N 3.28Å; K234-E236 HydrophobicContact CB-CG 4.06Å
235	G	76.7	Confident	86.7	Confident	35 Å²	35	23.6 Å²	23.6	36%	0.361	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	6.2	-174.4	0	0	0	0	0	113.7	G231 V232 R233 N237	G231-G235 PolarHBondContact O-N 3.14Å; G231-G235 VanDerWaalsContact O-N 3.1Å; V232-G235 PolarHBondContact O-N 3.28Å; R233-G235 VanDerWaalsContact C-N 3.28Å; G235-N237 VanDerWaalsContact C-N 3.26Å; G235-N237 PolarHBondContact O-N 3.08Å; G235-N237 VanDerWaalsContact O-N 3.12Å
236	E	82.6	Confident	86.6	Confident	13 Å²	13	22 Å²	22	6%	0.061	11%	0.112	C	C	.	.			trans	-91.4	54.6	-176.6	-59.8	174.6	168.4	0	0	110.6	V23 S27 L166 G231 K234 D238 I239 A240	V23-E236 WeakPolarHBondContact CG1-OE2 3.37Å; S27-E236 WeakPolarHBondContact CB-OE1 3.33Å; S27-E236 PolarHBondContact OG-OE1 3.12Å; S27-E236 PolarHBondContact OG-OE2 3.21Å; L166-E236 HydrophobicContact CD2-CG 3.85Å; G231-E236 WeakPolarHBondContact O-CA 3.36Å; G231-E236 PolarHBondContact O-N 3.35Å; K234-E236 VanDerWaalsContact C-N 3.28Å; K234-E236 HydrophobicContact CB-CG 4.06Å; E236-D238 VanDerWaalsContact C-N 3.25Å; E236-D238 PolarHBondContact O-N 3.1Å; E236-I239 HydrophobicContact CB-CB 4.39Å; E236-I239 HydrophobicContact CB-CD1 4.11Å; E236-I239 HydrophobicContact CB-CG1 4.27Å; E236-I239 PolarHBondContact O-N 3.32Å; E236-I239 VanDerWaalsContact O-N 3.1Å; E236-A240 PolarHBondContact O-N 2.87Å
237	N	82.4	Confident	86.7	Confident	30 Å²	30	21.4 Å²	21.4	16%	0.16	11%	0.106	C	C	.	.	H	α-helix	trans	-58.4	-36.9	-172.7	-63.2	-26.1	0	0	0	112.7	F94 G235 I239 A240 V241	F94-N237 HydrophobicContact CB-CB 3.95Å; F94-N237 VanDerWaalsContact CB-CG 3.44Å; G235-N237 VanDerWaalsContact C-N 3.26Å; G235-N237 PolarHBondContact O-N 3.08Å; G235-N237 VanDerWaalsContact O-N 3.12Å; N237-I239 VanDerWaalsContact C-N 3.32Å; N237-I239 PolarHBondContact O-N 3.19Å; N237-A240 PolarHBondContact O-N 3.28Å; N237-V241 WeakPolarHBondContact O-CG2 3.42Å; N237-V241 PolarHBondContact O-N 3.29Å
238	D	83.7	Confident	86.7	Confident	19 Å²	19	21.3 Å²	21.3	10%	0.102	11%	0.106	C	C	.	.	H	α-helix	trans	-67.4	-32.4	-179.6	-68.4	-44.5	0	0	0	112.2	P37 L38 H97 Q162 E236 G242	P37-D238 HydrophobicContact CB-CB 4.07Å; L38-D238 WeakPolarHBondContact CA-O 3.41Å; L38-D238 HydrophobicContact CB-CB 4.3Å; H97-D238 IonicContact CE1-OD1 2.69Å; H97-D238 PolarHBondContact CE1-OD1 3.1Å; H97-D238 IonicContact CE1-OD2 3.79Å; H97-D238 IonicContact ND1-OD1 3.6Å; H97-D238 PolarHBondContact ND1-OD1 3.14Å; H97-D238 IonicContact ND1-OD2 3.7Å; Q162-D238 PolarHBondContact NE2-OD2 2.93Å; E236-D238 VanDerWaalsContact C-N 3.25Å; E236-D238 PolarHBondContact O-N 3.1Å; D238-G242 PolarHBondContact O-N 3.47Å
239	I	87.6	Confident	86.7	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-66.9	-43.7	173	-60	-175.2	0	0	0	109.6	A26 S27 P37 V45 E236 N237 G242 N243	A26-I239 HydrophobicContact CB-CD1 4.3Å; S27-I239 WeakPolarHBondContact OG-CD1 3.39Å; P37-I239 HydrophobicContact CB-CD1 4.34Å; P37-I239 HydrophobicContact CB-CG1 3.66Å; V45-I239 HydrophobicContact CG2-CG2 3.84Å; E236-I239 HydrophobicContact CB-CB 4.39Å; E236-I239 HydrophobicContact CB-CD1 4.11Å; E236-I239 HydrophobicContact CB-CG1 4.27Å; E236-I239 PolarHBondContact O-N 3.32Å; E236-I239 VanDerWaalsContact O-N 3.1Å; N237-I239 VanDerWaalsContact C-N 3.32Å; N237-I239 PolarHBondContact O-N 3.19Å; I239-G242 PolarHBondContact O-N 3.23Å; I239-N243 VanDerWaalsContact O-CB 3.32Å; I239-N243 WeakPolarHBondContact O-CB 3.37Å; I239-N243 PolarHBondContact O-N 2.87Å
240	A	87.4	Confident	86.8	Confident	2 Å²	2	20 Å²	20	2%	0.017	10%	0.098	C	C	.	.	H	α-helix	trans	-63.7	-47.5	179.2	0	0	0	0	0	112.3	A228 V232 E236 N237 N243 I244	A228-A240 HydrophobicContact CB-CB 4.42Å; V232-A240 HydrophobicContact CG2-CB 3.99Å; E236-A240 PolarHBondContact O-N 2.87Å; N237-A240 PolarHBondContact O-N 3.28Å; A240-N243 WeakPolarHBondContact O-CB 3.48Å; A240-N243 PolarHBondContact O-N 3.44Å; A240-I244 WeakPolarHBondContact O-CG1 3.5Å; A240-I244 PolarHBondContact O-N 3.43Å; A240-I244 VanDerWaalsContact O-N 3.16Å
241	V	85.8	Confident	86.9	Confident	10 Å²	10	19.4 Å²	19.4	6%	0.061	9%	0.094	C	C	.	.	H	α-helix	trans	-64.7	-43.7	176.7	173	0	0	0	0	110.9	L38 F94 V96 V100 N237 N243 I244 I245	L38-V241 HydrophobicContact CD1-CG1 4.31Å; F94-V241 HydrophobicContact CD2-CG2 3.84Å; F94-V241 HydrophobicContact CE2-CG2 3.52Å; F94-V241 HydrophobicContact CZ-CG2 4.47Å; V96-V241 HydrophobicContact CG2-CG2 4.5Å; V100-V241 HydrophobicContact CG1-CG1 3.87Å; V100-V241 HydrophobicContact CG2-CG1 4.39Å; N237-V241 WeakPolarHBondContact O-CG2 3.42Å; N237-V241 PolarHBondContact O-N 3.29Å; V241-N243 VanDerWaalsContact C-N 3.28Å; V241-N243 PolarHBondContact O-N 3.45Å; V241-I244 PolarHBondContact O-N 3.24Å; V241-I245 HydrophobicContact CG1-CD1 3.88Å; V241-I245 WeakPolarHBondContact O-CG1 3.36Å; V241-I245 PolarHBondContact O-N 3.27Å; V241-I245 VanDerWaalsContact O-N 3.08Å
242	G	87.9	Confident	87	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-41.5	175.8	0	0	0	0	0	111.7	G41 M42 D238 I239 I245 G246	G41-G242 CarbonylContact C-O 3.57Å; M42-G242 WeakPolarHBondContact CA-O 3.41Å; M42-G242 WeakPolarHBondContact CG-O 3.39Å; M42-G242 PolarHBondContact N-O 3.42Å; D238-G242 PolarHBondContact O-N 3.47Å; I239-G242 PolarHBondContact O-N 3.23Å; G242-I245 PolarHBondContact O-N 3.35Å; G242-G246 PolarHBondContact O-N 3.29Å
243	N	91.2	Very high	87.3	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-48.8	176.5	-174.1	50.6	0	0	0	112.2	G41 V45 S46 T49 T227 I239 A240 V241 I245 G246 A247	G41-N243 WeakPolarHBondContact O-CA 3.45Å; V45-N243 HydrophobicContact CG1-CB 4.08Å; V45-N243 WeakPolarHBondContact CG1-OD1 3.29Å; S46-N243 WeakPolarHBondContact CA-OD1 3.42Å; S46-N243 PolarHBondContact N-OD1 2.99Å; S46-N243 VanDerWaalsContact N-OD1 3.14Å; T49-N243 PolarHBondContact OG1-OD1 3.21Å; T227-N243 PolarHBondContact OG1-ND2 3.03Å; I239-N243 VanDerWaalsContact O-CB 3.32Å; I239-N243 WeakPolarHBondContact O-CB 3.37Å; I239-N243 PolarHBondContact O-N 2.87Å; A240-N243 WeakPolarHBondContact O-CB 3.48Å; A240-N243 PolarHBondContact O-N 3.44Å; V241-N243 VanDerWaalsContact C-N 3.28Å; V241-N243 PolarHBondContact O-N 3.45Å; N243-I245 PolarHBondContact O-N 2.98Å; N243-G246 PolarHBondContact O-N 2.77Å; N243-A247 WeakPolarHBondContact O-CB 3.3Å; N243-A247 PolarHBondContact O-N 3.41Å
244	I	89.1	Confident	87.7	Confident	9 Å²	9	12.5 Å²	12.5	5%	0.046	7%	0.07	C	C	.	.	H	α-helix	trans	-62	-45	-179.1	-65.2	168.9	0	0	0	111.1	I84 L85 A228 A240 V241 N248	I84-I244 HydrophobicContact CG2-CD1 4.31Å; I84-I244 HydrophobicContact CG2-CG1 4.46Å; L85-I244 HydrophobicContact CB-CD1 4.28Å; L85-I244 HydrophobicContact CD1-CD1 3.65Å; A228-I244 HydrophobicContact CB-CD1 4.33Å; A240-I244 WeakPolarHBondContact O-CG1 3.5Å; A240-I244 PolarHBondContact O-N 3.43Å; A240-I244 VanDerWaalsContact O-N 3.16Å; V241-I244 PolarHBondContact O-N 3.24Å; I244-N248 PolarHBondContact O-N 2.96Å; I244-N248 VanDerWaalsContact O-N 3.14Å; I244-N248 PolarHBondContact O-ND2 3.24Å
245	I	88.5	Confident	88	Confident	6 Å²	6	8.9 Å²	8.9	3%	0.031	6%	0.055	C	C	.	.	H	α-helix	trans	-66.3	-47.4	179.6	-65.3	172.7	0	0	0	110.6	M42 V100 E104 M108 V241 G242 N243 N248 I249	M42-I245 HydrophobicContact CG-CB 4.45Å; M42-I245 HydrophobicContact SD-CG2 4.13Å; V100-I245 HydrophobicContact CG1-CD1 3.42Å; V100-I245 VanDerWaalsContact CG1-CD1 3.42Å; E104-I245 HydrophobicContact CB-CD1 4.11Å; E104-I245 HydrophobicContact CB-CG2 4.29Å; M108-I245 HydrophobicContact CB-CG2 4.41Å; M108-I245 HydrophobicContact SD-CG2 4.49Å; V241-I245 HydrophobicContact CG1-CD1 3.88Å; V241-I245 WeakPolarHBondContact O-CG1 3.36Å; V241-I245 PolarHBondContact O-N 3.27Å; V241-I245 VanDerWaalsContact O-N 3.08Å; G242-I245 PolarHBondContact O-N 3.35Å; N243-I245 PolarHBondContact O-N 2.98Å; I245-N248 PolarHBondContact O-N 2.93Å; I245-I249 HydrophobicContact CG2-CD1 4.1Å; I245-I249 WeakPolarHBondContact O-CG1 3.49Å; I245-I249 PolarHBondContact O-N 3.25Å; I245-I249 VanDerWaalsContact O-N 3.15Å
246	G	90.5	Very high	88.5	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-59	-49	178.3	0	0	0	0	0	111.8	G242 N243 N248 I249 F250	G242-G246 PolarHBondContact O-N 3.29Å; N243-G246 PolarHBondContact O-N 2.77Å; G246-N248 VanDerWaalsContact C-N 3.35Å; G246-N248 PolarHBondContact O-N 2.98Å; G246-I249 PolarHBondContact O-N 3.19Å; G246-F250 WeakPolarHBondContact O-CB 3.37Å; G246-F250 VanDerWaalsContact O-CD2 3.29Å; G246-F250 WeakPolarHBondContact O-CD2 3.45Å; G246-F250 PolarHBondContact O-N 3.47Å
247	A	92.9	Very high	88.8	Confident	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-61.4	-41.3	-178.2	0	0	0	0	0	111.9	S50 E224 N243 F250 N251	S50-A247 WeakPolarHBondContact OG-CB 3.43Å; E224-A247 HydrophobicContact CG-CB 3.78Å; N243-A247 WeakPolarHBondContact O-CB 3.3Å; N243-A247 PolarHBondContact O-N 3.41Å; A247-F250 PolarHBondContact O-N 2.63Å; A247-N251 VanDerWaalsContact O-CB 3.31Å; A247-N251 WeakPolarHBondContact O-CB 3.46Å; A247-N251 PolarHBondContact O-N 3.14Å; A247-N251 PolarHBondContact O-ND2 3.43Å
248	N	91	Very high	89.2	Confident	1 Å²	1	7.3 Å²	7.3	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-62	-46.8	175.4	-75.2	-41.2	0	0	0	112.2	N77 N80 I81 M108 I244 I245 G246 F250 N251 I252	N77-N248 WeakPolarHBondContact CA-OD1 3.47Å; N77-N248 PolarHBondContact O-OD1 3.02Å; N77-N248 WeakPolarHBondContact OD1-CA 3.32Å; N77-N248 WeakPolarHBondContact OD1-CB 3.44Å; N77-N248 PolarHBondContact OD1-O 3.45Å; N77-N248 PolarHBondContact OD1-OD1 2.83Å; N77-N248 VanDerWaalsContact OD1-OD1 3.14Å; N80-N248 WeakPolarHBondContact CB-OD1 3.38Å; N80-N248 PolarHBondContact ND2-OD1 3.34Å; I81-N248 WeakPolarHBondContact CG1-ND2 3.49Å; M108-N248 HydrophobicContact CG-CB 4.15Å; M108-N248 HydrophobicContact SD-CB 3.76Å; I244-N248 PolarHBondContact O-N 2.96Å; I244-N248 VanDerWaalsContact O-N 3.14Å; I244-N248 PolarHBondContact O-ND2 3.24Å; I245-N248 PolarHBondContact O-N 2.93Å; G246-N248 VanDerWaalsContact C-N 3.35Å; G246-N248 PolarHBondContact O-N 2.98Å; N248-F250 PolarHBondContact O-N 3.15Å; N248-N251 PolarHBondContact O-N 3.41Å; N248-I252 WeakPolarHBondContact O-CD1 3.22Å; N248-I252 WeakPolarHBondContact O-CG1 3.41Å; N248-I252 PolarHBondContact O-N 2.89Å; N248-I252 VanDerWaalsContact O-N 3.15Å
249	I	90.5	Very high	89.1	Confident	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-62.2	-46.8	177.9	-64.4	174.6	0	0	0	110	M108 V111 W139 I245 G246 N251 I252 V253	M108-I249 HydrophobicContact CB-CD1 4.11Å; M108-I249 HydrophobicContact CB-CG1 4.07Å; M108-I249 HydrophobicContact CG-CG1 3.98Å; V111-I249 HydrophobicContact CG1-CG2 4.41Å; W139-I249 HydrophobicContact CD2-CG2 3.79Å; W139-I249 HydrophobicContact CE3-CG2 4.44Å; W139-I249 HydrophobicContact CG-CG2 3.94Å; W139-I249 HydrophobicContact CZ2-CB 4.04Å; W139-I249 HydrophobicContact CZ2-CD1 4.01Å; W139-I249 HydrophobicContact CZ2-CG2 3.98Å; W139-I249 VanDerWaalsContact NE1-CD1 3.29Å; I245-I249 HydrophobicContact CG2-CD1 4.1Å; I245-I249 WeakPolarHBondContact O-CG1 3.49Å; I245-I249 PolarHBondContact O-N 3.25Å; I245-I249 VanDerWaalsContact O-N 3.15Å; G246-I249 PolarHBondContact O-N 3.19Å; I249-N251 PolarHBondContact O-N 3.41Å; I249-I252 PolarHBondContact O-N 3.3Å; I249-V253 HydrophobicContact CG2-CG1 4.37Å; I249-V253 HydrophobicContact CG2-CG2 4.36Å; I249-V253 VanDerWaalsContact O-CG2 3.23Å; I249-V253 WeakPolarHBondContact O-CG2 3.27Å; I249-V253 PolarHBondContact O-N 3.45Å
250	F	91.1	Very high	89	Confident	14 Å²	14	6.6 Å²	6.6	6%	0.061	4%	0.035	C	C	.	.	H	α-helix	trans	-58.6	-44	177.3	-93.2	-68.2	0	0	0	113.4	I47 W139 L140 G246 A247 N248 I252 V253 I254 V255	I47-F250 HydrophobicContact CD1-CE1 4.49Å; I47-F250 HydrophobicContact CD1-CE2 4.12Å; I47-F250 HydrophobicContact CD1-CZ 3.62Å; I47-F250 HydrophobicContact CG1-CD2 4.26Å; I47-F250 HydrophobicContact CG1-CE1 3.85Å; I47-F250 HydrophobicContact CG1-CE2 3.36Å; I47-F250 HydrophobicContact CG1-CZ 3.12Å; W139-F250 HydrophobicContact CE3-CE2 4.45Å; W139-F250 HydrophobicContact CE3-CZ 4.39Å; W139-F250 AromaticContact CH2-CD2 3.7Å; W139-F250 HydrophobicContact CH2-CD2 3.7Å; W139-F250 AromaticContact CH2-CE2 3.34Å; W139-F250 HydrophobicContact CH2-CE2 3.34Å; W139-F250 HydrophobicContact CH2-CZ 4.04Å; W139-F250 AromaticContact CZ3-CD2 3.84Å; W139-F250 HydrophobicContact CZ3-CD2 3.84Å; W139-F250 HydrophobicContact CZ3-CE1 4.18Å; W139-F250 AromaticContact CZ3-CE2 3.21Å; W139-F250 HydrophobicContact CZ3-CE2 3.21Å; W139-F250 AromaticContact CZ3-CZ 3.4Å; W139-F250 HydrophobicContact CZ3-CZ 3.4Å; W139-F250 VanDerWaalsContact CZ3-CZ 3.4Å; L140-F250 HydrophobicContact CD2-CZ 3.94Å; G246-F250 WeakPolarHBondContact O-CB 3.37Å; G246-F250 VanDerWaalsContact O-CD2 3.29Å; G246-F250 WeakPolarHBondContact O-CD2 3.45Å; G246-F250 PolarHBondContact O-N 3.47Å; A247-F250 PolarHBondContact O-N 2.63Å; N248-F250 PolarHBondContact O-N 3.15Å; F250-I252 PolarHBondContact O-N 2.9Å; F250-V253 PolarHBondContact O-N 3.07Å; F250-I254 HydrophobicContact CD1-CB 4.46Å; F250-I254 HydrophobicContact CD1-CD1 3.49Å; F250-I254 VanDerWaalsContact CD1-CD1 3.49Å; F250-I254 HydrophobicContact CD1-CG1 3.85Å; F250-I254 HydrophobicContact CE1-CD1 3.48Å; F250-I254 VanDerWaalsContact CE1-CD1 3.48Å; F250-I254 HydrophobicContact CE1-CG1 4.29Å; F250-I254 WeakPolarHBondContact O-CA 3.46Å; F250-I254 WeakPolarHBondContact O-CB 3.42Å; F250-I254 PolarHBondContact O-N 3.26Å; F250-V255 PolarHBondContact O-N 2.99Å
251	N	90.5	Very high	89.1	Confident	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.048	C	C	.	.	I	π-helix	trans	-60.9	-37.8	178.3	-74.4	-16.4	0	0	0	111.3	S76 N77 A247 N248 I249 V255 L256	S76-N251 WeakPolarHBondContact CB-ND2 3.24Å; N77-N251 VanDerWaalsContact ND2-CB 3.32Å; N77-N251 WeakPolarHBondContact ND2-CB 3.43Å; A247-N251 VanDerWaalsContact O-CB 3.31Å; A247-N251 WeakPolarHBondContact O-CB 3.46Å; A247-N251 PolarHBondContact O-N 3.14Å; A247-N251 PolarHBondContact O-ND2 3.43Å; N248-N251 PolarHBondContact O-N 3.41Å; I249-N251 PolarHBondContact O-N 3.41Å; N251-V255 WeakPolarHBondContact O-CB 3.36Å; N251-V255 PolarHBondContact O-N 3.09Å; N251-V255 WeakPolarHBondContact OD1-CG2 3.49Å; N251-L256 PolarHBondContact O-N 2.93Å
252	I	88.8	Confident	89.1	Confident	9 Å²	9	11.9 Å²	11.9	5%	0.046	6%	0.061	C	C	.	.	I	π-helix	trans	-73.2	-48.1	177.9	-66.6	163.6	0	0	0	112.1	V111 S112 A115 N248 I249 F250 L256	V111-I252 HydrophobicContact CG1-CB 4.02Å; V111-I252 HydrophobicContact CG1-CD1 4.23Å; V111-I252 HydrophobicContact CG1-CG2 3.61Å; S112-I252 VanDerWaalsContact OG-CD1 3.28Å; S112-I252 WeakPolarHBondContact OG-CD1 3.34Å; A115-I252 HydrophobicContact CB-CG2 3.25Å; N248-I252 WeakPolarHBondContact O-CD1 3.22Å; N248-I252 WeakPolarHBondContact O-CG1 3.41Å; N248-I252 PolarHBondContact O-N 2.89Å; N248-I252 VanDerWaalsContact O-N 3.15Å; I249-I252 PolarHBondContact O-N 3.3Å; F250-I252 PolarHBondContact O-N 2.9Å; I252-L256 VanDerWaalsContact O-CB 3.32Å; I252-L256 WeakPolarHBondContact O-CB 3.28Å
253	V	90.7	Very high	88.8	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.066	C	C	.	.	I	π-helix	trans	-88.4	-27.8	-169.2	-57.6	0	0	0	0	113.4	V111 L132 L135 A136 I249 F250	V111-V253 HydrophobicContact CG1-CG1 3.62Å; L132-V253 CarbonylContact C-O 3.56Å; L135-V253 HydrophobicContact CB-CG1 4.45Å; L135-V253 HydrophobicContact CD2-CG1 4.02Å; L135-V253 HydrophobicContact CG-CG1 4.25Å; A136-V253 HydrophobicContact CB-CB 3.8Å; A136-V253 HydrophobicContact CB-CG2 3.41Å; A136-V253 VanDerWaalsContact CB-CG2 3.41Å; I249-V253 HydrophobicContact CG2-CG1 4.37Å; I249-V253 HydrophobicContact CG2-CG2 4.36Å; I249-V253 VanDerWaalsContact O-CG2 3.23Å; I249-V253 WeakPolarHBondContact O-CG2 3.27Å; I249-V253 PolarHBondContact O-N 3.45Å; F250-V253 PolarHBondContact O-N 3.07Å
254	I	91.3	Very high	88.4	Confident	36 Å²	36	14.3 Å²	14.3	19%	0.185	8%	0.077	C	C	.	.	I	π-helix	trans	-107.9	-54.4	-179.3	-55.9	-159	0	0	0	111.7	V54 L133 A136 F250 L256 G257 L258	V54-I254 HydrophobicContact CG2-CG2 4.21Å; L133-I254 HydrophobicContact CD2-CG1 4.47Å; A136-I254 HydrophobicContact CB-CD1 4.26Å; A136-I254 HydrophobicContact CB-CG1 3.85Å; F250-I254 HydrophobicContact CD1-CB 4.46Å; F250-I254 HydrophobicContact CD1-CD1 3.49Å; F250-I254 VanDerWaalsContact CD1-CD1 3.49Å; F250-I254 HydrophobicContact CD1-CG1 3.85Å; F250-I254 HydrophobicContact CE1-CD1 3.48Å; F250-I254 VanDerWaalsContact CE1-CD1 3.48Å; F250-I254 HydrophobicContact CE1-CG1 4.29Å; F250-I254 WeakPolarHBondContact O-CA 3.46Å; F250-I254 WeakPolarHBondContact O-CB 3.42Å; F250-I254 PolarHBondContact O-N 3.26Å; I254-L256 VanDerWaalsContact C-N 3.32Å; I254-L256 PolarHBondContact O-N 3.1Å; I254-G257 PolarHBondContact O-N 3.12Å; I254-L258 HydrophobicContact CG2-CD1 3.61Å; I254-L258 HydrophobicContact CG2-CG 4.11Å; I254-L258 WeakPolarHBondContact O-CB 3.37Å; I254-L258 WeakPolarHBondContact O-CG 3.38Å; I254-L258 PolarHBondContact O-N 3.35Å
255	V	88.7	Confident	88.1	Confident	1 Å²	1	15 Å²	15	1%	0.006	9%	0.086	C	C	.	.	I	π-helix	trans	-68.1	-33.4	-172.9	-174.9	0	0	0	0	111.4	E53 V54 S57 A73 F250 N251 P259	E53-V255 HydrophobicContact CB-CG1 4.04Å; E53-V255 HydrophobicContact CB-CG2 3.91Å; V54-V255 HydrophobicContact CG2-CG2 3.66Å; S57-V255 PolarHBondContact OG-O 3.17Å; A73-V255 HydrophobicContact CB-CB 4.16Å; A73-V255 HydrophobicContact CB-CG1 3.84Å; F250-V255 PolarHBondContact O-N 2.99Å; N251-V255 WeakPolarHBondContact O-CB 3.36Å; N251-V255 PolarHBondContact O-N 3.09Å; N251-V255 WeakPolarHBondContact OD1-CG2 3.49Å; V255-P259 WeakPolarHBondContact O-CD 3.19Å; V255-P259 WeakPolarHBondContact O-CG 3.38Å
256	L	86.5	Confident	87.6	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-35.1	170.4	-170.2	68.7	0	0	0	112.7	V70 A73 A115 L119 L124 L132 N251 I252 I254 P259	V70-L256 HydrophobicContact CB-CD1 4.31Å; V70-L256 HydrophobicContact CG1-CD1 3.91Å; V70-L256 HydrophobicContact CG2-CD1 4.08Å; A73-L256 HydrophobicContact CB-CB 4.12Å; A73-L256 HydrophobicContact CB-CD1 4.27Å; A115-L256 HydrophobicContact CB-CD2 4.4Å; L119-L256 HydrophobicContact CD1-CD1 4.46Å; L119-L256 HydrophobicContact CD1-CD2 3.77Å; L119-L256 HydrophobicContact CD2-CD1 4.35Å; L119-L256 HydrophobicContact CD2-CD2 4.31Å; L119-L256 HydrophobicContact CG-CD2 4.11Å; L124-L256 HydrophobicContact CD1-CG 4.47Å; L132-L256 HydrophobicContact CD1-CB 4.31Å; L132-L256 HydrophobicContact CD1-CD2 3.93Å; L132-L256 HydrophobicContact CD1-CG 4.09Å; N251-L256 PolarHBondContact O-N 2.93Å; I252-L256 VanDerWaalsContact O-CB 3.32Å; I252-L256 WeakPolarHBondContact O-CB 3.28Å; I254-L256 VanDerWaalsContact C-N 3.32Å; I254-L256 PolarHBondContact O-N 3.1Å; L256-P259 WeakPolarHBondContact O-CD 3.43Å
257	G	89.1	Confident	86.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-71.8	-34.6	-175.7	0	0	0	0	0	114.5	G129 I254 A260	G129-G257 WeakPolarHBondContact CA-O 3.45Å; I254-G257 PolarHBondContact O-N 3.12Å; G257-A260 WeakPolarHBondContact O-CB 3.44Å
258	L	89.7	Confident	85.5	Confident	43 Å²	43	24.6 Å²	24.6	23%	0.225	13%	0.133	C	C	.	.	H	α-helix	trans	-68	-49.2	179.8	-76.2	172.1	0	0	0	113.4	V54 L58 L133 I254 A260 L261 I262	V54-L258 HydrophobicContact CG1-CD1 3.92Å; L58-L258 HydrophobicContact CD1-CD1 4.23Å; L58-L258 HydrophobicContact CD2-CB 3.92Å; L58-L258 HydrophobicContact CD2-CD1 4.26Å; L58-L258 HydrophobicContact CG-CD1 4.33Å; L133-L258 HydrophobicContact CD1-CD2 4.24Å; L133-L258 HydrophobicContact CD2-CD2 4.36Å; L133-L258 HydrophobicContact CD2-CG 4.3Å; I254-L258 HydrophobicContact CG2-CD1 3.61Å; I254-L258 HydrophobicContact CG2-CG 4.11Å; I254-L258 WeakPolarHBondContact O-CB 3.37Å; I254-L258 WeakPolarHBondContact O-CG 3.38Å; I254-L258 PolarHBondContact O-N 3.35Å; L258-A260 PolarHBondContact O-N 3.13Å; L258-L261 WeakPolarHBondContact O-CB 3.45Å; L258-L261 PolarHBondContact O-N 3.37Å; L258-L261 VanDerWaalsContact O-N 3.08Å; L258-I262 PolarHBondContact O-N 3.29Å
259	P	82.5	Confident	84.1	Confident	4 Å²	4	28.3 Å²	28.3	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-56.6	-36.7	175.4	-27	34.4	0	0	0	113.7	S57 S61 A69 V255 L256 L261 I262 T263	S57-P259 WeakPolarHBondContact OG-CG 3.24Å; S61-P259 WeakPolarHBondContact OG-CA 3.36Å; S61-P259 PolarHBondContact OG-O 3.35Å; A69-P259 HydrophobicContact CB-CB 3.94Å; A69-P259 HydrophobicContact CB-CG 3.94Å; V255-P259 WeakPolarHBondContact O-CD 3.19Å; V255-P259 WeakPolarHBondContact O-CG 3.38Å; L256-P259 WeakPolarHBondContact O-CD 3.43Å; P259-L261 PolarHBondContact O-N 3.45Å; P259-I262 PolarHBondContact O-N 2.93Å; P259-T263 PolarHBondContact O-N 3.38Å
260	A	86.3	Confident	82.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-31.6	177.2	0	0	0	0	0	113	L124 G257 L258	L124-A260 HydrophobicContact CD1-CB 4.08Å; L124-A260 HydrophobicContact CD2-CB 3.61Å; L124-A260 HydrophobicContact CG-CB 3.51Å; G257-A260 WeakPolarHBondContact O-CB 3.44Å; L258-A260 PolarHBondContact O-N 3.13Å
261	L	88	Confident	81.1	Confident	57 Å²	57	31.6 Å²	31.6	30%	0.298	18%	0.178	S	C	.	.	H	α-helix	trans	-76.5	-40.2	176.9	-66.2	-174.7	0	0	0	112.9	R126 I130 L133 L258 P259	R126-L261 PolarHBondContact NE-O 3.08Å; I130-L261 HydrophobicContact CG1-CD2 3.67Å; L133-L261 HydrophobicContact CD1-CD1 3.41Å; L133-L261 VanDerWaalsContact CD1-CD1 3.41Å; L133-L261 HydrophobicContact CD1-CG 4.22Å; L258-L261 WeakPolarHBondContact O-CB 3.45Å; L258-L261 PolarHBondContact O-N 3.37Å; L258-L261 VanDerWaalsContact O-N 3.08Å; P259-L261 PolarHBondContact O-N 3.45Å
262	I	85.8	Confident	79.4	Confident	66 Å²	66	36.7 Å²	36.7	34%	0.338	20%	0.197	S	C	.	.	H	α-helix	trans	-78.1	-52	-173.1	-58.4	178.4	0	0	0	109.6	L58 L62 L258 P259	L58-I262 HydrophobicContact CD2-CD1 3.35Å; L62-I262 HydrophobicContact CD2-CG2 4.01Å; L258-I262 PolarHBondContact O-N 3.29Å; P259-I262 PolarHBondContact O-N 2.93Å
263	T	82.2	Confident	77.5	Confident	15 Å²	15	37.1 Å²	37.1	9%	0.092	20%	0.201	C	C	.	.	S	Bend	trans	-133.3	71.4	-169.6	-43.3	0	0	0	0	109.7	S61 E64 R66 P259	S61-T263 PolarHBondContact O-OG1 3.24Å; S61-T263 WeakPolarHBondContact OG-CB 3.42Å; S61-T263 PolarHBondContact OG-OG1 3.07Å; S61-T263 VanDerWaalsContact OG-OG1 3.1Å; E64-T263 HydrophobicContact CB-CG2 4.42Å; E64-T263 HydrophobicContact CG-CG2 4.36Å; R66-T263 VanDerWaalsContact CD-O 3.29Å; R66-T263 WeakPolarHBondContact CD-O 3.41Å; R66-T263 HydrophobicContact CG-CG2 3.86Å; R66-T263 WeakPolarHBondContact CG-O 3.45Å; R66-T263 PolarHBondContact NE-O 3.44Å; R66-T263 VanDerWaalsContact NH2-CG2 3.34Å; P259-T263 PolarHBondContact O-N 3.38Å
264	P	83.7	Confident	75.6	Confident	37 Å²	37	44 Å²	44	24%	0.24	23%	0.227	C	C	.	.			trans	-66.9	146.5	177.7	31	-38.4	0	0	0	111.1	R66 L124 R126	R66-P264 VanDerWaalsContact NE-C 3.34Å; R66-P264 PolarHBondContact NE-O 3.36Å; R66-P264 VanDerWaalsContact NE-O 3.08Å; R66-P264 PolarHBondContact NH2-O 3.39Å; L124-P264 CarbonylContact O-C 3.59Å; L124-P264 WeakPolarHBondContact O-CA 3.27Å; L124-P264 WeakPolarHBondContact O-CB 3.44Å; R126-P264 HydrophobicContact CG-CB 3.97Å; R126-P264 HydrophobicContact CG-CG 3.8Å
265	G	81.5	Confident	73.8	Confident	24 Å²	24	46.9 Å²	46.9	25%	0.247	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	-175.5	179	0	0	0	0	0	114.2	L124	L124-G265 PolarHBondContact N-O 3Å; L124-G265 PolarHBondContact O-N 2.84Å
266	E	78.2	Confident	71.9	Confident	147 Å²	147	54.5 Å²	54.5	69%	0.687	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	139.7	173.2	-69.1	178.4	173.3	0	0	110.4	G122 Q123	G122-E266 WeakPolarHBondContact O-CA 3.44Å; Q123-E266 HydrophobicContact CG-CG 4.06Å
267	I	71.4	Confident	70.3	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.062	29%	0.294	C	S	.	.			trans	-105.4	142.4	172.9	-59.6	166.8	0	0	0	107.6	V70 L119 G122 L124 P269 A271	V70-I267 HydrophobicContact CG1-CD1 4.12Å; V70-I267 HydrophobicContact CG1-CG2 4.29Å; V70-I267 HydrophobicContact CG2-CD1 3.82Å; V70-I267 HydrophobicContact CG2-CG1 4.17Å; L119-I267 HydrophobicContact CD2-CD1 3.39Å; G122-I267 PolarHBondContact O-N 3.32Å; L124-I267 HydrophobicContact CB-CD1 3.64Å; L124-I267 HydrophobicContact CB-CG1 4.08Å; L124-I267 HydrophobicContact CD1-CD1 4.25Å; L124-I267 HydrophobicContact CD2-CD1 4.41Å; L124-I267 HydrophobicContact CG-CD1 4.32Å; I267-P269 WeakPolarHBondContact O-CD 3.44Å; I267-A271 HydrophobicContact CG2-CB 3.86Å
268	D	68.2	Low	68.7	Low	49 Å²	49	60.8 Å²	60.8	26%	0.262	31%	0.314	S	S	.	.			trans	-52.4	121.6	171.9	-174.5	-16.7	0	0	0	110.7	D67 L209 L270 A271	D67-D268 PolarHBondContact OD1-N 2.98Å; D67-D268 VanDerWaalsContact OD1-N 3.09Å; L209-D268 HydrophobicContact CD2-CB 4.05Å; D268-L270 PolarHBondContact O-N 2.64Å; D268-L270 WeakPolarHBondContact OD1-CB 3.19Å; D268-L270 WeakPolarHBondContact OD1-CG 3.37Å; D268-L270 PolarHBondContact OD1-N 2.89Å; D268-A271 VanDerWaalsContact O-CB 3.25Å; D268-A271 WeakPolarHBondContact O-CB 3.37Å; D268-A271 PolarHBondContact O-N 3.08Å
269	P	62.2	Low	67.4	Low	79 Å²	79	61.7 Å²	61.7	51%	0.513	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-53.9	-21.6	176.5	-24.7	32.9	0	0	0	113.3	I267 A271 Y272 S273	I267-P269 WeakPolarHBondContact O-CD 3.44Å; P269-A271 PolarHBondContact O-N 3.45Å; P269-Y272 WeakPolarHBondContact O-CB 3.47Å; P269-Y272 PolarHBondContact O-N 2.84Å; P269-S273 PolarHBondContact O-N 3.2Å
270	L	58.4	Low	66.5	Low	65 Å²	65	65.5 Å²	65.5	34%	0.34	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-61.4	-18.8	173.9	-63.3	-179.9	0	0	0	113.8	L209 D268 Y272 S273 M279	L209-L270 HydrophobicContact CD2-CB 3.87Å; D268-L270 PolarHBondContact O-N 2.64Å; D268-L270 WeakPolarHBondContact OD1-CB 3.19Å; D268-L270 WeakPolarHBondContact OD1-CG 3.37Å; D268-L270 PolarHBondContact OD1-N 2.89Å; L270-Y272 PolarHBondContact O-N 2.99Å; L270-S273 WeakPolarHBondContact CA-OG 3.45Å; L270-S273 WeakPolarHBondContact CD2-OG 3.5Å; L270-S273 PolarHBondContact O-N 2.93Å; L270-M279 HydrophobicContact CD2-CB 4.05Å; L270-M279 HydrophobicContact CD2-CG 3.55Å
271	A	58.9	Low	65.7	Low	18 Å²	18	70.8 Å²	70.8	15%	0.149	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-60.1	-26.4	172.9	0	0	0	0	0	111.8	L74 L209 I267 D268 P269	L74-A271 HydrophobicContact CD1-CB 4.46Å; L209-A271 HydrophobicContact CD1-CB 4.14Å; L209-A271 HydrophobicContact CD2-CB 4.18Å; I267-A271 HydrophobicContact CG2-CB 3.86Å; D268-A271 VanDerWaalsContact O-CB 3.25Å; D268-A271 WeakPolarHBondContact O-CB 3.37Å; D268-A271 PolarHBondContact O-N 3.08Å; P269-A271 PolarHBondContact O-N 3.45Å
272	Y	54.7	Low	64.9	Low	106 Å²	106	72.2 Å²	72.2	42%	0.416	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-36.6	174	-76.1	-74.5	0	0	0	114.3	G116 L119 Y120 P269 L270 R274	G116-Y272 PolarHBondContact O-OH 3.31Å; L119-Y272 WeakPolarHBondContact CA-OH 3.22Å; L119-Y272 HydrophobicContact CB-CE2 4.19Å; L119-Y272 WeakPolarHBondContact CB-OH 3.28Å; L119-Y272 WeakPolarHBondContact O-CE2 3.43Å; L119-Y272 PolarHBondContact O-OH 2.87Å; Y120-Y272 VanDerWaalsContact CA-OH 3.25Å; Y120-Y272 WeakPolarHBondContact CA-OH 3.45Å; Y120-Y272 PolarHBondContact N-OH 3.38Å; P269-Y272 WeakPolarHBondContact O-CB 3.47Å; P269-Y272 PolarHBondContact O-N 2.84Å; L270-Y272 PolarHBondContact O-N 2.99Å; Y272-R274 VanDerWaalsContact C-N 3.29Å; Y272-R274 PolarHBondContact O-N 3.29Å
273	S	50.5	Low	64.2	Low	18 Å²	18	71.2 Å²	71.2	13%	0.126	37%	0.372	C	S	.	.			trans	-87.1	72.7	-171.9	69.1	0	0	0	0	110.8	P269 L270	P269-S273 PolarHBondContact O-N 3.2Å; L270-S273 WeakPolarHBondContact CA-OG 3.45Å; L270-S273 WeakPolarHBondContact CD2-OG 3.5Å; L270-S273 PolarHBondContact O-N 2.93Å
274	R	50.9	Low	64.2	Low	146 Å²	146	72.3 Å²	72.3	55%	0.551	39%	0.386	S	S	*	.			trans	-75.4	-17.1	159.1	-106.6	-161	-178	-158.8	4.2	112.9	Y272 Y276	Y272-R274 VanDerWaalsContact C-N 3.29Å; Y272-R274 PolarHBondContact O-N 3.29Å; R274-Y276 PolarHBondContact O-N 3.05Å
275	D	52	Low	64.2	Low	96 Å²	96	76.7 Å²	76.7	51%	0.513	40%	0.401	S	S	.	.	S	Bend	trans	-70.7	106	169.4	-157	-26.5	0	0	0	107.3	S277 V278 M279	D275-S277 PolarHBondContact O-N 3.01Å; D275-S277 WeakPolarHBondContact OD1-CB 3.48Å; D275-S277 PolarHBondContact OD1-N 2.95Å; D275-S277 PolarHBondContact OD1-OG 3.21Å; D275-V278 HydrophobicContact CB-CB 4.15Å; D275-V278 HydrophobicContact CB-CG2 3.8Å; D275-V278 WeakPolarHBondContact O-CA 3.28Å; D275-V278 WeakPolarHBondContact O-CB 3.48Å; D275-V278 PolarHBondContact O-N 3.14Å; D275-M279 PolarHBondContact O-N 3.47Å
276	Y	50.2	Low	64.2	Low	160 Å²	160	80.9 Å²	80.9	63%	0.627	41%	0.414	S	S	*	.	H	α-helix	trans	-46.9	-36.1	178.4	177.1	-104.5	0	0	0	111.1	R274 M279 L280	R274-Y276 PolarHBondContact O-N 3.05Å; Y276-M279 HydrophobicContact CD2-CE 4Å; Y276-M279 HydrophobicContact CE2-CE 3.99Å; Y276-M279 PolarHBondContact O-N 3.33Å; Y276-L280 HydrophobicContact CD1-CD1 3.78Å; Y276-L280 HydrophobicContact CD1-CG 4.42Å; Y276-L280 HydrophobicContact CE1-CD1 3.29Å; Y276-L280 HydrophobicContact CE1-CG 4.14Å; Y276-L280 HydrophobicContact CE2-CD1 4.38Å; Y276-L280 HydrophobicContact CE2-CG 4.42Å; Y276-L280 WeakPolarHBondContact O-CG 3.45Å; Y276-L280 PolarHBondContact O-N 3.31Å
277	S	52.5	Low	64.6	Low	65 Å²	65	76.6 Å²	76.6	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-61.2	-43	175.3	-37.9	0	0	0	0	112.6	D275 L281	D275-S277 PolarHBondContact O-N 3.01Å; D275-S277 WeakPolarHBondContact OD1-CB 3.48Å; D275-S277 PolarHBondContact OD1-N 2.95Å; D275-S277 PolarHBondContact OD1-OG 3.21Å; S277-L281 WeakPolarHBondContact O-CB 3.21Å; S277-L281 WeakPolarHBondContact O-CG 3.32Å; S277-L281 PolarHBondContact O-N 2.9Å
278	V	56	Low	65.5	Low	70 Å²	70	81.4 Å²	81.4	42%	0.424	42%	0.423	S	S	.	.	H	α-helix	trans	-72	-41.2	-180	177.5	0	0	0	0	110.9	D275 L281 Q282	D275-V278 HydrophobicContact CB-CB 4.15Å; D275-V278 HydrophobicContact CB-CG2 3.8Å; D275-V278 WeakPolarHBondContact O-CA 3.28Å; D275-V278 WeakPolarHBondContact O-CB 3.48Å; D275-V278 PolarHBondContact O-N 3.14Å; V278-L281 PolarHBondContact O-N 2.99Å; V278-Q282 WeakPolarHBondContact O-CB 3.48Å; V278-Q282 PolarHBondContact O-N 3.04Å
279	M	61.8	Low	66.6	Low	62 Å²	62	81.8 Å²	81.8	31%	0.305	43%	0.433	S	S	.	.	H	α-helix	trans	-57.6	-49.7	173.4	177.7	-152	74.9	0	0	110.8	L270 D275 Y276 L281 Q282 A283	L270-M279 HydrophobicContact CD2-CB 4.05Å; L270-M279 HydrophobicContact CD2-CG 3.55Å; D275-M279 PolarHBondContact O-N 3.47Å; Y276-M279 HydrophobicContact CD2-CE 4Å; Y276-M279 HydrophobicContact CE2-CE 3.99Å; Y276-M279 PolarHBondContact O-N 3.33Å; M279-L281 PolarHBondContact O-N 3.02Å; M279-Q282 PolarHBondContact O-N 2.99Å; M279-A283 WeakPolarHBondContact O-CB 3.2Å; M279-A283 PolarHBondContact O-N 3Å
280	L	64	Low	67.8	Low	83 Å²	83	79 Å²	79	44%	0.435	41%	0.414	S	S	.	.	H	α-helix	trans	-61.3	-43.6	178.6	-73	179.2	0	0	0	112.2	Y276 G284	Y276-L280 HydrophobicContact CD1-CD1 3.78Å; Y276-L280 HydrophobicContact CD1-CG 4.42Å; Y276-L280 HydrophobicContact CE1-CD1 3.29Å; Y276-L280 HydrophobicContact CE1-CG 4.14Å; Y276-L280 HydrophobicContact CE2-CD1 4.38Å; Y276-L280 HydrophobicContact CE2-CG 4.42Å; Y276-L280 WeakPolarHBondContact O-CG 3.45Å; Y276-L280 PolarHBondContact O-N 3.31Å; L280-G284 PolarHBondContact O-N 3.19Å
281	L	68.6	Low	69.5	Low	112 Å²	112	78 Å²	78	59%	0.586	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-44.6	177.4	-87.3	162.6	0	0	0	112	S277 V278 M279 G284 K285	S277-L281 WeakPolarHBondContact O-CB 3.21Å; S277-L281 WeakPolarHBondContact O-CG 3.32Å; S277-L281 PolarHBondContact O-N 2.9Å; V278-L281 PolarHBondContact O-N 2.99Å; M279-L281 PolarHBondContact O-N 3.02Å; L281-G284 PolarHBondContact O-N 3.33Å; L281-K285 WeakPolarHBondContact O-CG 3.38Å; L281-K285 PolarHBondContact O-N 3.32Å
282	Q	71.1	Confident	71.2	Confident	86 Å²	86	86.2 Å²	86.2	40%	0.402	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-46	-178.9	-171.8	61.5	17.6	0	0	111.3	V278 M279 G284 K285 E286	V278-Q282 WeakPolarHBondContact O-CB 3.48Å; V278-Q282 PolarHBondContact O-N 3.04Å; M279-Q282 PolarHBondContact O-N 2.99Å; Q282-G284 VanDerWaalsContact C-N 3.27Å; Q282-G284 PolarHBondContact O-N 3.49Å; Q282-K285 PolarHBondContact O-N 3.33Å; Q282-K285 VanDerWaalsContact O-N 3.1Å; Q282-E286 WeakPolarHBondContact O-CB 3.47Å; Q282-E286 PolarHBondContact O-N 3.33Å
283	A	70.9	Confident	73.1	Confident	46 Å²	46	87.8 Å²	87.8	38%	0.38	45%	0.446	S	S	.	.	H	α-helix	trans	-57.3	-41.8	174.7	0	0	0	0	0	111.6	M279 E286 V287	M279-A283 WeakPolarHBondContact O-CB 3.2Å; M279-A283 PolarHBondContact O-N 3Å; A283-E286 PolarHBondContact O-N 2.95Å; A283-V287 WeakPolarHBondContact O-CG2 3.5Å; A283-V287 PolarHBondContact O-N 3.42Å; A283-V287 VanDerWaalsContact O-N 3.08Å
284	G	82.9	Confident	75.1	Confident	37 Å²	37	87.2 Å²	87.2	38%	0.381	44%	0.442	S	S	.	.	H	α-helix	trans	-61.6	-42.7	174.7	0	0	0	0	0	113.4	L280 L281 Q282 E286 L288	L280-G284 PolarHBondContact O-N 3.19Å; L281-G284 PolarHBondContact O-N 3.33Å; Q282-G284 VanDerWaalsContact C-N 3.27Å; Q282-G284 PolarHBondContact O-N 3.49Å; G284-E286 VanDerWaalsContact C-N 3.35Å; G284-L288 WeakPolarHBondContact O-CG 3.5Å; G284-L288 PolarHBondContact O-N 2.91Å
285	K	82.8	Confident	77.2	Confident	129 Å²	129	83 Å²	83	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-65.4	-37.9	175.9	-75.3	177.2	179.8	178.5	0	112.6	L281 Q282 L288 A289	L281-K285 WeakPolarHBondContact O-CG 3.38Å; L281-K285 PolarHBondContact O-N 3.32Å; Q282-K285 PolarHBondContact O-N 3.33Å; Q282-K285 VanDerWaalsContact O-N 3.1Å; K285-L288 WeakPolarHBondContact O-CB 3.49Å; K285-L288 PolarHBondContact O-N 2.9Å; K285-A289 PolarHBondContact O-N 3.26Å
286	E	81.5	Confident	79.2	Confident	113 Å²	113	82 Å²	82	53%	0.528	44%	0.435	S	S	.	.	H	α-helix	trans	-67.2	-42.6	-179.4	-154	171.2	-150.9	0	0	111.4	Q282 A283 G284 L288 A289 I290	Q282-E286 WeakPolarHBondContact O-CB 3.47Å; Q282-E286 PolarHBondContact O-N 3.33Å; A283-E286 PolarHBondContact O-N 2.95Å; G284-E286 VanDerWaalsContact C-N 3.35Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 3.2Å; E286-A289 PolarHBondContact O-N 2.96Å; E286-I290 WeakPolarHBondContact O-CG1 3.49Å; E286-I290 PolarHBondContact O-N 3.06Å
287	V	86.7	Confident	81.2	Confident	57 Å²	57	78.3 Å²	78.3	35%	0.345	42%	0.423	S	S	.	.	H	α-helix	trans	-57	-47.3	171.3	169.9	0	0	0	0	111	A283 A289 I290 E291 A421	A283-V287 WeakPolarHBondContact O-CG2 3.5Å; A283-V287 PolarHBondContact O-N 3.42Å; A283-V287 VanDerWaalsContact O-N 3.08Å; V287-A289 VanDerWaalsContact C-N 3.31Å; V287-A289 PolarHBondContact O-N 3.43Å; V287-I290 PolarHBondContact O-N 3.12Å; V287-E291 PolarHBondContact O-N 3.47Å; V287-A421 HydrophobicContact CB-CB 4.3Å; V287-A421 HydrophobicContact CG1-CB 3.92Å; V287-A421 HydrophobicContact CG2-CB 4.21Å
288	L	91.8	Very high	83.2	Confident	113 Å²	113	75.7 Å²	75.7	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-60.8	-38.9	177.6	-74.6	171.1	0	0	0	112.6	G284 K285 E286 R292	G284-L288 WeakPolarHBondContact O-CG 3.5Å; G284-L288 PolarHBondContact O-N 2.91Å; K285-L288 WeakPolarHBondContact O-CB 3.49Å; K285-L288 PolarHBondContact O-N 2.9Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 3.2Å; L288-R292 WeakPolarHBondContact O-CB 3.34Å; L288-R292 WeakPolarHBondContact O-CG 3.41Å; L288-R292 PolarHBondContact O-N 2.7Å; L288-R292 VanDerWaalsContact O-N 3.07Å
289	A	90.4	Very high	85	Confident	57 Å²	57	78.3 Å²	78.3	47%	0.471	42%	0.416	S	S	.	.	H	α-helix	trans	-64.3	-49.5	177.3	0	0	0	0	0	111.2	K285 E286 V287 E291 R292 E293	K285-A289 PolarHBondContact O-N 3.26Å; E286-A289 PolarHBondContact O-N 2.96Å; V287-A289 VanDerWaalsContact C-N 3.31Å; V287-A289 PolarHBondContact O-N 3.43Å; A289-E291 PolarHBondContact O-N 3.35Å; A289-R292 PolarHBondContact O-N 2.96Å; A289-E293 PolarHBondContact O-N 3.02Å
290	I	87.9	Confident	86.5	Confident	20 Å²	20	80.9 Å²	80.9	10%	0.103	43%	0.427	C	S	.	.	H	α-helix	trans	-60.9	-45.7	-180	-65	168.7	0	0	0	111	E286 V287 E293 C294 K419 A421	E286-I290 WeakPolarHBondContact O-CG1 3.49Å; E286-I290 PolarHBondContact O-N 3.06Å; V287-I290 PolarHBondContact O-N 3.12Å; I290-E293 PolarHBondContact O-N 2.94Å; I290-C294 PolarHBondContact O-N 3.09Å; I290-C294 PolarHBondContact O-SG 3.01Å; I290-K419 HydrophobicContact CD1-CD 4.38Å; I290-K419 HydrophobicContact CG2-CB 4.45Å; I290-K419 HydrophobicContact CG2-CG 4.48Å; I290-A421 HydrophobicContact CB-CB 4.19Å; I290-A421 HydrophobicContact CD1-CB 4.44Å; I290-A421 HydrophobicContact CG2-CB 4.05Å
291	E	94.2	Very high	88	Confident	45 Å²	45	78.7 Å²	78.7	21%	0.21	41%	0.413	C	S	.	.	H	α-helix	trans	-66.1	-39.2	179.7	-71.4	-157	-175.6	0	0	112.5	V287 A289 E293 C294 L295 A421 T433	V287-E291 PolarHBondContact O-N 3.47Å; A289-E291 PolarHBondContact O-N 3.35Å; E291-E293 VanDerWaalsContact C-N 3.35Å; E291-E293 PolarHBondContact O-N 2.97Å; E291-C294 PolarHBondContact O-N 2.93Å; E291-L295 WeakPolarHBondContact O-CB 3.48Å; E291-L295 VanDerWaalsContact O-CG 3.29Å; E291-L295 WeakPolarHBondContact O-CG 3.33Å; E291-L295 PolarHBondContact O-N 3.3Å; E291-A421 HydrophobicContact CG-CB 4.32Å; E291-T433 PolarHBondContact OE2-OG1 2.86Å
292	R	94.9	Very high	89.3	Confident	190 Å²	190	77.1 Å²	77.1	72%	0.717	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-42.7	175	-77.9	175.8	63.3	179.4	-0.9	112.2	L288 A289 L295 A296	L288-R292 WeakPolarHBondContact O-CB 3.34Å; L288-R292 WeakPolarHBondContact O-CG 3.41Å; L288-R292 PolarHBondContact O-N 2.7Å; L288-R292 VanDerWaalsContact O-N 3.07Å; A289-R292 PolarHBondContact O-N 2.96Å; R292-L295 PolarHBondContact O-N 2.58Å; R292-A296 PolarHBondContact O-N 2.95Å
293	E	94	Very high	90.5	Very high	138 Å²	138	76.2 Å²	76.2	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-65.7	-44.4	179.8	-152.7	168.8	-145.1	0	0	110.8	A289 I290 E291 L295 A296 E297	A289-E293 PolarHBondContact O-N 3.02Å; I290-E293 PolarHBondContact O-N 2.94Å; E291-E293 VanDerWaalsContact C-N 3.35Å; E291-E293 PolarHBondContact O-N 2.97Å; E293-L295 VanDerWaalsContact C-N 3.31Å; E293-L295 PolarHBondContact O-N 3.27Å; E293-A296 WeakPolarHBondContact O-CB 3.25Å; E293-A296 PolarHBondContact O-N 3.12Å; E293-E297 PolarHBondContact O-N 2.66Å
294	C	92.4	Very high	91.8	Very high	7 Å²	7	81.1 Å²	81.1	5%	0.047	42%	0.417	C	S	.	.	H	α-helix	trans	-59.5	-39.7	173.3	-70.1	0	0	0	0	112.8	I290 E291 E297 L298 V417 K419	I290-C294 PolarHBondContact O-N 3.09Å; I290-C294 PolarHBondContact O-SG 3.01Å; E291-C294 PolarHBondContact O-N 2.93Å; C294-E297 PolarHBondContact O-N 3.45Å; C294-L298 PolarHBondContact O-N 3.08Å; C294-V417 HydrophobicContact CB-CB 4.44Å; C294-V417 HydrophobicContact CB-CG1 4.07Å; C294-K419 PolarHBondContact SG-O 3.34Å
295	L	94.6	Very high	92.5	Very high	57 Å²	57	82.6 Å²	82.6	30%	0.298	42%	0.417	S	S	.	.	H	α-helix	trans	-70.5	-34.7	177.5	-73.4	176.5	0	0	0	112.6	E291 R292 E293 E297 L298 T433 V437	E291-L295 WeakPolarHBondContact O-CB 3.48Å; E291-L295 VanDerWaalsContact O-CG 3.29Å; E291-L295 WeakPolarHBondContact O-CG 3.33Å; E291-L295 PolarHBondContact O-N 3.3Å; R292-L295 PolarHBondContact O-N 2.58Å; E293-L295 VanDerWaalsContact C-N 3.31Å; E293-L295 PolarHBondContact O-N 3.27Å; L295-E297 VanDerWaalsContact C-N 3.3Å; L295-E297 PolarHBondContact O-N 3.17Å; L295-L298 WeakPolarHBondContact O-CB 3.2Å; L295-L298 PolarHBondContact O-N 3.5Å; L295-L298 VanDerWaalsContact O-N 3.1Å; L295-T433 HydrophobicContact CD1-CG2 4.11Å; L295-T433 HydrophobicContact CD2-CG2 4.28Å; L295-T433 HydrophobicContact CG-CG2 4.46Å; L295-V437 HydrophobicContact CD1-CG2 4.48Å; L295-V437 HydrophobicContact CD2-CB 3.94Å; L295-V437 HydrophobicContact CD2-CG1 4.21Å; L295-V437 HydrophobicContact CD2-CG2 3.67Å
296	A	94.6	Very high	93.2	Very high	74 Å²	74	77.4 Å²	77.4	61%	0.612	39%	0.394	S	S	*	.	H	α-helix	trans	-62.4	-39	175.1	0	0	0	0	0	111.5	R292 E293 L298	R292-A296 PolarHBondContact O-N 2.95Å; E293-A296 WeakPolarHBondContact O-CB 3.25Å; E293-A296 PolarHBondContact O-N 3.12Å; A296-L298 PolarHBondContact O-N 2.87Å
297	E	92.6	Very high	94	Very high	84 Å²	84	75.1 Å²	75.1	39%	0.393	39%	0.388	S	S	.	.	H	α-helix	trans	-66.8	-21.2	174.5	-69.2	-171.3	168.6	0	0	113.4	E293 C294 L295 D299 Q300	E293-E297 PolarHBondContact O-N 2.66Å; C294-E297 PolarHBondContact O-N 3.45Å; L295-E297 VanDerWaalsContact C-N 3.3Å; L295-E297 PolarHBondContact O-N 3.17Å; E297-D299 VanDerWaalsContact C-N 3.25Å; E297-D299 PolarHBondContact O-N 3.12Å; E297-Q300 VanDerWaalsContact O-CG 3.25Å; E297-Q300 WeakPolarHBondContact O-CG 3.36Å; E297-Q300 PolarHBondContact O-NE2 2.96Å
298	L	93.9	Very high	94.5	Very high	9 Å²	9	75.9 Å²	75.9	5%	0.047	39%	0.39	C	S	.	.	H	α-helix	trans	-67.6	-25.7	-175.8	-147.2	86.2	0	0	0	113.1	C294 L295 A296 Q300 Y301 V415 A434 V437 M438	C294-L298 PolarHBondContact O-N 3.08Å; L295-L298 WeakPolarHBondContact O-CB 3.2Å; L295-L298 PolarHBondContact O-N 3.5Å; L295-L298 VanDerWaalsContact O-N 3.1Å; A296-L298 PolarHBondContact O-N 2.87Å; L298-Q300 PolarHBondContact O-N 3.46Å; L298-Y301 HydrophobicContact CD1-CD2 4.39Å; L298-Y301 WeakPolarHBondContact O-CB 3.42Å; L298-Y301 PolarHBondContact O-N 3.28Å; L298-V415 HydrophobicContact CD1-CB 4.44Å; L298-V415 HydrophobicContact CD1-CG1 4.49Å; L298-A434 HydrophobicContact CD1-CB 3.64Å; L298-V437 HydrophobicContact CD2-CB 4.33Å; L298-V437 HydrophobicContact CD2-CG1 4.09Å; L298-M438 HydrophobicContact CD2-CB 4.45Å; L298-M438 HydrophobicContact CD2-CE 4.2Å; L298-M438 HydrophobicContact CG-CE 4.3Å
299	D	93.6	Very high	94.8	Very high	126 Å²	126	70.5 Å²	70.5	67%	0.674	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-54.9	-37.7	-178.2	-171.3	61.1	0	0	0	112.1	E297 Y301 I302	E297-D299 VanDerWaalsContact C-N 3.25Å; E297-D299 PolarHBondContact O-N 3.12Å; D299-Y301 PolarHBondContact O-N 3.31Å; D299-I302 WeakPolarHBondContact O-CB 3.5Å; D299-I302 PolarHBondContact O-N 3.34Å
300	Q	94.2	Very high	95.1	Very high	116 Å²	116	68.7 Å²	68.7	54%	0.542	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-61.3	-20.8	178.3	83.4	-170.5	-72.1	0	0	113.6	E297 L298	E297-Q300 VanDerWaalsContact O-CG 3.25Å; E297-Q300 WeakPolarHBondContact O-CG 3.36Å; E297-Q300 PolarHBondContact O-NE2 2.96Å; L298-Q300 PolarHBondContact O-N 3.46Å
301	Y	95.2	Very high	95.6	Very high	37 Å²	37	72.8 Å²	72.8	15%	0.145	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-90	-5.2	-179.9	-58.2	-50.7	0	0	0	113.1	L298 D299 N303 C414 K416	L298-Y301 HydrophobicContact CD1-CD2 4.39Å; L298-Y301 WeakPolarHBondContact O-CB 3.42Å; L298-Y301 PolarHBondContact O-N 3.28Å; D299-Y301 PolarHBondContact O-N 3.31Å; Y301-N303 VanDerWaalsContact C-N 3.29Å; Y301-N303 PolarHBondContact O-N 2.96Å; Y301-C414 VanDerWaalsContact CB-O 3.32Å; Y301-C414 WeakPolarHBondContact CB-O 3.5Å; Y301-C414 HydrophobicContact CD1-CB 3.76Å; Y301-C414 WeakPolarHBondContact CD2-O 3.36Å; Y301-C414 HydrophobicContact CE1-CB 3.92Å; Y301-C414 HydrophobicContact CG-CB 4.17Å; Y301-C414 VanDerWaalsContact CG-O 3.29Å; Y301-K416 HydrophobicContact CE2-CB 4.32Å
302	I	96.3	Very high	95.7	Very high	78 Å²	78	74 Å²	74	40%	0.4	37%	0.369	S	S	.	.			trans	-80.5	80.1	167.7	-52.3	-58.9	0	0	0	108.7	D299 F306 M438 A441	D299-I302 WeakPolarHBondContact O-CB 3.5Å; D299-I302 PolarHBondContact O-N 3.34Å; I302-F306 HydrophobicContact CD1-CD2 3.75Å; I302-F306 HydrophobicContact CD1-CE2 3.86Å; I302-F306 HydrophobicContact CD1-CG 4.21Å; I302-F306 HydrophobicContact CD1-CZ 4.41Å; I302-F306 HydrophobicContact CG2-CD1 4.01Å; I302-F306 HydrophobicContact CG2-CE1 4.34Å; I302-F306 HydrophobicContact CG2-CG 4.25Å; I302-M438 HydrophobicContact CD1-CE 4.02Å; I302-M438 HydrophobicContact CD1-SD 3.95Å; I302-A441 HydrophobicContact CD1-CB 4.44Å
303	N	96.1	Very high	95.8	Very high	68 Å²	68	65 Å²	65	36%	0.364	34%	0.335	S	S	.	.	S	Bend	trans	-131.8	-162.5	-172.4	63.2	35.2	0	0	0	112.1	Y301 N305 F306 T307	Y301-N303 VanDerWaalsContact C-N 3.29Å; Y301-N303 PolarHBondContact O-N 2.96Å; N303-N305 PolarHBondContact O-N 2.85Å; N303-N305 WeakPolarHBondContact OD1-CB 3.36Å; N303-N305 PolarHBondContact OD1-N 2.99Å; N303-F306 WeakPolarHBondContact O-CA 3.5Å; N303-F306 VanDerWaalsContact O-CB 3.28Å; N303-F306 WeakPolarHBondContact O-CB 3.45Å; N303-F306 PolarHBondContact O-N 3.39Å; N303-T307 PolarHBondContact O-N 3.43Å; N303-T307 VanDerWaalsContact O-N 3.14Å; N303-T307 PolarHBondContact O-OG1 3.1Å
304	Q	96.9	Very high	96	Very high	148 Å²	148	61.1 Å²	61.1	69%	0.692	32%	0.316	S	S	*	.	H	α-helix	trans	-56	-35.5	-178.7	-136.4	79.5	19.2	0	0	113.8	F306 T307 L308	Q304-F306 VanDerWaalsContact C-N 3.33Å; Q304-T307 WeakPolarHBondContact O-CB 3.44Å; Q304-T307 PolarHBondContact O-N 3.42Å; Q304-L308 PolarHBondContact O-N 3.09Å
305	N	97.3	Very high	96.1	Very high	68 Å²	68	69.8 Å²	69.8	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-67.3	-37	177.2	-74.7	-10.7	0	0	0	111.2	N303 T307 L308 A309 V411 H412 L413	N303-N305 PolarHBondContact O-N 2.85Å; N303-N305 WeakPolarHBondContact OD1-CB 3.36Å; N303-N305 PolarHBondContact OD1-N 2.99Å; N305-T307 VanDerWaalsContact C-N 3.34Å; N305-L308 PolarHBondContact O-N 3.48Å; N305-A309 WeakPolarHBondContact O-CB 3.28Å; N305-A309 PolarHBondContact O-N 2.88Å; N305-V411 HydrophobicContact CB-CG1 4.12Å; N305-V411 WeakPolarHBondContact O-CG1 3.45Å; N305-H412 WeakPolarHBondContact CB-O 3.14Å; N305-H412 PolarHBondContact ND2-O 2.97Å; N305-H412 VanDerWaalsContact ND2-O 3.09Å; N305-L413 HydrophobicContact CB-CD2 4.29Å
306	F	98.1	Very high	96.2	Very high	20 Å²	20	68.3 Å²	68.3	9%	0.088	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-45.6	172.8	179.8	-88.7	0	0	0	111	I302 N303 Q304 L308 A309 C310 L413 M438 A441 L442 A445	I302-F306 HydrophobicContact CD1-CD2 3.75Å; I302-F306 HydrophobicContact CD1-CE2 3.86Å; I302-F306 HydrophobicContact CD1-CG 4.21Å; I302-F306 HydrophobicContact CD1-CZ 4.41Å; I302-F306 HydrophobicContact CG2-CD1 4.01Å; I302-F306 HydrophobicContact CG2-CE1 4.34Å; I302-F306 HydrophobicContact CG2-CG 4.25Å; N303-F306 WeakPolarHBondContact O-CA 3.5Å; N303-F306 VanDerWaalsContact O-CB 3.28Å; N303-F306 WeakPolarHBondContact O-CB 3.45Å; N303-F306 PolarHBondContact O-N 3.39Å; Q304-F306 VanDerWaalsContact C-N 3.33Å; F306-L308 PolarHBondContact O-N 3.47Å; F306-A309 PolarHBondContact O-N 3.29Å; F306-C310 PolarHBondContact O-N 2.8Å; F306-L413 HydrophobicContact CB-CD2 4.25Å; F306-M438 HydrophobicContact CD2-SD 3.75Å; F306-M438 HydrophobicContact CE2-SD 3.99Å; F306-A441 HydrophobicContact CE2-CB 3.91Å; F306-A441 HydrophobicContact CZ-CB 4Å; F306-L442 HydrophobicContact CD2-CD2 3.9Å; F306-L442 HydrophobicContact CD2-CG 4.41Å; F306-L442 HydrophobicContact CE2-CD2 3.58Å; F306-L442 HydrophobicContact CE2-CG 3.8Å; F306-L442 HydrophobicContact CZ-CD2 4.08Å; F306-L442 HydrophobicContact CZ-CG 4.45Å; F306-A445 HydrophobicContact CE1-CB 4.14Å; F306-A445 HydrophobicContact CZ-CB 4.14Å
307	T	97.7	Very high	96.1	Very high	65 Å²	65	73.6 Å²	73.6	40%	0.399	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-45.9	175.1	-50.6	0	0	0	0	111.9	N303 Q304 N305 A309 C310 E311	N303-T307 PolarHBondContact O-N 3.43Å; N303-T307 VanDerWaalsContact O-N 3.14Å; N303-T307 PolarHBondContact O-OG1 3.1Å; Q304-T307 WeakPolarHBondContact O-CB 3.44Å; Q304-T307 PolarHBondContact O-N 3.42Å; N305-T307 VanDerWaalsContact C-N 3.34Å; T307-A309 VanDerWaalsContact C-N 3.33Å; T307-A309 PolarHBondContact O-N 2.79Å; T307-C310 WeakPolarHBondContact O-CB 3.41Å; T307-C310 PolarHBondContact O-N 3.33Å; T307-E311 WeakPolarHBondContact O-CG 3.31Å; T307-E311 PolarHBondContact O-N 3.42Å
308	L	97.8	Very high	96.2	Very high	73 Å²	73	70.6 Å²	70.6	38%	0.382	34%	0.343	S	S	.	.	H	α-helix	trans	-61.9	-38.6	178	-111.3	127.1	0	0	0	112.9	Q304 N305 F306 E311 K312 V411	Q304-L308 PolarHBondContact O-N 3.09Å; N305-L308 PolarHBondContact O-N 3.48Å; F306-L308 PolarHBondContact O-N 3.47Å; L308-E311 PolarHBondContact O-N 2.8Å; L308-K312 PolarHBondContact O-N 3.46Å; L308-V411 HydrophobicContact CB-CG1 4.29Å; L308-V411 HydrophobicContact CB-CG2 4.13Å; L308-V411 HydrophobicContact CD2-CG2 4.13Å
309	A	98.1	Very high	96.3	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-49.6	174.2	0	0	0	0	0	110.7	N305 F306 T307 E311 K312 M313 I395 V411 L413 L442	N305-A309 WeakPolarHBondContact O-CB 3.28Å; N305-A309 PolarHBondContact O-N 2.88Å; F306-A309 PolarHBondContact O-N 3.29Å; T307-A309 VanDerWaalsContact C-N 3.33Å; T307-A309 PolarHBondContact O-N 2.79Å; A309-E311 PolarHBondContact O-N 2.97Å; A309-K312 PolarHBondContact O-N 2.8Å; A309-M313 WeakPolarHBondContact O-CG 3.11Å; A309-M313 PolarHBondContact O-N 3.18Å; A309-I395 HydrophobicContact CB-CD1 4.01Å; A309-I395 HydrophobicContact CB-CG2 4.32Å; A309-V411 HydrophobicContact CB-CG1 3.99Å; A309-L413 HydrophobicContact CB-CD1 3.99Å; A309-L413 HydrophobicContact CB-CD2 4.07Å; A309-L413 HydrophobicContact CB-CG 4.32Å; A309-L442 HydrophobicContact CB-CD2 4.12Å
310	C	97.9	Very high	96.6	Very high	19 Å²	19	69.2 Å²	69.2	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-56.8	-46.4	174.9	-75	0	0	0	0	111.8	F306 T307 K312 M313 F314 L446	F306-C310 PolarHBondContact O-N 2.8Å; T307-C310 WeakPolarHBondContact O-CB 3.41Å; T307-C310 PolarHBondContact O-N 3.33Å; C310-K312 PolarHBondContact O-N 3.41Å; C310-M313 PolarHBondContact O-N 2.81Å; C310-F314 WeakPolarHBondContact O-CB 3.31Å; C310-F314 PolarHBondContact O-N 2.92Å; C310-L446 WeakPolarHBondContact O-CD2 3.16Å
311	E	97.3	Very high	96.7	Very high	106 Å²	106	63.7 Å²	63.7	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-45	179.1	-75.3	179.6	167.2	0	0	112.3	T307 L308 A309 M313 F314 W315	T307-E311 WeakPolarHBondContact O-CG 3.31Å; T307-E311 PolarHBondContact O-N 3.42Å; L308-E311 PolarHBondContact O-N 2.8Å; A309-E311 PolarHBondContact O-N 2.97Å; E311-M313 VanDerWaalsContact C-N 3.32Å; E311-M313 PolarHBondContact O-N 3.04Å; E311-F314 PolarHBondContact O-N 3.02Å; E311-W315 PolarHBondContact O-N 3.36Å
312	K	96.8	Very high	96.9	Very high	72 Å²	72	61.9 Å²	61.9	31%	0.313	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-42.5	176.2	-82.6	-165.1	177.2	-76.7	0	112	L308 A309 C310 C316 P393 V411	L308-K312 PolarHBondContact O-N 3.46Å; A309-K312 PolarHBondContact O-N 2.8Å; C310-K312 PolarHBondContact O-N 3.41Å; K312-C316 PolarHBondContact O-N 3.36Å; K312-P393 HydrophobicContact CD-CB 4.1Å; K312-V411 HydrophobicContact CD-CG2 4.05Å
313	M	97.7	Very high	96.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.9	-35.3	176.9	-68.3	172.2	71.8	0	0	112.4	A309 C310 E311 C316 V320 F339 V367 I369 I395 L442 L446 R450	A309-M313 WeakPolarHBondContact O-CG 3.11Å; A309-M313 PolarHBondContact O-N 3.18Å; C310-M313 PolarHBondContact O-N 2.81Å; E311-M313 VanDerWaalsContact C-N 3.32Å; E311-M313 PolarHBondContact O-N 3.04Å; M313-C316 VanDerWaalsContact O-CB 3.27Å; M313-C316 WeakPolarHBondContact O-CB 3.42Å; M313-C316 PolarHBondContact O-N 3.49Å; M313-V320 HydrophobicContact CB-CG2 4.37Å; M313-V320 HydrophobicContact CE-CG1 4.05Å; M313-V320 HydrophobicContact CE-CG2 3.97Å; M313-V320 HydrophobicContact CG-CG2 4.15Å; M313-F339 HydrophobicContact CE-CD1 4.2Å; M313-F339 HydrophobicContact CE-CD2 4.17Å; M313-F339 HydrophobicContact CE-CE1 3.89Å; M313-F339 HydrophobicContact CE-CE2 3.84Å; M313-F339 HydrophobicContact CE-CG 4.35Å; M313-F339 HydrophobicContact CE-CZ 3.7Å; M313-V367 HydrophobicContact CG-CG1 4.41Å; M313-I369 HydrophobicContact CE-CD1 3.78Å; M313-I369 HydrophobicContact SD-CD1 3.82Å; M313-I395 HydrophobicContact CG-CD1 3.95Å; M313-I395 HydrophobicContact SD-CD1 4.29Å; M313-L442 HydrophobicContact SD-CD1 4.5Å; M313-L442 HydrophobicContact SD-CD2 4.48Å; M313-L446 HydrophobicContact CB-CD1 3.78Å; M313-L446 HydrophobicContact CB-CD2 4.02Å; M313-L446 HydrophobicContact CE-CD1 3.34Å; M313-L446 HydrophobicContact CG-CD1 4.47Å; M313-L446 HydrophobicContact SD-CD1 3.89Å; M313-R450 PolarHBondContact O-NH2 3.38Å
314	F	96.7	Very high	96.9	Very high	56 Å²	56	55 Å²	55	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-46.4	179.5	-174.5	-93.3	0	0	0	111.3	C310 E311 C316 L446 A449 R450	C310-F314 WeakPolarHBondContact O-CB 3.31Å; C310-F314 PolarHBondContact O-N 2.92Å; E311-F314 PolarHBondContact O-N 3.02Å; F314-C316 VanDerWaalsContact C-N 3.3Å; F314-C316 PolarHBondContact O-N 3.26Å; F314-L446 HydrophobicContact CB-CD2 3.88Å; F314-L446 HydrophobicContact CD2-CD2 4.33Å; F314-A449 HydrophobicContact CD2-CB 3.87Å; F314-A449 HydrophobicContact CE2-CB 3.82Å; F314-A449 WeakPolarHBondContact CE2-O 3.42Å; F314-R450 HydrophobicContact CD2-CG 3.85Å; F314-R450 HydrophobicContact CE2-CB 4.32Å; F314-R450 HydrophobicContact CE2-CG 3.52Å; F314-R450 PolarHBondContact O-NH2 2.66Å
315	W	95.6	Very high	96.8	Very high	190 Å²	190	50.3 Å²	50.3	72%	0.72	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	1.9	179.5	-64.3	116.2	0	0	0	114.6	E311 K317	E311-W315 PolarHBondContact O-N 3.36Å; W315-K317 PolarHBondContact O-N 3.01Å
316	C	95.7	Very high	96.6	Very high	26 Å²	26	49.4 Å²	49.4	18%	0.176	25%	0.247	C	C	.	.			trans	-59.3	122.8	175.3	179.6	0	0	0	0	110.4	K312 M313 F314 V367	K312-C316 PolarHBondContact O-N 3.36Å; M313-C316 VanDerWaalsContact O-CB 3.27Å; M313-C316 WeakPolarHBondContact O-CB 3.42Å; M313-C316 PolarHBondContact O-N 3.49Å; F314-C316 VanDerWaalsContact C-N 3.3Å; F314-C316 PolarHBondContact O-N 3.26Å; C316-V367 HydrophobicContact CB-CG2 3.86Å
317	K	92.8	Very high	96.4	Very high	185 Å²	185	54.3 Å²	54.3	80%	0.804	27%	0.268	S	S	*	.	S	Bend	trans	-88.2	-27.1	176.9	-68.3	-165	177.9	-173.7	0	113.1	W315	W315-K317 PolarHBondContact O-N 3.01Å
318	G	95.3	Very high	96.2	Very high	21 Å²	21	52.3 Å²	52.3	22%	0.216	26%	0.257	C	S	.	.	S	Bend	trans	-86.6	-128.5	172.4	0	0	0	0	0	111.2	Q365 D366	G318-Q365 WeakPolarHBondContact CA-O 3.47Å; G318-Q365 PolarHBondContact N-O 2.93Å; G318-D366 VanDerWaalsContact CA-OD1 3.25Å; G318-D366 WeakPolarHBondContact CA-OD1 3.36Å
319	K	96.4	Very high	96.1	Very high	104 Å²	104	49.1 Å²	49.1	45%	0.452	24%	0.242	S	C	.	.			trans	-124.8	159.6	-179.9	-50.5	-165.8	-157.9	-61.8	0	110.9	P345 F347 D366 V367	K319-P345 CarbonylContact C-O 3.38Å; K319-P345 WeakPolarHBondContact CA-O 3.41Å; K319-P345 WeakPolarHBondContact CB-O 3.42Å; K319-P345 HydrophobicContact CG-CB 4.27Å; K319-F347 HydrophobicContact CB-CD1 4.24Å; K319-F347 HydrophobicContact CB-CE1 3.98Å; K319-F347 HydrophobicContact CD-CD1 3.87Å; K319-F347 HydrophobicContact CD-CE1 3.8Å; K319-F347 HydrophobicContact CG-CE1 4.42Å; K319-D366 PolarHBondContact N-OD1 3Å; K319-D366 CarbonylContact O-C 3.59Å; K319-D366 VanDerWaalsContact O-CA 3.24Å; K319-D366 WeakPolarHBondContact O-CA 3.2Å; K319-D366 VanDerWaalsContact O-CB 3.23Å; K319-D366 WeakPolarHBondContact O-CB 3.36Å; K319-V367 PolarHBondContact O-N 3.13Å
320	V	97.9	Very high	96.1	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.8	166.5	176	0	0	0	0	108.7	M313 V322 F339 T344 P345 S346 F347 V367 I369	M313-V320 HydrophobicContact CB-CG2 4.37Å; M313-V320 HydrophobicContact CE-CG1 4.05Å; M313-V320 HydrophobicContact CE-CG2 3.97Å; M313-V320 HydrophobicContact CG-CG2 4.15Å; V320-V322 HydrophobicContact CG1-CG2 4.14Å; V320-F339 HydrophobicContact CG1-CD2 4.25Å; V320-F339 HydrophobicContact CG1-CE2 4.42Å; V320-T344 HydrophobicContact CB-CG2 4.47Å; V320-T344 HydrophobicContact CG2-CG2 3.71Å; V320-P345 PolarHBondContact N-O 3.12Å; V320-S346 CarbonylContact O-C 3.58Å; V320-S346 WeakPolarHBondContact O-CA 3.25Å; V320-S346 WeakPolarHBondContact O-CB 3.44Å; V320-F347 PolarHBondContact O-N 2.97Å; V320-F347 VanDerWaalsContact O-N 3.1Å; V320-V367 CarbonylContact C-O 3.57Å; V320-V367 WeakPolarHBondContact CA-O 3.44Å; V320-I369 HydrophobicContact CG1-CD1 3.62Å; V320-I369 HydrophobicContact CG1-CG1 4.01Å
321	V	97.7	Very high	96	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.3	177.8	-175.9	0	0	0	0	108.6	M323 F347 V349 V362 D366 V367 V368 I369	V321-M323 HydrophobicContact CG1-CE 4.14Å; V321-F347 HydrophobicContact CG1-CE2 4.29Å; V321-F347 HydrophobicContact CG1-CZ 4.35Å; V321-F347 HydrophobicContact CG2-CD1 4.48Å; V321-F347 HydrophobicContact CG2-CE1 3.68Å; V321-F347 HydrophobicContact CG2-CE2 4.34Å; V321-F347 HydrophobicContact CG2-CZ 3.61Å; V321-V349 HydrophobicContact CG1-CB 4.04Å; V321-V349 HydrophobicContact CG1-CG2 3.61Å; V321-V362 HydrophobicContact CG1-CG2 4.17Å; V321-V362 HydrophobicContact CG2-CG2 4.35Å; V321-D366 HydrophobicContact CG2-CB 4.26Å; V321-V367 PolarHBondContact N-O 3.01Å; V321-V368 HydrophobicContact CB-CG2 4.16Å; V321-V368 CarbonylContact O-C 3.45Å; V321-V368 WeakPolarHBondContact O-CA 3.11Å; V321-I369 PolarHBondContact O-N 2.7Å
322	V	98.1	Very high	96.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.6	179.8	-169.1	0	0	0	0	109.8	V320 G332 A336 F339 F347 F348 V349 I369 I371	V320-V322 HydrophobicContact CG1-CG2 4.14Å; V322-G332 WeakPolarHBondContact CG1-O 3.34Å; V322-A336 HydrophobicContact CB-CB 4.11Å; V322-A336 HydrophobicContact CG2-CB 3.86Å; V322-F339 HydrophobicContact CG2-CD2 4.18Å; V322-F339 HydrophobicContact CG2-CE2 4.11Å; V322-F347 PolarHBondContact N-O 3.44Å; V322-F348 CarbonylContact O-C 3.56Å; V322-F348 VanDerWaalsContact O-CA 3.29Å; V322-F348 WeakPolarHBondContact O-CA 3.29Å; V322-F348 VanDerWaalsContact O-CD2 3.24Å; V322-F348 WeakPolarHBondContact O-CD2 3.4Å; V322-V349 PolarHBondContact O-N 2.88Å; V322-I369 CarbonylContact C-O 3.51Å; V322-I369 WeakPolarHBondContact CA-O 3.32Å; V322-I369 HydrophobicContact CG1-CB 4.46Å; V322-I369 HydrophobicContact CG1-CG2 4.5Å; V322-I369 HydrophobicContact CG2-CB 4.45Å; V322-I371 HydrophobicContact CG1-CD1 3.86Å; V322-I371 HydrophobicContact CG1-CG1 4.49Å
323	M	96.9	Very high	96.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.2	178.6	59.2	-176.3	63.9	0	0	112.6	V321 V349 V368 I369 A370 I371 L383	V321-M323 HydrophobicContact CG1-CE 4.14Å; M323-V349 WeakPolarHBondContact CA-O 3.49Å; M323-V349 VanDerWaalsContact CB-O 3.22Å; M323-V349 WeakPolarHBondContact CB-O 3.34Å; M323-V368 HydrophobicContact CE-CG1 3.59Å; M323-V368 HydrophobicContact CE-CG2 4.34Å; M323-V368 HydrophobicContact CG-CG1 4.19Å; M323-V368 HydrophobicContact SD-CG1 3.82Å; M323-I369 PolarHBondContact N-O 2.99Å; M323-A370 HydrophobicContact CG-CB 4.03Å; M323-I371 PolarHBondContact O-N 3.36Å; M323-L383 HydrophobicContact SD-CD1 4.4Å
324	G	96.5	Very high	96.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	154.5	-179.2	0	0	0	0	0	111.6	G329 P351	G324-G329 VanDerWaalsContact C-CA 3.5Å; G324-G329 VanDerWaalsContact O-CA 3.22Å; G324-G329 WeakPolarHBondContact O-CA 3.37Å; G324-P351 WeakPolarHBondContact O-CD 3.5Å
325	M	94.2	Very high	96.2	Very high	50 Å²	50	55.1 Å²	55.1	25%	0.246	26%	0.262	C	S	.	.	S	Bend	trans	-100.9	148.1	176.7	-77.7	-61.2	-76.5	0	0	112.1	K327 S328 G329 H350 P351 E379	M325-K327 PolarHBondContact O-N 3.37Å; M325-S328 WeakPolarHBondContact O-CB 3.32Å; M325-S328 PolarHBondContact O-N 3.49Å; M325-S328 VanDerWaalsContact O-N 3.13Å; M325-G329 PolarHBondContact O-N 2.95Å; M325-H350 PolarHBondContact SD-CE1 3.49Å; M325-P351 HydrophobicContact CG-CG 3.68Å; M325-P351 HydrophobicContact SD-CG 3.66Å; M325-E379 HydrophobicContact CE-CG 4.02Å; M325-E379 HydrophobicContact CG-CB 4.09Å; M325-E379 HydrophobicContact CG-CG 4.26Å; M325-E379 HydrophobicContact SD-CB 4.32Å; M325-E379 HydrophobicContact SD-CG 4.17Å
326	G	92.8	Very high	96.3	Very high	50 Å²	50	46.2 Å²	46.2	52%	0.515	23%	0.229	S	C	.	.	H	α-helix	trans	54.7	-129.4	174.7	0	0	0	0	0	113.4	S328 G329 H330	G326-S328 VanDerWaalsContact C-N 3.28Å; G326-S328 PolarHBondContact O-N 3.44Å; G326-G329 WeakPolarHBondContact O-CA 3.4Å; G326-G329 PolarHBondContact O-N 3.1Å; G326-H330 PolarHBondContact O-CD2 3.3Å; G326-H330 PolarHBondContact O-N 2.71Å
327	K	93.9	Very high	96.2	Very high	123 Å²	123	48 Å²	48	54%	0.535	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-37.1	178.3	-60.7	-56.2	-173.9	-169.6	0	112.7	M325 G329 H330 I331 P428 T432	M325-K327 PolarHBondContact O-N 3.37Å; K327-G329 VanDerWaalsContact C-N 3.26Å; K327-G329 PolarHBondContact O-N 3.11Å; K327-H330 PolarHBondContact O-N 3.39Å; K327-I331 WeakPolarHBondContact O-CG1 3.36Å; K327-I331 PolarHBondContact O-N 3.07Å; K327-P428 HydrophobicContact CB-CG 4.48Å; K327-P428 HydrophobicContact CG-CG 4.22Å; K327-T432 HydrophobicContact CB-CG2 3.88Å
328	S	94.8	Very high	96.4	Very high	23 Å²	23	40.4 Å²	40.4	16%	0.161	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-33.4	173.9	-55.4	0	0	0	0	112.2	M325 G326 I331 G332	M325-S328 WeakPolarHBondContact O-CB 3.32Å; M325-S328 PolarHBondContact O-N 3.49Å; M325-S328 VanDerWaalsContact O-N 3.13Å; G326-S328 VanDerWaalsContact C-N 3.28Å; G326-S328 PolarHBondContact O-N 3.44Å; S328-I331 PolarHBondContact O-N 3.46Å; S328-G332 PolarHBondContact O-N 3.01Å
329	G	96	Very high	96.4	Very high	6 Å²	6	39.4 Å²	39.4	6%	0.062	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-39	173.8	0	0	0	0	0	113.5	G324 M325 G326 K327 G332 R333 F348	G324-G329 VanDerWaalsContact C-CA 3.5Å; G324-G329 VanDerWaalsContact O-CA 3.22Å; G324-G329 WeakPolarHBondContact O-CA 3.37Å; M325-G329 PolarHBondContact O-N 2.95Å; G326-G329 WeakPolarHBondContact O-CA 3.4Å; G326-G329 PolarHBondContact O-N 3.1Å; K327-G329 VanDerWaalsContact C-N 3.26Å; K327-G329 PolarHBondContact O-N 3.11Å; G329-G332 PolarHBondContact O-N 3.39Å; G329-R333 PolarHBondContact O-N 3.19Å; G329-F348 WeakPolarHBondContact O-CE2 3.34Å
330	H	96.5	Very high	96.2	Very high	121 Å²	121	36.4 Å²	36.4	56%	0.56	20%	0.2	S	C	*	.	H	α-helix	trans	-62.9	-45.5	174.5	-66.4	-59.9	0	0	0	111.9	G326 K327 G332 R333 K334	G326-H330 PolarHBondContact O-CD2 3.3Å; G326-H330 PolarHBondContact O-N 2.71Å; K327-H330 PolarHBondContact O-N 3.39Å; H330-G332 VanDerWaalsContact C-N 3.34Å; H330-R333 PolarHBondContact O-N 2.96Å; H330-K334 PolarHBondContact O-N 3Å; H330-K334 VanDerWaalsContact O-N 3.16Å
331	I	97.5	Very high	95.8	Very high	26 Å²	26	37.4 Å²	37.4	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-43.6	176.2	-56.1	-56.7	0	0	0	110.4	K327 S328 R333 K334 M335 T432 T435 L436	K327-I331 WeakPolarHBondContact O-CG1 3.36Å; K327-I331 PolarHBondContact O-N 3.07Å; S328-I331 PolarHBondContact O-N 3.46Å; I331-R333 VanDerWaalsContact C-N 3.29Å; I331-R333 PolarHBondContact O-N 2.98Å; I331-K334 PolarHBondContact O-N 3.34Å; I331-M335 HydrophobicContact CG2-CE 4.2Å; I331-M335 WeakPolarHBondContact O-CB 3.35Å; I331-M335 PolarHBondContact O-N 3.18Å; I331-T432 HydrophobicContact CG1-CG2 4.47Å; I331-T435 HydrophobicContact CG2-CG2 3.82Å; I331-L436 HydrophobicContact CD1-CB 4.35Å; I331-L436 HydrophobicContact CG2-CB 3.94Å; I331-L436 HydrophobicContact CG2-CD1 4.31Å
332	G	97.7	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-38.3	175.2	0	0	0	0	0	113.4	V322 S328 G329 H330 M335 A336	V322-G332 WeakPolarHBondContact CG1-O 3.34Å; S328-G332 PolarHBondContact O-N 3.01Å; G329-G332 PolarHBondContact O-N 3.39Å; H330-G332 VanDerWaalsContact C-N 3.34Å; G332-M335 PolarHBondContact O-N 3.16Å; G332-A336 PolarHBondContact O-N 2.88Å
333	R	97.7	Very high	95	Very high	150 Å²	150	39 Å²	39	57%	0.566	22%	0.221	S	C	*	.	H	α-helix	trans	-66.5	-43.5	177.1	-162.7	-178.3	-64.5	-115.8	2.8	112.3	G329 H330 I331 M335 A337 F348	G329-R333 PolarHBondContact O-N 3.19Å; H330-R333 PolarHBondContact O-N 2.96Å; I331-R333 VanDerWaalsContact C-N 3.29Å; I331-R333 PolarHBondContact O-N 2.98Å; R333-M335 VanDerWaalsContact C-N 3.34Å; R333-A337 PolarHBondContact O-N 3.33Å; R333-A337 VanDerWaalsContact O-N 3.08Å; R333-F348 HydrophobicContact CB-CB 4.33Å; R333-F348 HydrophobicContact CB-CD2 4.19Å; R333-F348 HydrophobicContact CB-CG 4.08Å; R333-F348 HydrophobicContact CG-CB 4.14Å; R333-F348 HydrophobicContact CG-CD1 4.46Å; R333-F348 HydrophobicContact CG-CG 4.22Å
334	K	97.6	Very high	94.9	Very high	80 Å²	80	39.1 Å²	39.1	35%	0.348	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-45.8	172.5	-172.8	-74.3	-171.2	-171.5	0	110.5	H330 I331 A336 A337 T338 L436 D440	H330-K334 PolarHBondContact O-N 3Å; H330-K334 VanDerWaalsContact O-N 3.16Å; I331-K334 PolarHBondContact O-N 3.34Å; K334-A336 PolarHBondContact O-N 3.35Å; K334-A337 WeakPolarHBondContact O-CB 3.31Å; K334-A337 PolarHBondContact O-N 3.42Å; K334-A337 VanDerWaalsContact O-N 3.17Å; K334-T338 WeakPolarHBondContact CD-OG1 3.24Å; K334-T338 WeakPolarHBondContact CE-OG1 3.43Å; K334-T338 PolarHBondContact NZ-OG1 3.03Å; K334-T338 PolarHBondContact O-N 2.91Å; K334-T338 PolarHBondContact O-OG1 3.1Å; K334-L436 HydrophobicContact CD-CD1 3.47Å; K334-L436 VanDerWaalsContact CD-CD1 3.47Å; K334-L436 HydrophobicContact CG-CD1 4.11Å; K334-D440 IonicContact NZ-OD1 3.72Å; K334-D440 PolarHBondContact NZ-OD1 3.44Å; K334-D440 IonicContact NZ-OD2 3.66Å; K334-D440 PolarHBondContact NZ-OD2 3.19Å
335	M	97.8	Very high	94.7	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-47.3	-179	-160.3	-174.3	-57.8	0	0	111.3	I331 G332 R333 A337 T338 F339 I371 I397 T435 G439	I331-M335 HydrophobicContact CG2-CE 4.2Å; I331-M335 WeakPolarHBondContact O-CB 3.35Å; I331-M335 PolarHBondContact O-N 3.18Å; G332-M335 PolarHBondContact O-N 3.16Å; R333-M335 VanDerWaalsContact C-N 3.34Å; M335-A337 PolarHBondContact O-N 2.96Å; M335-T338 WeakPolarHBondContact O-CB 3.23Å; M335-T338 PolarHBondContact O-N 3.47Å; M335-T338 VanDerWaalsContact O-N 3.12Å; M335-F339 HydrophobicContact CB-CE2 4.45Å; M335-F339 HydrophobicContact CG-CD2 4.32Å; M335-F339 HydrophobicContact CG-CE1 4.31Å; M335-F339 HydrophobicContact CG-CE2 3.51Å; M335-F339 HydrophobicContact CG-CZ 3.5Å; M335-F339 VanDerWaalsContact CG-CZ 3.5Å; M335-F339 WeakPolarHBondContact O-CD2 3.31Å; M335-F339 WeakPolarHBondContact O-CG 3.29Å; M335-F339 PolarHBondContact O-N 3.19Å; M335-F339 HydrophobicContact SD-CE2 3.92Å; M335-F339 HydrophobicContact SD-CZ 3.85Å; M335-I371 HydrophobicContact CE-CD1 3.56Å; M335-I371 HydrophobicContact SD-CD1 4.23Å; M335-I397 HydrophobicContact CE-CD1 4.23Å; M335-I397 HydrophobicContact SD-CD1 4.26Å; M335-T435 HydrophobicContact CE-CG2 4.15Å; M335-G439 VanDerWaalsContact SD-CA 3.6Å
336	A	97.5	Very high	94.8	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-46	173.6	0	0	0	0	0	112.3	V322 G332 K334 T338 F339 A340 S346 F348	V322-A336 HydrophobicContact CB-CB 4.11Å; V322-A336 HydrophobicContact CG2-CB 3.86Å; G332-A336 PolarHBondContact O-N 2.88Å; K334-A336 PolarHBondContact O-N 3.35Å; A336-T338 PolarHBondContact O-N 2.94Å; A336-F339 PolarHBondContact O-N 3.16Å; A336-A340 WeakPolarHBondContact O-CB 3.35Å; A336-A340 PolarHBondContact O-N 2.84Å; A336-S346 VanDerWaalsContact C-OG 3.23Å; A336-S346 WeakPolarHBondContact CA-OG 3.34Å; A336-S346 PolarHBondContact O-OG 3.25Å; A336-F348 HydrophobicContact CB-CB 4.23Å
337	A	95.5	Very high	95	Very high	62 Å²	62	40.7 Å²	40.7	51%	0.512	22%	0.222	S	C	.	.	H	α-helix	trans	-59.2	-37.8	176	0	0	0	0	0	112.2	R333 K334 M335 S341	R333-A337 PolarHBondContact O-N 3.33Å; R333-A337 VanDerWaalsContact O-N 3.08Å; K334-A337 WeakPolarHBondContact O-CB 3.31Å; K334-A337 PolarHBondContact O-N 3.42Å; K334-A337 VanDerWaalsContact O-N 3.17Å; M335-A337 PolarHBondContact O-N 2.96Å; A337-S341 WeakPolarHBondContact O-CB 3.49Å; A337-S341 PolarHBondContact O-N 2.71Å; A337-S341 PolarHBondContact O-OG 3.01Å; A337-S341 VanDerWaalsContact O-OG 3.1Å
338	T	95.3	Very high	95.2	Very high	26 Å²	26	36.5 Å²	36.5	16%	0.16	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-41.3	178.5	-53.3	0	0	0	0	111.8	K334 M335 A336 S341 T342 A443	K334-T338 WeakPolarHBondContact CD-OG1 3.24Å; K334-T338 WeakPolarHBondContact CE-OG1 3.43Å; K334-T338 PolarHBondContact NZ-OG1 3.03Å; K334-T338 PolarHBondContact O-N 2.91Å; K334-T338 PolarHBondContact O-OG1 3.1Å; M335-T338 WeakPolarHBondContact O-CB 3.23Å; M335-T338 PolarHBondContact O-N 3.47Å; M335-T338 VanDerWaalsContact O-N 3.12Å; A336-T338 PolarHBondContact O-N 2.94Å; T338-S341 WeakPolarHBondContact CA-OG 3.38Å; T338-S341 PolarHBondContact O-N 3.24Å; T338-S341 PolarHBondContact O-OG 3.32Å; T338-T342 WeakPolarHBondContact O-CB 3.45Å; T338-T342 VanDerWaalsContact O-CG2 3.28Å; T338-T342 WeakPolarHBondContact O-CG2 3.42Å; T338-T342 PolarHBondContact O-N 3.46Å; T338-T342 VanDerWaalsContact O-N 3.14Å; T338-T342 PolarHBondContact O-OG1 2.82Å; T338-A443 HydrophobicContact CG2-CB 3.74Å
339	F	96.3	Very high	95.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-45.3	174.4	-63.4	-37.3	0	0	0	111.5	M313 V320 V322 M335 A336 S341 T342 G343 T344 S346 I369 G439 L442 A443	M313-F339 HydrophobicContact CE-CD1 4.2Å; M313-F339 HydrophobicContact CE-CD2 4.17Å; M313-F339 HydrophobicContact CE-CE1 3.89Å; M313-F339 HydrophobicContact CE-CE2 3.84Å; M313-F339 HydrophobicContact CE-CG 4.35Å; M313-F339 HydrophobicContact CE-CZ 3.7Å; V320-F339 HydrophobicContact CG1-CD2 4.25Å; V320-F339 HydrophobicContact CG1-CE2 4.42Å; V322-F339 HydrophobicContact CG2-CD2 4.18Å; V322-F339 HydrophobicContact CG2-CE2 4.11Å; M335-F339 HydrophobicContact CB-CE2 4.45Å; M335-F339 HydrophobicContact CG-CD2 4.32Å; M335-F339 HydrophobicContact CG-CE1 4.31Å; M335-F339 HydrophobicContact CG-CE2 3.51Å; M335-F339 HydrophobicContact CG-CZ 3.5Å; M335-F339 VanDerWaalsContact CG-CZ 3.5Å; M335-F339 WeakPolarHBondContact O-CD2 3.31Å; M335-F339 WeakPolarHBondContact O-CG 3.29Å; M335-F339 PolarHBondContact O-N 3.19Å; M335-F339 HydrophobicContact SD-CE2 3.92Å; M335-F339 HydrophobicContact SD-CZ 3.85Å; A336-F339 PolarHBondContact O-N 3.16Å; F339-S341 VanDerWaalsContact C-N 3.31Å; F339-S341 PolarHBondContact O-N 3.46Å; F339-T342 CarbonylContact O-C 3.53Å; F339-T342 PolarHBondContact O-N 3.38Å; F339-T342 VanDerWaalsContact O-N 3.15Å; F339-T342 PolarHBondContact O-OG1 3.02Å; F339-G343 PolarHBondContact O-N 3.43Å; F339-T344 CarbonylContact C-O 3.39Å; F339-T344 HydrophobicContact CB-CG2 4.39Å; F339-T344 CarbonylContact O-C 3.36Å; F339-T344 WeakPolarHBondContact O-CA 3.16Å; F339-T344 PolarHBondContact O-N 3.34Å; F339-S346 WeakPolarHBondContact CB-OG 3.44Å; F339-I369 HydrophobicContact CE2-CD1 3.81Å; F339-I369 HydrophobicContact CZ-CD1 4.24Å; F339-G439 WeakPolarHBondContact CE1-O 3.37Å; F339-L442 HydrophobicContact CE1-CB 3.88Å; F339-L442 HydrophobicContact CZ-CB 4.08Å; F339-L442 HydrophobicContact CZ-CD1 4.34Å; F339-A443 HydrophobicContact CD1-CB 3.58Å; F339-A443 HydrophobicContact CE1-CB 3.66Å
340	A	92.8	Very high	95.2	Very high	42 Å²	42	38.4 Å²	38.4	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-40.2	179.8	0	0	0	0	0	111.7	A336 T342 T344	A336-A340 WeakPolarHBondContact O-CB 3.35Å; A336-A340 PolarHBondContact O-N 2.84Å; A340-T342 VanDerWaalsContact C-N 3.27Å; A340-T342 PolarHBondContact O-N 3Å; A340-T344 WeakPolarHBondContact CA-O 3.08Å; A340-T344 PolarHBondContact N-O 3.44Å
341	S	88.4	Confident	95.1	Very high	22 Å²	22	32.7 Å²	32.7	15%	0.154	18%	0.182	C	C	.	.	H	α-helix	trans	-71.2	-20.3	177.9	63.2	0	0	0	0	113.8	A337 T338 F339 F457 H461	A337-S341 WeakPolarHBondContact O-CB 3.49Å; A337-S341 PolarHBondContact O-N 2.71Å; A337-S341 PolarHBondContact O-OG 3.01Å; A337-S341 VanDerWaalsContact O-OG 3.1Å; T338-S341 WeakPolarHBondContact CA-OG 3.38Å; T338-S341 PolarHBondContact O-N 3.24Å; T338-S341 PolarHBondContact O-OG 3.32Å; F339-S341 VanDerWaalsContact C-N 3.31Å; F339-S341 PolarHBondContact O-N 3.46Å; S341-F457 WeakPolarHBondContact O-CD2 3.36Å; S341-F457 WeakPolarHBondContact O-CE2 3.34Å; S341-H461 WeakPolarHBondContact CB-CE1 3.38Å; S341-H461 WeakPolarHBondContact CB-NE2 3.34Å
342	T	90	Very high	94.8	Very high	12 Å²	12	32.2 Å²	32.2	7%	0.074	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	19.7	-175.9	57.1	0	0	0	0	113.6	T338 F339 A340 L447	T338-T342 WeakPolarHBondContact O-CB 3.45Å; T338-T342 VanDerWaalsContact O-CG2 3.28Å; T338-T342 WeakPolarHBondContact O-CG2 3.42Å; T338-T342 PolarHBondContact O-N 3.46Å; T338-T342 VanDerWaalsContact O-N 3.14Å; T338-T342 PolarHBondContact O-OG1 2.82Å; F339-T342 CarbonylContact O-C 3.53Å; F339-T342 PolarHBondContact O-N 3.38Å; F339-T342 VanDerWaalsContact O-N 3.15Å; F339-T342 PolarHBondContact O-OG1 3.02Å; A340-T342 VanDerWaalsContact C-N 3.27Å; A340-T342 PolarHBondContact O-N 3Å; T342-L447 HydrophobicContact CG2-CD1 3.74Å
343	G	89.1	Confident	94.4	Very high	22 Å²	22	37.4 Å²	37.4	23%	0.227	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	9.5	171.1	0	0	0	0	0	115.9	F339	F339-G343 PolarHBondContact O-N 3.43Å
344	T	94.2	Very high	94.1	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.012	18%	0.182	C	C	.	.			trans	-108.1	103.9	172	-61.1	0	0	0	0	109.1	V320 F339 A340 S346 L446 R450	V320-T344 HydrophobicContact CB-CG2 4.47Å; V320-T344 HydrophobicContact CG2-CG2 3.71Å; F339-T344 CarbonylContact C-O 3.39Å; F339-T344 HydrophobicContact CB-CG2 4.39Å; F339-T344 CarbonylContact O-C 3.36Å; F339-T344 WeakPolarHBondContact O-CA 3.16Å; F339-T344 PolarHBondContact O-N 3.34Å; A340-T344 WeakPolarHBondContact CA-O 3.08Å; A340-T344 PolarHBondContact N-O 3.44Å; T344-S346 PolarHBondContact O-N 3.4Å; T344-L446 HydrophobicContact CG2-CD1 4.46Å; T344-R450 PolarHBondContact OG1-NE 2.82Å
345	P	94	Very high	93.7	Very high	70 Å²	70	29.2 Å²	29.2	46%	0.455	19%	0.187	S	C	.	.			trans	-54.4	118.1	-178.1	-25.8	34.2	0	0	0	110.9	K319 V320	K319-P345 CarbonylContact C-O 3.38Å; K319-P345 WeakPolarHBondContact CA-O 3.41Å; K319-P345 WeakPolarHBondContact CB-O 3.42Å; K319-P345 HydrophobicContact CG-CB 4.27Å; V320-P345 PolarHBondContact N-O 3.12Å
346	S	96.4	Very high	93.2	Very high	17 Å²	17	37.1 Å²	37.1	12%	0.119	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.8	-175.3	102.8	0	0	0	0	113	V320 A336 F339 T344	V320-S346 CarbonylContact O-C 3.58Å; V320-S346 WeakPolarHBondContact O-CA 3.25Å; V320-S346 WeakPolarHBondContact O-CB 3.44Å; A336-S346 VanDerWaalsContact C-OG 3.23Å; A336-S346 WeakPolarHBondContact CA-OG 3.34Å; A336-S346 PolarHBondContact O-OG 3.25Å; F339-S346 WeakPolarHBondContact CB-OG 3.44Å; T344-S346 PolarHBondContact O-N 3.4Å
347	F	96.2	Very high	92.5	Very high	46 Å²	46	39.4 Å²	39.4	20%	0.202	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	161.6	173.9	63.2	-79.1	0	0	0	111.1	K319 V320 V321 V322 V349 M361	K319-F347 HydrophobicContact CB-CD1 4.24Å; K319-F347 HydrophobicContact CB-CE1 3.98Å; K319-F347 HydrophobicContact CD-CD1 3.87Å; K319-F347 HydrophobicContact CD-CE1 3.8Å; K319-F347 HydrophobicContact CG-CE1 4.42Å; V320-F347 PolarHBondContact O-N 2.97Å; V320-F347 VanDerWaalsContact O-N 3.1Å; V321-F347 HydrophobicContact CG1-CE2 4.29Å; V321-F347 HydrophobicContact CG1-CZ 4.35Å; V321-F347 HydrophobicContact CG2-CD1 4.48Å; V321-F347 HydrophobicContact CG2-CE1 3.68Å; V321-F347 HydrophobicContact CG2-CE2 4.34Å; V321-F347 HydrophobicContact CG2-CZ 3.61Å; V322-F347 PolarHBondContact N-O 3.44Å; F347-V349 HydrophobicContact CD2-CG2 3.67Å; F347-V349 HydrophobicContact CE2-CG2 3.31Å; F347-V349 HydrophobicContact CZ-CG2 4.37Å; F347-M361 HydrophobicContact CD2-CE 4.29Å; F347-M361 HydrophobicContact CE2-CB 4.13Å; F347-M361 HydrophobicContact CE2-CE 3.8Å; F347-M361 HydrophobicContact CE2-SD 4.34Å; F347-M361 HydrophobicContact CZ-CB 4.22Å; F347-M361 HydrophobicContact CZ-CE 4.44Å
348	F	97.5	Very high	92.2	Very high	35 Å²	35	39.8 Å²	39.8	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	136.9	177.2	177.2	-94	0	0	0	110.9	V322 G329 R333 A336 H350	V322-F348 CarbonylContact O-C 3.56Å; V322-F348 VanDerWaalsContact O-CA 3.29Å; V322-F348 WeakPolarHBondContact O-CA 3.29Å; V322-F348 VanDerWaalsContact O-CD2 3.24Å; V322-F348 WeakPolarHBondContact O-CD2 3.4Å; G329-F348 WeakPolarHBondContact O-CE2 3.34Å; R333-F348 HydrophobicContact CB-CB 4.33Å; R333-F348 HydrophobicContact CB-CD2 4.19Å; R333-F348 HydrophobicContact CB-CG 4.08Å; R333-F348 HydrophobicContact CG-CB 4.14Å; R333-F348 HydrophobicContact CG-CD1 4.46Å; R333-F348 HydrophobicContact CG-CG 4.22Å; A336-F348 HydrophobicContact CB-CB 4.23Å; F348-H350 HydrophobicContact CE1-CB 4.08Å
349	V	95.8	Very high	91.8	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.024	24%	0.24	C	C	.	.			trans	-122.5	130.7	170.7	177.7	0	0	0	0	109.1	V321 V322 M323 F347 A354 D358	V321-V349 HydrophobicContact CG1-CB 4.04Å; V321-V349 HydrophobicContact CG1-CG2 3.61Å; V322-V349 PolarHBondContact O-N 2.88Å; M323-V349 WeakPolarHBondContact CA-O 3.49Å; M323-V349 VanDerWaalsContact CB-O 3.22Å; M323-V349 WeakPolarHBondContact CB-O 3.34Å; F347-V349 HydrophobicContact CD2-CG2 3.67Å; F347-V349 HydrophobicContact CE2-CG2 3.31Å; F347-V349 HydrophobicContact CZ-CG2 4.37Å; V349-A354 HydrophobicContact CG1-CB 3.8Å; V349-D358 HydrophobicContact CG1-CB 4.24Å
350	H	95.4	Very high	91.3	Very high	65 Å²	65	43.1 Å²	43.1	30%	0.301	28%	0.275	S	S	.	.			trans	-76.3	122.7	174.7	-168.1	-89.9	0	0	0	109.4	M325 F348 G352 E353 A354	M325-H350 PolarHBondContact SD-CE1 3.49Å; F348-H350 HydrophobicContact CE1-CB 4.08Å; H350-G352 VanDerWaalsContact C-N 3.26Å; H350-G352 PolarHBondContact ND1-N 3.38Å; H350-G352 PolarHBondContact O-N 3.11Å; H350-E353 HydrophobicContact CB-CB 4.3Å; H350-E353 HydrophobicContact CB-CG 4.01Å; H350-E353 PolarHBondContact O-N 3.31Å; H350-A354 PolarHBondContact O-N 3.22Å
351	P	94.2	Very high	91.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-29.5	-172.6	22.1	-30.3	0	0	0	113.1	G324 M325 A354 A355 E379 I380 L383	G324-P351 WeakPolarHBondContact O-CD 3.5Å; M325-P351 HydrophobicContact CG-CG 3.68Å; M325-P351 HydrophobicContact SD-CG 3.66Å; P351-A354 PolarHBondContact O-N 3.3Å; P351-A355 PolarHBondContact O-N 2.94Å; P351-E379 HydrophobicContact CB-CB 4.24Å; P351-E379 HydrophobicContact CG-CB 4.45Å; P351-I380 HydrophobicContact CB-CG1 3.9Å; P351-I380 HydrophobicContact CG-CG1 3.96Å; P351-L383 HydrophobicContact CB-CD1 3.94Å
352	G	90.8	Very high	91.4	Very high	16 Å²	16	45.5 Å²	45.5	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-39	172.1	0	0	0	0	0	113.5	H350 H356	H350-G352 VanDerWaalsContact C-N 3.26Å; H350-G352 PolarHBondContact ND1-N 3.38Å; H350-G352 PolarHBondContact O-N 3.11Å; G352-H356 PolarHBondContact O-ND1 3.42Å
353	E	90.3	Very high	91.6	Very high	109 Å²	109	47.9 Å²	47.9	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-76.5	-35.4	176.8	-59.9	-58.1	141.2	0	0	110.7	H350 A355 H356 G357 D358	H350-E353 HydrophobicContact CB-CB 4.3Å; H350-E353 HydrophobicContact CB-CG 4.01Å; H350-E353 PolarHBondContact O-N 3.31Å; E353-A355 VanDerWaalsContact C-N 3.29Å; E353-A355 PolarHBondContact O-N 2.95Å; E353-H356 CarbonylContact O-C 3.47Å; E353-H356 WeakPolarHBondContact O-CA 3.42Å; E353-H356 PolarHBondContact O-N 3.05Å; E353-G357 PolarHBondContact O-N 2.88Å; E353-D358 HydrophobicContact CB-CB 4.34Å; E353-D358 WeakPolarHBondContact CB-OD2 3.46Å; E353-D358 PolarHBondContact O-N 2.87Å; E353-D358 VanDerWaalsContact O-N 3.1Å
354	A	91.9	Very high	91.8	Very high	3 Å²	3	50.8 Å²	50.8	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-43.4	174.2	0	0	0	0	0	111.7	V349 H350 P351 H356 G357 L359 L383	V349-A354 HydrophobicContact CG1-CB 3.8Å; H350-A354 PolarHBondContact O-N 3.22Å; P351-A354 PolarHBondContact O-N 3.3Å; A354-H356 PolarHBondContact O-N 2.99Å; A354-G357 PolarHBondContact O-N 3.1Å; A354-L359 HydrophobicContact CB-CB 4.32Å; A354-L359 HydrophobicContact CB-CD1 4.17Å; A354-L359 WeakPolarHBondContact O-CB 2.83Å; A354-L359 PolarHBondContact O-N 3.31Å; A354-L383 HydrophobicContact CB-CD1 3.88Å; A354-L383 HydrophobicContact CB-CD2 4.48Å
355	A	87.7	Confident	91.9	Very high	55 Å²	55	56.5 Å²	56.5	46%	0.455	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.7	175.5	0	0	0	0	0	113.4	P351 E353 L383	P351-A355 PolarHBondContact O-N 2.94Å; E353-A355 VanDerWaalsContact C-N 3.29Å; E353-A355 PolarHBondContact O-N 2.95Å; A355-L383 HydrophobicContact CB-CD2 4.08Å
356	H	87.7	Confident	92	Very high	167 Å²	167	53.5 Å²	53.5	77%	0.773	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	9.2	-178	-67.2	88.8	0	0	0	114.2	G352 E353 A354	G352-H356 PolarHBondContact O-ND1 3.42Å; E353-H356 CarbonylContact O-C 3.47Å; E353-H356 WeakPolarHBondContact O-CA 3.42Å; E353-H356 PolarHBondContact O-N 3.05Å; A354-H356 PolarHBondContact O-N 2.99Å
357	G	82.8	Confident	92.1	Very high	52 Å²	52	52.9 Å²	52.9	54%	0.536	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	150.4	-33.4	170.8	0	0	0	0	0	114.9	E353 A354 L359 G360	E353-G357 PolarHBondContact O-N 2.88Å; A354-G357 PolarHBondContact O-N 3.1Å; G357-L359 PolarHBondContact O-N 3.42Å; G357-G360 PolarHBondContact O-N 2.77Å; G357-G360 VanDerWaalsContact O-N 3.16Å
358	D	88.8	Confident	92.2	Very high	71 Å²	71	50.7 Å²	50.7	38%	0.38	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-69.8	-9.6	-171.9	-73.7	-0.6	0	0	0	113.5	V349 E353 G360 M361	V349-D358 HydrophobicContact CG1-CB 4.24Å; E353-D358 HydrophobicContact CB-CB 4.34Å; E353-D358 WeakPolarHBondContact CB-OD2 3.46Å; E353-D358 PolarHBondContact O-N 2.87Å; E353-D358 VanDerWaalsContact O-N 3.1Å; D358-G360 PolarHBondContact O-N 3.23Å; D358-G360 VanDerWaalsContact O-N 3.11Å; D358-M361 VanDerWaalsContact O-CB 3.26Å; D358-M361 WeakPolarHBondContact O-CB 3.48Å; D358-M361 VanDerWaalsContact O-CG 3.31Å; D358-M361 WeakPolarHBondContact O-CG 3.38Å; D358-M361 PolarHBondContact O-N 3.4Å
359	L	87.7	Confident	92.2	Very high	24 Å²	24	49 Å²	49	13%	0.126	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-60.8	-21.7	173	-159.5	73	0	0	0	112	A354 G357 M361 V362 L383 V386 L387	A354-L359 HydrophobicContact CB-CB 4.32Å; A354-L359 HydrophobicContact CB-CD1 4.17Å; A354-L359 WeakPolarHBondContact O-CB 2.83Å; A354-L359 PolarHBondContact O-N 3.31Å; G357-L359 PolarHBondContact O-N 3.42Å; L359-M361 PolarHBondContact O-N 3.36Å; L359-M361 VanDerWaalsContact O-N 3.15Å; L359-V362 HydrophobicContact CD1-CG2 4.31Å; L359-V362 WeakPolarHBondContact O-CB 3.49Å; L359-V362 PolarHBondContact O-N 2.9Å; L359-L383 HydrophobicContact CD1-CD2 4.24Å; L359-L383 HydrophobicContact CD2-CD2 4.32Å; L359-V386 HydrophobicContact CD2-CB 3.97Å; L359-V386 HydrophobicContact CD2-CG1 3.51Å; L359-L387 HydrophobicContact CD1-CD2 4.13Å
360	G	86.7	Confident	92.3	Very high	72 Å²	72	48.9 Å²	48.9	74%	0.742	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-61.3	-15.3	171.3	0	0	0	0	0	114.3	G357 D358 V362	G357-G360 PolarHBondContact O-N 2.77Å; G357-G360 VanDerWaalsContact O-N 3.16Å; D358-G360 PolarHBondContact O-N 3.23Å; D358-G360 VanDerWaalsContact O-N 3.11Å; G360-V362 VanDerWaalsContact C-N 3.26Å
361	M	88.4	Confident	92.5	Very high	104 Å²	104	45.8 Å²	45.8	51%	0.512	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-74.5	-15.5	171.7	-59.5	-172.8	73.2	0	0	113.1	F347 D358 L359	F347-M361 HydrophobicContact CD2-CE 4.29Å; F347-M361 HydrophobicContact CE2-CB 4.13Å; F347-M361 HydrophobicContact CE2-CE 3.8Å; F347-M361 HydrophobicContact CE2-SD 4.34Å; F347-M361 HydrophobicContact CZ-CB 4.22Å; F347-M361 HydrophobicContact CZ-CE 4.44Å; D358-M361 VanDerWaalsContact O-CB 3.26Å; D358-M361 WeakPolarHBondContact O-CB 3.48Å; D358-M361 VanDerWaalsContact O-CG 3.31Å; D358-M361 WeakPolarHBondContact O-CG 3.38Å; D358-M361 PolarHBondContact O-N 3.4Å; L359-M361 PolarHBondContact O-N 3.36Å; L359-M361 VanDerWaalsContact O-N 3.15Å
362	V	94.3	Very high	92.6	Very high	10 Å²	10	46 Å²	46	6%	0.061	28%	0.28	C	S	.	.			trans	-95.8	127.6	-179	-171.6	0	0	0	0	109.9	V321 L359 G360 D366 V368 L387 V392	V321-V362 HydrophobicContact CG1-CG2 4.17Å; V321-V362 HydrophobicContact CG2-CG2 4.35Å; L359-V362 HydrophobicContact CD1-CG2 4.31Å; L359-V362 WeakPolarHBondContact O-CB 3.49Å; L359-V362 PolarHBondContact O-N 2.9Å; G360-V362 VanDerWaalsContact C-N 3.26Å; V362-D366 HydrophobicContact CG1-CB 4.4Å; V362-V368 HydrophobicContact CG1-CG2 3.91Å; V362-L387 HydrophobicContact CG1-CD2 4.24Å; V362-V392 HydrophobicContact CG1-CG1 4.07Å; V362-V392 HydrophobicContact CG1-CG2 4.11Å
363	T	93.6	Very high	92.8	Very high	61 Å²	61	47.9 Å²	47.9	37%	0.374	29%	0.286	S	S	.	.			trans	-114.2	160.1	-179.8	75	0	0	0	0	111.2	Q365 D366	T363-Q365 PolarHBondContact O-N 2.86Å; T363-Q365 PolarHBondContact OG1-N 2.93Å; T363-D366 WeakPolarHBondContact CA-OD2 3.35Å; T363-D366 WeakPolarHBondContact CB-OD2 3.38Å; T363-D366 PolarHBondContact N-OD2 3.44Å; T363-D366 WeakPolarHBondContact O-CB 3.5Å; T363-D366 PolarHBondContact O-N 3.37Å; T363-D366 PolarHBondContact OG1-OD1 2.97Å; T363-D366 PolarHBondContact OG1-OD2 3.15Å
364	P	94.1	Very high	93	Very high	83 Å²	83	44.7 Å²	44.7	54%	0.539	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-11.6	176.2	-24.8	35.4	0	0	0	115.4
365	Q	95.5	Very high	93.2	Very high	122 Å²	122	44.6 Å²	44.6	57%	0.57	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-8.1	177	-60.4	-159.3	14.1	0	0	113.4	G318 T363	G318-Q365 WeakPolarHBondContact CA-O 3.47Å; G318-Q365 PolarHBondContact N-O 2.93Å; T363-Q365 PolarHBondContact O-N 2.86Å; T363-Q365 PolarHBondContact OG1-N 2.93Å
366	D	97.4	Very high	93.5	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	27%	0.272	C	S	.	.	S	Bend	trans	-85.5	167	-177.6	-60.7	-35.3	0	0	0	111.5	G318 K319 V321 V362 T363 P393	G318-D366 VanDerWaalsContact CA-OD1 3.25Å; G318-D366 WeakPolarHBondContact CA-OD1 3.36Å; K319-D366 PolarHBondContact N-OD1 3Å; K319-D366 CarbonylContact O-C 3.59Å; K319-D366 VanDerWaalsContact O-CA 3.24Å; K319-D366 WeakPolarHBondContact O-CA 3.2Å; K319-D366 VanDerWaalsContact O-CB 3.23Å; K319-D366 WeakPolarHBondContact O-CB 3.36Å; V321-D366 HydrophobicContact CG2-CB 4.26Å; V362-D366 HydrophobicContact CG1-CB 4.4Å; T363-D366 WeakPolarHBondContact CA-OD2 3.35Å; T363-D366 WeakPolarHBondContact CB-OD2 3.38Å; T363-D366 PolarHBondContact N-OD2 3.44Å; T363-D366 WeakPolarHBondContact O-CB 3.5Å; T363-D366 PolarHBondContact O-N 3.37Å; T363-D366 PolarHBondContact OG1-OD1 2.97Å; T363-D366 PolarHBondContact OG1-OD2 3.15Å; D366-P393 WeakPolarHBondContact O-CD 3.36Å
367	V	98	Very high	93.8	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.9	168.8	173.6	0	0	0	0	108.2	M313 C316 K319 V320 V321 P393 I395	M313-V367 HydrophobicContact CG-CG1 4.41Å; C316-V367 HydrophobicContact CB-CG2 3.86Å; K319-V367 PolarHBondContact O-N 3.13Å; V320-V367 CarbonylContact C-O 3.57Å; V320-V367 WeakPolarHBondContact CA-O 3.44Å; V321-V367 PolarHBondContact N-O 3.01Å; V367-P393 HydrophobicContact CG2-CB 4.19Å; V367-P393 HydrophobicContact CG2-CG 4.35Å; V367-I395 HydrophobicContact CG1-CD1 3.75Å; V367-I395 HydrophobicContact CG1-CG1 4.14Å
368	V	98	Very high	94.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	131.6	177.9	171.8	0	0	0	0	110.4	V321 M323 V362 L387 V392 P393 L394 I395	V321-V368 HydrophobicContact CB-CG2 4.16Å; V321-V368 CarbonylContact O-C 3.45Å; V321-V368 WeakPolarHBondContact O-CA 3.11Å; M323-V368 HydrophobicContact CE-CG1 3.59Å; M323-V368 HydrophobicContact CE-CG2 4.34Å; M323-V368 HydrophobicContact CG-CG1 4.19Å; M323-V368 HydrophobicContact SD-CG1 3.82Å; V362-V368 HydrophobicContact CG1-CG2 3.91Å; V368-L387 HydrophobicContact CG1-CD1 4.14Å; V368-L387 HydrophobicContact CG2-CD2 4.02Å; V368-V392 HydrophobicContact CB-CG1 4.38Å; V368-V392 HydrophobicContact CG2-CG1 3.7Å; V368-P393 PolarHBondContact N-O 3.22Å; V368-L394 HydrophobicContact CB-CD1 4.07Å; V368-L394 HydrophobicContact CG1-CD1 3.72Å; V368-I395 PolarHBondContact O-N 3.43Å
369	I	98.3	Very high	94.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.4	167	-59.6	176.9	0	0	0	108.4	M313 V320 V321 V322 M323 F339 I371 I395 I397	M313-I369 HydrophobicContact CE-CD1 3.78Å; M313-I369 HydrophobicContact SD-CD1 3.82Å; V320-I369 HydrophobicContact CG1-CD1 3.62Å; V320-I369 HydrophobicContact CG1-CG1 4.01Å; V321-I369 PolarHBondContact O-N 2.7Å; V322-I369 CarbonylContact C-O 3.51Å; V322-I369 WeakPolarHBondContact CA-O 3.32Å; V322-I369 HydrophobicContact CG1-CB 4.46Å; V322-I369 HydrophobicContact CG1-CG2 4.5Å; V322-I369 HydrophobicContact CG2-CB 4.45Å; M323-I369 PolarHBondContact N-O 2.99Å; F339-I369 HydrophobicContact CE2-CD1 3.81Å; F339-I369 HydrophobicContact CZ-CD1 4.24Å; I369-I371 HydrophobicContact CG2-CG1 4.21Å; I369-I395 CarbonylContact C-O 3.59Å; I369-I395 VanDerWaalsContact CA-O 3.31Å; I369-I395 WeakPolarHBondContact CA-O 3.22Å; I369-I395 HydrophobicContact CG1-CB 4.19Å; I369-I395 HydrophobicContact CG1-CD1 4.4Å; I369-I397 HydrophobicContact CG2-CD1 3.83Å; I369-I397 HydrophobicContact CG2-CG1 4.06Å
370	A	97.8	Very high	95	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.4	177.6	0	0	0	0	0	111.2	M323 I380 L394 I395 C396 I397 M405	M323-A370 HydrophobicContact CG-CB 4.03Å; A370-I380 HydrophobicContact CB-CG2 3.8Å; A370-L394 HydrophobicContact CB-CD1 4.15Å; A370-I395 PolarHBondContact N-O 3.15Å; A370-C396 WeakPolarHBondContact O-CA 3.48Å; A370-I397 PolarHBondContact O-N 3.23Å; A370-M405 HydrophobicContact CB-CE 3.69Å
371	I	98.2	Very high	95.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.2	-172.8	-51.5	176.5	0	0	0	110.2	V322 M323 M335 I369 I380 I397 T435	V322-I371 HydrophobicContact CG1-CD1 3.86Å; V322-I371 HydrophobicContact CG1-CG1 4.49Å; M323-I371 PolarHBondContact O-N 3.36Å; M335-I371 HydrophobicContact CE-CD1 3.56Å; M335-I371 HydrophobicContact SD-CD1 4.23Å; I369-I371 HydrophobicContact CG2-CG1 4.21Å; I371-I380 WeakPolarHBondContact O-CD1 3.43Å; I371-I397 HydrophobicContact CG1-CB 4.4Å; I371-I397 HydrophobicContact CG1-CD1 4.39Å; I371-T435 HydrophobicContact CD1-CG2 4.38Å; I371-T435 HydrophobicContact CG2-CG2 3.54Å
372	S	97	Very high	95.7	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.028	21%	0.214	C	C	.	.			trans	-158.6	123.4	170.5	178.8	0	0	0	0	110.6	S374 G375 S377 I397 T398 M405	S372-S374 PolarHBondContact O-N 3.45Å; S372-S374 PolarHBondContact OG-OG 3.38Å; S372-G375 PolarHBondContact O-N 2.91Å; S372-G375 VanDerWaalsContact O-N 3.14Å; S372-G375 PolarHBondContact OG-N 3.29Å; S372-G375 VanDerWaalsContact OG-N 3.17Å; S372-S377 PolarHBondContact OG-OG 2.88Å; S372-I397 PolarHBondContact N-O 3.32Å; S372-T398 WeakPolarHBondContact O-CA 3.38Å; S372-T398 WeakPolarHBondContact O-CB 3.43Å; S372-T398 WeakPolarHBondContact O-CG2 3.48Å; S372-M405 VanDerWaalsContact CB-SD 3.51Å
373	N	94.8	Very high	95.8	Very high	56 Å²	56	36 Å²	36	30%	0.299	21%	0.213	S	C	.	.	S	Bend	trans	-60.3	-45.8	179.5	-174	27.7	0	0	0	112	G375 G399	N373-G375 VanDerWaalsContact C-N 3.31Å; N373-G399 WeakPolarHBondContact O-CA 3.36Å; N373-G399 PolarHBondContact O-N 3.31Å
374	S	93.8	Very high	95.9	Very high	42 Å²	42	33.9 Å²	33.9	29%	0.294	20%	0.199	S	C	.	.	S	Bend	trans	-71.1	-29.9	175.8	63.8	0	0	0	0	112.5	S372 E376 S403	S372-S374 PolarHBondContact O-N 3.45Å; S372-S374 PolarHBondContact OG-OG 3.38Å; S374-E376 PolarHBondContact O-N 3.23Å; S374-E376 PolarHBondContact OG-N 3.22Å; S374-S403 WeakPolarHBondContact O-CB 3.44Å
375	G	95.7	Very high	95.9	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	71	18.6	-173.1	0	0	0	0	0	113.9	S372 N373 S403 M405	S372-G375 PolarHBondContact O-N 2.91Å; S372-G375 VanDerWaalsContact O-N 3.14Å; S372-G375 PolarHBondContact OG-N 3.29Å; S372-G375 VanDerWaalsContact OG-N 3.17Å; N373-G375 VanDerWaalsContact C-N 3.31Å; G375-S403 WeakPolarHBondContact CA-OG 3.41Å; G375-S403 WeakPolarHBondContact O-CB 3.32Å; G375-S403 PolarHBondContact O-OG 3.28Å; G375-M405 WeakPolarHBondContact O-CB 3.4Å; G375-M405 VanDerWaalsContact O-CG 3.26Å; G375-M405 WeakPolarHBondContact O-CG 3.49Å; G375-M405 PolarHBondContact O-N 3.41Å; G375-M405 VanDerWaalsContact O-N 3.09Å
376	E	95.7	Very high	95.8	Very high	87 Å²	87	31.4 Å²	31.4	41%	0.407	19%	0.192	S	C	.	.			trans	-127.5	17.9	-176.2	-59.2	-59.1	159.3	0	0	112.6	S374 S378 S403 S404	S374-E376 PolarHBondContact O-N 3.23Å; S374-E376 PolarHBondContact OG-N 3.22Å; E376-S378 PolarHBondContact O-N 3.36Å; E376-S378 VanDerWaalsContact O-N 3.14Å; E376-S403 VanDerWaalsContact OE1-CA 3.28Å; E376-S403 WeakPolarHBondContact OE1-CA 3.46Å; E376-S403 WeakPolarHBondContact OE1-CB 3.43Å; E376-S404 PolarHBondContact OE1-N 3.28Å; E376-S404 PolarHBondContact OE1-OG 3.15Å; E376-S404 WeakPolarHBondContact OE2-CB 3.45Å; E376-S404 PolarHBondContact OE2-OG 3.07Å
377	S	94.1	Very high	95.7	Very high	25 Å²	25	31.2 Å²	31.2	18%	0.175	19%	0.191	C	C	.	.			trans	-63	115.8	178.8	-69.1	0	0	0	0	111	S372 E379 I380 T381	S372-S377 PolarHBondContact OG-OG 2.88Å; S377-E379 VanDerWaalsContact C-N 3.28Å; S377-E379 PolarHBondContact O-N 3.02Å; S377-I380 PolarHBondContact O-N 3.49Å; S377-T381 PolarHBondContact O-N 3.34Å; S377-T381 PolarHBondContact O-OG1 3.33Å; S377-T381 VanDerWaalsContact O-OG1 3.04Å
378	S	94	Very high	95.6	Very high	76 Å²	76	34.7 Å²	34.7	53%	0.531	21%	0.206	S	C	.	.	H	α-helix	trans	-55	-39.4	-175.7	34.8	0	0	0	0	113.8	E376 I380 T381 A382	E376-S378 PolarHBondContact O-N 3.36Å; E376-S378 VanDerWaalsContact O-N 3.14Å; S378-I380 VanDerWaalsContact C-N 3.28Å; S378-I380 PolarHBondContact O-N 3.4Å; S378-T381 VanDerWaalsContact CA-OG1 3.31Å; S378-T381 WeakPolarHBondContact CA-OG1 3.46Å; S378-T381 PolarHBondContact O-OG1 3.08Å; S378-A382 VanDerWaalsContact O-CB 3.24Å; S378-A382 WeakPolarHBondContact O-CB 3.39Å; S378-A382 PolarHBondContact O-N 2.98Å
379	E	94.3	Very high	95.4	Very high	69 Å²	69	45 Å²	45	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-33.9	-179.4	-61.8	81.3	175.9	0	0	111.4	M325 P351 S377 L383	M325-E379 HydrophobicContact CE-CG 4.02Å; M325-E379 HydrophobicContact CG-CB 4.09Å; M325-E379 HydrophobicContact CG-CG 4.26Å; M325-E379 HydrophobicContact SD-CB 4.32Å; M325-E379 HydrophobicContact SD-CG 4.17Å; P351-E379 HydrophobicContact CB-CB 4.24Å; P351-E379 HydrophobicContact CG-CB 4.45Å; S377-E379 VanDerWaalsContact C-N 3.28Å; S377-E379 PolarHBondContact O-N 3.02Å; E379-L383 WeakPolarHBondContact O-CG 3.33Å
380	I	95.6	Very high	95.1	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-84.1	-45.7	178.9	-60.9	179.4	0	0	0	110.2	P351 A370 I371 S377 S378 A382 L383 I384 M405	P351-I380 HydrophobicContact CB-CG1 3.9Å; P351-I380 HydrophobicContact CG-CG1 3.96Å; A370-I380 HydrophobicContact CB-CG2 3.8Å; I371-I380 WeakPolarHBondContact O-CD1 3.43Å; S377-I380 PolarHBondContact O-N 3.49Å; S378-I380 VanDerWaalsContact C-N 3.28Å; S378-I380 PolarHBondContact O-N 3.4Å; I380-A382 PolarHBondContact O-N 3.22Å; I380-L383 WeakPolarHBondContact O-CB 3.48Å; I380-L383 PolarHBondContact O-N 2.91Å; I380-I384 PolarHBondContact O-N 2.63Å; I380-M405 HydrophobicContact CB-SD 4.12Å; I380-M405 HydrophobicContact CD1-CE 4.18Å; I380-M405 HydrophobicContact CD1-SD 4.35Å; I380-M405 HydrophobicContact CG2-CE 3.71Å; I380-M405 HydrophobicContact CG2-CG 4.38Å; I380-M405 HydrophobicContact CG2-SD 3.81Å
381	T	95.6	Very high	95	Very high	41 Å²	41	55.8 Å²	55.8	25%	0.252	30%	0.297	S	S	.	.	H	α-helix	trans	-62.3	-30.8	-179.3	46.6	0	0	0	0	112.2	S377 S378 L383 I384 M405	S377-T381 PolarHBondContact O-N 3.34Å; S377-T381 PolarHBondContact O-OG1 3.33Å; S377-T381 VanDerWaalsContact O-OG1 3.04Å; S378-T381 VanDerWaalsContact CA-OG1 3.31Å; S378-T381 WeakPolarHBondContact CA-OG1 3.46Å; S378-T381 PolarHBondContact O-OG1 3.08Å; T381-L383 VanDerWaalsContact C-N 3.26Å; T381-L383 PolarHBondContact O-N 3.23Å; T381-I384 HydrophobicContact CG2-CD1 4.24Å; T381-I384 PolarHBondContact O-N 3.45Å; T381-M405 HydrophobicContact CG2-CG 3.88Å
382	A	94.2	Very high	94.9	Very high	66 Å²	66	55.9 Å²	55.9	55%	0.545	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.2	172.1	0	0	0	0	0	114	S378 I380	S378-A382 VanDerWaalsContact O-CB 3.24Å; S378-A382 WeakPolarHBondContact O-CB 3.39Å; S378-A382 PolarHBondContact O-N 2.98Å; I380-A382 PolarHBondContact O-N 3.22Å
383	L	95.2	Very high	94.9	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.037	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-24.1	-178.1	-61.4	173.1	0	0	0	113.2	M323 P351 A354 A355 L359 E379 I380 T381 P385 V386 L387	M323-L383 HydrophobicContact SD-CD1 4.4Å; P351-L383 HydrophobicContact CB-CD1 3.94Å; A354-L383 HydrophobicContact CB-CD1 3.88Å; A354-L383 HydrophobicContact CB-CD2 4.48Å; A355-L383 HydrophobicContact CB-CD2 4.08Å; L359-L383 HydrophobicContact CD1-CD2 4.24Å; L359-L383 HydrophobicContact CD2-CD2 4.32Å; E379-L383 WeakPolarHBondContact O-CG 3.33Å; I380-L383 WeakPolarHBondContact O-CB 3.48Å; I380-L383 PolarHBondContact O-N 2.91Å; T381-L383 VanDerWaalsContact C-N 3.26Å; T381-L383 PolarHBondContact O-N 3.23Å; L383-P385 VanDerWaalsContact C-CD 3.49Å; L383-V386 PolarHBondContact O-N 3.17Å; L383-L387 PolarHBondContact O-N 3.24Å
384	I	96.1	Very high	95	Very high	18 Å²	18	54.7 Å²	54.7	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-52.1	-46.9	-175.4	-67.6	176.3	0	0	0	113.3	I380 T381 V386 L387 K388 L394 M405 A408	I380-I384 PolarHBondContact O-N 2.63Å; T381-I384 HydrophobicContact CG2-CD1 4.24Å; T381-I384 PolarHBondContact O-N 3.45Å; I384-V386 PolarHBondContact O-N 3.27Å; I384-L387 PolarHBondContact O-N 2.95Å; I384-K388 HydrophobicContact CG2-CG 4.32Å; I384-K388 WeakPolarHBondContact O-CG 3.26Å; I384-K388 PolarHBondContact O-N 3.39Å; I384-L394 HydrophobicContact CG1-CD2 4.2Å; I384-L394 HydrophobicContact CG2-CD2 4.43Å; I384-M405 HydrophobicContact CD1-CG 4.14Å; I384-A408 HydrophobicContact CD1-CB 4.02Å; I384-A408 HydrophobicContact CG2-CB 3.71Å
385	P	94.8	Very high	95.3	Very high	86 Å²	86	52.7 Å²	52.7	56%	0.558	28%	0.278	S	S	*	.	H	α-helix	trans	-60.2	-36.1	-179.5	-23.9	34.8	0	0	0	112.9	L383 R389	L383-P385 VanDerWaalsContact C-CD 3.49Å; P385-R389 WeakPolarHBondContact O-CB 3.44Å; P385-R389 PolarHBondContact O-N 3.47Å
386	V	94	Very high	95.4	Very high	67 Å²	67	52.7 Å²	52.7	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-72.4	-45.4	179.6	-174.1	0	0	0	0	110.3	L359 L383 I384 K388 R389 L390	L359-V386 HydrophobicContact CD2-CB 3.97Å; L359-V386 HydrophobicContact CD2-CG1 3.51Å; L383-V386 PolarHBondContact O-N 3.17Å; I384-V386 PolarHBondContact O-N 3.27Å; V386-K388 VanDerWaalsContact C-N 3.33Å; V386-K388 PolarHBondContact O-N 2.96Å; V386-R389 PolarHBondContact O-N 3.07Å; V386-R389 VanDerWaalsContact O-N 3.15Å; V386-L390 HydrophobicContact CG1-CD1 4.17Å; V386-L390 WeakPolarHBondContact O-CG 3.22Å; V386-L390 PolarHBondContact O-N 3.47Å
387	L	95.3	Very high	95.5	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-44.7	176.2	-68.2	175.1	0	0	0	111.9	L359 V362 V368 L383 I384 R389 L390 H391 V392 L394	L359-L387 HydrophobicContact CD1-CD2 4.13Å; V362-L387 HydrophobicContact CG1-CD2 4.24Å; V368-L387 HydrophobicContact CG1-CD1 4.14Å; V368-L387 HydrophobicContact CG2-CD2 4.02Å; L383-L387 PolarHBondContact O-N 3.24Å; I384-L387 PolarHBondContact O-N 2.95Å; L387-R389 PolarHBondContact O-N 3.34Å; L387-L390 PolarHBondContact O-N 2.91Å; L387-H391 PolarHBondContact O-N 2.79Å; L387-V392 HydrophobicContact CD2-CB 4.48Å; L387-V392 PolarHBondContact O-N 3.4Å; L387-V392 VanDerWaalsContact O-N 3.11Å; L387-L394 HydrophobicContact CD1-CD1 4.24Å
388	K	94.8	Very high	95.7	Very high	77 Å²	77	47.4 Å²	47.4	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-62.8	-41.4	175.6	-74.3	-72.3	-176.6	177.4	0	112.1	I384 V386 L390 H391 A408 D410	I384-K388 HydrophobicContact CG2-CG 4.32Å; I384-K388 WeakPolarHBondContact O-CG 3.26Å; I384-K388 PolarHBondContact O-N 3.39Å; V386-K388 VanDerWaalsContact C-N 3.33Å; V386-K388 PolarHBondContact O-N 2.96Å; K388-L390 VanDerWaalsContact C-N 3.31Å; K388-L390 PolarHBondContact O-N 2.94Å; K388-H391 WeakPolarHBondContact O-CA 3.24Å; K388-H391 PolarHBondContact O-N 3.35Å; K388-A408 WeakPolarHBondContact CE-O 3.35Å; K388-A408 PolarHBondContact NZ-O 3.43Å; K388-D410 IonicContact NZ-OD1 2.88Å; K388-D410 PolarHBondContact NZ-OD1 3.26Å; K388-D410 IonicContact NZ-OD2 3.02Å
389	R	94	Very high	95.7	Very high	217 Å²	217	44 Å²	44	82%	0.819	23%	0.228	S	C	*	.	H	α-helix	trans	-66.5	-33.6	178	-170.3	178.3	-114	-176.7	-2.4	112.5	P385 V386 L387 H391	P385-R389 WeakPolarHBondContact O-CB 3.44Å; P385-R389 PolarHBondContact O-N 3.47Å; V386-R389 PolarHBondContact O-N 3.07Å; V386-R389 VanDerWaalsContact O-N 3.15Å; L387-R389 PolarHBondContact O-N 3.34Å; R389-H391 PolarHBondContact O-CE1 2.97Å; R389-H391 PolarHBondContact O-N 3.01Å; R389-H391 PolarHBondContact O-ND1 3Å
390	L	93.1	Very high	95.8	Very high	66 Å²	66	48.1 Å²	48.1	35%	0.346	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-4.4	172.4	-68.4	171.9	0	0	0	113.1	V386 L387 K388 V392	V386-L390 HydrophobicContact CG1-CD1 4.17Å; V386-L390 WeakPolarHBondContact O-CG 3.22Å; V386-L390 PolarHBondContact O-N 3.47Å; L387-L390 PolarHBondContact O-N 2.91Å; K388-L390 VanDerWaalsContact C-N 3.31Å; K388-L390 PolarHBondContact O-N 2.94Å; L390-V392 HydrophobicContact CB-CG2 3.73Å; L390-V392 PolarHBondContact O-N 2.76Å
391	H	94.5	Very high	95.6	Very high	161 Å²	161	51.5 Å²	51.5	75%	0.745	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	31	-175.5	-56	77.1	0	0	0	113	L387 K388 R389 P393	L387-H391 PolarHBondContact O-N 2.79Å; K388-H391 WeakPolarHBondContact O-CA 3.24Å; K388-H391 PolarHBondContact O-N 3.35Å; R389-H391 PolarHBondContact O-CE1 2.97Å; R389-H391 PolarHBondContact O-N 3.01Å; R389-H391 PolarHBondContact O-ND1 3Å; H391-P393 WeakPolarHBondContact O-CD 3.25Å
392	V	96.2	Very high	95.6	Very high	3 Å²	3	56 Å²	56	2%	0.018	28%	0.281	C	S	.	.			trans	-78.6	122.2	176.1	179.9	0	0	0	0	108.3	V362 V368 L387 L390 L394	V362-V392 HydrophobicContact CG1-CG1 4.07Å; V362-V392 HydrophobicContact CG1-CG2 4.11Å; V368-V392 HydrophobicContact CB-CG1 4.38Å; V368-V392 HydrophobicContact CG2-CG1 3.7Å; L387-V392 HydrophobicContact CD2-CB 4.48Å; L387-V392 PolarHBondContact O-N 3.4Å; L387-V392 VanDerWaalsContact O-N 3.11Å; L390-V392 HydrophobicContact CB-CG2 3.73Å; L390-V392 PolarHBondContact O-N 2.76Å; V392-L394 PolarHBondContact O-N 3.11Å
393	P	97.3	Very high	95.7	Very high	31 Å²	31	53 Å²	53	20%	0.201	26%	0.256	C	S	.	.			trans	-56.7	128.9	173.3	-23.1	31.7	0	0	0	112	K312 D366 V367 V368 H391 D410	K312-P393 HydrophobicContact CD-CB 4.1Å; D366-P393 WeakPolarHBondContact O-CD 3.36Å; V367-P393 HydrophobicContact CG2-CB 4.19Å; V367-P393 HydrophobicContact CG2-CG 4.35Å; V368-P393 PolarHBondContact N-O 3.22Å; H391-P393 WeakPolarHBondContact O-CD 3.25Å; P393-D410 WeakPolarHBondContact CA-OD2 3.31Å
394	L	97.8	Very high	95.8	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.1	-176.3	179.1	62.7	0	0	0	111.2	V368 A370 I384 L387 V392 D410 V411	V368-L394 HydrophobicContact CB-CD1 4.07Å; V368-L394 HydrophobicContact CG1-CD1 3.72Å; A370-L394 HydrophobicContact CB-CD1 4.15Å; I384-L394 HydrophobicContact CG1-CD2 4.2Å; I384-L394 HydrophobicContact CG2-CD2 4.43Å; L387-L394 HydrophobicContact CD1-CD1 4.24Å; V392-L394 PolarHBondContact O-N 3.11Å; L394-D410 PolarHBondContact N-OD2 3Å; L394-D410 PolarHBondContact O-N 2.89Å; L394-V411 PolarHBondContact O-N 3.05Å
395	I	98.3	Very high	95.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.8	170.4	-56.2	174.4	0	0	0	107.7	A309 M313 V367 V368 I369 A370 V411 L413	A309-I395 HydrophobicContact CB-CD1 4.01Å; A309-I395 HydrophobicContact CB-CG2 4.32Å; M313-I395 HydrophobicContact CG-CD1 3.95Å; M313-I395 HydrophobicContact SD-CD1 4.29Å; V367-I395 HydrophobicContact CG1-CD1 3.75Å; V367-I395 HydrophobicContact CG1-CG1 4.14Å; V368-I395 PolarHBondContact O-N 3.43Å; I369-I395 CarbonylContact C-O 3.59Å; I369-I395 VanDerWaalsContact CA-O 3.31Å; I369-I395 WeakPolarHBondContact CA-O 3.22Å; I369-I395 HydrophobicContact CG1-CB 4.19Å; I369-I395 HydrophobicContact CG1-CD1 4.4Å; A370-I395 PolarHBondContact N-O 3.15Å; I395-V411 VanDerWaalsContact CA-O 3.32Å; I395-V411 WeakPolarHBondContact CA-O 3.35Å; I395-V411 HydrophobicContact CG1-CB 4.27Å; I395-L413 HydrophobicContact CG2-CD1 4.12Å; I395-L413 HydrophobicContact CG2-CG 4.28Å
396	C	98.2	Very high	96	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.2	176	-70.5	0	0	0	0	110.9	A370 T398 M405 A409 V411 H412 L413	A370-C396 WeakPolarHBondContact O-CA 3.48Å; C396-T398 HydrophobicContact CB-CG2 4.34Å; C396-M405 HydrophobicContact CB-CB 4.4Å; C396-M405 HydrophobicContact CB-CE 4.44Å; C396-M405 PolarHBondContact SG-O 3.07Å; C396-A409 HydrophobicContact CB-CB 3.65Å; C396-V411 PolarHBondContact N-O 3.31Å; C396-H412 WeakPolarHBondContact O-CA 3.43Å; C396-H412 PolarHBondContact O-CD2 3.19Å; C396-L413 PolarHBondContact O-N 3.11Å
397	I	98.1	Very high	96.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	111.8	172.5	-52.6	-175.5	0	0	0	108.4	M335 I369 A370 I371 S372 L413 V415 T435	M335-I397 HydrophobicContact CE-CD1 4.23Å; M335-I397 HydrophobicContact SD-CD1 4.26Å; I369-I397 HydrophobicContact CG2-CD1 3.83Å; I369-I397 HydrophobicContact CG2-CG1 4.06Å; A370-I397 PolarHBondContact O-N 3.23Å; I371-I397 HydrophobicContact CG1-CB 4.4Å; I371-I397 HydrophobicContact CG1-CD1 4.39Å; S372-I397 PolarHBondContact N-O 3.32Å; I397-L413 WeakPolarHBondContact CA-O 3.39Å; I397-L413 HydrophobicContact CD1-CD1 4.39Å; I397-L413 HydrophobicContact CG1-CB 4.2Å; I397-L413 HydrophobicContact CG1-CD1 4.22Å; I397-V415 HydrophobicContact CG2-CB 4.33Å; I397-V415 HydrophobicContact CG2-CG1 3.71Å; I397-V415 HydrophobicContact CG2-CG2 3.61Å; I397-T435 HydrophobicContact CG2-CG2 4.27Å
398	T	97.5	Very high	96.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	155.4	-178	82.3	0	0	0	0	113.1	S372 C396 R400 M405 H412 L413 C414 V415	S372-T398 WeakPolarHBondContact O-CA 3.38Å; S372-T398 WeakPolarHBondContact O-CB 3.43Å; S372-T398 WeakPolarHBondContact O-CG2 3.48Å; C396-T398 HydrophobicContact CB-CG2 4.34Å; T398-R400 VanDerWaalsContact C-N 3.33Å; T398-R400 PolarHBondContact OG1-N 3.2Å; T398-R400 PolarHBondContact OG1-O 3.07Å; T398-M405 HydrophobicContact CG2-CB 4.1Å; T398-M405 HydrophobicContact CG2-CE 4.39Å; T398-H412 PolarHBondContact OG1-NE2 3.16Å; T398-L413 PolarHBondContact N-O 3.46Å; T398-L413 VanDerWaalsContact N-O 3.1Å; T398-C414 WeakPolarHBondContact O-CA 3.18Å; T398-V415 PolarHBondContact O-N 3.2Å
399	G	95.3	Very high	96.2	Very high	5 Å²	5	54.7 Å²	54.7	5%	0.052	26%	0.26	C	S	.	.	S	Bend	trans	-82.9	-7.7	173.4	0	0	0	0	0	113.9	N373 K416	N373-G399 WeakPolarHBondContact O-CA 3.36Å; N373-G399 PolarHBondContact O-N 3.31Å; G399-K416 WeakPolarHBondContact O-CB 3.38Å; G399-K416 WeakPolarHBondContact O-CG 3.26Å
400	R	95	Very high	96.4	Very high	155 Å²	155	47.9 Å²	47.9	59%	0.585	24%	0.24	S	C	*	.			trans	-124.4	108	-175.7	-66.4	-174.8	-175.4	174.4	0.3	111	T398 E402 S403	T398-R400 VanDerWaalsContact C-N 3.33Å; T398-R400 PolarHBondContact OG1-N 3.2Å; T398-R400 PolarHBondContact OG1-O 3.07Å; R400-E402 PolarHBondContact O-N 3.29Å; R400-S403 WeakPolarHBondContact O-CB 3.26Å; R400-S403 PolarHBondContact O-N 2.95Å; R400-S403 PolarHBondContact O-OG 3.09Å
401	P	93.1	Very high	96.6	Very high	74 Å²	74	45 Å²	45	48%	0.481	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.2	-179.4	-22.5	32.1	0	0	0	114.6	S403 A406	P401-S403 VanDerWaalsContact C-N 3.34Å; P401-A406 VanDerWaalsContact O-CB 3.26Å; P401-A406 WeakPolarHBondContact O-CB 3.36Å
402	E	95	Very high	96.8	Very high	137 Å²	137	38.6 Å²	38.6	64%	0.64	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.9	-176.7	-64.3	-73.6	169.6	0	0	113.4	R400 R407	R400-E402 PolarHBondContact O-N 3.29Å; E402-R407 VanDerWaalsContact O-CZ 3.24Å; E402-R407 PolarHBondContact O-NE 2.96Å; E402-R407 VanDerWaalsContact O-NE 3.11Å; E402-R407 PolarHBondContact O-NH2 3.27Å; E402-R407 IonicContact OE2-CZ 3.49Å; E402-R407 IonicContact OE2-NE 3.76Å; E402-R407 IonicContact OE2-NH2 3.51Å; E402-R407 PolarHBondContact OE2-NH2 3.24Å
403	S	96.6	Very high	96.8	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.021	20%	0.196	C	C	.	.	S	Bend	trans	-71.1	160.1	-171.1	82.3	0	0	0	0	113	S374 G375 E376 R400 P401 M405 A406 R407	S374-S403 WeakPolarHBondContact O-CB 3.44Å; G375-S403 WeakPolarHBondContact CA-OG 3.41Å; G375-S403 WeakPolarHBondContact O-CB 3.32Å; G375-S403 PolarHBondContact O-OG 3.28Å; E376-S403 VanDerWaalsContact OE1-CA 3.28Å; E376-S403 WeakPolarHBondContact OE1-CA 3.46Å; E376-S403 WeakPolarHBondContact OE1-CB 3.43Å; R400-S403 WeakPolarHBondContact O-CB 3.26Å; R400-S403 PolarHBondContact O-N 2.95Å; R400-S403 PolarHBondContact O-OG 3.09Å; P401-S403 VanDerWaalsContact C-N 3.34Å; S403-M405 VanDerWaalsContact C-N 3.29Å; S403-M405 PolarHBondContact O-N 3.06Å; S403-A406 PolarHBondContact O-N 3.14Å; S403-A406 VanDerWaalsContact O-N 3.07Å; S403-A406 PolarHBondContact OG-N 3.17Å; S403-R407 PolarHBondContact O-N 3.45Å
404	S	96.9	Very high	96.8	Very high	60 Å²	60	37.9 Å²	37.9	42%	0.42	19%	0.191	S	C	.	.	H	α-helix	trans	-53.9	-45.6	176.8	-57.4	0	0	0	0	112.1	E376 A408	E376-S404 PolarHBondContact OE1-N 3.28Å; E376-S404 PolarHBondContact OE1-OG 3.15Å; E376-S404 WeakPolarHBondContact OE2-CB 3.45Å; E376-S404 PolarHBondContact OE2-OG 3.07Å; S404-A408 WeakPolarHBondContact O-CB 3.28Å; S404-A408 PolarHBondContact O-N 2.73Å; S404-A408 VanDerWaalsContact O-N 3.15Å
405	M	97.5	Very high	96.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-41.9	175.8	-74.4	178.6	57.7	0	0	113.1	A370 S372 G375 I380 T381 I384 C396 T398 S403 A408 A409	A370-M405 HydrophobicContact CB-CE 3.69Å; S372-M405 VanDerWaalsContact CB-SD 3.51Å; G375-M405 WeakPolarHBondContact O-CB 3.4Å; G375-M405 VanDerWaalsContact O-CG 3.26Å; G375-M405 WeakPolarHBondContact O-CG 3.49Å; G375-M405 PolarHBondContact O-N 3.41Å; G375-M405 VanDerWaalsContact O-N 3.09Å; I380-M405 HydrophobicContact CB-SD 4.12Å; I380-M405 HydrophobicContact CD1-CE 4.18Å; I380-M405 HydrophobicContact CD1-SD 4.35Å; I380-M405 HydrophobicContact CG2-CE 3.71Å; I380-M405 HydrophobicContact CG2-CG 4.38Å; I380-M405 HydrophobicContact CG2-SD 3.81Å; T381-M405 HydrophobicContact CG2-CG 3.88Å; I384-M405 HydrophobicContact CD1-CG 4.14Å; C396-M405 HydrophobicContact CB-CB 4.4Å; C396-M405 HydrophobicContact CB-CE 4.44Å; C396-M405 PolarHBondContact SG-O 3.07Å; T398-M405 HydrophobicContact CG2-CB 4.1Å; T398-M405 HydrophobicContact CG2-CE 4.39Å; S403-M405 VanDerWaalsContact C-N 3.29Å; S403-M405 PolarHBondContact O-N 3.06Å; M405-A408 PolarHBondContact O-N 3.39Å; M405-A409 PolarHBondContact O-N 2.56Å; M405-A409 VanDerWaalsContact O-N 3.12Å
406	A	96.8	Very high	96.6	Very high	10 Å²	10	43.1 Å²	43.1	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-44.2	-178.2	0	0	0	0	0	111.4	P401 S403 A408 A409	P401-A406 VanDerWaalsContact O-CB 3.26Å; P401-A406 WeakPolarHBondContact O-CB 3.36Å; S403-A406 PolarHBondContact O-N 3.14Å; S403-A406 VanDerWaalsContact O-N 3.07Å; S403-A406 PolarHBondContact OG-N 3.17Å; A406-A408 VanDerWaalsContact C-N 3.31Å; A406-A408 PolarHBondContact O-N 3.44Å; A406-A409 PolarHBondContact O-N 3.39Å
407	R	96.6	Very high	96.3	Very high	178 Å²	178	44.1 Å²	44.1	67%	0.672	22%	0.22	S	C	*	.	H	α-helix	trans	-67	-31.3	177.9	-67.8	-179.7	-176.4	165.8	3.9	113.4	E402 S403	E402-R407 VanDerWaalsContact O-CZ 3.24Å; E402-R407 PolarHBondContact O-NE 2.96Å; E402-R407 VanDerWaalsContact O-NE 3.11Å; E402-R407 PolarHBondContact O-NH2 3.27Å; E402-R407 IonicContact OE2-CZ 3.49Å; E402-R407 IonicContact OE2-NE 3.76Å; E402-R407 IonicContact OE2-NH2 3.51Å; E402-R407 PolarHBondContact OE2-NH2 3.24Å; S403-R407 PolarHBondContact O-N 3.45Å
408	A	95.9	Very high	95.8	Very high	27 Å²	27	47.7 Å²	47.7	22%	0.223	25%	0.25	C	C	.	.	H	α-helix	trans	-83	-17.7	179.2	0	0	0	0	0	113.4	I384 K388 S404 M405 A406	I384-A408 HydrophobicContact CD1-CB 4.02Å; I384-A408 HydrophobicContact CG2-CB 3.71Å; K388-A408 WeakPolarHBondContact CE-O 3.35Å; K388-A408 PolarHBondContact NZ-O 3.43Å; S404-A408 WeakPolarHBondContact O-CB 3.28Å; S404-A408 PolarHBondContact O-N 2.73Å; S404-A408 VanDerWaalsContact O-N 3.15Å; M405-A408 PolarHBondContact O-N 3.39Å; A406-A408 VanDerWaalsContact C-N 3.31Å; A406-A408 PolarHBondContact O-N 3.44Å
409	A	97.1	Very high	95.3	Very high	17 Å²	17	53.7 Å²	53.7	14%	0.14	28%	0.276	C	S	.	.			trans	-67.8	149.2	-177.5	0	0	0	0	0	112.1	C396 M405 A406 V411	C396-A409 HydrophobicContact CB-CB 3.65Å; M405-A409 PolarHBondContact O-N 2.56Å; M405-A409 VanDerWaalsContact O-N 3.12Å; A406-A409 PolarHBondContact O-N 3.39Å; A409-V411 VanDerWaalsContact C-N 3.34Å; A409-V411 WeakPolarHBondContact CB-O 3.47Å
410	D	97.1	Very high	95.1	Very high	75 Å²	75	55.1 Å²	55.1	40%	0.401	28%	0.281	S	S	.	.	S	Bend	trans	-76.1	-29.7	165.6	-55.5	-52.7	0	0	0	110.8	K388 P393 L394	K388-D410 IonicContact NZ-OD1 2.88Å; K388-D410 PolarHBondContact NZ-OD1 3.26Å; K388-D410 IonicContact NZ-OD2 3.02Å; P393-D410 WeakPolarHBondContact CA-OD2 3.31Å; L394-D410 PolarHBondContact N-OD2 3Å; L394-D410 PolarHBondContact O-N 2.89Å
411	V	97.7	Very high	94.6	Very high	4 Å²	4	48 Å²	48	2%	0.024	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	128.9	171.3	-174.1	0	0	0	0	109.4	N305 L308 A309 K312 L394 I395 C396 A409 L413	N305-V411 HydrophobicContact CB-CG1 4.12Å; N305-V411 WeakPolarHBondContact O-CG1 3.45Å; L308-V411 HydrophobicContact CB-CG1 4.29Å; L308-V411 HydrophobicContact CB-CG2 4.13Å; L308-V411 HydrophobicContact CD2-CG2 4.13Å; A309-V411 HydrophobicContact CB-CG1 3.99Å; K312-V411 HydrophobicContact CD-CG2 4.05Å; L394-V411 PolarHBondContact O-N 3.05Å; I395-V411 VanDerWaalsContact CA-O 3.32Å; I395-V411 WeakPolarHBondContact CA-O 3.35Å; I395-V411 HydrophobicContact CG1-CB 4.27Å; C396-V411 PolarHBondContact N-O 3.31Å; A409-V411 VanDerWaalsContact C-N 3.34Å; A409-V411 WeakPolarHBondContact CB-O 3.47Å; V411-L413 HydrophobicContact CG1-CD2 4.48Å
412	H	97.9	Very high	93.9	Very high	28 Å²	28	45.6 Å²	45.6	13%	0.13	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.2	175	173.7	-117.8	0	0	0	110.9	N305 C396 T398	N305-H412 WeakPolarHBondContact CB-O 3.14Å; N305-H412 PolarHBondContact ND2-O 2.97Å; N305-H412 VanDerWaalsContact ND2-O 3.09Å; C396-H412 WeakPolarHBondContact O-CA 3.43Å; C396-H412 PolarHBondContact O-CD2 3.19Å; T398-H412 PolarHBondContact OG1-NE2 3.16Å
413	L	98.1	Very high	92.4	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.3	171	-59	178.7	0	0	0	108.9	N305 F306 A309 I395 C396 I397 T398 V411 L442	N305-L413 HydrophobicContact CB-CD2 4.29Å; F306-L413 HydrophobicContact CB-CD2 4.25Å; A309-L413 HydrophobicContact CB-CD1 3.99Å; A309-L413 HydrophobicContact CB-CD2 4.07Å; A309-L413 HydrophobicContact CB-CG 4.32Å; I395-L413 HydrophobicContact CG2-CD1 4.12Å; I395-L413 HydrophobicContact CG2-CG 4.28Å; C396-L413 PolarHBondContact O-N 3.11Å; I397-L413 WeakPolarHBondContact CA-O 3.39Å; I397-L413 HydrophobicContact CD1-CD1 4.39Å; I397-L413 HydrophobicContact CG1-CB 4.2Å; I397-L413 HydrophobicContact CG1-CD1 4.22Å; T398-L413 PolarHBondContact N-O 3.46Å; T398-L413 VanDerWaalsContact N-O 3.1Å; V411-L413 HydrophobicContact CG1-CD2 4.48Å; L413-L442 HydrophobicContact CD1-CD1 3.8Å; L413-L442 HydrophobicContact CD1-CD2 4.22Å; L413-L442 HydrophobicContact CD1-CG 4.42Å
414	C	96.8	Very high	91	Very high	15 Å²	15	51.5 Å²	51.5	10%	0.101	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.3	178.5	-164.5	0	0	0	0	110.6	Y301 T398	Y301-C414 VanDerWaalsContact CB-O 3.32Å; Y301-C414 WeakPolarHBondContact CB-O 3.5Å; Y301-C414 HydrophobicContact CD1-CB 3.76Å; Y301-C414 WeakPolarHBondContact CD2-O 3.36Å; Y301-C414 HydrophobicContact CE1-CB 3.92Å; Y301-C414 HydrophobicContact CG-CB 4.17Å; Y301-C414 VanDerWaalsContact CG-O 3.29Å; T398-C414 WeakPolarHBondContact O-CA 3.18Å
415	V	96	Very high	89.7	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	29%	0.287	C	S	.	.			trans	-131.3	40.2	175.2	-68.1	0	0	0	0	110.6	L298 I397 T398 V417 M438	L298-V415 HydrophobicContact CD1-CB 4.44Å; L298-V415 HydrophobicContact CD1-CG1 4.49Å; I397-V415 HydrophobicContact CG2-CB 4.33Å; I397-V415 HydrophobicContact CG2-CG1 3.71Å; I397-V415 HydrophobicContact CG2-CG2 3.61Å; T398-V415 PolarHBondContact O-N 3.2Å; V415-V417 PolarHBondContact O-N 3.21Å; V415-M438 HydrophobicContact CG1-CB 3.78Å; V415-M438 HydrophobicContact CG1-CE 4.06Å; V415-M438 HydrophobicContact CG1-CG 3.9Å
416	K	95.1	Very high	88.4	Confident	113 Å²	113	57.8 Å²	57.8	49%	0.491	32%	0.322	S	S	.	.			trans	-62.1	133.6	-179.5	-175.1	179.5	175.8	-173.3	0	109.5	Y301 G399	Y301-K416 HydrophobicContact CE2-CB 4.32Å; G399-K416 WeakPolarHBondContact O-CB 3.38Å; G399-K416 WeakPolarHBondContact O-CG 3.26Å
417	V	91.9	Very high	87.5	Confident	21 Å²	21	59.5 Å²	59.5	13%	0.127	34%	0.336	C	S	.	.			trans	-115.1	137.9	171.5	-67.2	0	0	0	0	109.4	C294 V415 A434	C294-V417 HydrophobicContact CB-CB 4.44Å; C294-V417 HydrophobicContact CB-CG1 4.07Å; V415-V417 PolarHBondContact O-N 3.21Å; V417-A434 HydrophobicContact CG1-CB 3.7Å
418	A	88.5	Confident	87.1	Confident	76 Å²	76	54 Å²	54	63%	0.628	32%	0.324	S	S	*	.	S	Bend	trans	-69.9	-37.8	-179.4	0	0	0	0	0	112.5
419	K	87.4	Confident	87	Confident	126 Å²	126	54.2 Å²	54.2	55%	0.548	32%	0.322	S	S	.	.			trans	-145.8	141.8	-174.8	-173.4	177.8	176.7	-173.9	0	110.8	I290 C294 S430	I290-K419 HydrophobicContact CD1-CD 4.38Å; I290-K419 HydrophobicContact CG2-CB 4.45Å; I290-K419 HydrophobicContact CG2-CG 4.48Å; C294-K419 PolarHBondContact SG-O 3.34Å; K419-S430 WeakPolarHBondContact O-CB 3.33Å; K419-S430 PolarHBondContact O-OG 2.92Å
420	E	90.4	Very high	86.9	Confident	35 Å²	35	53.5 Å²	53.5	16%	0.164	32%	0.316	C	S	.	.			trans	-84.5	140.2	167.1	-70.5	-70.6	174.1	0	0	109.7	C422 T429 S430 S431	E420-C422 PolarHBondContact O-N 2.55Å; E420-T429 WeakPolarHBondContact OE2-CA 3.47Å; E420-T429 PolarHBondContact OE2-N 2.86Å; E420-T429 PolarHBondContact OE2-OG1 3.36Å; E420-S430 PolarHBondContact OE2-N 2.84Å; E420-S431 WeakPolarHBondContact OE1-CB 3.47Å; E420-S431 PolarHBondContact OE1-OG 3.35Å
421	A	84.3	Confident	86.7	Confident	6 Å²	6	50.1 Å²	50.1	5%	0.05	30%	0.298	C	S	.	.	S	Bend	trans	-66.8	-23.7	175	0	0	0	0	0	112.7	V287 I290 E291 P423 T429 S430	V287-A421 HydrophobicContact CB-CB 4.3Å; V287-A421 HydrophobicContact CG1-CB 3.92Å; V287-A421 HydrophobicContact CG2-CB 4.21Å; I290-A421 HydrophobicContact CB-CB 4.19Å; I290-A421 HydrophobicContact CD1-CB 4.44Å; I290-A421 HydrophobicContact CG2-CB 4.05Å; E291-A421 HydrophobicContact CG-CB 4.32Å; A421-P423 VanDerWaalsContact O-CD 3.29Å; A421-P423 WeakPolarHBondContact O-CD 3.48Å; A421-T429 PolarHBondContact N-OG1 3.31Å; A421-S430 PolarHBondContact N-OG 3.2Å; A421-S430 VanDerWaalsContact N-OG 3.13Å
422	C	78.8	Confident	86.6	Confident	23 Å²	23	51.2 Å²	51.2	16%	0.155	31%	0.305	C	S	.	.	S	Bend	trans	-63.5	118	168.1	-178	0	0	0	0	110	E420 L424 G425 A427 T429	E420-C422 PolarHBondContact O-N 2.55Å; C422-L424 PolarHBondContact O-N 2.85Å; C422-L424 VanDerWaalsContact O-N 3.11Å; C422-G425 PolarHBondContact O-N 2.83Å; C422-A427 HydrophobicContact CB-CB 4.01Å; C422-A427 WeakPolarHBondContact CB-O 3.23Å; C422-T429 HydrophobicContact CB-CG2 4.27Å; C422-T429 PolarHBondContact N-OG1 2.97Å
423	P	63.6	Low	86.5	Confident	128 Å²	128	51.4 Å²	51.4	83%	0.831	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29	-177.6	-22	31.5	0	0	0	113.2	A421 G425	A421-P423 VanDerWaalsContact O-CD 3.29Å; A421-P423 WeakPolarHBondContact O-CD 3.48Å; P423-G425 VanDerWaalsContact C-N 3.34Å
424	L	66.6	Low	86.5	Confident	136 Å²	136	51.2 Å²	51.2	71%	0.712	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-11.3	178.9	-57.4	176.1	0	0	0	112.9	C422 L426	C422-L424 PolarHBondContact O-N 2.85Å; C422-L424 VanDerWaalsContact O-N 3.11Å; L424-L426 HydrophobicContact CB-CB 4.34Å; L424-L426 HydrophobicContact CB-CD1 3.89Å; L424-L426 HydrophobicContact CB-CG 3.84Å; L424-L426 HydrophobicContact CD1-CD1 4.05Å; L424-L426 PolarHBondContact O-N 3.11Å; L424-L426 VanDerWaalsContact O-N 3.12Å
425	G	68.9	Low	86.5	Confident	51 Å²	51	50.8 Å²	50.8	53%	0.526	30%	0.304	S	S	.	.	S	Bend	trans	63.5	12.5	-173.6	0	0	0	0	0	114.6	C422 P423	C422-G425 PolarHBondContact O-N 2.83Å; P423-G425 VanDerWaalsContact C-N 3.34Å
426	L	71.6	Confident	86.6	Confident	141 Å²	141	53 Å²	53	74%	0.738	32%	0.316	S	S	*	.			trans	-88.6	-38.3	-176.1	-63.9	175.6	0	0	0	112.5	L424	L424-L426 HydrophobicContact CB-CB 4.34Å; L424-L426 HydrophobicContact CB-CD1 3.89Å; L424-L426 HydrophobicContact CB-CG 3.84Å; L424-L426 HydrophobicContact CD1-CD1 4.05Å; L424-L426 PolarHBondContact O-N 3.11Å; L424-L426 VanDerWaalsContact O-N 3.12Å
427	A	77.6	Confident	86.7	Confident	46 Å²	46	50.4 Å²	50.4	38%	0.38	31%	0.309	S	S	.	.	S	Bend	trans	-94.1	122.4	-179.3	0	0	0	0	0	109.7	C422 T429	C422-A427 HydrophobicContact CB-CB 4.01Å; C422-A427 WeakPolarHBondContact CB-O 3.23Å; A427-T429 PolarHBondContact O-N 2.9Å
428	P	88.7	Confident	87	Confident	62 Å²	62	49.5 Å²	49.5	40%	0.403	30%	0.303	S	S	.	.			trans	-63.9	122	170.6	-16.7	29.6	0	0	0	109.3	K327 T432	K327-P428 HydrophobicContact CB-CG 4.48Å; K327-P428 HydrophobicContact CG-CG 4.22Å; P428-T432 HydrophobicContact CB-CG2 3.7Å
429	T	92.1	Very high	87.4	Confident	32 Å²	32	45.9 Å²	45.9	20%	0.196	27%	0.274	C	S	.	.			trans	-126.9	-84.2	-178.2	46	0	0	0	0	107.7	E420 A421 C422 A427 S431 T432 T433	E420-T429 WeakPolarHBondContact OE2-CA 3.47Å; E420-T429 PolarHBondContact OE2-N 2.86Å; E420-T429 PolarHBondContact OE2-OG1 3.36Å; A421-T429 PolarHBondContact N-OG1 3.31Å; C422-T429 HydrophobicContact CB-CG2 4.27Å; C422-T429 PolarHBondContact N-OG1 2.97Å; A427-T429 PolarHBondContact O-N 2.9Å; T429-S431 VanDerWaalsContact C-N 3.31Å; T429-S431 PolarHBondContact O-N 3Å; T429-T432 PolarHBondContact O-N 3.38Å; T429-T432 PolarHBondContact O-OG1 3.32Å; T429-T433 PolarHBondContact O-N 3.04Å; T429-T433 VanDerWaalsContact O-N 3.16Å; T429-T433 PolarHBondContact O-OG1 2.92Å
430	S	94.9	Very high	87.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-55.6	-39.9	179.5	-45.9	0	0	0	0	112.9	K419 E420 A421 T432 T433 A434	K419-S430 WeakPolarHBondContact O-CB 3.33Å; K419-S430 PolarHBondContact O-OG 2.92Å; E420-S430 PolarHBondContact OE2-N 2.84Å; A421-S430 PolarHBondContact N-OG 3.2Å; A421-S430 VanDerWaalsContact N-OG 3.13Å; S430-T432 VanDerWaalsContact C-N 3.32Å; S430-T432 PolarHBondContact O-N 2.78Å; S430-T433 PolarHBondContact O-N 3.26Å; S430-A434 VanDerWaalsContact O-CB 3.31Å; S430-A434 WeakPolarHBondContact O-CB 3.35Å; S430-A434 PolarHBondContact O-N 3.1Å
431	S	94.3	Very high	88.2	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.028	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-33.6	177.5	54.6	0	0	0	0	113.5	E420 T429 T435	E420-S431 WeakPolarHBondContact OE1-CB 3.47Å; E420-S431 PolarHBondContact OE1-OG 3.35Å; T429-S431 VanDerWaalsContact C-N 3.31Å; T429-S431 PolarHBondContact O-N 3Å; S431-T435 WeakPolarHBondContact O-CB 3.37Å; S431-T435 PolarHBondContact O-N 2.99Å; S431-T435 VanDerWaalsContact O-N 3.11Å; S431-T435 PolarHBondContact O-OG1 3.13Å
432	T	95.8	Very high	88.8	Confident	28 Å²	28	41.8 Å²	41.8	17%	0.172	26%	0.263	C	S	.	.	H	α-helix	trans	-73	-40.8	176.6	61	0	0	0	0	111.5	K327 I331 P428 T429 S430 T435 L436	K327-T432 HydrophobicContact CB-CG2 3.88Å; I331-T432 HydrophobicContact CG1-CG2 4.47Å; P428-T432 HydrophobicContact CB-CG2 3.7Å; T429-T432 PolarHBondContact O-N 3.38Å; T429-T432 PolarHBondContact O-OG1 3.32Å; S430-T432 VanDerWaalsContact C-N 3.32Å; S430-T432 PolarHBondContact O-N 2.78Å; T432-T435 PolarHBondContact O-N 2.64Å; T432-L436 WeakPolarHBondContact O-CB 3.37Å; T432-L436 PolarHBondContact O-N 2.96Å
433	T	96.2	Very high	89.7	Confident	31 Å²	31	40.7 Å²	40.7	19%	0.19	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-46.3	174.3	-53.4	0	0	0	0	111.1	E291 L295 T429 S430 T435 L436 V437	E291-T433 PolarHBondContact OE2-OG1 2.86Å; L295-T433 HydrophobicContact CD1-CG2 4.11Å; L295-T433 HydrophobicContact CD2-CG2 4.28Å; L295-T433 HydrophobicContact CG-CG2 4.46Å; T429-T433 PolarHBondContact O-N 3.04Å; T429-T433 VanDerWaalsContact O-N 3.16Å; T429-T433 PolarHBondContact O-OG1 2.92Å; S430-T433 PolarHBondContact O-N 3.26Å; T433-T435 VanDerWaalsContact C-N 3.34Å; T433-T435 PolarHBondContact O-N 2.88Å; T433-L436 WeakPolarHBondContact O-CB 3.35Å; T433-L436 PolarHBondContact O-N 3.23Å; T433-V437 WeakPolarHBondContact O-CG2 3.44Å; T433-V437 PolarHBondContact O-N 2.86Å
434	A	96.6	Very high	91.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-45.6	175.8	0	0	0	0	0	112.4	L298 V417 S430 L436 V437 M438	L298-A434 HydrophobicContact CD1-CB 3.64Å; V417-A434 HydrophobicContact CG1-CB 3.7Å; S430-A434 VanDerWaalsContact O-CB 3.31Å; S430-A434 WeakPolarHBondContact O-CB 3.35Å; S430-A434 PolarHBondContact O-N 3.1Å; A434-L436 PolarHBondContact O-N 3.07Å; A434-V437 PolarHBondContact O-N 3.23Å; A434-M438 WeakPolarHBondContact O-CB 3.29Å; A434-M438 PolarHBondContact O-N 3.49Å
435	T	97.4	Very high	92.7	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-40.1	177.5	-57.3	0	0	0	0	112	I331 M335 I371 I397 S431 T432 T433 G439	I331-T435 HydrophobicContact CG2-CG2 3.82Å; M335-T435 HydrophobicContact CE-CG2 4.15Å; I371-T435 HydrophobicContact CD1-CG2 4.38Å; I371-T435 HydrophobicContact CG2-CG2 3.54Å; I397-T435 HydrophobicContact CG2-CG2 4.27Å; S431-T435 WeakPolarHBondContact O-CB 3.37Å; S431-T435 PolarHBondContact O-N 2.99Å; S431-T435 VanDerWaalsContact O-N 3.11Å; S431-T435 PolarHBondContact O-OG1 3.13Å; T432-T435 PolarHBondContact O-N 2.64Å; T433-T435 VanDerWaalsContact C-N 3.34Å; T433-T435 PolarHBondContact O-N 2.88Å; T435-G439 PolarHBondContact O-N 3.33Å
436	L	97.7	Very high	94.1	Very high	47 Å²	47	30.9 Å²	30.9	25%	0.246	19%	0.191	C	C	.	.	H	α-helix	trans	-62.3	-48.6	177.3	177.4	61.7	0	0	0	111.3	I331 K334 T432 T433 A434 M438 G439 D440	I331-L436 HydrophobicContact CD1-CB 4.35Å; I331-L436 HydrophobicContact CG2-CB 3.94Å; I331-L436 HydrophobicContact CG2-CD1 4.31Å; K334-L436 HydrophobicContact CD-CD1 3.47Å; K334-L436 VanDerWaalsContact CD-CD1 3.47Å; K334-L436 HydrophobicContact CG-CD1 4.11Å; T432-L436 WeakPolarHBondContact O-CB 3.37Å; T432-L436 PolarHBondContact O-N 2.96Å; T433-L436 WeakPolarHBondContact O-CB 3.35Å; T433-L436 PolarHBondContact O-N 3.23Å; A434-L436 PolarHBondContact O-N 3.07Å; L436-M438 VanDerWaalsContact C-N 3.34Å; L436-M438 PolarHBondContact O-N 2.97Å; L436-G439 WeakPolarHBondContact O-CA 3.35Å; L436-G439 PolarHBondContact O-N 2.94Å; L436-G439 VanDerWaalsContact O-N 3.12Å; L436-D440 PolarHBondContact O-N 2.93Å
437	V	97.3	Very high	95.1	Very high	59 Å²	59	26.3 Å²	26.3	36%	0.358	17%	0.168	S	C	.	.	H	α-helix	trans	-63.5	-40.2	179.6	171.3	0	0	0	0	111.4	L295 L298 T433 A434 G439 D440 A441	L295-V437 HydrophobicContact CD1-CG2 4.48Å; L295-V437 HydrophobicContact CD2-CB 3.94Å; L295-V437 HydrophobicContact CD2-CG1 4.21Å; L295-V437 HydrophobicContact CD2-CG2 3.67Å; L298-V437 HydrophobicContact CD2-CB 4.33Å; L298-V437 HydrophobicContact CD2-CG1 4.09Å; T433-V437 WeakPolarHBondContact O-CG2 3.44Å; T433-V437 PolarHBondContact O-N 2.86Å; A434-V437 PolarHBondContact O-N 3.23Å; V437-G439 VanDerWaalsContact C-N 3.31Å; V437-G439 PolarHBondContact O-N 3.5Å; V437-D440 PolarHBondContact O-N 3.23Å; V437-A441 WeakPolarHBondContact O-CB 3.43Å; V437-A441 PolarHBondContact O-N 3.05Å
438	M	97.5	Very high	95.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-60.2	-41.3	173.1	-175.6	60.7	70.4	0	0	111.9	L298 I302 F306 V415 A434 L436 A441 L442	L298-M438 HydrophobicContact CD2-CB 4.45Å; L298-M438 HydrophobicContact CD2-CE 4.2Å; L298-M438 HydrophobicContact CG-CE 4.3Å; I302-M438 HydrophobicContact CD1-CE 4.02Å; I302-M438 HydrophobicContact CD1-SD 3.95Å; F306-M438 HydrophobicContact CD2-SD 3.75Å; F306-M438 HydrophobicContact CE2-SD 3.99Å; V415-M438 HydrophobicContact CG1-CB 3.78Å; V415-M438 HydrophobicContact CG1-CE 4.06Å; V415-M438 HydrophobicContact CG1-CG 3.9Å; A434-M438 WeakPolarHBondContact O-CB 3.29Å; A434-M438 PolarHBondContact O-N 3.49Å; L436-M438 VanDerWaalsContact C-N 3.34Å; L436-M438 PolarHBondContact O-N 2.97Å; M438-A441 PolarHBondContact O-N 3.18Å; M438-L442 WeakPolarHBondContact O-CG 2.76Å; M438-L442 PolarHBondContact O-N 3.38Å; M438-L442 VanDerWaalsContact O-N 3.09Å
439	G	97.6	Very high	96.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-42.9	174.8	0	0	0	0	0	113.4	M335 F339 T435 L436 V437 L442 A443	M335-G439 VanDerWaalsContact SD-CA 3.6Å; F339-G439 WeakPolarHBondContact CE1-O 3.37Å; T435-G439 PolarHBondContact O-N 3.33Å; L436-G439 WeakPolarHBondContact O-CA 3.35Å; L436-G439 PolarHBondContact O-N 2.94Å; L436-G439 VanDerWaalsContact O-N 3.12Å; V437-G439 VanDerWaalsContact C-N 3.31Å; V437-G439 PolarHBondContact O-N 3.5Å; G439-L442 WeakPolarHBondContact O-CB 3.41Å; G439-L442 PolarHBondContact O-N 2.99Å; G439-A443 PolarHBondContact O-N 3.21Å
440	D	97.4	Very high	96.1	Very high	49 Å²	49	34.6 Å²	34.6	26%	0.262	20%	0.196	S	C	.	.	H	α-helix	trans	-68.7	-36.6	178.5	-72.2	-1.7	0	0	0	111.7	K334 L436 V437 A443 V444	K334-D440 IonicContact NZ-OD1 3.72Å; K334-D440 PolarHBondContact NZ-OD1 3.44Å; K334-D440 IonicContact NZ-OD2 3.66Å; K334-D440 PolarHBondContact NZ-OD2 3.19Å; L436-D440 PolarHBondContact O-N 2.93Å; V437-D440 PolarHBondContact O-N 3.23Å; D440-A443 PolarHBondContact O-N 3.47Å; D440-V444 WeakPolarHBondContact O-CG2 3.42Å; D440-V444 PolarHBondContact O-N 2.92Å
441	A	97.4	Very high	95.7	Very high	33 Å²	33	37 Å²	37	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-46.4	172.6	0	0	0	0	0	111.6	I302 F306 V437 M438 A443 A445	I302-A441 HydrophobicContact CD1-CB 4.44Å; F306-A441 HydrophobicContact CE2-CB 3.91Å; F306-A441 HydrophobicContact CZ-CB 4Å; V437-A441 WeakPolarHBondContact O-CB 3.43Å; V437-A441 PolarHBondContact O-N 3.05Å; M438-A441 PolarHBondContact O-N 3.18Å; A441-A443 VanDerWaalsContact C-N 3.33Å; A441-A443 PolarHBondContact O-N 3.27Å; A441-A445 VanDerWaalsContact O-CB 3.24Å; A441-A445 WeakPolarHBondContact O-CB 3.19Å; A441-A445 PolarHBondContact O-N 3.48Å
442	L	98	Very high	95.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-45.3	174.2	-72.7	169.9	0	0	0	111.3	F306 A309 M313 F339 L413 M438 G439 A445 L446	F306-L442 HydrophobicContact CD2-CD2 3.9Å; F306-L442 HydrophobicContact CD2-CG 4.41Å; F306-L442 HydrophobicContact CE2-CD2 3.58Å; F306-L442 HydrophobicContact CE2-CG 3.8Å; F306-L442 HydrophobicContact CZ-CD2 4.08Å; F306-L442 HydrophobicContact CZ-CG 4.45Å; A309-L442 HydrophobicContact CB-CD2 4.12Å; M313-L442 HydrophobicContact SD-CD1 4.5Å; M313-L442 HydrophobicContact SD-CD2 4.48Å; F339-L442 HydrophobicContact CE1-CB 3.88Å; F339-L442 HydrophobicContact CZ-CB 4.08Å; F339-L442 HydrophobicContact CZ-CD1 4.34Å; L413-L442 HydrophobicContact CD1-CD1 3.8Å; L413-L442 HydrophobicContact CD1-CD2 4.22Å; L413-L442 HydrophobicContact CD1-CG 4.42Å; M438-L442 WeakPolarHBondContact O-CG 2.76Å; M438-L442 PolarHBondContact O-N 3.38Å; M438-L442 VanDerWaalsContact O-N 3.09Å; G439-L442 WeakPolarHBondContact O-CB 3.41Å; G439-L442 PolarHBondContact O-N 2.99Å; L442-A445 PolarHBondContact O-N 3.28Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 WeakPolarHBondContact O-CG 3.25Å; L442-L446 PolarHBondContact O-N 3.24Å
443	A	97.3	Very high	94.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-47.9	-176.7	0	0	0	0	0	111.5	T338 F339 G439 D440 A441 L446 L447	T338-A443 HydrophobicContact CG2-CB 3.74Å; F339-A443 HydrophobicContact CD1-CB 3.58Å; F339-A443 HydrophobicContact CE1-CB 3.66Å; G439-A443 PolarHBondContact O-N 3.21Å; D440-A443 PolarHBondContact O-N 3.47Å; A441-A443 VanDerWaalsContact C-N 3.33Å; A441-A443 PolarHBondContact O-N 3.27Å; A443-L446 PolarHBondContact O-N 2.94Å; A443-L447 WeakPolarHBondContact O-CB 3.19Å; A443-L447 PolarHBondContact O-N 2.98Å
444	V	96.5	Very high	93.4	Very high	74 Å²	74	41.7 Å²	41.7	45%	0.448	25%	0.252	S	S	.	.	H	α-helix	trans	-68.7	-36.5	-179.7	175.3	0	0	0	0	111.4	D440 L447 K448	D440-V444 WeakPolarHBondContact O-CG2 3.42Å; D440-V444 PolarHBondContact O-N 2.92Å; V444-L447 PolarHBondContact O-N 3.44Å; V444-K448 WeakPolarHBondContact O-CG 3.32Å; V444-K448 PolarHBondContact O-N 3.03Å
445	A	97	Very high	92.1	Very high	33 Å²	33	47.9 Å²	47.9	27%	0.273	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-45.4	174.5	0	0	0	0	0	111.4	F306 A441 L442 K448 A449	F306-A445 HydrophobicContact CE1-CB 4.14Å; F306-A445 HydrophobicContact CZ-CB 4.14Å; A441-A445 VanDerWaalsContact O-CB 3.24Å; A441-A445 WeakPolarHBondContact O-CB 3.19Å; A441-A445 PolarHBondContact O-N 3.48Å; L442-A445 PolarHBondContact O-N 3.28Å; A445-K448 PolarHBondContact O-N 2.92Å; A445-A449 WeakPolarHBondContact O-CB 3.22Å; A445-A449 PolarHBondContact O-N 3.49Å
446	L	96.4	Very high	91.1	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-42.8	176.4	-75.5	165.6	0	0	0	112.6	C310 M313 F314 T344 L442 A443 K448 A449 R450	C310-L446 WeakPolarHBondContact O-CD2 3.16Å; M313-L446 HydrophobicContact CB-CD1 3.78Å; M313-L446 HydrophobicContact CB-CD2 4.02Å; M313-L446 HydrophobicContact CE-CD1 3.34Å; M313-L446 HydrophobicContact CG-CD1 4.47Å; M313-L446 HydrophobicContact SD-CD1 3.89Å; F314-L446 HydrophobicContact CB-CD2 3.88Å; F314-L446 HydrophobicContact CD2-CD2 4.33Å; T344-L446 HydrophobicContact CG2-CD1 4.46Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 WeakPolarHBondContact O-CG 3.25Å; L442-L446 PolarHBondContact O-N 3.24Å; A443-L446 PolarHBondContact O-N 2.94Å; L446-K448 VanDerWaalsContact C-N 3.31Å; L446-K448 PolarHBondContact O-N 3.37Å; L446-A449 PolarHBondContact O-N 3.47Å; L446-R450 WeakPolarHBondContact O-CB 3.16Å; L446-R450 WeakPolarHBondContact O-CG 3.4Å; L446-R450 PolarHBondContact O-N 2.98Å
447	L	94.2	Very high	89.9	Confident	46 Å²	46	51 Å²	51	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-53.6	-50.7	174.8	-178.2	163.2	0	0	0	110.2	T342 A443 V444 R450 G451 F452	T342-L447 HydrophobicContact CG2-CD1 3.74Å; A443-L447 WeakPolarHBondContact O-CB 3.19Å; A443-L447 PolarHBondContact O-N 2.98Å; V444-L447 PolarHBondContact O-N 3.44Å; L447-R450 PolarHBondContact O-N 3.03Å; L447-G451 PolarHBondContact O-N 3.31Å; L447-F452 HydrophobicContact CD1-CD1 4.48Å; L447-F452 HydrophobicContact CD2-CB 4.45Å; L447-F452 HydrophobicContact CG-CB 4.03Å; L447-F452 HydrophobicContact CG-CD1 4.25Å; L447-F452 PolarHBondContact O-N 3.33Å; L447-F452 VanDerWaalsContact O-N 3.13Å
448	K	94.2	Very high	88.5	Confident	161 Å²	161	48.2 Å²	48.2	70%	0.7	28%	0.279	S	S	*	.	H	α-helix	trans	-63.1	-45.8	177.8	-74.9	-178.1	178.3	-178.3	0	112	V444 A445 L446 R450 G451	V444-K448 WeakPolarHBondContact O-CG 3.32Å; V444-K448 PolarHBondContact O-N 3.03Å; A445-K448 PolarHBondContact O-N 2.92Å; L446-K448 VanDerWaalsContact C-N 3.31Å; L446-K448 PolarHBondContact O-N 3.37Å; K448-R450 VanDerWaalsContact C-N 3.27Å; K448-R450 PolarHBondContact O-N 3.28Å; K448-G451 PolarHBondContact O-N 3.27Å; K448-G451 VanDerWaalsContact O-N 3.13Å
449	A	93.5	Very high	87.1	Confident	65 Å²	65	53.6 Å²	53.6	54%	0.537	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-34.2	-180	0	0	0	0	0	112.6	F314 A445 L446 G451	F314-A449 HydrophobicContact CD2-CB 3.87Å; F314-A449 HydrophobicContact CE2-CB 3.82Å; F314-A449 WeakPolarHBondContact CE2-O 3.42Å; A445-A449 WeakPolarHBondContact O-CB 3.22Å; A445-A449 PolarHBondContact O-N 3.49Å; L446-A449 PolarHBondContact O-N 3.47Å; A449-G451 VanDerWaalsContact C-N 3.32Å
450	R	91.2	Very high	85.7	Confident	87 Å²	87	56.3 Å²	56.3	33%	0.328	33%	0.326	S	S	.	.	H	α-helix	trans	-79.6	-12.8	177.5	-70.2	-178.5	-177.4	-71.8	-3.8	113.4	M313 F314 T344 L446 L447 K448 F452	M313-R450 PolarHBondContact O-NH2 3.38Å; F314-R450 HydrophobicContact CD2-CG 3.85Å; F314-R450 HydrophobicContact CE2-CB 4.32Å; F314-R450 HydrophobicContact CE2-CG 3.52Å; F314-R450 PolarHBondContact O-NH2 2.66Å; T344-R450 PolarHBondContact OG1-NE 2.82Å; L446-R450 WeakPolarHBondContact O-CB 3.16Å; L446-R450 WeakPolarHBondContact O-CG 3.4Å; L446-R450 PolarHBondContact O-N 2.98Å; L447-R450 PolarHBondContact O-N 3.03Å; K448-R450 VanDerWaalsContact C-N 3.27Å; K448-R450 PolarHBondContact O-N 3.28Å; R450-F452 PolarHBondContact O-N 3.41Å
451	G	86.8	Confident	84.3	Confident	51 Å²	51	57.1 Å²	57.1	53%	0.526	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	29.1	-172	0	0	0	0	0	112.8	L447 K448 A449 T453	L447-G451 PolarHBondContact O-N 3.31Å; K448-G451 PolarHBondContact O-N 3.27Å; K448-G451 VanDerWaalsContact O-N 3.13Å; A449-G451 VanDerWaalsContact C-N 3.32Å; G451-T453 WeakPolarHBondContact O-CG2 3.35Å; G451-T453 PolarHBondContact O-N 2.85Å
452	F	85.4	Confident	82.5	Confident	36 Å²	36	59.6 Å²	59.6	16%	0.158	34%	0.341	C	S	.	.			trans	-66.4	125	-174.7	-171.4	-92.2	0	0	0	110.7	L447 R450 D456 F457	L447-F452 HydrophobicContact CD1-CD1 4.48Å; L447-F452 HydrophobicContact CD2-CB 4.45Å; L447-F452 HydrophobicContact CG-CB 4.03Å; L447-F452 HydrophobicContact CG-CD1 4.25Å; L447-F452 PolarHBondContact O-N 3.33Å; L447-F452 VanDerWaalsContact O-N 3.13Å; R450-F452 PolarHBondContact O-N 3.41Å; F452-D456 HydrophobicContact CD1-CB 4.15Å; F452-D456 HydrophobicContact CD2-CB 3.58Å; F452-D456 HydrophobicContact CE1-CB 3.94Å; F452-D456 HydrophobicContact CE2-CB 3.34Å; F452-D456 HydrophobicContact CG-CB 4Å; F452-D456 HydrophobicContact CZ-CB 3.55Å; F452-D456 WeakPolarHBondContact CZ-O 3.48Å; F452-F457 HydrophobicContact CE1-CB 3.71Å; F452-F457 HydrophobicContact CE1-CD2 4.01Å; F452-F457 HydrophobicContact CE1-CG 4.35Å; F452-F457 HydrophobicContact CZ-CB 4.44Å
453	T	79.7	Confident	80.5	Confident	64 Å²	64	62.1 Å²	62.1	39%	0.393	37%	0.367	S	S	.	.			trans	-97.7	171.1	-170	68.8	0	0	0	0	112.3	G451 E455 D456 F457	G451-T453 WeakPolarHBondContact O-CG2 3.35Å; G451-T453 PolarHBondContact O-N 2.85Å; T453-E455 PolarHBondContact O-N 3.48Å; T453-E455 PolarHBondContact OG1-N 3.04Å; T453-D456 WeakPolarHBondContact CB-OD2 3.38Å; T453-D456 PolarHBondContact N-OD2 3.28Å; T453-D456 PolarHBondContact O-N 3.14Å; T453-D456 VanDerWaalsContact OG1-CG 3.23Å; T453-D456 PolarHBondContact OG1-N 2.93Å; T453-D456 PolarHBondContact OG1-OD2 3.41Å; T453-F457 PolarHBondContact O-N 3.26Å
454	A	72.8	Confident	78.5	Confident	62 Å²	62	63.7 Å²	63.7	51%	0.512	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-33	172.3	0	0	0	0	0	112.2	F457 A458 L470	A454-F457 WeakPolarHBondContact O-CB 3.37Å; A454-F457 PolarHBondContact O-N 3.01Å; A454-A458 PolarHBondContact O-N 3.35Å; A454-L470 HydrophobicContact CB-CD1 4.16Å; A454-L470 WeakPolarHBondContact O-CD1 3.5Å
455	E	69	Low	76.4	Confident	130 Å²	130	62.5 Å²	62.5	61%	0.607	38%	0.381	S	S	*	.	H	α-helix	trans	-68.2	-41.3	176.6	-69.3	165.2	179.8	0	0	111.2	T453 F457 A458 L459	T453-E455 PolarHBondContact O-N 3.48Å; T453-E455 PolarHBondContact OG1-N 3.04Å; E455-F457 VanDerWaalsContact C-N 3.28Å; E455-F457 PolarHBondContact O-N 3.04Å; E455-A458 WeakPolarHBondContact O-CB 3.42Å; E455-A458 PolarHBondContact O-N 3Å; E455-L459 WeakPolarHBondContact O-CG 3.38Å; E455-L459 PolarHBondContact O-N 3.3Å
456	D	77.4	Confident	74.4	Confident	60 Å²	60	65.4 Å²	65.4	32%	0.321	39%	0.391	S	S	.	.	H	α-helix	trans	-62.7	-38.2	173.6	-57.5	-53	0	0	0	111.6	F452 T453 A458 L459 S460	F452-D456 HydrophobicContact CD1-CB 4.15Å; F452-D456 HydrophobicContact CD2-CB 3.58Å; F452-D456 HydrophobicContact CE1-CB 3.94Å; F452-D456 HydrophobicContact CE2-CB 3.34Å; F452-D456 HydrophobicContact CG-CB 4Å; F452-D456 HydrophobicContact CZ-CB 3.55Å; F452-D456 WeakPolarHBondContact CZ-O 3.48Å; T453-D456 WeakPolarHBondContact CB-OD2 3.38Å; T453-D456 PolarHBondContact N-OD2 3.28Å; T453-D456 PolarHBondContact O-N 3.14Å; T453-D456 VanDerWaalsContact OG1-CG 3.23Å; T453-D456 PolarHBondContact OG1-N 2.93Å; T453-D456 PolarHBondContact OG1-OD2 3.41Å; D456-A458 VanDerWaalsContact C-N 3.34Å; D456-L459 PolarHBondContact O-N 3.45Å; D456-S460 PolarHBondContact O-N 3.01Å; D456-S460 VanDerWaalsContact O-N 3.13Å; D456-S460 PolarHBondContact O-OG 2.76Å
457	F	71.5	Confident	72.6	Confident	60 Å²	60	65.4 Å²	65.4	26%	0.263	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-42	174.7	-167.2	-85.7	0	0	0	111.5	S341 F452 T453 A454 E455 S460 H461 L466	S341-F457 WeakPolarHBondContact O-CD2 3.36Å; S341-F457 WeakPolarHBondContact O-CE2 3.34Å; F452-F457 HydrophobicContact CE1-CB 3.71Å; F452-F457 HydrophobicContact CE1-CD2 4.01Å; F452-F457 HydrophobicContact CE1-CG 4.35Å; F452-F457 HydrophobicContact CZ-CB 4.44Å; T453-F457 PolarHBondContact O-N 3.26Å; A454-F457 WeakPolarHBondContact O-CB 3.37Å; A454-F457 PolarHBondContact O-N 3.01Å; E455-F457 VanDerWaalsContact C-N 3.28Å; E455-F457 PolarHBondContact O-N 3.04Å; F457-S460 WeakPolarHBondContact O-CB 3.31Å; F457-S460 PolarHBondContact O-N 2.72Å; F457-S460 VanDerWaalsContact O-N 3.16Å; F457-H461 AromaticContact CD1-ND1 3.75Å; F457-H461 AromaticContact CE1-CE1 3.75Å; F457-H461 AromaticContact CE1-ND1 3.49Å; F457-H461 WeakPolarHBondContact CE1-ND1 3.24Å; F457-H461 AromaticContact CE2-CE1 3.79Å; F457-H461 AromaticContact CZ-CE1 3.49Å; F457-H461 VanDerWaalsContact CZ-CE1 3.49Å; F457-H461 WeakPolarHBondContact CZ-CE1 3.22Å; F457-H461 AromaticContact CZ-ND1 3.74Å; F457-H461 PolarHBondContact O-N 3.25Å; F457-H461 PolarHBondContact O-ND1 3.46Å; F457-L466 HydrophobicContact CD1-CD2 3.82Å; F457-L466 HydrophobicContact CE1-CD2 3.95Å
458	A	67	Low	71.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-62.1	-43.4	177.2	0	0	0	0	0	112	A454 E455 D456 S460 H461 L470 L471	A454-A458 PolarHBondContact O-N 3.35Å; E455-A458 WeakPolarHBondContact O-CB 3.42Å; E455-A458 PolarHBondContact O-N 3Å; D456-A458 VanDerWaalsContact C-N 3.34Å; A458-S460 PolarHBondContact O-N 3.08Å; A458-H461 CarbonylContact O-C 3.59Å; A458-H461 PolarHBondContact O-N 3.4Å; A458-L470 HydrophobicContact CB-CB 3.65Å; A458-L470 HydrophobicContact CB-CD1 3.85Å; A458-L470 HydrophobicContact CB-CG 4.39Å; A458-L471 HydrophobicContact CB-CD1 3.96Å; A458-L471 HydrophobicContact CB-CD2 4.34Å; A458-L471 HydrophobicContact CB-CG 3.86Å
459	L	69.8	Low	69.5	Low	114 Å²	114	66.3 Å²	66.3	60%	0.597	39%	0.39	S	S	*	.	H	α-helix	trans	-62.1	-29.9	175.1	-74.3	167.3	0	0	0	112.5	E455 D456 H461 L471	E455-L459 WeakPolarHBondContact O-CG 3.38Å; E455-L459 PolarHBondContact O-N 3.3Å; D456-L459 PolarHBondContact O-N 3.45Å; L459-H461 VanDerWaalsContact C-N 3.32Å; L459-L471 HydrophobicContact CD2-CD1 4.2Å; L459-L471 HydrophobicContact CD2-CD2 4.25Å; L459-L471 HydrophobicContact CG-CD1 4.5Å; L459-L471 HydrophobicContact CG-CD2 4.35Å
460	S	68	Low	68	Low	56 Å²	56	65.5 Å²	65.5	39%	0.392	38%	0.377	S	S	.	.	H	α-helix	trans	-79.8	-13.2	175.6	-52.1	0	0	0	0	112.9	D456 F457 A458	D456-S460 PolarHBondContact O-N 3.01Å; D456-S460 VanDerWaalsContact O-N 3.13Å; D456-S460 PolarHBondContact O-OG 2.76Å; F457-S460 WeakPolarHBondContact O-CB 3.31Å; F457-S460 PolarHBondContact O-N 2.72Å; F457-S460 VanDerWaalsContact O-N 3.16Å; A458-S460 PolarHBondContact O-N 3.08Å
461	H	67.1	Low	67	Low	67 Å²	67	64.4 Å²	64.4	31%	0.31	38%	0.377	S	S	.	.			trans	-136.3	56.1	179.9	-56.3	78.9	0	0	0	112.7	S341 F457 A458 L459 G463 G464 G467	S341-H461 WeakPolarHBondContact CB-CE1 3.38Å; S341-H461 WeakPolarHBondContact CB-NE2 3.34Å; F457-H461 AromaticContact CD1-ND1 3.75Å; F457-H461 AromaticContact CE1-CE1 3.75Å; F457-H461 AromaticContact CE1-ND1 3.49Å; F457-H461 WeakPolarHBondContact CE1-ND1 3.24Å; F457-H461 AromaticContact CE2-CE1 3.79Å; F457-H461 AromaticContact CZ-CE1 3.49Å; F457-H461 VanDerWaalsContact CZ-CE1 3.49Å; F457-H461 WeakPolarHBondContact CZ-CE1 3.22Å; F457-H461 AromaticContact CZ-ND1 3.74Å; F457-H461 PolarHBondContact O-N 3.25Å; F457-H461 PolarHBondContact O-ND1 3.46Å; A458-H461 CarbonylContact O-C 3.59Å; A458-H461 PolarHBondContact O-N 3.4Å; L459-H461 VanDerWaalsContact C-N 3.32Å; H461-G463 PolarHBondContact O-N 3.05Å; H461-G463 VanDerWaalsContact O-N 3.12Å; H461-G464 PolarHBondContact O-N 3.36Å; H461-G467 WeakPolarHBondContact O-CA 3.14Å
462	P	60.2	Low	66.5	Low	85 Å²	85	63.6 Å²	63.6	55%	0.552	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.9	-170.6	25.1	-34.3	0	0	0	113.2
463	G	56.3	Low	66.5	Low	53 Å²	53	67.8 Å²	67.8	55%	0.546	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-19.7	178.6	0	0	0	0	0	115	H461 R468	H461-G463 PolarHBondContact O-N 3.05Å; H461-G463 VanDerWaalsContact O-N 3.12Å; G463-R468 PolarHBondContact O-NE 3.23Å; G463-R468 PolarHBondContact O-NH2 2.88Å
464	G	55.7	Low	67	Low	33 Å²	33	64.8 Å²	64.8	34%	0.34	36%	0.357	S	S	.	.	S	Bend	trans	-78.5	156.1	-174.7	0	0	0	0	0	112.9	H461 L466 G467 R468	H461-G464 PolarHBondContact O-N 3.36Å; G464-L466 PolarHBondContact O-N 3.46Å; G464-G467 PolarHBondContact O-N 3.02Å; G464-R468 PolarHBondContact O-N 3.46Å
465	A	52.4	Low	68	Low	49 Å²	49	65.3 Å²	65.3	41%	0.405	35%	0.351	S	S	.	.	H	α-helix	trans	-51.8	-42.9	-180	0	0	0	0	0	112.5	K469 A597	A465-K469 VanDerWaalsContact O-CB 3.26Å; A465-K469 WeakPolarHBondContact O-CB 3.48Å; A465-K469 PolarHBondContact O-N 3.17Å; A465-A597 HydrophobicContact CB-CB 3.84Å
466	L	54.7	Low	68.7	Low	93 Å²	93	63.9 Å²	63.9	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-66.7	-40.4	177.6	-162.5	74.8	0	0	0	112.6	F457 G464 K469 L470	F457-L466 HydrophobicContact CD1-CD2 3.82Å; F457-L466 HydrophobicContact CE1-CD2 3.95Å; G464-L466 PolarHBondContact O-N 3.46Å; L466-K469 PolarHBondContact O-N 3.47Å; L466-L470 HydrophobicContact CD2-CD1 4.48Å; L466-L470 HydrophobicContact CG-CD1 3.99Å; L466-L470 WeakPolarHBondContact O-CB 3.29Å; L466-L470 WeakPolarHBondContact O-CG 3.34Å; L466-L470 PolarHBondContact O-N 2.87Å
467	G	57.8	Low	69.2	Low	1 Å²	1	62.6 Å²	62.6	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-46.3	179.1	0	0	0	0	0	112.1	H461 G464 L470 L471	H461-G467 WeakPolarHBondContact O-CA 3.14Å; G464-G467 PolarHBondContact O-N 3.02Å; G467-L470 PolarHBondContact O-N 3.12Å; G467-L471 WeakPolarHBondContact O-CB 3.32Å; G467-L471 WeakPolarHBondContact O-CG 3.47Å; G467-L471 PolarHBondContact O-N 2.83Å
468	R	62.8	Low	70.2	Confident	119 Å²	119	61.3 Å²	61.3	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-42.2	174.6	-64.2	-171.5	-158.7	-179.7	6.2	112	G463 G464 L470 L471 L472	G463-R468 PolarHBondContact O-NE 3.23Å; G463-R468 PolarHBondContact O-NH2 2.88Å; G464-R468 PolarHBondContact O-N 3.46Å; R468-L470 PolarHBondContact O-N 3.47Å; R468-L471 PolarHBondContact O-N 3Å; R468-L472 WeakPolarHBondContact O-CB 3.36Å; R468-L472 PolarHBondContact O-N 2.93Å
469	K	61.3	Low	71.4	Confident	107 Å²	107	63 Å²	63	47%	0.465	34%	0.343	S	S	.	.	H	α-helix	trans	-57.4	-36.8	177.5	-168.2	175.3	-176.5	172.2	0	112.3	A465 L466 V559	A465-K469 VanDerWaalsContact O-CB 3.26Å; A465-K469 WeakPolarHBondContact O-CB 3.48Å; A465-K469 PolarHBondContact O-N 3.17Å; L466-K469 PolarHBondContact O-N 3.47Å; K469-V559 HydrophobicContact CB-CG2 4.29Å; K469-V559 HydrophobicContact CD-CG2 4.46Å; K469-V559 HydrophobicContact CG-CG2 3.38Å; K469-V559 WeakPolarHBondContact O-CG2 3.49Å
470	L	61.2	Low	72.5	Confident	49 Å²	49	61 Å²	61	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-91.8	-19.1	-175.9	-68.9	170.7	0	0	0	114.3	A454 A458 L466 G467 R468 L557	A454-L470 HydrophobicContact CB-CD1 4.16Å; A454-L470 WeakPolarHBondContact O-CD1 3.5Å; A458-L470 HydrophobicContact CB-CB 3.65Å; A458-L470 HydrophobicContact CB-CD1 3.85Å; A458-L470 HydrophobicContact CB-CG 4.39Å; L466-L470 HydrophobicContact CD2-CD1 4.48Å; L466-L470 HydrophobicContact CG-CD1 3.99Å; L466-L470 WeakPolarHBondContact O-CB 3.29Å; L466-L470 WeakPolarHBondContact O-CG 3.34Å; L466-L470 PolarHBondContact O-N 2.87Å; G467-L470 PolarHBondContact O-N 3.12Å; R468-L470 PolarHBondContact O-N 3.47Å; L470-L557 WeakPolarHBondContact O-CD2 3.33Å
471	L	70	Confident	73.6	Confident	63 Å²	63	60.6 Å²	60.6	33%	0.33	34%	0.341	S	S	.	.	H	α-helix	trans	-114	-26.2	-172.8	-64.8	172.4	0	0	0	114.8	A458 L459 G467 R468 R473	A458-L471 HydrophobicContact CB-CD1 3.96Å; A458-L471 HydrophobicContact CB-CD2 4.34Å; A458-L471 HydrophobicContact CB-CG 3.86Å; L459-L471 HydrophobicContact CD2-CD1 4.2Å; L459-L471 HydrophobicContact CD2-CD2 4.25Å; L459-L471 HydrophobicContact CG-CD1 4.5Å; L459-L471 HydrophobicContact CG-CD2 4.35Å; G467-L471 WeakPolarHBondContact O-CB 3.32Å; G467-L471 WeakPolarHBondContact O-CG 3.47Å; G467-L471 PolarHBondContact O-N 2.83Å; R468-L471 PolarHBondContact O-N 3Å; L471-R473 PolarHBondContact O-N 3.02Å
472	L	76.3	Confident	74.6	Confident	34 Å²	34	64.6 Å²	64.6	18%	0.178	37%	0.365	C	S	.	.			trans	-69.5	123	-173.3	-167.8	76.5	0	0	0	110.7	R468 D476 I477 A558 A593 V595	R468-L472 WeakPolarHBondContact O-CB 3.36Å; R468-L472 PolarHBondContact O-N 2.93Å; L472-D476 HydrophobicContact CD1-CB 4.18Å; L472-I477 HydrophobicContact CD1-CG2 4.06Å; L472-I477 HydrophobicContact CD2-CD1 4.07Å; L472-I477 HydrophobicContact CD2-CG2 4.04Å; L472-I477 HydrophobicContact CG-CG2 4.28Å; L472-A558 HydrophobicContact CB-CB 4.16Å; L472-A558 HydrophobicContact CD2-CB 3.85Å; L472-A558 HydrophobicContact CG-CB 4.09Å; L472-A558 WeakPolarHBondContact O-CB 3.34Å; L472-A558 PolarHBondContact O-N 3.26Å; L472-A593 HydrophobicContact CD2-CB 3.51Å; L472-V595 HydrophobicContact CD2-CG2 3.56Å
473	R	86.6	Confident	76	Confident	125 Å²	125	65.5 Å²	65.5	47%	0.472	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-103.4	158.7	177.5	-65.4	178.3	-174	-104.1	1.7	110.8	L471 N475 D476 G555 I556 L557	L471-R473 PolarHBondContact O-N 3.02Å; R473-N475 VanDerWaalsContact C-N 3.3Å; R473-N475 WeakPolarHBondContact CB-OD1 3.45Å; R473-N475 PolarHBondContact O-N 2.92Å; R473-D476 PolarHBondContact N-OD2 3.34Å; R473-D476 WeakPolarHBondContact O-CB 3.44Å; R473-D476 PolarHBondContact O-N 3.21Å; R473-D476 VanDerWaalsContact O-N 3.11Å; R473-G555 PolarHBondContact NH1-O 3.48Å; R473-I556 WeakPolarHBondContact CA-O 3.49Å; R473-L557 HydrophobicContact CG-CD2 4.49Å
474	V	90.2	Very high	77.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-61.5	-38.1	-177.9	168.8	0	0	0	0	112.4	D476 I477 M478 V552 I556 A561 V575 L585	V474-D476 PolarHBondContact O-N 3.2Å; V474-I477 PolarHBondContact O-N 3.23Å; V474-I477 VanDerWaalsContact O-N 3.1Å; V474-M478 HydrophobicContact CG1-CB 4.19Å; V474-M478 WeakPolarHBondContact O-CB 3.48Å; V474-M478 PolarHBondContact O-N 3.42Å; V474-V552 HydrophobicContact CG1-CG2 4.32Å; V474-I556 HydrophobicContact CB-CG2 4.08Å; V474-I556 HydrophobicContact CG2-CG2 3.38Å; V474-I556 PolarHBondContact N-O 2.9Å; V474-A561 HydrophobicContact CG2-CB 3.54Å; V474-V575 HydrophobicContact CG1-CB 4.4Å; V474-V575 HydrophobicContact CG1-CG1 3.99Å; V474-V575 HydrophobicContact CG1-CG2 3.48Å; V474-V575 VanDerWaalsContact CG1-CG2 3.48Å; V474-L585 HydrophobicContact CG1-CB 4.25Å; V474-L585 HydrophobicContact CG1-CD2 4.05Å; V474-L585 HydrophobicContact CG2-CD2 3.82Å
475	N	92	Very high	79.6	Confident	74 Å²	74	61.7 Å²	61.7	40%	0.396	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-62.3	-20	176.7	64.2	-38.4	0	0	0	114.3	R473 I477 M478 P554	R473-N475 VanDerWaalsContact C-N 3.3Å; R473-N475 WeakPolarHBondContact CB-OD1 3.45Å; R473-N475 PolarHBondContact O-N 2.92Å; N475-I477 VanDerWaalsContact C-N 3.3Å; N475-M478 HydrophobicContact CB-CE 4.2Å; N475-P554 HydrophobicContact CB-CB 3.97Å; N475-P554 WeakPolarHBondContact CB-O 3.15Å; N475-P554 PolarHBondContact N-O 3.42Å; N475-P554 PolarHBondContact OD1-O 2.9Å
476	D	85.1	Confident	81.6	Confident	99 Å²	99	62.7 Å²	62.7	53%	0.529	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-78.2	-17.1	177.7	-55.9	-39.5	0	0	0	112.3	L472 R473 V474	L472-D476 HydrophobicContact CD1-CB 4.18Å; R473-D476 PolarHBondContact N-OD2 3.34Å; R473-D476 WeakPolarHBondContact O-CB 3.44Å; R473-D476 PolarHBondContact O-N 3.21Å; R473-D476 VanDerWaalsContact O-N 3.11Å; V474-D476 PolarHBondContact O-N 3.2Å
477	I	87.7	Confident	83.6	Confident	33 Å²	33	59 Å²	59	17%	0.169	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	-6.4	-170.2	60	167.1	0	0	0	115.2	L472 V474 N475 A558 L585 L590 A593	L472-I477 HydrophobicContact CD1-CG2 4.06Å; L472-I477 HydrophobicContact CD2-CD1 4.07Å; L472-I477 HydrophobicContact CD2-CG2 4.04Å; L472-I477 HydrophobicContact CG-CG2 4.28Å; V474-I477 PolarHBondContact O-N 3.23Å; V474-I477 VanDerWaalsContact O-N 3.1Å; N475-I477 VanDerWaalsContact C-N 3.3Å; I477-A558 HydrophobicContact CD1-CB 4.09Å; I477-L585 HydrophobicContact CD1-CD1 3.62Å; I477-L585 HydrophobicContact CG1-CD1 3.7Å; I477-L590 HydrophobicContact CD1-CD2 3.65Å; I477-L590 HydrophobicContact CD1-CG 4.31Å; I477-A593 HydrophobicContact CD1-CB 4.42Å; I477-A593 HydrophobicContact CG2-CB 3.87Å
478	M	92.1	Very high	85.3	Confident	33 Å²	33	64.2 Å²	64.2	16%	0.163	32%	0.321	C	S	.	.	S	Bend	trans	-71	149.5	179.6	69.1	-175.4	-176.1	0	0	112.3	V474 N475 T480 V575	V474-M478 HydrophobicContact CG1-CB 4.19Å; V474-M478 WeakPolarHBondContact O-CB 3.48Å; V474-M478 PolarHBondContact O-N 3.42Å; N475-M478 HydrophobicContact CB-CE 4.2Å; M478-T480 HydrophobicContact CE-CG2 3.61Å; M478-T480 HydrophobicContact CG-CG2 3.78Å; M478-T480 HydrophobicContact SD-CG2 4.36Å; M478-V575 HydrophobicContact CB-CG2 4.02Å; M478-V575 HydrophobicContact SD-CB 3.73Å; M478-V575 HydrophobicContact SD-CG1 3.52Å; M478-V575 VanDerWaalsContact SD-CG1 3.52Å; M478-V575 HydrophobicContact SD-CG2 3.91Å
479	H	93	Very high	86.7	Confident	36 Å²	36	63 Å²	63	17%	0.167	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-69.4	134.4	167	-70.3	-73.6	0	0	0	110.8	E483 L505 G583 V584 D589	H479-E483 HydrophobicContact CB-CB 3.94Å; H479-E483 IonicContact CE1-OE2 3.7Å; H479-E483 IonicContact CG-OE2 3.64Å; H479-E483 IonicContact ND1-OE2 2.89Å; H479-E483 PolarHBondContact ND1-OE2 2.96Å; H479-L505 HydrophobicContact CB-CD1 4.47Å; H479-G583 CarbonylContact O-C 3.52Å; H479-G583 WeakPolarHBondContact O-CA 3.47Å; H479-V584 WeakPolarHBondContact CB-O 3.15Å; H479-V584 PolarHBondContact N-O 3.19Å; H479-V584 PolarHBondContact O-N 3.13Å; H479-D589 IonicContact CD2-OD2 2.81Å; H479-D589 PolarHBondContact CD2-OD2 3.47Å; H479-D589 IonicContact NE2-OD1 2.59Å; H479-D589 PolarHBondContact NE2-OD1 3.5Å; H479-D589 IonicContact NE2-OD2 3.39Å; H479-D589 PolarHBondContact NE2-OD2 2.83Å
480	T	92.6	Very high	88.1	Confident	71 Å²	71	64 Å²	64	44%	0.436	33%	0.334	S	S	.	.			trans	-134.1	163.7	-175.7	60.8	0	0	0	0	112.8	M478 D482 E483	M478-T480 HydrophobicContact CE-CG2 3.61Å; M478-T480 HydrophobicContact CG-CG2 3.78Å; M478-T480 HydrophobicContact SD-CG2 4.36Å; T480-D482 PolarHBondContact O-N 3.3Å; T480-E483 WeakPolarHBondContact O-CB 3.35Å; T480-E483 PolarHBondContact O-N 3.09Å; T480-E483 VanDerWaalsContact O-N 3.11Å
481	G	90.5	Very high	89.6	Confident	49 Å²	49	62.3 Å²	62.3	51%	0.505	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	58.2	-127.8	176.2	0	0	0	0	0	112.4	E483 I484	G481-E483 PolarHBondContact O-N 2.89Å; G481-E483 VanDerWaalsContact O-N 3.13Å; G481-I484 WeakPolarHBondContact O-CB 3.32Å; G481-I484 WeakPolarHBondContact O-CG1 3.47Å; G481-I484 PolarHBondContact O-N 3.41Å
482	D	88.6	Confident	90.6	Very high	150 Å²	150	61.4 Å²	61.4	80%	0.802	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-63.3	-16.4	-179.2	-71.9	-22	0	0	0	113.1	T480 I484 K503	T480-D482 PolarHBondContact O-N 3.3Å; D482-I484 VanDerWaalsContact C-N 3.28Å; D482-I484 PolarHBondContact O-N 2.92Å; D482-K503 WeakPolarHBondContact O-CE 3.29Å; D482-K503 PolarHBondContact O-NZ 3.4Å
483	E	89.5	Confident	91.2	Very high	105 Å²	105	59.9 Å²	59.9	49%	0.491	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-76.3	-16.6	178.3	-60.7	-168	146.6	0	0	113.3	H479 T480 G481 P485	H479-E483 HydrophobicContact CB-CB 3.94Å; H479-E483 IonicContact CE1-OE2 3.7Å; H479-E483 IonicContact CG-OE2 3.64Å; H479-E483 IonicContact ND1-OE2 2.89Å; H479-E483 PolarHBondContact ND1-OE2 2.96Å; T480-E483 WeakPolarHBondContact O-CB 3.35Å; T480-E483 PolarHBondContact O-N 3.09Å; T480-E483 VanDerWaalsContact O-N 3.11Å; G481-E483 PolarHBondContact O-N 2.89Å; G481-E483 VanDerWaalsContact O-N 3.13Å; E483-P485 VanDerWaalsContact O-CD 3.26Å; E483-P485 WeakPolarHBondContact O-CD 3.33Å
484	I	94.1	Very high	91.2	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.026	33%	0.329	C	S	.	.	S	Bend	trans	-72	115.4	-177.9	-58.9	172.1	0	0	0	109.6	G481 D482 H486 M515 L581 V584	G481-I484 WeakPolarHBondContact O-CB 3.32Å; G481-I484 WeakPolarHBondContact O-CG1 3.47Å; G481-I484 PolarHBondContact O-N 3.41Å; D482-I484 VanDerWaalsContact C-N 3.28Å; D482-I484 PolarHBondContact O-N 2.92Å; I484-H486 PolarHBondContact O-N 3.44Å; I484-H486 VanDerWaalsContact O-N 3.14Å; I484-H486 PolarHBondContact O-ND1 3.11Å; I484-M515 HydrophobicContact CD1-CE 4.28Å; I484-M515 HydrophobicContact CG2-CE 4.39Å; I484-L581 HydrophobicContact CG2-CD2 3.48Å; I484-L581 VanDerWaalsContact CG2-CD2 3.48Å; I484-L581 HydrophobicContact CG2-CG 4.15Å; I484-V584 HydrophobicContact CG2-CG2 4.11Å
485	P	93.5	Very high	91.2	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.349	C	S	.	.			trans	-70.2	112.2	174.4	27.8	-32.1	0	0	0	109.3	E483 E499 K503 L505 M507 T508 V509	E483-P485 VanDerWaalsContact O-CD 3.26Å; E483-P485 WeakPolarHBondContact O-CD 3.33Å; P485-E499 HydrophobicContact CB-CG 4.37Å; P485-K503 HydrophobicContact CB-CB 3.8Å; P485-K503 HydrophobicContact CB-CG 3.7Å; P485-K503 HydrophobicContact CG-CB 4.33Å; P485-L505 HydrophobicContact CG-CB 4.42Å; P485-L505 HydrophobicContact CG-CD1 4.11Å; P485-M507 WeakPolarHBondContact CB-O 3.25Å; P485-M507 HydrophobicContact CG-CG 4.45Å; P485-M507 VanDerWaalsContact CG-O 3.23Å; P485-M507 WeakPolarHBondContact CG-O 3.42Å; P485-T508 WeakPolarHBondContact O-CA 3.34Å; P485-T508 PolarHBondContact O-OG1 3.32Å; P485-V509 PolarHBondContact O-N 3.3Å
486	H	95.2	Very high	91.1	Very high	71 Å²	71	63 Å²	63	33%	0.329	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	151	177.3	70.6	-77.5	0	0	0	113	I484 T508 V509 C511	I484-H486 PolarHBondContact O-N 3.44Å; I484-H486 VanDerWaalsContact O-N 3.14Å; I484-H486 PolarHBondContact O-ND1 3.11Å; H486-T508 WeakPolarHBondContact CA-OG1 3.47Å; H486-T508 PolarHBondContact N-OG1 2.94Å; H486-V509 CarbonylContact C-O 3.49Å; H486-V509 WeakPolarHBondContact CA-O 3.49Å; H486-V509 HydrophobicContact CB-CB 4.38Å; H486-V509 WeakPolarHBondContact CB-O 2.9Å; H486-C511 VanDerWaalsContact CD2-SG 3.58Å
487	V	95.3	Very high	91.3	Very high	16 Å²	16	60.4 Å²	60.4	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.4	175.7	-64.8	0	0	0	0	110.8	A491 A496 E499 T508 V509 I510 C511 I541	V487-A491 HydrophobicContact CB-CB 3.95Å; V487-A491 HydrophobicContact CG2-CB 4.21Å; V487-A496 HydrophobicContact CG2-CB 4.3Å; V487-E499 HydrophobicContact CG1-CB 3.87Å; V487-E499 HydrophobicContact CG1-CG 4.06Å; V487-T508 HydrophobicContact CG2-CG2 4.17Å; V487-V509 PolarHBondContact N-O 3.42Å; V487-I510 HydrophobicContact CG2-CG1 4.19Å; V487-I510 WeakPolarHBondContact O-CA 3.18Å; V487-C511 PolarHBondContact O-N 2.98Å; V487-I541 HydrophobicContact CG2-CG1 4.46Å
488	K	94.5	Very high	91.3	Very high	110 Å²	110	63.5 Å²	63.5	48%	0.478	33%	0.332	S	S	.	.			trans	-74.4	154.7	173.8	-59.6	-166.9	-171	-165.1	0	111.4	T490 A491 C511 D513	K488-T490 PolarHBondContact O-N 2.98Å; K488-T490 VanDerWaalsContact O-N 3.1Å; K488-A491 WeakPolarHBondContact O-CB 3.39Å; K488-A491 PolarHBondContact O-N 3.28Å; K488-C511 WeakPolarHBondContact CA-O 3.08Å; K488-D513 WeakPolarHBondContact CE-OD1 3.48Å; K488-D513 IonicContact NZ-OD1 3.41Å; K488-D513 PolarHBondContact NZ-OD1 3.3Å; K488-D513 IonicContact NZ-OD2 3.9Å
489	K	91.7	Very high	91.3	Very high	94 Å²	94	63.5 Å²	63.5	41%	0.409	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.6	174.6	-160.3	-164.2	-156.4	128.3	0	113.9	A491 I510 E518 I541 A542	K489-A491 VanDerWaalsContact C-N 3.26Å; K489-A491 PolarHBondContact O-N 2.94Å; K489-I510 HydrophobicContact CB-CG2 4.02Å; K489-I510 HydrophobicContact CG-CG2 4.3Å; K489-E518 WeakPolarHBondContact CD-OE2 3.43Å; K489-E518 VanDerWaalsContact CE-OE2 3.24Å; K489-E518 WeakPolarHBondContact CE-OE2 3.28Å; K489-E518 WeakPolarHBondContact CG-OE2 3.48Å; K489-E518 IonicContact NZ-OE2 2.7Å; K489-E518 PolarHBondContact NZ-OE2 3.24Å; K489-I541 WeakPolarHBondContact O-CG2 3.4Å; K489-A542 HydrophobicContact CG-CB 3.98Å
490	T	91.2	Very high	91	Very high	128 Å²	128	62 Å²	62	79%	0.785	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.6	178.6	58.3	0	0	0	0	113.8	K488	K488-T490 PolarHBondContact O-N 2.98Å; K488-T490 VanDerWaalsContact O-N 3.1Å
491	A	91.2	Very high	90.5	Very high	13 Å²	13	63.7 Å²	63.7	11%	0.107	34%	0.336	C	S	.	.			trans	-66.4	147.8	-179.7	0	0	0	0	0	111.5	V487 K488 K489 D495 S540 I541	V487-A491 HydrophobicContact CB-CB 3.95Å; V487-A491 HydrophobicContact CG2-CB 4.21Å; K488-A491 WeakPolarHBondContact O-CB 3.39Å; K488-A491 PolarHBondContact O-N 3.28Å; K489-A491 VanDerWaalsContact C-N 3.26Å; K489-A491 PolarHBondContact O-N 2.94Å; A491-D495 HydrophobicContact CB-CB 4.26Å; A491-S540 PolarHBondContact O-OG 2.93Å; A491-I541 HydrophobicContact CB-CG2 4.18Å; A491-I541 WeakPolarHBondContact O-CG2 3.46Å; A491-I541 PolarHBondContact O-N 2.85Å; A491-I541 VanDerWaalsContact O-N 3.07Å
492	S	91.4	Very high	90.2	Very high	44 Å²	44	70.4 Å²	70.4	31%	0.308	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-73.2	157.2	170.2	71.7	0	0	0	0	110.1	R494 D495 A496	S492-R494 PolarHBondContact O-N 3.1Å; S492-D495 WeakPolarHBondContact CB-OD2 3.46Å; S492-D495 PolarHBondContact N-OD2 2.92Å; S492-D495 VanDerWaalsContact N-OD2 3.17Å; S492-D495 PolarHBondContact O-N 2.92Å; S492-D495 VanDerWaalsContact O-N 3.07Å; S492-D495 PolarHBondContact OG-N 3.17Å; S492-D495 PolarHBondContact OG-OD2 3.31Å; S492-A496 PolarHBondContact O-N 3.1Å
493	L	88.7	Confident	90.2	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-56.7	-32.5	172	178.6	54.8	0	0	0	112.1	A496 L497 F521 V529 V536 L539 I541 V544	L493-A496 PolarHBondContact O-N 2.92Å; L493-L497 HydrophobicContact CD1-CD1 4.46Å; L493-L497 HydrophobicContact CD1-CG 4.32Å; L493-L497 HydrophobicContact CG-CD1 4.23Å; L493-L497 VanDerWaalsContact O-CG 3.29Å; L493-L497 WeakPolarHBondContact O-CG 3.38Å; L493-L497 PolarHBondContact O-N 3.19Å; L493-F521 HydrophobicContact CD1-CE1 3.88Å; L493-F521 HydrophobicContact CD1-CE2 4Å; L493-F521 HydrophobicContact CD1-CZ 3.5Å; L493-V529 HydrophobicContact CD2-CG1 4.1Å; L493-V536 HydrophobicContact CD2-CG1 3.41Å; L493-V536 VanDerWaalsContact CD2-CG1 3.41Å; L493-V536 HydrophobicContact CG-CG1 4.3Å; L493-L539 HydrophobicContact CB-CB 4.49Å; L493-L539 WeakPolarHBondContact CB-O 3.33Å; L493-L539 HydrophobicContact CD2-CB 4.24Å; L493-L539 HydrophobicContact CD2-CD1 4.49Å; L493-L539 PolarHBondContact N-O 3.47Å; L493-L539 VanDerWaalsContact N-O 3.16Å; L493-I541 HydrophobicContact CD1-CD1 4.17Å; L493-V544 HydrophobicContact CD1-CG2 4.07Å
494	R	87.3	Confident	89.8	Confident	189 Å²	189	67.3 Å²	67.3	71%	0.713	33%	0.33	S	S	*	.	H	α-helix	trans	-62.1	-43.7	175	-179.1	-176.4	174	-172.7	-2.4	112.3	S492 A496 L497 L498	S492-R494 PolarHBondContact O-N 3.1Å; R494-A496 VanDerWaalsContact C-N 3.34Å; R494-L497 PolarHBondContact O-N 2.9Å; R494-L498 HydrophobicContact CG-CD1 4.35Å; R494-L498 WeakPolarHBondContact O-CG 3.39Å; R494-L498 PolarHBondContact O-N 3.43Å
495	D	90.3	Very high	89.3	Confident	77 Å²	77	67.6 Å²	67.6	41%	0.412	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-41.1	-179.8	-57.4	-42.6	0	0	0	110.6	A491 S492 L497 L498 E499	A491-D495 HydrophobicContact CB-CB 4.26Å; S492-D495 WeakPolarHBondContact CB-OD2 3.46Å; S492-D495 PolarHBondContact N-OD2 2.92Å; S492-D495 VanDerWaalsContact N-OD2 3.17Å; S492-D495 PolarHBondContact O-N 2.92Å; S492-D495 VanDerWaalsContact O-N 3.07Å; S492-D495 PolarHBondContact OG-N 3.17Å; S492-D495 PolarHBondContact OG-OD2 3.31Å; D495-L497 PolarHBondContact O-N 3.25Å; D495-L498 PolarHBondContact O-N 2.71Å; D495-E499 PolarHBondContact O-N 3.39Å
496	A	90.6	Very high	88.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-43.9	174.3	0	0	0	0	0	112.2	V487 S492 L493 R494 L498 E499 V500 T508 I541	V487-A496 HydrophobicContact CG2-CB 4.3Å; S492-A496 PolarHBondContact O-N 3.1Å; L493-A496 PolarHBondContact O-N 2.92Å; R494-A496 VanDerWaalsContact C-N 3.34Å; A496-L498 VanDerWaalsContact C-N 3.35Å; A496-L498 PolarHBondContact O-N 3.15Å; A496-E499 PolarHBondContact O-N 3.49Å; A496-V500 VanDerWaalsContact O-CG2 3.28Å; A496-V500 WeakPolarHBondContact O-CG2 3.47Å; A496-V500 PolarHBondContact O-N 3.34Å; A496-T508 HydrophobicContact CB-CG2 4.03Å; A496-I541 HydrophobicContact CB-CD1 3.41Å; A496-I541 VanDerWaalsContact CB-CD1 3.41Å; A496-I541 HydrophobicContact CB-CG1 3.94Å
497	L	87.8	Confident	88.7	Confident	43 Å²	43	65.2 Å²	65.2	23%	0.225	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-38.2	177.4	-73.3	171.3	0	0	0	113.1	L493 R494 D495 E499 T501 F521 L526	L493-L497 HydrophobicContact CD1-CD1 4.46Å; L493-L497 HydrophobicContact CD1-CG 4.32Å; L493-L497 HydrophobicContact CG-CD1 4.23Å; L493-L497 VanDerWaalsContact O-CG 3.29Å; L493-L497 WeakPolarHBondContact O-CG 3.38Å; L493-L497 PolarHBondContact O-N 3.19Å; R494-L497 PolarHBondContact O-N 2.9Å; D495-L497 PolarHBondContact O-N 3.25Å; L497-E499 VanDerWaalsContact C-N 3.34Å; L497-T501 WeakPolarHBondContact O-CB 3.42Å; L497-T501 PolarHBondContact O-N 3.08Å; L497-T501 VanDerWaalsContact O-N 3.09Å; L497-T501 PolarHBondContact O-OG1 3.29Å; L497-F521 HydrophobicContact CD2-CE1 4.07Å; L497-L526 HydrophobicContact CD1-CD1 4.09Å; L497-L526 HydrophobicContact CD2-CD1 3.76Å; L497-L526 HydrophobicContact CD2-CD2 3.49Å; L497-L526 VanDerWaalsContact CD2-CD2 3.49Å; L497-L526 HydrophobicContact CD2-CG 4.1Å; L497-L526 HydrophobicContact CG-CD1 4.46Å
498	L	88.3	Confident	88.7	Confident	99 Å²	99	64.4 Å²	64.4	52%	0.518	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-42	173.7	-74.9	170.1	0	0	0	110.9	R494 D495 A496 T501 R502	R494-L498 HydrophobicContact CG-CD1 4.35Å; R494-L498 WeakPolarHBondContact O-CG 3.39Å; R494-L498 PolarHBondContact O-N 3.43Å; D495-L498 PolarHBondContact O-N 2.71Å; A496-L498 VanDerWaalsContact C-N 3.35Å; A496-L498 PolarHBondContact O-N 3.15Å; L498-T501 PolarHBondContact O-N 3.17Å; L498-R502 WeakPolarHBondContact O-CB 3.5Å; L498-R502 PolarHBondContact O-N 3.06Å
499	E	91.4	Very high	88.8	Confident	32 Å²	32	59.2 Å²	59.2	15%	0.15	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-45.7	178.7	-167.2	61.2	-158.4	0	0	112.2	P485 V487 D495 A496 L497 T501 R502 K503	P485-E499 HydrophobicContact CB-CG 4.37Å; V487-E499 HydrophobicContact CG1-CB 3.87Å; V487-E499 HydrophobicContact CG1-CG 4.06Å; D495-E499 PolarHBondContact O-N 3.39Å; A496-E499 PolarHBondContact O-N 3.49Å; L497-E499 VanDerWaalsContact C-N 3.34Å; E499-T501 VanDerWaalsContact C-N 3.29Å; E499-T501 PolarHBondContact O-N 3.49Å; E499-R502 PolarHBondContact O-N 3.18Å; E499-R502 VanDerWaalsContact O-N 3.16Å; E499-K503 PolarHBondContact O-N 3.26Å; E499-K503 WeakPolarHBondContact OE1-CE 3.49Å; E499-K503 WeakPolarHBondContact OE1-CG 3.48Å; E499-K503 IonicContact OE1-NZ 3.36Å
500	V	88.1	Confident	89	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-53.9	-48.1	174.4	171	0	0	0	0	110.9	A496 N504 T508 D523	A496-V500 VanDerWaalsContact O-CG2 3.28Å; A496-V500 WeakPolarHBondContact O-CG2 3.47Å; A496-V500 PolarHBondContact O-N 3.34Å; V500-N504 PolarHBondContact O-N 3.4Å; V500-T508 HydrophobicContact CG2-CG2 3.86Å; V500-D523 WeakPolarHBondContact CG1-OD1 3.23Å
501	T	80.5	Confident	89.1	Confident	108 Å²	108	48.7 Å²	48.7	66%	0.663	24%	0.241	S	C	*	.	H	α-helix	trans	-66.2	-41.4	179.8	-53.7	0	0	0	0	111.4	L497 L498 E499 N504	L497-T501 WeakPolarHBondContact O-CB 3.42Å; L497-T501 PolarHBondContact O-N 3.08Å; L497-T501 VanDerWaalsContact O-N 3.09Å; L497-T501 PolarHBondContact O-OG1 3.29Å; L498-T501 PolarHBondContact O-N 3.17Å; E499-T501 VanDerWaalsContact C-N 3.29Å; E499-T501 PolarHBondContact O-N 3.49Å; T501-N504 PolarHBondContact O-N 2.85Å
502	R	85.9	Confident	89.2	Confident	190 Å²	190	50.6 Å²	50.6	72%	0.717	25%	0.25	S	C	*	.	H	α-helix	trans	-66.7	-38.6	-176.2	-174.5	179.9	-177.1	-168.3	0.6	112.5	L498 E499	L498-R502 WeakPolarHBondContact O-CB 3.5Å; L498-R502 PolarHBondContact O-N 3.06Å; E499-R502 PolarHBondContact O-N 3.18Å; E499-R502 VanDerWaalsContact O-N 3.16Å
503	K	86.9	Confident	89.1	Confident	52 Å²	52	54.4 Å²	54.4	23%	0.226	27%	0.267	C	S	.	.	H	α-helix	trans	-90.2	-15.4	-179.2	-58.1	-58.8	-178.7	-178.5	0	113.5	D482 P485 E499 L505	D482-K503 WeakPolarHBondContact O-CE 3.29Å; D482-K503 PolarHBondContact O-NZ 3.4Å; P485-K503 HydrophobicContact CB-CB 3.8Å; P485-K503 HydrophobicContact CB-CG 3.7Å; P485-K503 HydrophobicContact CG-CB 4.33Å; E499-K503 PolarHBondContact O-N 3.26Å; E499-K503 WeakPolarHBondContact OE1-CE 3.49Å; E499-K503 WeakPolarHBondContact OE1-CG 3.48Å; E499-K503 IonicContact OE1-NZ 3.36Å; K503-L505 PolarHBondContact O-N 3.05Å
504	N	82.7	Confident	89.2	Confident	138 Å²	138	59.7 Å²	59.7	74%	0.738	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	31.8	174.7	-162.1	35.2	0	0	0	114.3	V500 T501	V500-N504 PolarHBondContact O-N 3.4Å; T501-N504 PolarHBondContact O-N 2.85Å
505	L	83.6	Confident	89.5	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.058	27%	0.271	C	S	.	.	S	Bend	trans	-107.6	7.8	176.4	-58.2	-174	0	0	0	113	H479 P485 K503 M507 S572 V584 H586	H479-L505 HydrophobicContact CB-CD1 4.47Å; P485-L505 HydrophobicContact CG-CB 4.42Å; P485-L505 HydrophobicContact CG-CD1 4.11Å; K503-L505 PolarHBondContact O-N 3.05Å; L505-M507 HydrophobicContact CB-CG 4.46Å; L505-M507 PolarHBondContact O-N 3.32Å; L505-M507 VanDerWaalsContact O-N 3.1Å; L505-S572 PolarHBondContact O-OG 3.03Å; L505-V584 HydrophobicContact CD1-CB 4.4Å; L505-V584 HydrophobicContact CD1-CG1 4.03Å; L505-H586 HydrophobicContact CD2-CB 4.02Å
506	G	83.9	Confident	89.7	Confident	18 Å²	18	52.3 Å²	52.3	19%	0.186	27%	0.268	C	S	.	.	S	Bend	trans	64.5	12.5	179	0	0	0	0	0	114.9	T522 D523	G506-T522 WeakPolarHBondContact O-CA 3.48Å; G506-D523 WeakPolarHBondContact CA-OD2 3.5Å; G506-D523 PolarHBondContact O-N 3.38Å
507	M	91.7	Very high	89.9	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	161.5	-175	74.1	139.4	-62.3	0	0	112.9	P485 L505 V509 I520 F521 T522 V584	P485-M507 WeakPolarHBondContact CB-O 3.25Å; P485-M507 HydrophobicContact CG-CG 4.45Å; P485-M507 VanDerWaalsContact CG-O 3.23Å; P485-M507 WeakPolarHBondContact CG-O 3.42Å; L505-M507 HydrophobicContact CB-CG 4.46Å; L505-M507 PolarHBondContact O-N 3.32Å; L505-M507 VanDerWaalsContact O-N 3.1Å; M507-V509 HydrophobicContact CE-CB 4.38Å; M507-V509 HydrophobicContact CE-CG2 3.4Å; M507-V509 VanDerWaalsContact CE-CG2 3.4Å; M507-I520 HydrophobicContact CE-CD1 3.43Å; M507-I520 VanDerWaalsContact CE-CD1 3.43Å; M507-I520 HydrophobicContact CE-CG1 3.52Å; M507-I520 HydrophobicContact SD-CD1 3.73Å; M507-I520 HydrophobicContact SD-CG1 4.41Å; M507-F521 CarbonylContact C-O 3.6Å; M507-F521 VanDerWaalsContact CA-O 3.24Å; M507-F521 WeakPolarHBondContact CA-O 3.29Å; M507-T522 HydrophobicContact CB-CG2 3.97Å; M507-V584 HydrophobicContact SD-CG1 4.08Å
508	T	94.9	Very high	90.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142.1	166.8	-170.4	0	0	0	0	110.8	P485 H486 V487 A496 V500 F521	P485-T508 WeakPolarHBondContact O-CA 3.34Å; P485-T508 PolarHBondContact O-OG1 3.32Å; H486-T508 WeakPolarHBondContact CA-OG1 3.47Å; H486-T508 PolarHBondContact N-OG1 2.94Å; V487-T508 HydrophobicContact CG2-CG2 4.17Å; A496-T508 HydrophobicContact CB-CG2 4.03Å; V500-T508 HydrophobicContact CG2-CG2 3.86Å; T508-F521 HydrophobicContact CG2-CB 4.18Å; T508-F521 PolarHBondContact N-O 2.94Å; T508-F521 PolarHBondContact O-N 2.97Å
509	V	95.8	Very high	90.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132.9	177.7	-171.4	0	0	0	0	109.1	P485 H486 V487 M507 I517 M574 L581 V584	P485-V509 PolarHBondContact O-N 3.3Å; H486-V509 CarbonylContact C-O 3.49Å; H486-V509 WeakPolarHBondContact CA-O 3.49Å; H486-V509 HydrophobicContact CB-CB 4.38Å; H486-V509 WeakPolarHBondContact CB-O 2.9Å; V487-V509 PolarHBondContact N-O 3.42Å; M507-V509 HydrophobicContact CE-CB 4.38Å; M507-V509 HydrophobicContact CE-CG2 3.4Å; M507-V509 VanDerWaalsContact CE-CG2 3.4Å; V509-I517 HydrophobicContact CG1-CG1 4.19Å; V509-I517 HydrophobicContact CG1-CG2 4.06Å; V509-M574 HydrophobicContact CB-SD 4.37Å; V509-M574 HydrophobicContact CG1-SD 3.69Å; V509-M574 HydrophobicContact CG2-CG 3.81Å; V509-M574 HydrophobicContact CG2-SD 3.74Å; V509-L581 HydrophobicContact CB-CD2 3.78Å; V509-L581 HydrophobicContact CG1-CD2 3.8Å; V509-L581 HydrophobicContact CG2-CD1 4.21Å; V509-L581 HydrophobicContact CG2-CD2 3.82Å; V509-V584 HydrophobicContact CG2-CG2 4.31Å
510	I	96	Very high	90.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.7	171.6	-62.2	77.4	0	0	0	106.9	V487 K489 E518 G519 F521 I541 M545	V487-I510 HydrophobicContact CG2-CG1 4.19Å; V487-I510 WeakPolarHBondContact O-CA 3.18Å; K489-I510 HydrophobicContact CB-CG2 4.02Å; K489-I510 HydrophobicContact CG-CG2 4.3Å; I510-E518 HydrophobicContact CG2-CB 4.31Å; I510-E518 PolarHBondContact O-N 3.44Å; I510-G519 PolarHBondContact N-O 3.45Å; I510-G519 PolarHBondContact O-N 2.94Å; I510-F521 HydrophobicContact CD1-CB 3.94Å; I510-I541 HydrophobicContact CD1-CG1 3.94Å; I510-I541 HydrophobicContact CG1-CG1 3.74Å; I510-I541 HydrophobicContact CG1-CG2 4.13Å; I510-M545 HydrophobicContact CB-SD 3.85Å; I510-M545 HydrophobicContact CD1-CB 3.77Å; I510-M545 HydrophobicContact CD1-SD 4.27Å; I510-M545 HydrophobicContact CG1-CB 4.24Å; I510-M545 HydrophobicContact CG1-SD 3.85Å; I510-M545 HydrophobicContact CG2-SD 3.83Å
511	C	94.4	Very high	90.9	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	162.3	179.8	63.4	0	0	0	0	113	H486 V487 K488 M516	H486-C511 VanDerWaalsContact CD2-SG 3.58Å; V487-C511 PolarHBondContact O-N 2.98Å; K488-C511 WeakPolarHBondContact CA-O 3.08Å; C511-M516 WeakPolarHBondContact CA-O 3.44Å; C511-M516 WeakPolarHBondContact CB-O 3.14Å
512	D	92.8	Very high	91.3	Very high	53 Å²	53	45.1 Å²	45.1	28%	0.283	23%	0.226	S	C	.	.			trans	-81.8	-175.4	174.1	78.5	-5.7	0	0	0	112.5	N514 M515 M516	D512-N514 PolarHBondContact O-N 2.78Å; D512-N514 VanDerWaalsContact OD1-C 3.27Å; D512-N514 VanDerWaalsContact OD1-CA 3.31Å; D512-N514 WeakPolarHBondContact OD1-CA 3.42Å; D512-N514 WeakPolarHBondContact OD1-CB 3.47Å; D512-N514 PolarHBondContact OD1-N 3.04Å; D512-M515 PolarHBondContact O-N 3.34Å; D512-M515 VanDerWaalsContact O-N 3.09Å; D512-M515 PolarHBondContact OD1-N 2.71Å; D512-M515 VanDerWaalsContact OD1-N 3.15Å; D512-M516 PolarHBondContact N-O 2.88Å; D512-M516 VanDerWaalsContact OD1-CB 3.3Å; D512-M516 WeakPolarHBondContact OD1-CB 3.35Å; D512-M516 WeakPolarHBondContact OD1-CG 3.3Å; D512-M516 PolarHBondContact OD1-N 2.91Å
513	D	89.2	Confident	91.1	Very high	125 Å²	125	40.3 Å²	40.3	67%	0.668	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.5	178.9	-68.7	-19.9	0	0	0	113.8	K488	K488-D513 WeakPolarHBondContact CE-OD1 3.48Å; K488-D513 IonicContact NZ-OD1 3.41Å; K488-D513 PolarHBondContact NZ-OD1 3.3Å; K488-D513 IonicContact NZ-OD2 3.9Å
514	N	91.7	Very high	90.6	Very high	111 Å²	111	39.2 Å²	39.2	59%	0.594	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	15.9	176.7	-58.5	-51.6	0	0	0	112	D512 M516 H580	D512-N514 PolarHBondContact O-N 2.78Å; D512-N514 VanDerWaalsContact OD1-C 3.27Å; D512-N514 VanDerWaalsContact OD1-CA 3.31Å; D512-N514 WeakPolarHBondContact OD1-CA 3.42Å; D512-N514 WeakPolarHBondContact OD1-CB 3.47Å; D512-N514 PolarHBondContact OD1-N 3.04Å; N514-M516 HydrophobicContact CB-CG 4.07Å; N514-M516 PolarHBondContact O-N 3.45Å; N514-H580 PolarHBondContact O-CE1 2.93Å; N514-H580 PolarHBondContact O-ND1 3.17Å
515	M	92.4	Very high	90.6	Very high	42 Å²	42	33 Å²	33	21%	0.207	19%	0.185	C	C	.	.			trans	60	27.4	-177.3	-60.4	-70.2	-75.8	0	0	113.5	I484 D512 L581	I484-M515 HydrophobicContact CD1-CE 4.28Å; I484-M515 HydrophobicContact CG2-CE 4.39Å; D512-M515 PolarHBondContact O-N 3.34Å; D512-M515 VanDerWaalsContact O-N 3.09Å; D512-M515 PolarHBondContact OD1-N 2.71Å; D512-M515 VanDerWaalsContact OD1-N 3.15Å; M515-L581 HydrophobicContact CB-CB 4.42Å; M515-L581 HydrophobicContact CE-CB 4.41Å; M515-L581 HydrophobicContact CE-CD2 3.92Å; M515-L581 HydrophobicContact CE-CG 4.37Å; M515-L581 WeakPolarHBondContact O-CB 3.46Å; M515-L581 PolarHBondContact O-N 3.29Å
516	M	94.9	Very high	90.6	Very high	70 Å²	70	34 Å²	34	35%	0.345	19%	0.19	S	C	.	.	B	Isolated β-bridge	trans	-80.8	125.8	175.6	-57.6	-61.9	-72.1	0	0	110	C511 D512 N514 E518 D579 H580	C511-M516 WeakPolarHBondContact CA-O 3.44Å; C511-M516 WeakPolarHBondContact CB-O 3.14Å; D512-M516 PolarHBondContact N-O 2.88Å; D512-M516 VanDerWaalsContact OD1-CB 3.3Å; D512-M516 WeakPolarHBondContact OD1-CB 3.35Å; D512-M516 WeakPolarHBondContact OD1-CG 3.3Å; D512-M516 PolarHBondContact OD1-N 2.91Å; N514-M516 HydrophobicContact CB-CG 4.07Å; N514-M516 PolarHBondContact O-N 3.45Å; M516-E518 PolarHBondContact O-N 3.19Å; M516-D579 CarbonylContact C-O 3.58Å; M516-D579 WeakPolarHBondContact CA-O 3.23Å; M516-D579 HydrophobicContact CE-CB 3.47Å; M516-D579 VanDerWaalsContact CE-CB 3.47Å; M516-H580 HydrophobicContact SD-CB 4Å
517	I	95.3	Very high	90.1	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.062	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.7	-173.1	-59.2	166.8	0	0	0	110.4	V509 R551 M574 A576 D579 L581	V509-I517 HydrophobicContact CG1-CG1 4.19Å; V509-I517 HydrophobicContact CG1-CG2 4.06Å; I517-R551 HydrophobicContact CD1-CG 4.43Å; I517-M574 HydrophobicContact CD1-CB 4.5Å; I517-M574 HydrophobicContact CD1-SD 4.15Å; I517-M574 HydrophobicContact CG2-CE 4.28Å; I517-M574 HydrophobicContact CG2-SD 3.87Å; I517-A576 HydrophobicContact CD1-CB 3.75Å; I517-D579 WeakPolarHBondContact CG1-O 3.34Å; I517-D579 PolarHBondContact N-O 3.45Å; I517-L581 HydrophobicContact CD1-CB 4.06Å; I517-L581 HydrophobicContact CD1-CD1 3.94Å; I517-L581 HydrophobicContact CG1-CB 3.77Å; I517-L581 HydrophobicContact CG1-CD1 4.25Å
518	E	94.2	Very high	89.4	Confident	62 Å²	62	47.7 Å²	47.7	29%	0.29	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-30.7	172.4	-62.7	-166.9	-162.4	0	0	112.8	K489 I510 M516 G548	K489-E518 WeakPolarHBondContact CD-OE2 3.43Å; K489-E518 VanDerWaalsContact CE-OE2 3.24Å; K489-E518 WeakPolarHBondContact CE-OE2 3.28Å; K489-E518 WeakPolarHBondContact CG-OE2 3.48Å; K489-E518 IonicContact NZ-OE2 2.7Å; K489-E518 PolarHBondContact NZ-OE2 3.24Å; I510-E518 HydrophobicContact CG2-CB 4.31Å; I510-E518 PolarHBondContact O-N 3.44Å; M516-E518 PolarHBondContact O-N 3.19Å; E518-G548 PolarHBondContact O-N 3.34Å
519	G	94.1	Very high	88.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	179.6	-177.4	0	0	0	0	0	114.1	I510 T546 G548	I510-G519 PolarHBondContact N-O 3.45Å; I510-G519 PolarHBondContact O-N 2.94Å; G519-T546 CarbonylContact C-O 3.55Å; G519-T546 WeakPolarHBondContact CA-O 3.43Å; G519-G548 CarbonylContact C-O 3.38Å; G519-G548 WeakPolarHBondContact CA-O 3.17Å
520	I	94.5	Very high	87.8	Confident	22 Å²	22	54 Å²	54	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.9	176.3	-175	167.8	0	0	0	110.2	M507 T522 T546 M574	M507-I520 HydrophobicContact CE-CD1 3.43Å; M507-I520 VanDerWaalsContact CE-CD1 3.43Å; M507-I520 HydrophobicContact CE-CG1 3.52Å; M507-I520 HydrophobicContact SD-CD1 3.73Å; M507-I520 HydrophobicContact SD-CG1 4.41Å; I520-T522 HydrophobicContact CD1-CG2 4.12Å; I520-T522 HydrophobicContact CG1-CG2 4.05Å; I520-T546 HydrophobicContact CG2-CG2 4.37Å; I520-T546 PolarHBondContact N-O 3.35Å; I520-T546 PolarHBondContact O-N 3.44Å; I520-M574 HydrophobicContact CB-CE 4.43Å; I520-M574 HydrophobicContact CD1-CE 4.44Å
521	F	93.1	Very high	86.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	133	170.2	-176.7	-99.8	0	0	0	110.2	L493 L497 M507 T508 I510 D525 L526 V529 I541 V544	L493-F521 HydrophobicContact CD1-CE1 3.88Å; L493-F521 HydrophobicContact CD1-CE2 4Å; L493-F521 HydrophobicContact CD1-CZ 3.5Å; L497-F521 HydrophobicContact CD2-CE1 4.07Å; M507-F521 CarbonylContact C-O 3.6Å; M507-F521 VanDerWaalsContact CA-O 3.24Å; M507-F521 WeakPolarHBondContact CA-O 3.29Å; T508-F521 HydrophobicContact CG2-CB 4.18Å; T508-F521 PolarHBondContact N-O 2.94Å; T508-F521 PolarHBondContact O-N 2.97Å; I510-F521 HydrophobicContact CD1-CB 3.94Å; F521-D525 HydrophobicContact CD2-CB 3.68Å; F521-D525 HydrophobicContact CE2-CB 3.59Å; F521-D525 HydrophobicContact CZ-CB 4.35Å; F521-L526 HydrophobicContact CE1-CB 4.34Å; F521-L526 HydrophobicContact CZ-CB 3.89Å; F521-L526 HydrophobicContact CZ-CD1 4.25Å; F521-V529 HydrophobicContact CE2-CG2 4.38Å; F521-I541 HydrophobicContact CB-CD1 3.75Å; F521-I541 HydrophobicContact CB-CG1 4.47Å; F521-I541 HydrophobicContact CD1-CD1 3.99Å; F521-I541 HydrophobicContact CD2-CD1 3.82Å; F521-I541 HydrophobicContact CE2-CD1 4.43Å; F521-I541 HydrophobicContact CG-CD1 3.57Å; F521-V544 HydrophobicContact CD2-CG2 4.13Å; F521-V544 HydrophobicContact CE2-CB 4.45Å; F521-V544 HydrophobicContact CE2-CG2 3.89Å
522	T	88.9	Confident	85.7	Confident	39 Å²	39	67 Å²	67	24%	0.239	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	164	-174.9	66.6	0	0	0	0	112	G506 M507 I520 G524 D525 L526	G506-T522 WeakPolarHBondContact O-CA 3.48Å; M507-T522 HydrophobicContact CB-CG2 3.97Å; I520-T522 HydrophobicContact CD1-CG2 4.12Å; I520-T522 HydrophobicContact CG1-CG2 4.05Å; T522-G524 PolarHBondContact O-N 2.93Å; T522-G524 VanDerWaalsContact O-N 3.14Å; T522-G524 PolarHBondContact OG1-N 3.4Å; T522-D525 WeakPolarHBondContact CB-OD2 3.31Å; T522-D525 PolarHBondContact N-OD2 3.18Å; T522-D525 WeakPolarHBondContact O-CA 3.35Å; T522-D525 WeakPolarHBondContact O-CB 3.32Å; T522-D525 PolarHBondContact O-N 2.94Å; T522-D525 PolarHBondContact OG1-N 3.34Å; T522-D525 PolarHBondContact OG1-OD2 3.15Å; T522-L526 PolarHBondContact O-N 3.38Å; T522-L526 VanDerWaalsContact O-N 3.09Å
523	D	82.1	Confident	84.4	Confident	88 Å²	88	68 Å²	68	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-55.6	-30.1	170.6	-75	-22.9	0	0	0	112.6	V500 G506 L526 R527	V500-D523 WeakPolarHBondContact CG1-OD1 3.23Å; G506-D523 WeakPolarHBondContact CA-OD2 3.5Å; G506-D523 PolarHBondContact O-N 3.38Å; D523-L526 WeakPolarHBondContact O-CB 3.37Å; D523-L526 PolarHBondContact O-N 3.45Å; D523-R527 PolarHBondContact O-N 2.84Å
524	G	76.7	Confident	83.5	Confident	30 Å²	30	65.5 Å²	65.5	31%	0.309	34%	0.343	S	S	.	.	H	α-helix	trans	-72	-28.9	174.8	0	0	0	0	0	113.9	T522 R528	T522-G524 PolarHBondContact O-N 2.93Å; T522-G524 VanDerWaalsContact O-N 3.14Å; T522-G524 PolarHBondContact OG1-N 3.4Å; G524-R528 PolarHBondContact O-NE 3.35Å; G524-R528 VanDerWaalsContact O-NE 3.12Å
525	D	83	Confident	82.7	Confident	7 Å²	7	63.2 Å²	63.2	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-71.6	-41.6	170.8	-62.1	-59.7	0	0	0	110.4	F521 T522 R527 R528 V529 T546	F521-D525 HydrophobicContact CD2-CB 3.68Å; F521-D525 HydrophobicContact CE2-CB 3.59Å; F521-D525 HydrophobicContact CZ-CB 4.35Å; T522-D525 WeakPolarHBondContact CB-OD2 3.31Å; T522-D525 PolarHBondContact N-OD2 3.18Å; T522-D525 WeakPolarHBondContact O-CA 3.35Å; T522-D525 WeakPolarHBondContact O-CB 3.32Å; T522-D525 PolarHBondContact O-N 2.94Å; T522-D525 PolarHBondContact OG1-N 3.34Å; T522-D525 PolarHBondContact OG1-OD2 3.15Å; D525-R527 VanDerWaalsContact C-N 3.29Å; D525-R527 PolarHBondContact O-N 2.83Å; D525-R528 WeakPolarHBondContact O-CA 3.31Å; D525-R528 WeakPolarHBondContact O-CB 3.36Å; D525-R528 PolarHBondContact O-N 3.12Å; D525-R528 IonicContact OD1-CZ 3.44Å; D525-R528 IonicContact OD1-NH1 2.72Å; D525-R528 PolarHBondContact OD1-NH1 2.83Å; D525-R528 IonicContact OD1-NH2 3.33Å; D525-R528 PolarHBondContact OD1-NH2 3.45Å; D525-V529 WeakPolarHBondContact O-CG2 3.34Å; D525-V529 PolarHBondContact O-N 2.82Å; D525-T546 PolarHBondContact OD1-OG1 3.14Å
526	L	82.6	Confident	81.8	Confident	32 Å²	32	63 Å²	63	17%	0.168	33%	0.331	C	S	.	.	H	α-helix	trans	-53.5	-46.2	177.8	-179.8	61.1	0	0	0	112.2	L497 F521 T522 D523 R528 V529 F530	L497-L526 HydrophobicContact CD1-CD1 4.09Å; L497-L526 HydrophobicContact CD2-CD1 3.76Å; L497-L526 HydrophobicContact CD2-CD2 3.49Å; L497-L526 VanDerWaalsContact CD2-CD2 3.49Å; L497-L526 HydrophobicContact CD2-CG 4.1Å; L497-L526 HydrophobicContact CG-CD1 4.46Å; F521-L526 HydrophobicContact CE1-CB 4.34Å; F521-L526 HydrophobicContact CZ-CB 3.89Å; F521-L526 HydrophobicContact CZ-CD1 4.25Å; T522-L526 PolarHBondContact O-N 3.38Å; T522-L526 VanDerWaalsContact O-N 3.09Å; D523-L526 WeakPolarHBondContact O-CB 3.37Å; D523-L526 PolarHBondContact O-N 3.45Å; L526-R528 VanDerWaalsContact C-N 3.29Å; L526-R528 PolarHBondContact O-N 3.03Å; L526-V529 PolarHBondContact O-N 3.25Å; L526-F530 HydrophobicContact CD1-CD2 3.89Å; L526-F530 HydrophobicContact CD1-CE2 3.43Å; L526-F530 VanDerWaalsContact CD1-CE2 3.43Å; L526-F530 HydrophobicContact CD1-CZ 4.36Å; L526-F530 HydrophobicContact CD2-CE2 4.18Å; L526-F530 HydrophobicContact CG-CD2 3.95Å; L526-F530 HydrophobicContact CG-CE2 3.67Å; L526-F530 VanDerWaalsContact O-CD2 3.29Å; L526-F530 WeakPolarHBondContact O-CD2 3.41Å; L526-F530 PolarHBondContact O-N 3.38Å; L526-F530 VanDerWaalsContact O-N 3.14Å
527	R	73.8	Confident	80.7	Confident	175 Å²	175	69.7 Å²	69.7	66%	0.66	35%	0.353	S	S	*	.	H	α-helix	trans	-56.5	-43.6	176.4	-174.7	174.8	65.1	-175.1	0	111.9	D523 D525 F530 D531	D523-R527 PolarHBondContact O-N 2.84Å; D525-R527 VanDerWaalsContact C-N 3.29Å; D525-R527 PolarHBondContact O-N 2.83Å; R527-F530 PolarHBondContact O-N 3.39Å; R527-D531 PolarHBondContact O-N 2.95Å
528	R	78.1	Confident	79.8	Confident	133 Å²	133	77 Å²	77	50%	0.502	39%	0.387	S	S	.	.	H	α-helix	trans	-67	-35.1	178.9	-73.8	176.8	-86.4	157.5	-7.9	112.5	G524 D525 L526 D531 M532	G524-R528 PolarHBondContact O-NE 3.35Å; G524-R528 VanDerWaalsContact O-NE 3.12Å; D525-R528 WeakPolarHBondContact O-CA 3.31Å; D525-R528 WeakPolarHBondContact O-CB 3.36Å; D525-R528 PolarHBondContact O-N 3.12Å; D525-R528 IonicContact OD1-CZ 3.44Å; D525-R528 IonicContact OD1-NH1 2.72Å; D525-R528 PolarHBondContact OD1-NH1 2.83Å; D525-R528 IonicContact OD1-NH2 3.33Å; D525-R528 PolarHBondContact OD1-NH2 3.45Å; L526-R528 VanDerWaalsContact C-N 3.29Å; L526-R528 PolarHBondContact O-N 3.03Å; R528-D531 PolarHBondContact O-N 3Å; R528-M532 WeakPolarHBondContact O-CG 3.32Å
529	V	82.1	Confident	79.2	Confident	8 Å²	8	75.4 Å²	75.4	5%	0.048	38%	0.38	C	S	.	.	H	α-helix	trans	-64.9	-40.9	176.4	175.2	0	0	0	0	111.4	L493 F521 D525 L526 D531 M532 L539 V544	L493-V529 HydrophobicContact CD2-CG1 4.1Å; F521-V529 HydrophobicContact CE2-CG2 4.38Å; D525-V529 WeakPolarHBondContact O-CG2 3.34Å; D525-V529 PolarHBondContact O-N 2.82Å; L526-V529 PolarHBondContact O-N 3.25Å; V529-D531 VanDerWaalsContact C-N 3.3Å; V529-D531 PolarHBondContact O-N 3.47Å; V529-M532 PolarHBondContact O-N 2.87Å; V529-L539 HydrophobicContact CG1-CD1 3.81Å; V529-V544 HydrophobicContact CG1-CG1 4.14Å; V529-V544 HydrophobicContact CG2-CB 3.66Å; V529-V544 HydrophobicContact CG2-CG1 3.68Å; V529-V544 HydrophobicContact CG2-CG2 4.36Å
530	F	74.3	Confident	79	Confident	125 Å²	125	77 Å²	77	55%	0.548	39%	0.392	S	S	.	.	H	α-helix	trans	-63.2	-35.2	177.2	-83.3	-71.2	0	0	0	112.9	L526 R527 M532 G533 V536	L526-F530 HydrophobicContact CD1-CD2 3.89Å; L526-F530 HydrophobicContact CD1-CE2 3.43Å; L526-F530 VanDerWaalsContact CD1-CE2 3.43Å; L526-F530 HydrophobicContact CD1-CZ 4.36Å; L526-F530 HydrophobicContact CD2-CE2 4.18Å; L526-F530 HydrophobicContact CG-CD2 3.95Å; L526-F530 HydrophobicContact CG-CE2 3.67Å; L526-F530 VanDerWaalsContact O-CD2 3.29Å; L526-F530 WeakPolarHBondContact O-CD2 3.41Å; L526-F530 PolarHBondContact O-N 3.38Å; L526-F530 VanDerWaalsContact O-N 3.14Å; R527-F530 PolarHBondContact O-N 3.39Å; F530-M532 PolarHBondContact O-N 2.77Å; F530-G533 PolarHBondContact O-N 3.09Å; F530-V536 HydrophobicContact CD1-CG2 4.09Å; F530-V536 HydrophobicContact CE1-CG2 3.79Å; F530-V536 HydrophobicContact CZ-CG2 4.47Å
531	D	73	Confident	78.8	Confident	132 Å²	132	76 Å²	76	71%	0.706	39%	0.386	S	S	*	.	H	α-helix	trans	-70.2	-17.8	178.8	-68.2	-25.2	0	0	0	113.3	R527 R528 V529 G533	R527-D531 PolarHBondContact O-N 2.95Å; R528-D531 PolarHBondContact O-N 3Å; V529-D531 VanDerWaalsContact C-N 3.3Å; V529-D531 PolarHBondContact O-N 3.47Å; D531-G533 VanDerWaalsContact C-N 3.28Å; D531-G533 PolarHBondContact O-N 3.1Å
532	M	72.6	Confident	78.6	Confident	140 Å²	140	77.7 Å²	77.7	69%	0.69	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.9	179.6	-68	-177.4	172.9	0	0	113.9	R528 V529 F530 V534	R528-M532 WeakPolarHBondContact O-CG 3.32Å; V529-M532 PolarHBondContact O-N 2.87Å; F530-M532 PolarHBondContact O-N 2.77Å; M532-V534 HydrophobicContact CB-CG2 3.89Å; M532-V534 PolarHBondContact O-N 3.3Å
533	G	65.7	Low	78.5	Confident	75 Å²	75	81.2 Å²	81.2	77%	0.773	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	20.2	176.6	0	0	0	0	0	115	F530 D531	F530-G533 PolarHBondContact O-N 3.09Å; D531-G533 VanDerWaalsContact C-N 3.28Å; D531-G533 PolarHBondContact O-N 3.1Å
534	V	71.1	Confident	78.8	Confident	72 Å²	72	78.1 Å²	78.1	44%	0.436	40%	0.402	S	S	.	.			trans	-90.2	148.5	-178.9	-167.8	0	0	0	0	110.4	M532 V536 L539	M532-V534 HydrophobicContact CB-CG2 3.89Å; M532-V534 PolarHBondContact O-N 3.3Å; V534-V536 PolarHBondContact O-N 3.28Å; V534-L539 HydrophobicContact CB-CD1 3.99Å; V534-L539 HydrophobicContact CG1-CD1 3.85Å; V534-L539 HydrophobicContact CG1-CD2 4.02Å; V534-L539 HydrophobicContact CG1-CG 3.99Å
535	D	74.1	Confident	79.5	Confident	63 Å²	63	77.9 Å²	77.9	34%	0.337	39%	0.393	S	S	.	.			trans	-68.5	98.6	174.1	-168.4	-12.9	0	0	0	110.5	R537 Q538	D535-R537 PolarHBondContact O-N 3.1Å; D535-R537 WeakPolarHBondContact OD1-CB 3.38Å; D535-R537 WeakPolarHBondContact OD1-CG 3.43Å; D535-R537 IonicContact OD1-CZ 2.67Å; D535-R537 PolarHBondContact OD1-N 2.97Å; D535-R537 VanDerWaalsContact OD1-N 3.15Å; D535-R537 IonicContact OD1-NE 3.51Å; D535-R537 PolarHBondContact OD1-NE 3.43Å; D535-R537 IonicContact OD1-NH2 2.91Å; D535-R537 IonicContact OD2-CZ 3.29Å; D535-R537 IonicContact OD2-NE 3.85Å; D535-R537 PolarHBondContact OD2-NE 2.92Å; D535-R537 IonicContact OD2-NH2 2.82Å; D535-R537 PolarHBondContact OD2-NH2 3.34Å; D535-Q538 PolarHBondContact O-N 3.13Å
536	V	73	Confident	79.8	Confident	37 Å²	37	80.1 Å²	80.1	22%	0.224	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-24.3	-179.7	-162.1	0	0	0	0	112.8	L493 F530 V534 Q538	L493-V536 HydrophobicContact CD2-CG1 3.41Å; L493-V536 VanDerWaalsContact CD2-CG1 3.41Å; L493-V536 HydrophobicContact CG-CG1 4.3Å; F530-V536 HydrophobicContact CD1-CG2 4.09Å; F530-V536 HydrophobicContact CE1-CG2 3.79Å; F530-V536 HydrophobicContact CZ-CG2 4.47Å; V534-V536 PolarHBondContact O-N 3.28Å; V536-Q538 VanDerWaalsContact C-N 3.31Å; V536-Q538 PolarHBondContact O-N 2.82Å
537	R	71.8	Confident	80.1	Confident	211 Å²	211	83.5 Å²	83.5	80%	0.796	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-20.2	-178.5	-60.4	174.8	-65.7	178.4	2.9	113.8	D535	D535-R537 PolarHBondContact O-N 3.1Å; D535-R537 WeakPolarHBondContact OD1-CB 3.38Å; D535-R537 WeakPolarHBondContact OD1-CG 3.43Å; D535-R537 IonicContact OD1-CZ 2.67Å; D535-R537 PolarHBondContact OD1-N 2.97Å; D535-R537 VanDerWaalsContact OD1-N 3.15Å; D535-R537 IonicContact OD1-NE 3.51Å; D535-R537 PolarHBondContact OD1-NE 3.43Å; D535-R537 IonicContact OD1-NH2 2.91Å; D535-R537 IonicContact OD2-CZ 3.29Å; D535-R537 IonicContact OD2-NE 3.85Å; D535-R537 PolarHBondContact OD2-NE 2.92Å; D535-R537 IonicContact OD2-NH2 2.82Å; D535-R537 PolarHBondContact OD2-NH2 3.34Å
538	Q	78.1	Confident	80.6	Confident	167 Å²	167	76 Å²	76	78%	0.78	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-4.9	-176.1	-64.1	-172.7	-5.5	0	0	113.4	D535 V536	D535-Q538 PolarHBondContact O-N 3.13Å; V536-Q538 VanDerWaalsContact C-N 3.31Å; V536-Q538 PolarHBondContact O-N 2.82Å
539	L	81.5	Confident	81	Confident	28 Å²	28	71.1 Å²	71.1	15%	0.147	40%	0.399	C	S	.	.			trans	-77.9	132.7	-178.1	-77.4	168.9	0	0	0	112	L493 V529 V534 D543 V544	L493-L539 HydrophobicContact CB-CB 4.49Å; L493-L539 WeakPolarHBondContact CB-O 3.33Å; L493-L539 HydrophobicContact CD2-CB 4.24Å; L493-L539 HydrophobicContact CD2-CD1 4.49Å; L493-L539 PolarHBondContact N-O 3.47Å; L493-L539 VanDerWaalsContact N-O 3.16Å; V529-L539 HydrophobicContact CG1-CD1 3.81Å; V534-L539 HydrophobicContact CB-CD1 3.99Å; V534-L539 HydrophobicContact CG1-CD1 3.85Å; V534-L539 HydrophobicContact CG1-CD2 4.02Å; V534-L539 HydrophobicContact CG1-CG 3.99Å; L539-D543 HydrophobicContact CD2-CB 4.12Å; L539-V544 HydrophobicContact CD1-CG1 4.11Å; L539-V544 HydrophobicContact CD2-CG1 4.29Å
540	S	88.3	Confident	81.4	Confident	34 Å²	34	73.2 Å²	73.2	24%	0.238	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-81.6	152.3	167	-179.5	0	0	0	0	109.9	A491 A542 D543	A491-S540 PolarHBondContact O-OG 2.93Å; S540-A542 PolarHBondContact O-N 3.2Å; S540-A542 PolarHBondContact OG-N 3.4Å; S540-D543 WeakPolarHBondContact CB-OD2 3.45Å; S540-D543 PolarHBondContact N-OD2 3.15Å; S540-D543 VanDerWaalsContact N-OD2 3.11Å; S540-D543 PolarHBondContact O-N 3.48Å; S540-D543 VanDerWaalsContact O-N 3.11Å
541	I	90.4	Very high	82.3	Confident	0 Å²	0	71 Å²	71	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-58.9	-30.4	172	-160.5	58.7	0	0	0	111.6	V487 K489 A491 L493 A496 I510 F521 D543 V544 M545	V487-I541 HydrophobicContact CG2-CG1 4.46Å; K489-I541 WeakPolarHBondContact O-CG2 3.4Å; A491-I541 HydrophobicContact CB-CG2 4.18Å; A491-I541 WeakPolarHBondContact O-CG2 3.46Å; A491-I541 PolarHBondContact O-N 2.85Å; A491-I541 VanDerWaalsContact O-N 3.07Å; L493-I541 HydrophobicContact CD1-CD1 4.17Å; A496-I541 HydrophobicContact CB-CD1 3.41Å; A496-I541 VanDerWaalsContact CB-CD1 3.41Å; A496-I541 HydrophobicContact CB-CG1 3.94Å; I510-I541 HydrophobicContact CD1-CG1 3.94Å; I510-I541 HydrophobicContact CG1-CG1 3.74Å; I510-I541 HydrophobicContact CG1-CG2 4.13Å; F521-I541 HydrophobicContact CB-CD1 3.75Å; F521-I541 HydrophobicContact CB-CG1 4.47Å; F521-I541 HydrophobicContact CD1-CD1 3.99Å; F521-I541 HydrophobicContact CD2-CD1 3.82Å; F521-I541 HydrophobicContact CE2-CD1 4.43Å; F521-I541 HydrophobicContact CG-CD1 3.57Å; I541-D543 PolarHBondContact O-N 3.39Å; I541-V544 HydrophobicContact CD1-CG2 4.11Å; I541-V544 PolarHBondContact O-N 2.97Å; I541-M545 VanDerWaalsContact O-CB 3.25Å; I541-M545 WeakPolarHBondContact O-CB 3.46Å; I541-M545 WeakPolarHBondContact O-CG 3.42Å; I541-M545 PolarHBondContact O-N 3.14Å
542	A	89.4	Confident	83.4	Confident	36 Å²	36	65.1 Å²	65.1	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-28.9	177.8	0	0	0	0	0	113.4	K489 S540	K489-A542 HydrophobicContact CG-CB 3.98Å; S540-A542 PolarHBondContact O-N 3.2Å; S540-A542 PolarHBondContact OG-N 3.4Å
543	D	87.1	Confident	84.5	Confident	113 Å²	113	67.5 Å²	67.5	60%	0.604	37%	0.368	S	S	*	.	H	α-helix	trans	-81	-21.7	-177.1	-56.6	-43.6	0	0	0	112.3	L539 S540 I541	L539-D543 HydrophobicContact CD2-CB 4.12Å; S540-D543 WeakPolarHBondContact CB-OD2 3.45Å; S540-D543 PolarHBondContact N-OD2 3.15Å; S540-D543 VanDerWaalsContact N-OD2 3.11Å; S540-D543 PolarHBondContact O-N 3.48Å; S540-D543 VanDerWaalsContact O-N 3.11Å; I541-D543 PolarHBondContact O-N 3.39Å
544	V	88.7	Confident	85.7	Confident	23 Å²	23	65.5 Å²	65.5	14%	0.139	34%	0.341	C	S	.	.	H	α-helix	trans	-123.7	-9.2	-170.7	-59.9	0	0	0	0	114.3	L493 F521 V529 L539 I541	L493-V544 HydrophobicContact CD1-CG2 4.07Å; F521-V544 HydrophobicContact CD2-CG2 4.13Å; F521-V544 HydrophobicContact CE2-CB 4.45Å; F521-V544 HydrophobicContact CE2-CG2 3.89Å; V529-V544 HydrophobicContact CG1-CG1 4.14Å; V529-V544 HydrophobicContact CG2-CB 3.66Å; V529-V544 HydrophobicContact CG2-CG1 3.68Å; V529-V544 HydrophobicContact CG2-CG2 4.36Å; L539-V544 HydrophobicContact CD1-CG1 4.11Å; L539-V544 HydrophobicContact CD2-CG1 4.29Å; I541-V544 HydrophobicContact CD1-CG2 4.11Å; I541-V544 PolarHBondContact O-N 2.97Å
545	M	90.5	Very high	86.6	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.123	34%	0.337	C	S	.	.	S	Bend	trans	-66.6	151	176.3	67.8	177	-171.1	0	0	111.3	I510 I541 P547	I510-M545 HydrophobicContact CB-SD 3.85Å; I510-M545 HydrophobicContact CD1-CB 3.77Å; I510-M545 HydrophobicContact CD1-SD 4.27Å; I510-M545 HydrophobicContact CG1-CB 4.24Å; I510-M545 HydrophobicContact CG1-SD 3.85Å; I510-M545 HydrophobicContact CG2-SD 3.83Å; I541-M545 VanDerWaalsContact O-CB 3.25Å; I541-M545 WeakPolarHBondContact O-CB 3.46Å; I541-M545 WeakPolarHBondContact O-CG 3.42Å; I541-M545 PolarHBondContact O-N 3.14Å; M545-P547 WeakPolarHBondContact O-CD 3.29Å
546	T	89.5	Confident	87.4	Confident	54 Å²	54	62.7 Å²	62.7	33%	0.331	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.8	164.2	-65.1	0	0	0	0	108.3	G519 I520 D525 G548	G519-T546 CarbonylContact C-O 3.55Å; G519-T546 WeakPolarHBondContact CA-O 3.43Å; I520-T546 HydrophobicContact CG2-CG2 4.37Å; I520-T546 PolarHBondContact N-O 3.35Å; I520-T546 PolarHBondContact O-N 3.44Å; D525-T546 PolarHBondContact OD1-OG1 3.14Å; T546-G548 PolarHBondContact O-N 3.42Å
547	P	89.9	Confident	88	Confident	102 Å²	102	63 Å²	63	66%	0.662	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	136.5	179	-22.6	34	0	0	0	111.7	M545 G549	M545-P547 WeakPolarHBondContact O-CD 3.29Å; P547-G549 PolarHBondContact O-N 3.37Å
548	G	84.6	Confident	88.6	Confident	17 Å²	17	53 Å²	53	18%	0.175	29%	0.294	C	S	.	.	S	Bend	trans	67.5	-122	-174.1	0	0	0	0	0	113.1	E518 G519 T546	E518-G548 PolarHBondContact O-N 3.34Å; G519-G548 CarbonylContact C-O 3.38Å; G519-G548 WeakPolarHBondContact CA-O 3.17Å; T546-G548 PolarHBondContact O-N 3.42Å
549	G	85.3	Confident	88.6	Confident	32 Å²	32	46.1 Å²	46.1	33%	0.33	26%	0.263	S	S	.	.			trans	128.5	170.1	-177.3	0	0	0	0	0	113.1	P547	P547-G549 PolarHBondContact O-N 3.37Å
550	I	91.5	Very high	88.6	Confident	52 Å²	52	49.5 Å²	49.5	27%	0.267	28%	0.278	S	S	.	.			trans	-78.7	135.6	-176.4	-62.9	161.3	0	0	0	109.7	L564 R568 I570 V573 M574	I550-L564 HydrophobicContact CG2-CD2 3.85Å; I550-L564 HydrophobicContact CG2-CG 4.28Å; I550-R568 HydrophobicContact CD1-CB 3.69Å; I550-R568 HydrophobicContact CD1-CG 3.68Å; I550-I570 HydrophobicContact CB-CD1 4.14Å; I550-I570 HydrophobicContact CD1-CD1 3.85Å; I550-I570 HydrophobicContact CD1-CG2 4.39Å; I550-I570 HydrophobicContact CG2-CD1 4.13Å; I550-V573 HydrophobicContact CB-CG2 4.47Å; I550-V573 HydrophobicContact CG2-CG2 3.9Å; I550-M574 WeakPolarHBondContact O-CE 3.44Å; I550-M574 PolarHBondContact O-N 3.16Å
551	R	93.3	Very high	88.6	Confident	77 Å²	77	47.9 Å²	47.9	29%	0.291	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.3	-174	-56.3	172.6	-151.1	178.2	0	111.3	I517 M574 A576 G578 D579	I517-R551 HydrophobicContact CD1-CG 4.43Å; R551-M574 CarbonylContact C-O 3.54Å; R551-M574 VanDerWaalsContact CA-O 3.24Å; R551-M574 WeakPolarHBondContact CA-O 3.38Å; R551-M574 HydrophobicContact CG-CB 4.28Å; R551-M574 HydrophobicContact CG-CE 4.1Å; R551-A576 HydrophobicContact CB-CB 4.43Å; R551-A576 HydrophobicContact CG-CB 4.47Å; R551-G578 PolarHBondContact NH1-O 2.92Å; R551-D579 IonicContact CZ-OD1 3.83Å; R551-D579 IonicContact NH1-OD1 3.69Å; R551-D579 PolarHBondContact NH1-OD1 3.47Å; R551-D579 IonicContact NH2-OD1 2.55Å; R551-D579 PolarHBondContact NH2-OD1 2.87Å
552	V	94.8	Very high	88.2	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.7	171.1	-66.8	0	0	0	0	110.6	V474 I556 L564 V573 M574 V575 A576	V474-V552 HydrophobicContact CG1-CG2 4.32Å; V552-I556 HydrophobicContact CB-CG2 4.12Å; V552-L564 HydrophobicContact CG1-CD2 3.45Å; V552-L564 VanDerWaalsContact CG1-CD2 3.45Å; V552-V573 HydrophobicContact CG1-CG1 4.49Å; V552-V573 HydrophobicContact CG1-CG2 4.01Å; V552-V573 HydrophobicContact CG2-CG1 3.95Å; V552-V573 HydrophobicContact CG2-CG2 4.27Å; V552-M574 PolarHBondContact N-O 3.28Å; V552-V575 HydrophobicContact CG2-CB 4.48Å; V552-V575 HydrophobicContact CG2-CG1 4.46Å; V552-V575 HydrophobicContact CG2-CG2 4.01Å; V552-V575 WeakPolarHBondContact O-CA 3.37Å; V552-A576 PolarHBondContact O-N 3.5Å
553	R	95.2	Very high	87.6	Confident	191 Å²	191	50.9 Å²	50.9	72%	0.721	28%	0.278	S	S	*	.			trans	-77.9	146.6	172.3	-71	-176.3	176.1	174.4	-1.4	110	G555 I556	R553-G555 PolarHBondContact O-N 3.39Å; R553-I556 VanDerWaalsContact O-CG2 3.25Å; R553-I556 WeakPolarHBondContact O-CG2 3.37Å; R553-I556 PolarHBondContact O-N 3.11Å
554	P	92.4	Very high	87.5	Confident	33 Å²	33	48 Å²	48	21%	0.214	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.2	-179.4	21.8	-33.3	0	0	0	113.6	N475 I556 V575 L582	N475-P554 HydrophobicContact CB-CB 3.97Å; N475-P554 WeakPolarHBondContact CB-O 3.15Å; N475-P554 PolarHBondContact N-O 3.42Å; N475-P554 PolarHBondContact OD1-O 2.9Å; P554-I556 PolarHBondContact O-N 3.17Å; P554-V575 HydrophobicContact CB-CG1 3.89Å; P554-L582 HydrophobicContact CG-CD1 3.91Å
555	G	90	Very high	87.3	Confident	33 Å²	33	46.9 Å²	46.9	34%	0.34	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.6	-178.1	0	0	0	0	0	116.1	R473 R553	R473-G555 PolarHBondContact NH1-O 3.48Å; R553-G555 PolarHBondContact O-N 3.39Å
556	I	90.8	Very high	86.5	Confident	43 Å²	43	50.5 Å²	50.5	22%	0.221	27%	0.272	C	S	.	.	S	Bend	trans	-69	152.5	179.1	-157.8	176.3	0	0	0	110.6	R473 V474 V552 R553 P554 E560 A561	R473-I556 WeakPolarHBondContact CA-O 3.49Å; V474-I556 HydrophobicContact CB-CG2 4.08Å; V474-I556 HydrophobicContact CG2-CG2 3.38Å; V474-I556 PolarHBondContact N-O 2.9Å; V552-I556 HydrophobicContact CB-CG2 4.12Å; R553-I556 VanDerWaalsContact O-CG2 3.25Å; R553-I556 WeakPolarHBondContact O-CG2 3.37Å; R553-I556 PolarHBondContact O-N 3.11Å; P554-I556 PolarHBondContact O-N 3.17Å; I556-E560 HydrophobicContact CD1-CB 3.85Å; I556-E560 HydrophobicContact CG1-CB 3.89Å; I556-E560 WeakPolarHBondContact CG1-OE2 3.48Å; I556-A561 HydrophobicContact CG2-CB 4.2Å
557	L	84.8	Confident	85.8	Confident	42 Å²	42	51.5 Å²	51.5	22%	0.22	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-65.6	140.2	173.5	-68.8	175	0	0	0	110.9	L470 R473 V559 E560 A561	L470-L557 WeakPolarHBondContact O-CD2 3.33Å; R473-L557 HydrophobicContact CG-CD2 4.49Å; L557-V559 PolarHBondContact O-N 2.9Å; L557-E560 HydrophobicContact CB-CB 4.41Å; L557-E560 HydrophobicContact CB-CG 4.15Å; L557-E560 WeakPolarHBondContact O-CB 3.34Å; L557-E560 PolarHBondContact O-N 3.31Å; L557-A561 PolarHBondContact O-N 2.86Å
558	A	84.1	Confident	85.5	Confident	1 Å²	1	54 Å²	54	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-34	179.1	0	0	0	0	0	112.2	L472 I477 A561 L562 L590 V595	L472-A558 HydrophobicContact CB-CB 4.16Å; L472-A558 HydrophobicContact CD2-CB 3.85Å; L472-A558 HydrophobicContact CG-CB 4.09Å; L472-A558 WeakPolarHBondContact O-CB 3.34Å; L472-A558 PolarHBondContact O-N 3.26Å; I477-A558 HydrophobicContact CD1-CB 4.09Å; A558-A561 PolarHBondContact O-N 3.4Å; A558-L562 WeakPolarHBondContact O-CB 3.17Å; A558-L562 PolarHBondContact O-N 3.45Å; A558-L590 HydrophobicContact CB-CD2 3.67Å; A558-L590 WeakPolarHBondContact O-CD2 3.47Å; A558-V595 HydrophobicContact CB-CG2 3.87Å
559	V	78.3	Confident	85.2	Confident	24 Å²	24	61.2 Å²	61.2	15%	0.145	31%	0.306	C	S	.	.	H	α-helix	trans	-66.8	-40.1	174.8	177.9	0	0	0	0	112.3	K469 L557 A561 L562 N563 V595	K469-V559 HydrophobicContact CB-CG2 4.29Å; K469-V559 HydrophobicContact CD-CG2 4.46Å; K469-V559 HydrophobicContact CG-CG2 3.38Å; K469-V559 WeakPolarHBondContact O-CG2 3.49Å; L557-V559 PolarHBondContact O-N 2.9Å; V559-A561 VanDerWaalsContact C-N 3.35Å; V559-L562 WeakPolarHBondContact O-CB 3.37Å; V559-L562 PolarHBondContact O-N 3.49Å; V559-N563 WeakPolarHBondContact O-CB 3.48Å; V559-N563 VanDerWaalsContact O-CG 3.22Å; V559-N563 PolarHBondContact O-N 2.91Å; V559-N563 PolarHBondContact O-ND2 3.44Å; V559-V595 HydrophobicContact CB-CG1 4.42Å; V559-V595 HydrophobicContact CG2-CG1 3.61Å
560	E	82	Confident	85.2	Confident	99 Å²	99	61.7 Å²	61.7	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-68.2	-39.8	177.4	-69.8	179	-164.2	0	0	110.7	I556 L557 N563 L564	I556-E560 HydrophobicContact CD1-CB 3.85Å; I556-E560 HydrophobicContact CG1-CB 3.89Å; I556-E560 WeakPolarHBondContact CG1-OE2 3.48Å; L557-E560 HydrophobicContact CB-CB 4.41Å; L557-E560 HydrophobicContact CB-CG 4.15Å; L557-E560 WeakPolarHBondContact O-CB 3.34Å; L557-E560 PolarHBondContact O-N 3.31Å; E560-N563 PolarHBondContact O-N 3.2Å; E560-L564 PolarHBondContact O-N 3.46Å
561	A	88.6	Confident	84.7	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-43.9	171.6	0	0	0	0	0	111.6	V474 I556 L557 A558 V559 N563 L564 M565 L585	V474-A561 HydrophobicContact CG2-CB 3.54Å; I556-A561 HydrophobicContact CG2-CB 4.2Å; L557-A561 PolarHBondContact O-N 2.86Å; A558-A561 PolarHBondContact O-N 3.4Å; V559-A561 VanDerWaalsContact C-N 3.35Å; A561-N563 PolarHBondContact O-N 2.92Å; A561-L564 PolarHBondContact O-N 3.08Å; A561-M565 WeakPolarHBondContact O-CG 3.45Å; A561-M565 PolarHBondContact O-N 3.31Å; A561-L585 HydrophobicContact CB-CD2 3.72Å
562	L	81.2	Confident	84.5	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-48.8	175	-179.3	60.7	0	0	0	111.7	A558 V559 L564 M565 Q566 M587 L590 V595 V596	A558-L562 WeakPolarHBondContact O-CB 3.17Å; A558-L562 PolarHBondContact O-N 3.45Å; V559-L562 WeakPolarHBondContact O-CB 3.37Å; V559-L562 PolarHBondContact O-N 3.49Å; L562-L564 VanDerWaalsContact C-N 3.31Å; L562-L564 PolarHBondContact O-N 3.42Å; L562-M565 WeakPolarHBondContact O-CB 3.34Å; L562-M565 PolarHBondContact O-N 3.23Å; L562-M565 VanDerWaalsContact O-N 3.15Å; L562-Q566 HydrophobicContact CD1-CG 4.29Å; L562-Q566 WeakPolarHBondContact O-CG 3.32Å; L562-Q566 PolarHBondContact O-N 3.37Å; L562-M587 HydrophobicContact CD1-CE 4.45Å; L562-M587 HydrophobicContact CD1-CG 3.96Å; L562-M587 HydrophobicContact CD1-SD 4.04Å; L562-L590 HydrophobicContact CB-CD1 3.88Å; L562-L590 HydrophobicContact CD1-CD1 3.84Å; L562-L590 HydrophobicContact CG-CD1 4.42Å; L562-V595 HydrophobicContact CD2-CG1 4.07Å; L562-V596 HydrophobicContact CD2-CG2 3.83Å
563	N	76.4	Confident	84.5	Confident	87 Å²	87	58.5 Å²	58.5	47%	0.465	29%	0.293	S	S	.	.	H	α-helix	trans	-60.8	-41.7	179.1	-71.7	-18.9	0	0	0	111.4	V559 E560 A561 Q566 S567	V559-N563 WeakPolarHBondContact O-CB 3.48Å; V559-N563 VanDerWaalsContact O-CG 3.22Å; V559-N563 PolarHBondContact O-N 2.91Å; V559-N563 PolarHBondContact O-ND2 3.44Å; E560-N563 PolarHBondContact O-N 3.2Å; A561-N563 PolarHBondContact O-N 2.92Å; N563-Q566 PolarHBondContact O-N 3.46Å; N563-S567 WeakPolarHBondContact O-CB 3.39Å; N563-S567 PolarHBondContact O-N 2.89Å; N563-S567 PolarHBondContact O-OG 2.94Å
564	L	86	Confident	84.5	Confident	51 Å²	51	49.4 Å²	49.4	27%	0.267	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-47.4	174.6	-179.6	67.2	0	0	0	110.7	I550 V552 E560 A561 L562 Q566 S567 R568	I550-L564 HydrophobicContact CG2-CD2 3.85Å; I550-L564 HydrophobicContact CG2-CG 4.28Å; V552-L564 HydrophobicContact CG1-CD2 3.45Å; V552-L564 VanDerWaalsContact CG1-CD2 3.45Å; E560-L564 PolarHBondContact O-N 3.46Å; A561-L564 PolarHBondContact O-N 3.08Å; L562-L564 VanDerWaalsContact C-N 3.31Å; L562-L564 PolarHBondContact O-N 3.42Å; L564-Q566 PolarHBondContact O-N 3.45Å; L564-S567 PolarHBondContact O-N 2.92Å; L564-S567 PolarHBondContact O-OG 3.08Å; L564-R568 HydrophobicContact CD1-CG 4.2Å; L564-R568 WeakPolarHBondContact O-CB 3.19Å; L564-R568 WeakPolarHBondContact O-CG 3.4Å; L564-R568 PolarHBondContact O-N 2.88Å; L564-R568 VanDerWaalsContact O-N 3.08Å
565	M	85.2	Confident	84.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-44	179.2	-69.5	169.7	76.5	0	0	112	A561 L562 R568 H569 I570 T571 V573 L585 M587 L590	A561-M565 WeakPolarHBondContact O-CG 3.45Å; A561-M565 PolarHBondContact O-N 3.31Å; L562-M565 WeakPolarHBondContact O-CB 3.34Å; L562-M565 PolarHBondContact O-N 3.23Å; L562-M565 VanDerWaalsContact O-N 3.15Å; M565-R568 CarbonylContact O-C 3.57Å; M565-R568 PolarHBondContact O-N 3.32Å; M565-H569 PolarHBondContact O-N 3.32Å; M565-I570 HydrophobicContact CB-CG1 4.03Å; M565-I570 HydrophobicContact CG-CD1 4.29Å; M565-I570 HydrophobicContact CG-CG1 4.12Å; M565-I570 PolarHBondContact O-N 2.92Å; M565-T571 WeakPolarHBondContact CE-O 3.46Å; M565-V573 HydrophobicContact CE-CG1 4.47Å; M565-V573 HydrophobicContact CG-CB 4.04Å; M565-V573 HydrophobicContact CG-CG1 3.94Å; M565-V573 HydrophobicContact SD-CB 4.34Å; M565-V573 HydrophobicContact SD-CG1 3.73Å; M565-L585 HydrophobicContact SD-CD2 4.18Å; M565-M587 HydrophobicContact CB-CE 4.07Å; M565-M587 HydrophobicContact CE-CB 3.95Å; M565-M587 HydrophobicContact CE-CE 4.38Å; M565-L590 HydrophobicContact CE-CD1 4.5Å; M565-L590 HydrophobicContact SD-CD1 3.67Å
566	Q	73.2	Confident	84.9	Confident	101 Å²	101	46.5 Å²	46.5	47%	0.472	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-48.9	175.8	-74.3	-179.7	-37.3	0	0	111.9	L562 N563 L564 R568 H569	L562-Q566 HydrophobicContact CD1-CG 4.29Å; L562-Q566 WeakPolarHBondContact O-CG 3.32Å; L562-Q566 PolarHBondContact O-N 3.37Å; N563-Q566 PolarHBondContact O-N 3.46Å; L564-Q566 PolarHBondContact O-N 3.45Å; Q566-R568 PolarHBondContact O-N 3.14Å; Q566-R568 VanDerWaalsContact O-N 3.16Å; Q566-H569 PolarHBondContact O-N 3.46Å
567	S	75.1	Confident	85.1	Confident	76 Å²	76	49.8 Å²	49.8	53%	0.531	25%	0.252	S	S	.	.	H	α-helix	trans	-61.7	-25.8	-179.7	72.6	0	0	0	0	113.5	N563 L564	N563-S567 WeakPolarHBondContact O-CB 3.39Å; N563-S567 PolarHBondContact O-N 2.89Å; N563-S567 PolarHBondContact O-OG 2.94Å; L564-S567 PolarHBondContact O-N 2.92Å; L564-S567 PolarHBondContact O-OG 3.08Å
568	R	83.1	Confident	85.3	Confident	153 Å²	153	50.3 Å²	50.3	58%	0.577	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-0.2	179.2	-64.2	-67.5	-168.8	141	1.5	112.9	I550 L564 M565 Q566 I570	I550-R568 HydrophobicContact CD1-CB 3.69Å; I550-R568 HydrophobicContact CD1-CG 3.68Å; L564-R568 HydrophobicContact CD1-CG 4.2Å; L564-R568 WeakPolarHBondContact O-CB 3.19Å; L564-R568 WeakPolarHBondContact O-CG 3.4Å; L564-R568 PolarHBondContact O-N 2.88Å; L564-R568 VanDerWaalsContact O-N 3.08Å; M565-R568 CarbonylContact O-C 3.57Å; M565-R568 PolarHBondContact O-N 3.32Å; Q566-R568 PolarHBondContact O-N 3.14Å; Q566-R568 VanDerWaalsContact O-N 3.16Å; R568-I570 VanDerWaalsContact C-N 3.25Å; R568-I570 HydrophobicContact CB-CD1 4.27Å; R568-I570 HydrophobicContact CB-CG1 4.11Å; R568-I570 HydrophobicContact CB-CG2 4.35Å; R568-I570 PolarHBondContact O-N 3.11Å
569	H	78.9	Confident	85.7	Confident	169 Å²	169	54.3 Å²	54.3	78%	0.782	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	42.3	-176	-56.5	-78.8	0	0	0	113.3	M565 Q566	M565-H569 PolarHBondContact O-N 3.32Å; Q566-H569 PolarHBondContact O-N 3.46Å
570	I	84.5	Confident	86.5	Confident	42 Å²	42	56.9 Å²	56.9	22%	0.215	30%	0.299	C	S	.	.			trans	-111.3	148.7	178	59.6	175.9	0	0	0	111.2	I550 M565 R568 V573 M587	I550-I570 HydrophobicContact CB-CD1 4.14Å; I550-I570 HydrophobicContact CD1-CD1 3.85Å; I550-I570 HydrophobicContact CD1-CG2 4.39Å; I550-I570 HydrophobicContact CG2-CD1 4.13Å; M565-I570 HydrophobicContact CB-CG1 4.03Å; M565-I570 HydrophobicContact CG-CD1 4.29Å; M565-I570 HydrophobicContact CG-CG1 4.12Å; M565-I570 PolarHBondContact O-N 2.92Å; R568-I570 VanDerWaalsContact C-N 3.25Å; R568-I570 HydrophobicContact CB-CD1 4.27Å; R568-I570 HydrophobicContact CB-CG1 4.11Å; R568-I570 HydrophobicContact CB-CG2 4.35Å; R568-I570 PolarHBondContact O-N 3.11Å; I570-V573 HydrophobicContact CD1-CB 4.2Å; I570-V573 HydrophobicContact CD1-CG2 4.34Å; I570-M587 VanDerWaalsContact O-CE 3.31Å; I570-M587 WeakPolarHBondContact O-CE 3.39Å
571	T	80.6	Confident	87.1	Confident	61 Å²	61	52.3 Å²	52.3	37%	0.374	28%	0.278	S	S	.	.	S	Bend	trans	-96.4	-18.9	179.4	60.5	0	0	0	0	113.6	M565 M587	M565-T571 WeakPolarHBondContact CE-O 3.46Å; T571-M587 PolarHBondContact O-N 2.97Å
572	S	90.3	Very high	87.5	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.063	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.8	-176.2	-42.9	0	0	0	0	109	L505 L585 H586	L505-S572 PolarHBondContact O-OG 3.03Å; S572-L585 CarbonylContact C-O 3.44Å; S572-L585 VanDerWaalsContact CA-O 3.29Å; S572-L585 WeakPolarHBondContact CA-O 3.36Å; S572-H586 PolarHBondContact OG-CD2 3.33Å
573	V	93.6	Very high	88.1	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.1	175.8	67.6	0	0	0	0	110.6	I550 V552 M565 I570 L585	I550-V573 HydrophobicContact CB-CG2 4.47Å; I550-V573 HydrophobicContact CG2-CG2 3.9Å; V552-V573 HydrophobicContact CG1-CG1 4.49Å; V552-V573 HydrophobicContact CG1-CG2 4.01Å; V552-V573 HydrophobicContact CG2-CG1 3.95Å; V552-V573 HydrophobicContact CG2-CG2 4.27Å; M565-V573 HydrophobicContact CE-CG1 4.47Å; M565-V573 HydrophobicContact CG-CB 4.04Å; M565-V573 HydrophobicContact CG-CG1 3.94Å; M565-V573 HydrophobicContact SD-CB 4.34Å; M565-V573 HydrophobicContact SD-CG1 3.73Å; I570-V573 HydrophobicContact CD1-CB 4.2Å; I570-V573 HydrophobicContact CD1-CG2 4.34Å; V573-L585 HydrophobicContact CG1-CB 3.85Å; V573-L585 HydrophobicContact CG1-CD2 4.09Å; V573-L585 HydrophobicContact CG1-CG 4.43Å; V573-L585 PolarHBondContact N-O 3.24Å; V573-L585 PolarHBondContact O-N 3.06Å
574	M	95.6	Very high	89	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.9	177.3	-64.7	175.9	-72.8	0	0	109.8	V509 I517 I520 I550 R551 V552 L581	V509-M574 HydrophobicContact CB-SD 4.37Å; V509-M574 HydrophobicContact CG1-SD 3.69Å; V509-M574 HydrophobicContact CG2-CG 3.81Å; V509-M574 HydrophobicContact CG2-SD 3.74Å; I517-M574 HydrophobicContact CD1-CB 4.5Å; I517-M574 HydrophobicContact CD1-SD 4.15Å; I517-M574 HydrophobicContact CG2-CE 4.28Å; I517-M574 HydrophobicContact CG2-SD 3.87Å; I520-M574 HydrophobicContact CB-CE 4.43Å; I520-M574 HydrophobicContact CD1-CE 4.44Å; I550-M574 WeakPolarHBondContact O-CE 3.44Å; I550-M574 PolarHBondContact O-N 3.16Å; R551-M574 CarbonylContact C-O 3.54Å; R551-M574 VanDerWaalsContact CA-O 3.24Å; R551-M574 WeakPolarHBondContact CA-O 3.38Å; R551-M574 HydrophobicContact CG-CB 4.28Å; R551-M574 HydrophobicContact CG-CE 4.1Å; V552-M574 PolarHBondContact N-O 3.28Å; M574-L581 HydrophobicContact CB-CD1 4.01Å; M574-L581 HydrophobicContact CG-CD1 4.21Å
575	V	96.2	Very high	89.3	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.3	172.6	-167.3	0	0	0	0	107.8	V474 M478 V552 P554 L582 G583 L585	V474-V575 HydrophobicContact CG1-CB 4.4Å; V474-V575 HydrophobicContact CG1-CG1 3.99Å; V474-V575 HydrophobicContact CG1-CG2 3.48Å; V474-V575 VanDerWaalsContact CG1-CG2 3.48Å; M478-V575 HydrophobicContact CB-CG2 4.02Å; M478-V575 HydrophobicContact SD-CB 3.73Å; M478-V575 HydrophobicContact SD-CG1 3.52Å; M478-V575 VanDerWaalsContact SD-CG1 3.52Å; M478-V575 HydrophobicContact SD-CG2 3.91Å; V552-V575 HydrophobicContact CG2-CB 4.48Å; V552-V575 HydrophobicContact CG2-CG1 4.46Å; V552-V575 HydrophobicContact CG2-CG2 4.01Å; V552-V575 WeakPolarHBondContact O-CA 3.37Å; P554-V575 HydrophobicContact CB-CG1 3.89Å; V575-L582 PolarHBondContact O-N 3.47Å; V575-G583 PolarHBondContact N-O 2.95Å; V575-G583 PolarHBondContact O-N 2.95Å; V575-L585 HydrophobicContact CG2-CB 4.1Å
576	A	95.2	Very high	89.6	Confident	5 Å²	5	48.7 Å²	48.7	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	150.8	-171.1	0	0	0	0	0	112.2	I517 R551 V552 H580	I517-A576 HydrophobicContact CD1-CB 3.75Å; R551-A576 HydrophobicContact CB-CB 4.43Å; R551-A576 HydrophobicContact CG-CB 4.47Å; V552-A576 PolarHBondContact O-N 3.5Å; A576-H580 WeakPolarHBondContact CA-O 3.46Å; A576-H580 VanDerWaalsContact CB-O 3.27Å; A576-H580 WeakPolarHBondContact CB-O 3.22Å
577	D	93.5	Very high	89.8	Confident	112 Å²	112	44.3 Å²	44.3	60%	0.599	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	104.1	162	-168.9	17	0	0	0	108.8	D579 H580 L582	D577-D579 PolarHBondContact O-N 2.94Å; D577-H580 PolarHBondContact N-O 2.88Å; D577-H580 VanDerWaalsContact N-O 3.08Å; D577-H580 PolarHBondContact O-N 3.47Å; D577-H580 VanDerWaalsContact O-N 3.16Å; D577-L582 HydrophobicContact CB-CD1 3.82Å
578	G	89.7	Confident	89.8	Confident	54 Å²	54	44.4 Å²	44.4	56%	0.557	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	-116.3	-167.4	0	0	0	0	0	112.4	R551	R551-G578 PolarHBondContact NH1-O 2.92Å
579	D	92.2	Very high	89.7	Confident	85 Å²	85	38 Å²	38	46%	0.455	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-4.2	177.2	-70.6	-48	0	0	0	113.1	M516 I517 R551 D577	M516-D579 CarbonylContact C-O 3.58Å; M516-D579 WeakPolarHBondContact CA-O 3.23Å; M516-D579 HydrophobicContact CE-CB 3.47Å; M516-D579 VanDerWaalsContact CE-CB 3.47Å; I517-D579 WeakPolarHBondContact CG1-O 3.34Å; I517-D579 PolarHBondContact N-O 3.45Å; R551-D579 IonicContact CZ-OD1 3.83Å; R551-D579 IonicContact NH1-OD1 3.69Å; R551-D579 PolarHBondContact NH1-OD1 3.47Å; R551-D579 IonicContact NH2-OD1 2.55Å; R551-D579 PolarHBondContact NH2-OD1 2.87Å; D577-D579 PolarHBondContact O-N 2.94Å
580	H	95	Very high	89.6	Confident	77 Å²	77	30 Å²	30	36%	0.356	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.8	-178.3	-171.8	69.6	0	0	0	111	N514 M516 A576 D577 L582	N514-H580 PolarHBondContact O-CE1 2.93Å; N514-H580 PolarHBondContact O-ND1 3.17Å; M516-H580 HydrophobicContact SD-CB 4Å; A576-H580 WeakPolarHBondContact CA-O 3.46Å; A576-H580 VanDerWaalsContact CB-O 3.27Å; A576-H580 WeakPolarHBondContact CB-O 3.22Å; D577-H580 PolarHBondContact N-O 2.88Å; D577-H580 VanDerWaalsContact N-O 3.08Å; D577-H580 PolarHBondContact O-N 3.47Å; D577-H580 VanDerWaalsContact O-N 3.16Å; H580-L582 PolarHBondContact O-N 3.32Å
581	L	95.7	Very high	88.7	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	120	179.8	-174.7	65.7	0	0	0	110.7	I484 V509 M515 I517 M574 G583	I484-L581 HydrophobicContact CG2-CD2 3.48Å; I484-L581 VanDerWaalsContact CG2-CD2 3.48Å; I484-L581 HydrophobicContact CG2-CG 4.15Å; V509-L581 HydrophobicContact CB-CD2 3.78Å; V509-L581 HydrophobicContact CG1-CD2 3.8Å; V509-L581 HydrophobicContact CG2-CD1 4.21Å; V509-L581 HydrophobicContact CG2-CD2 3.82Å; M515-L581 HydrophobicContact CB-CB 4.42Å; M515-L581 HydrophobicContact CE-CB 4.41Å; M515-L581 HydrophobicContact CE-CD2 3.92Å; M515-L581 HydrophobicContact CE-CG 4.37Å; M515-L581 WeakPolarHBondContact O-CB 3.46Å; M515-L581 PolarHBondContact O-N 3.29Å; I517-L581 HydrophobicContact CD1-CB 4.06Å; I517-L581 HydrophobicContact CD1-CD1 3.94Å; I517-L581 HydrophobicContact CG1-CB 3.77Å; I517-L581 HydrophobicContact CG1-CD1 4.25Å; M574-L581 HydrophobicContact CB-CD1 4.01Å; M574-L581 HydrophobicContact CG-CD1 4.21Å; L581-G583 WeakPolarHBondContact CD1-O 3.45Å
582	L	96	Very high	88	Confident	59 Å²	59	32.9 Å²	32.9	31%	0.309	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-28.5	178.4	-64.5	178.2	0	0	0	112.9	P554 V575 D577 H580	P554-L582 HydrophobicContact CG-CD1 3.91Å; V575-L582 PolarHBondContact O-N 3.47Å; D577-L582 HydrophobicContact CB-CD1 3.82Å; H580-L582 PolarHBondContact O-N 3.32Å
583	G	95.2	Very high	86.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	-179.8	-177	0	0	0	0	0	113.5	H479 V575 L581	H479-G583 CarbonylContact O-C 3.52Å; H479-G583 WeakPolarHBondContact O-CA 3.47Å; V575-G583 PolarHBondContact N-O 2.95Å; V575-G583 PolarHBondContact O-N 2.95Å; L581-G583 WeakPolarHBondContact CD1-O 3.45Å
584	V	94.9	Very high	85	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	135.1	172.2	173.7	0	0	0	0	108.4	H479 I484 L505 M507 V509	H479-V584 WeakPolarHBondContact CB-O 3.15Å; H479-V584 PolarHBondContact N-O 3.19Å; H479-V584 PolarHBondContact O-N 3.13Å; I484-V584 HydrophobicContact CG2-CG2 4.11Å; L505-V584 HydrophobicContact CD1-CB 4.4Å; L505-V584 HydrophobicContact CD1-CG1 4.03Å; M507-V584 HydrophobicContact SD-CG1 4.08Å; V509-V584 HydrophobicContact CG2-CG2 4.31Å
585	L	92.6	Very high	83.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.6	174	179.5	72.6	0	0	0	109.1	V474 I477 A561 M565 S572 V573 V575 D589 L590	V474-L585 HydrophobicContact CG1-CB 4.25Å; V474-L585 HydrophobicContact CG1-CD2 4.05Å; V474-L585 HydrophobicContact CG2-CD2 3.82Å; I477-L585 HydrophobicContact CD1-CD1 3.62Å; I477-L585 HydrophobicContact CG1-CD1 3.7Å; A561-L585 HydrophobicContact CB-CD2 3.72Å; M565-L585 HydrophobicContact SD-CD2 4.18Å; S572-L585 CarbonylContact C-O 3.44Å; S572-L585 VanDerWaalsContact CA-O 3.29Å; S572-L585 WeakPolarHBondContact CA-O 3.36Å; V573-L585 HydrophobicContact CG1-CB 3.85Å; V573-L585 HydrophobicContact CG1-CD2 4.09Å; V573-L585 HydrophobicContact CG1-CG 4.43Å; V573-L585 PolarHBondContact N-O 3.24Å; V573-L585 PolarHBondContact O-N 3.06Å; V575-L585 HydrophobicContact CG2-CB 4.1Å; L585-D589 HydrophobicContact CD1-CB 4.03Å; L585-L590 HydrophobicContact CD1-CD2 4.49Å; L585-L590 HydrophobicContact CD1-CG 4.32Å; L585-L590 HydrophobicContact CD2-CD1 4.03Å; L585-L590 HydrophobicContact CD2-CD2 4.18Å; L585-L590 HydrophobicContact CD2-CG 4.2Å; L585-L590 HydrophobicContact CG-CD1 4.42Å; L585-L590 HydrophobicContact CG-CG 4.37Å
586	H	89.6	Confident	81.6	Confident	14 Å²	14	36.2 Å²	36.2	7%	0.065	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	150.8	173.6	-166.4	-94.6	0	0	0	110.4	L505 S572 H588 D589	L505-H586 HydrophobicContact CD2-CB 4.02Å; S572-H586 PolarHBondContact OG-CD2 3.33Å; H586-H588 AromaticContact CE1-CD2 3.79Å; H586-H588 AromaticContact CE1-CE1 3.63Å; H586-H588 AromaticContact CE1-CG 3.48Å; H586-H588 VanDerWaalsContact CE1-CG 3.48Å; H586-H588 AromaticContact CE1-ND1 3.38Å; H586-H588 PolarHBondContact CE1-ND1 3.3Å; H586-H588 AromaticContact CE1-NE2 3.85Å; H586-H588 WeakPolarHBondContact ND1-CB 3.1Å; H586-H588 AromaticContact ND1-CD2 3.89Å; H586-H588 AromaticContact ND1-CG 3.31Å; H586-H588 VanDerWaalsContact ND1-CG 3.31Å; H586-H588 PolarHBondContact ND1-N 3.15Å; H586-H588 VanDerWaalsContact ND1-N 3.12Å; H586-H588 AromaticContact ND1-ND1 3.55Å; H586-H588 PolarHBondContact O-N 3.14Å; H586-H588 VanDerWaalsContact O-N 3.16Å; H586-D589 WeakPolarHBondContact CA-OD2 3.38Å; H586-D589 VanDerWaalsContact CB-OD2 3.27Å; H586-D589 WeakPolarHBondContact CB-OD2 3.36Å; H586-D589 PolarHBondContact N-OD2 2.83Å; H586-D589 WeakPolarHBondContact O-CB 3.02Å; H586-D589 PolarHBondContact O-N 2.91Å
587	M	78.7	Confident	79.7	Confident	9 Å²	9	37.3 Å²	37.3	4%	0.044	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-25	-179.5	-160.5	173.6	-58	0	0	112.3	L562 M565 I570 T571 D589 L590 L591 R738	L562-M587 HydrophobicContact CD1-CE 4.45Å; L562-M587 HydrophobicContact CD1-CG 3.96Å; L562-M587 HydrophobicContact CD1-SD 4.04Å; M565-M587 HydrophobicContact CB-CE 4.07Å; M565-M587 HydrophobicContact CE-CB 3.95Å; M565-M587 HydrophobicContact CE-CE 4.38Å; I570-M587 VanDerWaalsContact O-CE 3.31Å; I570-M587 WeakPolarHBondContact O-CE 3.39Å; T571-M587 PolarHBondContact O-N 2.97Å; M587-D589 VanDerWaalsContact C-N 3.27Å; M587-D589 PolarHBondContact O-N 3.45Å; M587-L590 WeakPolarHBondContact O-CB 3.37Å; M587-L590 PolarHBondContact O-N 3.41Å; M587-L591 WeakPolarHBondContact O-CG 3.5Å; M587-L591 PolarHBondContact O-N 2.8Å; M587-R738 PolarHBondContact SD-NE 2.69Å; M587-R738 PolarHBondContact SD-NH1 3.27Å; M587-R738 PolarHBondContact SD-NH2 3.07Å
588	H	74.2	Confident	78.4	Confident	79 Å²	79	37.8 Å²	37.8	37%	0.366	21%	0.207	S	C	.	.	H	α-helix	trans	-67	-28.7	173.7	-62.9	168.4	0	0	0	112.6	H586 L590 L591 R592	H586-H588 AromaticContact CE1-CD2 3.79Å; H586-H588 AromaticContact CE1-CE1 3.63Å; H586-H588 AromaticContact CE1-CG 3.48Å; H586-H588 VanDerWaalsContact CE1-CG 3.48Å; H586-H588 AromaticContact CE1-ND1 3.38Å; H586-H588 PolarHBondContact CE1-ND1 3.3Å; H586-H588 AromaticContact CE1-NE2 3.85Å; H586-H588 WeakPolarHBondContact ND1-CB 3.1Å; H586-H588 AromaticContact ND1-CD2 3.89Å; H586-H588 AromaticContact ND1-CG 3.31Å; H586-H588 VanDerWaalsContact ND1-CG 3.31Å; H586-H588 PolarHBondContact ND1-N 3.15Å; H586-H588 VanDerWaalsContact ND1-N 3.12Å; H586-H588 AromaticContact ND1-ND1 3.55Å; H586-H588 PolarHBondContact O-N 3.14Å; H586-H588 VanDerWaalsContact O-N 3.16Å; H588-L590 VanDerWaalsContact C-N 3.33Å; H588-L591 PolarHBondContact O-N 3.06Å; H588-R592 WeakPolarHBondContact O-CB 3.43Å; H588-R592 VanDerWaalsContact O-CG 3.31Å; H588-R592 WeakPolarHBondContact O-CG 3.44Å; H588-R592 PolarHBondContact O-N 3.16Å
589	D	81.6	Confident	77.8	Confident	18 Å²	18	35.5 Å²	35.5	10%	0.096	18%	0.183	C	C	.	.	H	α-helix	trans	-67.9	-40	176.1	-50.4	-35.7	0	0	0	109.9	H479 L585 H586 M587 R592 A593	H479-D589 IonicContact CD2-OD2 2.81Å; H479-D589 PolarHBondContact CD2-OD2 3.47Å; H479-D589 IonicContact NE2-OD1 2.59Å; H479-D589 PolarHBondContact NE2-OD1 3.5Å; H479-D589 IonicContact NE2-OD2 3.39Å; H479-D589 PolarHBondContact NE2-OD2 2.83Å; L585-D589 HydrophobicContact CD1-CB 4.03Å; H586-D589 WeakPolarHBondContact CA-OD2 3.38Å; H586-D589 VanDerWaalsContact CB-OD2 3.27Å; H586-D589 WeakPolarHBondContact CB-OD2 3.36Å; H586-D589 PolarHBondContact N-OD2 2.83Å; H586-D589 WeakPolarHBondContact O-CB 3.02Å; H586-D589 PolarHBondContact O-N 2.91Å; M587-D589 VanDerWaalsContact C-N 3.27Å; M587-D589 PolarHBondContact O-N 3.45Å; D589-R592 PolarHBondContact O-N 2.9Å; D589-A593 WeakPolarHBondContact O-CB 3.48Å; D589-A593 PolarHBondContact O-N 3.22Å
590	L	75.9	Confident	77.1	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-40.3	174.4	-66.1	165.8	0	0	0	112.1	I477 A558 L562 M565 L585 M587 H588 G594 V595	I477-L590 HydrophobicContact CD1-CD2 3.65Å; I477-L590 HydrophobicContact CD1-CG 4.31Å; A558-L590 HydrophobicContact CB-CD2 3.67Å; A558-L590 WeakPolarHBondContact O-CD2 3.47Å; L562-L590 HydrophobicContact CB-CD1 3.88Å; L562-L590 HydrophobicContact CD1-CD1 3.84Å; L562-L590 HydrophobicContact CG-CD1 4.42Å; M565-L590 HydrophobicContact CE-CD1 4.5Å; M565-L590 HydrophobicContact SD-CD1 3.67Å; L585-L590 HydrophobicContact CD1-CD2 4.49Å; L585-L590 HydrophobicContact CD1-CG 4.32Å; L585-L590 HydrophobicContact CD2-CD1 4.03Å; L585-L590 HydrophobicContact CD2-CD2 4.18Å; L585-L590 HydrophobicContact CD2-CG 4.2Å; L585-L590 HydrophobicContact CG-CD1 4.42Å; L585-L590 HydrophobicContact CG-CG 4.37Å; M587-L590 WeakPolarHBondContact O-CB 3.37Å; M587-L590 PolarHBondContact O-N 3.41Å; H588-L590 VanDerWaalsContact C-N 3.33Å; L590-G594 PolarHBondContact O-N 3.17Å; L590-V595 HydrophobicContact CB-CB 4.38Å; L590-V595 HydrophobicContact CB-CG2 4.42Å; L590-V595 HydrophobicContact CD2-CB 4.41Å; L590-V595 HydrophobicContact CD2-CG1 4.48Å; L590-V595 HydrophobicContact CD2-CG2 3.95Å; L590-V595 VanDerWaalsContact O-CB 3.31Å; L590-V595 WeakPolarHBondContact O-CB 3.11Å; L590-V595 WeakPolarHBondContact O-CG2 3.43Å; L590-V595 PolarHBondContact O-N 3.21Å
591	L	66.2	Low	76.3	Confident	9 Å²	9	31.9 Å²	31.9	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-49.1	175.5	-70.1	170.7	0	0	0	111.5	M587 H588 A593 G594 V596 L752	M587-L591 WeakPolarHBondContact O-CG 3.5Å; M587-L591 PolarHBondContact O-N 2.8Å; H588-L591 PolarHBondContact O-N 3.06Å; L591-A593 VanDerWaalsContact C-N 3.3Å; L591-A593 PolarHBondContact O-N 2.73Å; L591-G594 PolarHBondContact O-N 3.1Å; L591-V596 HydrophobicContact CD2-CB 3.9Å; L591-V596 HydrophobicContact CD2-CG2 3.68Å; L591-L752 HydrophobicContact CD1-CD1 4.43Å
592	R	66.3	Low	75.8	Confident	155 Å²	155	35.4 Å²	35.4	59%	0.585	19%	0.188	S	C	*	.	H	α-helix	trans	-61.6	-37.9	178.2	-76.5	177	174.8	-175.7	-4.9	112.3	H588 D589 G594 L755	H588-R592 WeakPolarHBondContact O-CB 3.43Å; H588-R592 VanDerWaalsContact O-CG 3.31Å; H588-R592 WeakPolarHBondContact O-CG 3.44Å; H588-R592 PolarHBondContact O-N 3.16Å; D589-R592 PolarHBondContact O-N 2.9Å; R592-G594 PolarHBondContact O-N 3.27Å; R592-L755 HydrophobicContact CG-CD1 4.42Å; R592-L755 HydrophobicContact CG-CD2 4.35Å
593	A	67	Low	75.6	Confident	19 Å²	19	32.6 Å²	32.6	16%	0.157	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-3.6	177.2	0	0	0	0	0	113.6	L472 I477 D589 L591 V595	L472-A593 HydrophobicContact CD2-CB 3.51Å; I477-A593 HydrophobicContact CD1-CB 4.42Å; I477-A593 HydrophobicContact CG2-CB 3.87Å; D589-A593 WeakPolarHBondContact O-CB 3.48Å; D589-A593 PolarHBondContact O-N 3.22Å; L591-A593 VanDerWaalsContact C-N 3.3Å; L591-A593 PolarHBondContact O-N 2.73Å; A593-V595 HydrophobicContact CB-CG2 4.33Å
594	G	54.9	Low	75.3	Confident	10 Å²	10	38 Å²	38	10%	0.103	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	24.9	177.3	0	0	0	0	0	113.3	L590 L591 R592 V596 A597	L590-G594 PolarHBondContact O-N 3.17Å; L591-G594 PolarHBondContact O-N 3.1Å; R592-G594 PolarHBondContact O-N 3.27Å; G594-V596 PolarHBondContact O-N 2.76Å; G594-A597 VanDerWaalsContact O-CB 3.29Å; G594-A597 WeakPolarHBondContact O-CB 3.18Å; G594-A597 PolarHBondContact O-N 3.32Å; G594-A597 VanDerWaalsContact O-N 3.09Å
595	V	59.7	Low	75.2	Confident	14 Å²	14	42.4 Å²	42.4	9%	0.085	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.5	173.5	-173.5	0	0	0	0	110.6	L472 A558 V559 L562 L590 A593	L472-V595 HydrophobicContact CD2-CG2 3.56Å; A558-V595 HydrophobicContact CB-CG2 3.87Å; V559-V595 HydrophobicContact CB-CG1 4.42Å; V559-V595 HydrophobicContact CG2-CG1 3.61Å; L562-V595 HydrophobicContact CD2-CG1 4.07Å; L590-V595 HydrophobicContact CB-CB 4.38Å; L590-V595 HydrophobicContact CB-CG2 4.42Å; L590-V595 HydrophobicContact CD2-CB 4.41Å; L590-V595 HydrophobicContact CD2-CG1 4.48Å; L590-V595 HydrophobicContact CD2-CG2 3.95Å; L590-V595 VanDerWaalsContact O-CB 3.31Å; L590-V595 WeakPolarHBondContact O-CB 3.11Å; L590-V595 WeakPolarHBondContact O-CG2 3.43Å; L590-V595 PolarHBondContact O-N 3.21Å; A593-V595 HydrophobicContact CB-CG2 4.33Å
596	V	60.2	Low	75.4	Confident	38 Å²	38	42.5 Å²	42.5	23%	0.23	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	46	170.1	-153.8	0	0	0	0	110.1	L562 L591 G594 D598 V599 M600	L562-V596 HydrophobicContact CD2-CG2 3.83Å; L591-V596 HydrophobicContact CD2-CB 3.9Å; L591-V596 HydrophobicContact CD2-CG2 3.68Å; G594-V596 PolarHBondContact O-N 2.76Å; V596-D598 PolarHBondContact O-N 3.04Å; V596-D598 VanDerWaalsContact O-N 3.08Å; V596-V599 HydrophobicContact CG1-CB 3.9Å; V596-V599 HydrophobicContact CG1-CG2 3.66Å; V596-V599 PolarHBondContact O-N 2.78Å; V596-V599 VanDerWaalsContact O-N 3.1Å; V596-M600 PolarHBondContact O-N 2.88Å
597	A	54	Low	75.7	Confident	28 Å²	28	49.6 Å²	49.6	23%	0.231	25%	0.249	C	C	.	.	H	α-helix	trans	-50.1	-37.1	-172.4	0	0	0	0	0	113.9	A465 G594 V599 M600 A601	A465-A597 HydrophobicContact CB-CB 3.84Å; G594-A597 VanDerWaalsContact O-CB 3.29Å; G594-A597 WeakPolarHBondContact O-CB 3.18Å; G594-A597 PolarHBondContact O-N 3.32Å; G594-A597 VanDerWaalsContact O-N 3.09Å; A597-V599 VanDerWaalsContact C-N 3.35Å; A597-V599 PolarHBondContact O-N 3.17Å; A597-M600 PolarHBondContact O-N 3.2Å; A597-A601 VanDerWaalsContact O-CB 3.29Å; A597-A601 WeakPolarHBondContact O-CB 3.21Å; A597-A601 PolarHBondContact O-N 2.99Å
598	D	67.5	Low	76.6	Confident	121 Å²	121	49.2 Å²	49.2	65%	0.647	25%	0.247	S	C	*	.	H	α-helix	trans	-66	-38.1	-176.3	-60.4	-27	0	0	0	111.9	V596 K602	V596-D598 PolarHBondContact O-N 3.04Å; V596-D598 VanDerWaalsContact O-N 3.08Å; D598-K602 WeakPolarHBondContact O-CB 3.34Å; D598-K602 WeakPolarHBondContact O-CG 3.4Å; D598-K602 PolarHBondContact O-N 3.47Å; D598-K602 VanDerWaalsContact O-N 3.1Å
599	V	75.8	Confident	77.8	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-72.5	-42.1	178.8	175.1	0	0	0	0	110.8	V596 A597 K602 A603 L718 D734 Y735 L752	V596-V599 HydrophobicContact CG1-CB 3.9Å; V596-V599 HydrophobicContact CG1-CG2 3.66Å; V596-V599 PolarHBondContact O-N 2.78Å; V596-V599 VanDerWaalsContact O-N 3.1Å; A597-V599 VanDerWaalsContact C-N 3.35Å; A597-V599 PolarHBondContact O-N 3.17Å; V599-K602 PolarHBondContact O-N 3.33Å; V599-A603 VanDerWaalsContact O-CB 3.25Å; V599-A603 WeakPolarHBondContact O-CB 3.43Å; V599-A603 PolarHBondContact O-N 3.41Å; V599-L718 HydrophobicContact CG1-CD1 4.06Å; V599-D734 VanDerWaalsContact CG2-O 3.28Å; V599-D734 WeakPolarHBondContact CG2-O 3.41Å; V599-Y735 HydrophobicContact CG1-CD2 4.07Å; V599-Y735 HydrophobicContact CG1-CG 4.29Å; V599-L752 HydrophobicContact CG1-CD1 4.47Å; V599-L752 HydrophobicContact CG1-CD2 3.92Å
600	M	77.8	Confident	78.6	Confident	31 Å²	31	44.6 Å²	44.6	15%	0.153	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-42.1	178.6	-69.4	-63	-70	0	0	111.8	V596 A597 K602 A603 E604 L752 L755 A756	V596-M600 PolarHBondContact O-N 2.88Å; A597-M600 PolarHBondContact O-N 3.2Å; M600-K602 VanDerWaalsContact C-N 3.34Å; M600-K602 PolarHBondContact O-N 3.32Å; M600-A603 PolarHBondContact O-N 3Å; M600-E604 PolarHBondContact O-N 3.43Å; M600-L752 HydrophobicContact SD-CD1 3.73Å; M600-L755 HydrophobicContact CE-CD2 4.45Å; M600-L755 HydrophobicContact CE-CG 4.25Å; M600-A756 HydrophobicContact CE-CB 3.81Å; M600-A756 HydrophobicContact SD-CB 4.25Å
601	A	77.8	Confident	79.6	Confident	54 Å²	54	44.6 Å²	44.6	45%	0.446	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-38.3	176.5	0	0	0	0	0	112.2	A597	A597-A601 VanDerWaalsContact O-CB 3.29Å; A597-A601 WeakPolarHBondContact O-CB 3.21Å; A597-A601 PolarHBondContact O-N 2.99Å
602	K	86.7	Confident	81	Confident	78 Å²	78	44.6 Å²	44.6	34%	0.339	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-43.2	172.6	-76.3	174.7	165.2	-146.7	0	111.8	D598 V599 M600 E604 I606 G717 L718 D734	D598-K602 WeakPolarHBondContact O-CB 3.34Å; D598-K602 WeakPolarHBondContact O-CG 3.4Å; D598-K602 PolarHBondContact O-N 3.47Å; D598-K602 VanDerWaalsContact O-N 3.1Å; V599-K602 PolarHBondContact O-N 3.33Å; M600-K602 VanDerWaalsContact C-N 3.34Å; M600-K602 PolarHBondContact O-N 3.32Å; K602-E604 PolarHBondContact O-N 3.34Å; K602-I606 WeakPolarHBondContact O-CD1 3.46Å; K602-I606 WeakPolarHBondContact O-CG1 3.32Å; K602-G717 VanDerWaalsContact CD-O 3.23Å; K602-G717 WeakPolarHBondContact CD-O 3.48Å; K602-G717 WeakPolarHBondContact CG-O 3.38Å; K602-L718 HydrophobicContact CB-CB 4.33Å; K602-L718 HydrophobicContact CB-CD1 4.08Å; K602-L718 HydrophobicContact CD-CD1 4.47Å; K602-D734 HydrophobicContact CD-CB 4.45Å; K602-D734 IonicContact NZ-OD1 2.71Å; K602-D734 PolarHBondContact NZ-OD1 3.34Å; K602-D734 IonicContact NZ-OD2 3.34Å; K602-D734 PolarHBondContact NZ-OD2 2.85Å
603	A	90.3	Very high	82.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-30.9	-178.6	0	0	0	0	0	113.9	V599 M600 N605 I606 L718 L753 A756	V599-A603 VanDerWaalsContact O-CB 3.25Å; V599-A603 WeakPolarHBondContact O-CB 3.43Å; V599-A603 PolarHBondContact O-N 3.41Å; M600-A603 PolarHBondContact O-N 3Å; A603-N605 VanDerWaalsContact C-N 3.26Å; A603-N605 PolarHBondContact O-N 3.37Å; A603-I606 WeakPolarHBondContact O-CG1 3.39Å; A603-I606 PolarHBondContact O-N 2.97Å; A603-L718 HydrophobicContact CB-CD2 4.09Å; A603-L753 HydrophobicContact CB-CD2 3.86Å; A603-A756 HydrophobicContact CB-CB 3.47Å; A603-A756 VanDerWaalsContact CB-CB 3.47Å
604	E	90.2	Very high	83.6	Confident	115 Å²	115	37.9 Å²	37.9	54%	0.537	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-36.1	-176.5	-172.5	176.4	-168.3	0	0	113	M600 K602 Q757	M600-E604 PolarHBondContact O-N 3.43Å; K602-E604 PolarHBondContact O-N 3.34Å; E604-Q757 WeakPolarHBondContact O-CG 3.2Å
605	N	91.8	Very high	85.3	Confident	92 Å²	92	37.7 Å²	37.7	49%	0.492	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.8	-174.2	-64	-64.9	0	0	0	114.2	A603 R607 N699	A603-N605 VanDerWaalsContact C-N 3.26Å; A603-N605 PolarHBondContact O-N 3.37Å; N605-R607 PolarHBondContact O-N 3.38Å; N605-N699 WeakPolarHBondContact O-CB 3.43Å; N605-N699 PolarHBondContact O-OD1 2.91Å
606	I	96.7	Very high	87.1	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.192	C	C	.	.			trans	-68.8	126	-176.1	-58.8	-58	0	0	0	111.2	K602 A603 L608 N699 V700 A701 L718 L753 Q757	K602-I606 WeakPolarHBondContact O-CD1 3.46Å; K602-I606 WeakPolarHBondContact O-CG1 3.32Å; A603-I606 WeakPolarHBondContact O-CG1 3.39Å; A603-I606 PolarHBondContact O-N 2.97Å; I606-L608 WeakPolarHBondContact CG2-O 3.16Å; I606-N699 WeakPolarHBondContact CA-O 3.43Å; I606-V700 WeakPolarHBondContact CD1-O 3.5Å; I606-A701 HydrophobicContact CD1-CB 4.15Å; I606-A701 HydrophobicContact CG1-CB 4.21Å; I606-A701 HydrophobicContact CG2-CB 3.71Å; I606-L718 HydrophobicContact CD1-CB 3.9Å; I606-L718 HydrophobicContact CG1-CB 4.34Å; I606-L718 HydrophobicContact CG1-CD2 4.49Å; I606-L753 HydrophobicContact CB-CD2 3.9Å; I606-L753 HydrophobicContact CG1-CD2 3.82Å; I606-L753 HydrophobicContact CG2-CD1 4.05Å; I606-L753 HydrophobicContact CG2-CD2 4.08Å; I606-Q757 PolarHBondContact O-NE2 3.07Å
607	R	96.6	Very high	88.7	Confident	164 Å²	164	35.7 Å²	35.7	62%	0.619	18%	0.183	S	C	*	.			trans	-115	-16.6	176.8	-67.2	-174	172	-159.7	-4.1	113.5	N605 E651 I695 N699	N605-R607 PolarHBondContact O-N 3.38Å; R607-E651 PolarHBondContact O-N 3.14Å; R607-I695 HydrophobicContact CB-CD1 4.01Å; R607-N699 PolarHBondContact N-O 3.15Å
608	L	97.9	Very high	90.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.4	178.6	175	64.4	0	0	0	110.1	I606 I610 E651 A653 L689 L693 I695 N699 V700 A701	I606-L608 WeakPolarHBondContact CG2-O 3.16Å; L608-I610 HydrophobicContact CD1-CG1 4.47Å; L608-I610 HydrophobicContact CD2-CD1 3.99Å; L608-I610 HydrophobicContact CD2-CG1 3.97Å; L608-I610 HydrophobicContact CG-CD1 4.47Å; L608-I610 HydrophobicContact CG-CG1 3.91Å; L608-E651 CarbonylContact C-O 3.58Å; L608-E651 WeakPolarHBondContact CA-O 3.41Å; L608-E651 HydrophobicContact CD1-CB 3.82Å; L608-A653 HydrophobicContact CD1-CB 4.01Å; L608-L689 HydrophobicContact CD2-CB 4.49Å; L608-L693 HydrophobicContact CD1-CD1 3.87Å; L608-L693 HydrophobicContact CD2-CD1 4.03Å; L608-L693 HydrophobicContact CG-CD1 4.46Å; L608-I695 HydrophobicContact CB-CD1 3.93Å; L608-N699 PolarHBondContact N-O 3.24Å; L608-V700 HydrophobicContact CB-CG1 4.31Å; L608-V700 HydrophobicContact CB-CG2 4.23Å; L608-V700 HydrophobicContact CD2-CG1 4.06Å; L608-V700 HydrophobicContact CD2-CG2 4.09Å; L608-V700 HydrophobicContact CG-CG1 4.15Å; L608-V700 CarbonylContact O-C 3.56Å; L608-V700 WeakPolarHBondContact O-CA 3.45Å; L608-A701 PolarHBondContact O-N 3.44Å
609	L	98.3	Very high	91.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	114.7	171.1	175.3	60.9	0	0	0	109.8	L611 I650 E651 V652 A653 A701 V703 V749 L753	L609-L611 HydrophobicContact CD1-CD2 3.89Å; L609-L611 HydrophobicContact CD2-CD2 4.11Å; L609-L611 HydrophobicContact CG-CD2 3.83Å; L609-L611 HydrophobicContact CG-CG 4.18Å; L609-I650 HydrophobicContact CB-CG2 4.26Å; L609-E651 PolarHBondContact N-O 2.91Å; L609-V652 HydrophobicContact CB-CG2 4.42Å; L609-V652 CarbonylContact O-C 3.52Å; L609-V652 WeakPolarHBondContact O-CA 3.43Å; L609-A653 PolarHBondContact O-N 3.44Å; L609-A701 HydrophobicContact CD1-CB 4.03Å; L609-V703 HydrophobicContact CD1-CG2 3.81Å; L609-V749 HydrophobicContact CD1-CG1 4.01Å; L609-L753 HydrophobicContact CB-CD1 4.31Å; L609-L753 HydrophobicContact CD1-CD1 4.25Å; L609-L753 HydrophobicContact CD2-CD1 4.24Å
610	I	98.3	Very high	92.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.3	175.9	-53.1	-178.6	0	0	0	109.4	L608 A653 I655 F686 L689 V700 A701 Y702 V703	L608-I610 HydrophobicContact CD1-CG1 4.47Å; L608-I610 HydrophobicContact CD2-CD1 3.99Å; L608-I610 HydrophobicContact CD2-CG1 3.97Å; L608-I610 HydrophobicContact CG-CD1 4.47Å; L608-I610 HydrophobicContact CG-CG1 3.91Å; I610-A653 CarbonylContact C-O 3.58Å; I610-A653 WeakPolarHBondContact CA-O 3.36Å; I610-A653 HydrophobicContact CG1-CB 4.39Å; I610-I655 HydrophobicContact CD1-CD1 4.35Å; I610-I655 HydrophobicContact CG2-CB 4.34Å; I610-I655 HydrophobicContact CG2-CD1 3.69Å; I610-I655 HydrophobicContact CG2-CG1 3.75Å; I610-F686 HydrophobicContact CD1-CD2 3.68Å; I610-F686 HydrophobicContact CD1-CE2 4.06Å; I610-L689 HydrophobicContact CD1-CD1 4.02Å; I610-L689 HydrophobicContact CG1-CD1 4.49Å; I610-V700 HydrophobicContact CD1-CG1 3.63Å; I610-V700 HydrophobicContact CG1-CG1 3.84Å; I610-A701 PolarHBondContact N-O 2.99Å; I610-Y702 HydrophobicContact CB-CD2 3.57Å; I610-Y702 HydrophobicContact CB-CE2 4.1Å; I610-Y702 HydrophobicContact CB-CG 4.31Å; I610-Y702 HydrophobicContact CD1-CD2 4.29Å; I610-Y702 HydrophobicContact CG1-CD2 4.48Å; I610-Y702 HydrophobicContact CG2-CD2 3.44Å; I610-Y702 VanDerWaalsContact CG2-CD2 3.44Å; I610-Y702 HydrophobicContact CG2-CE2 3.4Å; I610-Y702 HydrophobicContact CG2-CG 4.47Å; I610-Y702 WeakPolarHBondContact O-CA 3.23Å; I610-V703 PolarHBondContact O-N 2.83Å
611	L	97.9	Very high	92.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.1	-177.7	-55.5	174.6	0	0	0	110.7	L609 L617 I642 V652 A653 I654 I655 V703 V746	L609-L611 HydrophobicContact CD1-CD2 3.89Å; L609-L611 HydrophobicContact CD2-CD2 4.11Å; L609-L611 HydrophobicContact CG-CD2 3.83Å; L609-L611 HydrophobicContact CG-CG 4.18Å; L611-L617 HydrophobicContact CB-CD1 4.21Å; L611-L617 HydrophobicContact CB-CG 4.48Å; L611-L617 HydrophobicContact CD1-CD1 4.26Å; L611-L617 HydrophobicContact CD1-CD2 4.15Å; L611-L617 HydrophobicContact CD1-CG 4.38Å; L611-I642 HydrophobicContact CD1-CD1 3.91Å; L611-I642 HydrophobicContact CD1-CG1 4.12Å; L611-V652 HydrophobicContact CD1-CG1 3.96Å; L611-V652 HydrophobicContact CG-CG1 4.49Å; L611-A653 PolarHBondContact N-O 2.85Å; L611-I654 HydrophobicContact CB-CG1 4.28Å; L611-I654 WeakPolarHBondContact O-CA 3.41Å; L611-I655 PolarHBondContact O-N 2.94Å; L611-I655 VanDerWaalsContact O-N 3.09Å; L611-V703 HydrophobicContact CD2-CB 3.79Å; L611-V703 HydrophobicContact CD2-CG2 3.56Å; L611-V746 HydrophobicContact CD1-CG1 3.66Å; L611-V746 HydrophobicContact CD1-CG2 4.37Å; L611-V746 HydrophobicContact CD2-CG1 3.94Å; L611-V746 HydrophobicContact CD2-CG2 4.03Å; L611-V746 HydrophobicContact CG-CG1 4.48Å
612	D	96	Very high	93.1	Very high	9 Å²	9	34.1 Å²	34.1	5%	0.048	17%	0.173	C	C	.	.			trans	-74.3	166.6	155.5	-158.6	3.9	0	0	0	110.8	V616 K682 V703	D612-V616 HydrophobicContact CB-CB 4.2Å; D612-V616 HydrophobicContact CB-CG2 3.86Å; D612-V616 WeakPolarHBondContact O-CB 3.22Å; D612-K682 IonicContact OD1-NZ 3.31Å; D612-K682 PolarHBondContact OD1-NZ 3.11Å; D612-K682 IonicContact OD2-NZ 2.66Å; D612-K682 PolarHBondContact OD2-NZ 3.4Å; D612-V703 PolarHBondContact N-O 3.46Å
613	V	94.8	Very high	93.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.181	C	C	.	.	I	π-helix	trans	-100.9	-55.9	177.5	179	0	0	0	0	111.2	L617 S618 F634 I654 T656 V663	V613-L617 HydrophobicContact CG2-CD1 4.43Å; V613-L617 PolarHBondContact O-N 3.31Å; V613-L617 VanDerWaalsContact O-N 3.12Å; V613-S618 PolarHBondContact O-N 3.17Å; V613-S618 PolarHBondContact O-OG 2.9Å; V613-F634 HydrophobicContact CG1-CE1 4.09Å; V613-F634 HydrophobicContact CG1-CZ 4.38Å; V613-I654 HydrophobicContact CG2-CG2 3.37Å; V613-T656 HydrophobicContact CG2-CG2 3.93Å; V613-V663 HydrophobicContact CG1-CG2 3.93Å; V613-V663 HydrophobicContact CG2-CG1 3.91Å
614	D	91.7	Very high	92.8	Very high	33 Å²	33	42.7 Å²	42.7	18%	0.176	21%	0.212	C	C	.	.	I	π-helix	trans	-76	129.1	-175.4	-64.7	-24.2	0	0	0	108.1	V616 S618 K632 R658	D614-V616 PolarHBondContact O-N 3.34Å; D614-S618 WeakPolarHBondContact CA-OG 3.33Å; D614-K632 IonicContact OD1-NZ 2.65Å; D614-K632 PolarHBondContact OD1-NZ 3.16Å; D614-K632 IonicContact OD2-NZ 2.98Å; D614-R658 WeakPolarHBondContact OD2-CD 3.36Å
615	G	91.4	Very high	92.7	Very high	5 Å²	5	38.8 Å²	38.8	5%	0.052	20%	0.202	C	C	.	.	I	π-helix	trans	69.1	-4.1	-176.6	0	0	0	0	0	116.1	S618 D705 V722 G741	G615-S618 CarbonylContact C-O 3.05Å; G615-S618 WeakPolarHBondContact CA-O 3.5Å; G615-S618 PolarHBondContact N-O 2.88Å; G615-D705 WeakPolarHBondContact CA-OD2 3.32Å; G615-V722 WeakPolarHBondContact O-CG2 3.33Å; G615-G741 WeakPolarHBondContact O-CA 3.49Å
616	V	96.7	Very high	92.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-116.6	-67.7	175.6	176.8	0	0	0	0	111.9	D612 D614 S618 V703 D705 V722 G742 V746	D612-V616 HydrophobicContact CB-CB 4.2Å; D612-V616 HydrophobicContact CB-CG2 3.86Å; D612-V616 WeakPolarHBondContact O-CB 3.22Å; D614-V616 PolarHBondContact O-N 3.34Å; V616-S618 PolarHBondContact N-O 3.28Å; V616-V703 HydrophobicContact CG1-CB 4.04Å; V616-V703 HydrophobicContact CG1-CG1 3.59Å; V616-V703 HydrophobicContact CG2-CG1 4.47Å; V616-D705 HydrophobicContact CG2-CB 3.95Å; V616-V722 HydrophobicContact CB-CG1 4.43Å; V616-V722 HydrophobicContact CG1-CG1 4.25Å; V616-V722 HydrophobicContact CG2-CG1 4.09Å; V616-G742 PolarHBondContact O-N 3.39Å; V616-V746 HydrophobicContact CG1-CG2 3.78Å
617	L	94.8	Very high	92.1	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.052	26%	0.257	C	S	.	.	I	π-helix	trans	-79.3	-26	175	-76.1	168	0	0	0	112.9	L611 V613 F634 D638 I642 I654 G742 V746	L611-L617 HydrophobicContact CB-CD1 4.21Å; L611-L617 HydrophobicContact CB-CG 4.48Å; L611-L617 HydrophobicContact CD1-CD1 4.26Å; L611-L617 HydrophobicContact CD1-CD2 4.15Å; L611-L617 HydrophobicContact CD1-CG 4.38Å; V613-L617 HydrophobicContact CG2-CD1 4.43Å; V613-L617 PolarHBondContact O-N 3.31Å; V613-L617 VanDerWaalsContact O-N 3.12Å; L617-F634 HydrophobicContact CB-CD1 4.04Å; L617-F634 HydrophobicContact CB-CE1 4.07Å; L617-F634 WeakPolarHBondContact O-CD1 3.25Å; L617-D638 HydrophobicContact CD2-CB 4.36Å; L617-I642 HydrophobicContact CD2-CD1 3.81Å; L617-I654 HydrophobicContact CD1-CD1 3.62Å; L617-I654 HydrophobicContact CD1-CG1 4.02Å; L617-G742 WeakPolarHBondContact O-CA 3.41Å; L617-V746 HydrophobicContact CD2-CB 4.27Å; L617-V746 HydrophobicContact CD2-CG1 4.35Å; L617-V746 HydrophobicContact CD2-CG2 3.76Å; L617-V746 HydrophobicContact CG-CG2 4.26Å
618	S	93.5	Very high	91.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-111.6	162.9	173.2	67.7	0	0	0	0	110.3	V613 D614 G615 V616 G620 G741 G742	V613-S618 PolarHBondContact O-N 3.17Å; V613-S618 PolarHBondContact O-OG 2.9Å; D614-S618 WeakPolarHBondContact CA-OG 3.33Å; G615-S618 CarbonylContact C-O 3.05Å; G615-S618 WeakPolarHBondContact CA-O 3.5Å; G615-S618 PolarHBondContact N-O 2.88Å; V616-S618 PolarHBondContact N-O 3.28Å; S618-G620 PolarHBondContact O-N 2.84Å; S618-G620 VanDerWaalsContact O-N 3.14Å; S618-G741 CarbonylContact O-C 3.55Å; S618-G742 VanDerWaalsContact C-CA 3.46Å; S618-G742 PolarHBondContact O-N 3.45Å
619	D	90.1	Very high	90.6	Very high	28 Å²	28	48.6 Å²	48.6	15%	0.15	28%	0.278	C	S	.	.			trans	-80.3	18.4	178.7	64.7	-9.8	0	0	0	113.3	L621 G741 R743	D619-L621 PolarHBondContact O-N 3.38Å; D619-L621 VanDerWaalsContact O-N 3.16Å; D619-L621 PolarHBondContact OD1-N 3.29Å; D619-G741 WeakPolarHBondContact CA-O 3.44Å; D619-R743 IonicContact OD2-CZ 2.62Å; D619-R743 IonicContact OD2-NH2 3.44Å; D619-R743 PolarHBondContact OD2-NH2 2.87Å
620	G	87.9	Confident	90	Very high	44 Å²	44	51.8 Å²	51.8	45%	0.454	29%	0.293	S	S	.	.	S	Bend	trans	74.5	-6.2	-178.9	0	0	0	0	0	114.8	S618	S618-G620 PolarHBondContact O-N 2.84Å; S618-G620 VanDerWaalsContact O-N 3.14Å
621	L	87.5	Confident	89.3	Confident	84 Å²	84	57.4 Å²	57.4	44%	0.44	32%	0.322	S	S	.	.			trans	-88	139.3	-179.8	-60.8	176.3	0	0	0	111.7	D619 Y623	D619-L621 PolarHBondContact O-N 3.38Å; D619-L621 VanDerWaalsContact O-N 3.16Å; D619-L621 PolarHBondContact OD1-N 3.29Å; L621-Y623 HydrophobicContact CB-CE2 4.04Å
622	I	85.3	Confident	88.9	Confident	52 Å²	52	58.7 Å²	58.7	27%	0.267	33%	0.328	S	S	.	.			trans	-123.5	115.2	173.1	-53.9	-176.9	0	0	0	107.7	M624 E630 K632 R658	I622-M624 HydrophobicContact CG2-CG 4.03Å; I622-E630 HydrophobicContact CG2-CB 4.5Å; I622-E630 HydrophobicContact CG2-CG 4.46Å; I622-K632 VanDerWaalsContact CG1-NZ 3.33Å; I622-R658 VanDerWaalsContact CD1-CZ 3.41Å
623	Y	86.9	Confident	88.6	Confident	130 Å²	130	60.7 Å²	60.7	51%	0.51	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.8	174.8	-58.8	-93.8	0	0	0	108.4	L621 E630 L631	L621-Y623 HydrophobicContact CB-CE2 4.04Å; Y623-E630 WeakPolarHBondContact O-CA 3.32Å; Y623-L631 PolarHBondContact N-O 2.84Å; Y623-L631 VanDerWaalsContact N-O 3.08Å; Y623-L631 PolarHBondContact O-N 3.45Å
624	M	85.7	Confident	88.4	Confident	129 Å²	129	63 Å²	63	64%	0.635	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.4	-179.8	-61.2	-173.4	76.4	0	0	110.3	I622 E629 E630	I622-M624 HydrophobicContact CG2-CG 4.03Å; M624-E629 CarbonylContact C-O 3.59Å; M624-E629 WeakPolarHBondContact CA-O 3.32Å; M624-E630 HydrophobicContact CE-CG 4.38Å; M624-E630 HydrophobicContact CG-CG 4.41Å
625	G	86.5	Confident	88.4	Confident	32 Å²	32	63.2 Å²	63.2	33%	0.33	36%	0.357	S	S	.	.			trans	-78.2	153.9	170.3	0	0	0	0	0	111.7	N627 G628 E629	G625-N627 PolarHBondContact O-N 3.04Å; G625-N627 VanDerWaalsContact O-N 3.11Å; G625-G628 PolarHBondContact O-N 3Å; G625-G628 VanDerWaalsContact O-N 3.1Å; G625-E629 WeakPolarHBondContact CA-OE2 3.16Å; G625-E629 PolarHBondContact N-O 2.88Å
626	N	88.6	Confident	88.4	Confident	171 Å²	171	66.3 Å²	66.3	91%	0.914	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.1	179.9	-72	-24.7	0	0	0	113.7
627	N	87	Confident	88.1	Confident	140 Å²	140	74.3 Å²	74.3	75%	0.749	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	14.5	177.1	-40	-54.6	0	0	0	112.7	G625 E629	G625-N627 PolarHBondContact O-N 3.04Å; G625-N627 VanDerWaalsContact O-N 3.11Å; N627-E629 WeakPolarHBondContact CA-OE2 3.28Å; N627-E629 WeakPolarHBondContact CB-OE1 3.45Å; N627-E629 WeakPolarHBondContact CB-OE2 3.46Å; N627-E629 PolarHBondContact N-OE2 2.79Å; N627-E629 VanDerWaalsContact N-OE2 3.08Å; N627-E629 PolarHBondContact ND2-OE1 3Å
628	G	79.8	Confident	88	Confident	60 Å²	60	73.9 Å²	73.9	62%	0.619	40%	0.402	S	S	*	.	S	Bend	trans	86.1	13.2	179.3	0	0	0	0	0	114.4	G625	G625-G628 PolarHBondContact O-N 3Å; G625-G628 VanDerWaalsContact O-N 3.1Å
629	E	84.2	Confident	88	Confident	92 Å²	92	74 Å²	74	43%	0.43	40%	0.403	S	S	.	.			trans	-68.1	132.1	168.8	-52.9	92.9	156	0	0	110.2	M624 G625 N627	M624-E629 CarbonylContact C-O 3.59Å; M624-E629 WeakPolarHBondContact CA-O 3.32Å; G625-E629 WeakPolarHBondContact CA-OE2 3.16Å; G625-E629 PolarHBondContact N-O 2.88Å; N627-E629 WeakPolarHBondContact CA-OE2 3.28Å; N627-E629 WeakPolarHBondContact CB-OE1 3.45Å; N627-E629 WeakPolarHBondContact CB-OE2 3.46Å; N627-E629 PolarHBondContact N-OE2 2.79Å; N627-E629 VanDerWaalsContact N-OE2 3.08Å; N627-E629 PolarHBondContact ND2-OE1 3Å
630	E	84.5	Confident	88	Confident	68 Å²	68	75.7 Å²	75.7	32%	0.318	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.7	169.7	-68.1	-167.6	168.1	0	0	109.6	I622 Y623 M624 R658	I622-E630 HydrophobicContact CG2-CB 4.5Å; I622-E630 HydrophobicContact CG2-CG 4.46Å; Y623-E630 WeakPolarHBondContact O-CA 3.32Å; M624-E630 HydrophobicContact CE-CG 4.38Å; M624-E630 HydrophobicContact CG-CG 4.41Å; E630-R658 IonicContact OE1-NH2 2.6Å; E630-R658 PolarHBondContact OE1-NH2 3.41Å; E630-R658 IonicContact OE2-NH2 3.1Å
631	L	85.6	Confident	88.3	Confident	117 Å²	117	73.6 Å²	73.6	61%	0.613	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.3	176.5	-61.4	160.3	0	0	0	109.9	Y623	Y623-L631 PolarHBondContact N-O 2.84Å; Y623-L631 VanDerWaalsContact N-O 3.08Å; Y623-L631 PolarHBondContact O-N 3.45Å
632	K	88.6	Confident	88.6	Confident	28 Å²	28	69.6 Å²	69.6	12%	0.122	37%	0.365	C	S	.	.			trans	-129.3	144.6	172.3	-72	177.8	175.7	-81.1	0	109.6	D614 I622 F634 L662	D614-K632 IonicContact OD1-NZ 2.65Å; D614-K632 PolarHBondContact OD1-NZ 3.16Å; D614-K632 IonicContact OD2-NZ 2.98Å; I622-K632 VanDerWaalsContact CG1-NZ 3.33Å; K632-F634 HydrophobicContact CB-CE2 4.41Å; K632-L662 HydrophobicContact CB-CD1 3.91Å; K632-L662 HydrophobicContact CB-CD2 4.2Å; K632-L662 HydrophobicContact CD-CD1 3.87Å; K632-L662 HydrophobicContact CD-CD2 3.99Å; K632-L662 HydrophobicContact CD-CG 4.48Å; K632-L662 HydrophobicContact CG-CD1 4.33Å; K632-L662 HydrophobicContact CG-CD2 4.08Å
633	A	88.7	Confident	89.1	Confident	50 Å²	50	70.3 Å²	70.3	41%	0.413	37%	0.365	S	S	.	.			trans	-98.1	138.4	174.2	0	0	0	0	0	110.3
634	F	92	Very high	89.3	Confident	50 Å²	50	64.3 Å²	64.3	22%	0.219	34%	0.341	C	S	.	.			trans	-121.6	144	171.9	-64.4	-76.8	0	0	0	109.7	V613 L617 K632 L662 V663 R666	V613-F634 HydrophobicContact CG1-CE1 4.09Å; V613-F634 HydrophobicContact CG1-CZ 4.38Å; L617-F634 HydrophobicContact CB-CD1 4.04Å; L617-F634 HydrophobicContact CB-CE1 4.07Å; L617-F634 WeakPolarHBondContact O-CD1 3.25Å; K632-F634 HydrophobicContact CB-CE2 4.41Å; F634-L662 HydrophobicContact CE2-CD1 3.4Å; F634-L662 HydrophobicContact CZ-CD1 3.55Å; F634-V663 HydrophobicContact CZ-CG2 4.48Å; F634-R666 HydrophobicContact CD1-CG 4.47Å; F634-R666 HydrophobicContact CD2-CG 4.03Å; F634-R666 HydrophobicContact CE2-CB 4.19Å; F634-R666 HydrophobicContact CE2-CG 4.13Å; F634-R666 HydrophobicContact CG-CG 4.2Å; F634-R666 HydrophobicContact CZ-CB 4.49Å; F634-R666 HydrophobicContact CZ-CG 4.41Å
635	N	91.7	Very high	89.7	Confident	38 Å²	38	58.1 Å²	58.1	20%	0.203	31%	0.311	C	S	.	.			trans	-77.9	132.9	175.4	-151.5	-73.4	0	0	0	111.2	R637 D638 G639 G742 R743	N635-R637 VanDerWaalsContact C-N 3.26Å; N635-R637 PolarHBondContact O-N 3.24Å; N635-R637 VanDerWaalsContact OD1-CB 3.23Å; N635-R637 WeakPolarHBondContact OD1-CB 3.4Å; N635-R637 WeakPolarHBondContact OD1-CG 3.31Å; N635-R637 PolarHBondContact OD1-N 3.44Å; N635-D638 HydrophobicContact CB-CB 4.16Å; N635-D638 WeakPolarHBondContact CB-OD2 3.49Å; N635-D638 PolarHBondContact O-N 3.01Å; N635-G639 PolarHBondContact O-N 3.45Å; N635-G742 WeakPolarHBondContact CB-O 3.49Å; N635-G742 PolarHBondContact ND2-O 2.91Å; N635-R743 WeakPolarHBondContact ND2-CA 3.21Å; N635-R743 PolarHBondContact ND2-O 3.35Å
636	V	90.4	Very high	90.1	Very high	69 Å²	69	58.3 Å²	58.3	42%	0.418	30%	0.304	S	S	.	.	H	α-helix	trans	-65.4	-32.2	175	-180	0	0	0	0	111.3	D638 G639 Y640 S767	V636-D638 VanDerWaalsContact C-N 3.35Å; V636-D638 PolarHBondContact O-N 3.37Å; V636-G639 PolarHBondContact O-N 3.35Å; V636-Y640 PolarHBondContact O-N 3.49Å; V636-S767 WeakPolarHBondContact CG1-OG 3.33Å
637	R	90.5	Very high	90.1	Very high	168 Å²	168	53.5 Å²	53.5	63%	0.634	28%	0.281	S	S	*	.	H	α-helix	trans	-65.5	-39	177.8	-61.9	178.3	176.8	-176	-3.6	111.9	N635 G639 Y640 G641 R747	N635-R637 VanDerWaalsContact C-N 3.26Å; N635-R637 PolarHBondContact O-N 3.24Å; N635-R637 VanDerWaalsContact OD1-CB 3.23Å; N635-R637 WeakPolarHBondContact OD1-CB 3.4Å; N635-R637 WeakPolarHBondContact OD1-CG 3.31Å; N635-R637 PolarHBondContact OD1-N 3.44Å; R637-G639 VanDerWaalsContact C-N 3.31Å; R637-Y640 PolarHBondContact O-N 3.04Å; R637-G641 PolarHBondContact O-N 3.14Å; R637-R747 HydrophobicContact CB-CB 4.22Å; R637-R747 HydrophobicContact CB-CG 4.31Å; R637-R747 WeakPolarHBondContact O-CB 3.24Å; R637-R747 WeakPolarHBondContact O-CD 3.36Å
638	D	93.2	Very high	90.3	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.011	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-42.6	175.1	-68.1	-31.4	0	0	0	110.3	L617 N635 V636 Y640 G641 I642 G744 A745 V746 R747	L617-D638 HydrophobicContact CD2-CB 4.36Å; N635-D638 HydrophobicContact CB-CB 4.16Å; N635-D638 WeakPolarHBondContact CB-OD2 3.49Å; N635-D638 PolarHBondContact O-N 3.01Å; V636-D638 VanDerWaalsContact C-N 3.35Å; V636-D638 PolarHBondContact O-N 3.37Å; D638-Y640 PolarHBondContact O-N 3.2Å; D638-G641 PolarHBondContact O-N 3.3Å; D638-I642 WeakPolarHBondContact O-CG1 3.45Å; D638-I642 PolarHBondContact O-N 3.25Å; D638-G744 WeakPolarHBondContact OD1-CA 3.17Å; D638-G744 PolarHBondContact OD2-N 3.03Å; D638-A745 PolarHBondContact OD1-N 3.02Å; D638-V746 HydrophobicContact CB-CB 3.97Å; D638-V746 WeakPolarHBondContact OD1-CA 3.36Å; D638-V746 WeakPolarHBondContact OD1-CB 3.44Å; D638-V746 PolarHBondContact OD1-N 3.28Å; D638-R747 PolarHBondContact OD1-N 3.47Å
639	G	92.6	Very high	90.8	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-46.8	173.2	0	0	0	0	0	112.9	N635 V636 R637 G641 I642 R643 L670	N635-G639 PolarHBondContact O-N 3.45Å; V636-G639 PolarHBondContact O-N 3.35Å; R637-G639 VanDerWaalsContact C-N 3.31Å; G639-G641 PolarHBondContact O-N 2.94Å; G639-I642 PolarHBondContact O-N 3.21Å; G639-R643 WeakPolarHBondContact O-CG 3.36Å; G639-R643 PolarHBondContact O-N 3.01Å; G639-L670 VanDerWaalsContact CA-CD2 3.47Å
640	Y	91.5	Very high	91.4	Very high	64 Å²	64	46.8 Å²	46.8	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-45.4	175.3	-177.7	-82.2	0	0	0	112.2	V636 R637 D638 I642 R643 C644 G765	V636-Y640 PolarHBondContact O-N 3.49Å; R637-Y640 PolarHBondContact O-N 3.04Å; D638-Y640 PolarHBondContact O-N 3.2Å; Y640-I642 VanDerWaalsContact C-N 3.35Å; Y640-I642 PolarHBondContact O-N 3.45Å; Y640-R643 PolarHBondContact O-N 3.28Å; Y640-C644 WeakPolarHBondContact CE1-SG 3.3Å; Y640-C644 PolarHBondContact O-N 3.1Å; Y640-G765 VanDerWaalsContact CE2-C 3.45Å; Y640-G765 WeakPolarHBondContact CE2-O 3.5Å
641	G	92.6	Very high	91.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-45	179.1	0	0	0	0	0	112.4	R637 D638 G639 R643 C644 A645 C750	R637-G641 PolarHBondContact O-N 3.14Å; D638-G641 PolarHBondContact O-N 3.3Å; G639-G641 PolarHBondContact O-N 2.94Å; G641-R643 VanDerWaalsContact C-N 3.34Å; G641-R643 PolarHBondContact O-N 2.86Å; G641-C644 WeakPolarHBondContact O-CB 3.49Å; G641-C644 PolarHBondContact O-N 3.24Å; G641-A645 PolarHBondContact O-N 2.95Å; G641-C750 WeakPolarHBondContact O-CB 3.47Å; G641-C750 PolarHBondContact O-SG 3.19Å
642	I	95.6	Very high	92.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-44.3	175.6	-71.5	164	0	0	0	111.1	L611 L617 D638 G639 Y640 C644 A645 L646 V652 L670 I672 V746	L611-I642 HydrophobicContact CD1-CD1 3.91Å; L611-I642 HydrophobicContact CD1-CG1 4.12Å; L617-I642 HydrophobicContact CD2-CD1 3.81Å; D638-I642 WeakPolarHBondContact O-CG1 3.45Å; D638-I642 PolarHBondContact O-N 3.25Å; G639-I642 PolarHBondContact O-N 3.21Å; Y640-I642 VanDerWaalsContact C-N 3.35Å; Y640-I642 PolarHBondContact O-N 3.45Å; I642-C644 VanDerWaalsContact C-N 3.35Å; I642-C644 PolarHBondContact O-N 3.38Å; I642-A645 PolarHBondContact O-N 2.95Å; I642-L646 HydrophobicContact CG2-CD1 3.95Å; I642-L646 HydrophobicContact CG2-CG 4.48Å; I642-L646 WeakPolarHBondContact O-CG 3.26Å; I642-L646 PolarHBondContact O-N 2.86Å; I642-V652 HydrophobicContact CG2-CB 4.5Å; I642-V652 HydrophobicContact CG2-CG1 4.24Å; I642-V652 HydrophobicContact CG2-CG2 4.33Å; I642-L670 HydrophobicContact CD1-CD1 3.85Å; I642-L670 HydrophobicContact CG2-CB 4.25Å; I642-L670 HydrophobicContact CG2-CD1 4.48Å; I642-I672 HydrophobicContact CD1-CD1 4.39Å; I642-I672 HydrophobicContact CG2-CD1 3.98Å; I642-I672 HydrophobicContact CG2-CG1 3.98Å; I642-V746 HydrophobicContact CD1-CG1 4.12Å; I642-V746 HydrophobicContact CG1-CG1 3.91Å
643	R	94.5	Very high	92.9	Very high	68 Å²	68	40.3 Å²	40.3	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-43	177	-68.4	-57.7	-61.5	163.9	1.1	111.5	G639 Y640 G641 L646 T647 L670	G639-R643 WeakPolarHBondContact O-CG 3.36Å; G639-R643 PolarHBondContact O-N 3.01Å; Y640-R643 PolarHBondContact O-N 3.28Å; G641-R643 VanDerWaalsContact C-N 3.34Å; G641-R643 PolarHBondContact O-N 2.86Å; R643-L646 PolarHBondContact O-N 2.89Å; R643-T647 WeakPolarHBondContact O-CG2 3.3Å; R643-T647 PolarHBondContact O-N 3.11Å; R643-T647 PolarHBondContact O-OG1 2.86Å; R643-L670 WeakPolarHBondContact CD-O 3.39Å; R643-L670 HydrophobicContact CG-CD2 4.47Å; R643-L670 PolarHBondContact NH1-O 3.42Å
644	C	92.6	Very high	93.3	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-57.2	-49	174	-78.6	0	0	0	0	111.6	Y640 G641 I642 T647 S648 L754 A763 G765	Y640-C644 WeakPolarHBondContact CE1-SG 3.3Å; Y640-C644 PolarHBondContact O-N 3.1Å; G641-C644 WeakPolarHBondContact O-CB 3.49Å; G641-C644 PolarHBondContact O-N 3.24Å; I642-C644 VanDerWaalsContact C-N 3.35Å; I642-C644 PolarHBondContact O-N 3.38Å; C644-T647 WeakPolarHBondContact CA-OG1 3.45Å; C644-T647 PolarHBondContact O-N 3.18Å; C644-T647 PolarHBondContact O-OG1 3.4Å; C644-S648 WeakPolarHBondContact O-CB 3.28Å; C644-S648 PolarHBondContact O-N 2.89Å; C644-S648 PolarHBondContact O-OG 3.49Å; C644-L754 HydrophobicContact CB-CD1 3.7Å; C644-A763 HydrophobicContact CB-CB 3.88Å; C644-G765 PolarHBondContact SG-N 3.27Å
645	A	93.7	Very high	93.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.9	-50.6	178.2	0	0	0	0	0	112	G641 I642 T647 S648 I650 V652	G641-A645 PolarHBondContact O-N 2.95Å; I642-A645 PolarHBondContact O-N 2.95Å; A645-T647 VanDerWaalsContact C-N 3.32Å; A645-T647 PolarHBondContact O-N 3Å; A645-S648 CarbonylContact O-C 3.36Å; A645-S648 PolarHBondContact O-N 3.43Å; A645-I650 CarbonylContact C-O 3.56Å; A645-I650 HydrophobicContact CB-CB 4.16Å; A645-I650 HydrophobicContact CB-CG2 4.45Å; A645-I650 WeakPolarHBondContact O-CB 2.95Å; A645-I650 PolarHBondContact O-N 2.97Å; A645-I650 VanDerWaalsContact O-N 3.08Å; A645-V652 HydrophobicContact CB-CG2 4.24Å
646	L	93.3	Very high	93.6	Very high	36 Å²	36	34 Å²	34	19%	0.188	16%	0.164	C	C	.	.	H	α-helix	trans	-59.9	-39	178.3	-72.7	170.7	0	0	0	112.6	I642 R643 S648 I650 V652 L670 I672	I642-L646 HydrophobicContact CG2-CD1 3.95Å; I642-L646 HydrophobicContact CG2-CG 4.48Å; I642-L646 WeakPolarHBondContact O-CG 3.26Å; I642-L646 PolarHBondContact O-N 2.86Å; R643-L646 PolarHBondContact O-N 2.89Å; L646-S648 PolarHBondContact O-N 2.99Å; L646-I650 WeakPolarHBondContact CA-O 3.32Å; L646-V652 HydrophobicContact CD2-CB 3.96Å; L646-V652 HydrophobicContact CD2-CG2 3.86Å; L646-V652 HydrophobicContact CG-CB 4.29Å; L646-V652 HydrophobicContact CG-CG2 3.88Å; L646-L670 WeakPolarHBondContact CD1-O 3.36Å; L646-I672 HydrophobicContact CD1-CG1 4.46Å
647	T	90.5	Very high	93.6	Very high	70 Å²	70	32.6 Å²	32.6	43%	0.429	16%	0.163	S	C	.	.	H	α-helix	trans	-74.9	-6.9	177.3	55.9	0	0	0	0	114.2	R643 C644 A645 K764	R643-T647 WeakPolarHBondContact O-CG2 3.3Å; R643-T647 PolarHBondContact O-N 3.11Å; R643-T647 PolarHBondContact O-OG1 2.86Å; C644-T647 WeakPolarHBondContact CA-OG1 3.45Å; C644-T647 PolarHBondContact O-N 3.18Å; C644-T647 PolarHBondContact O-OG1 3.4Å; A645-T647 VanDerWaalsContact C-N 3.32Å; A645-T647 PolarHBondContact O-N 3Å; T647-K764 PolarHBondContact OG1-O 3.4Å
648	S	91	Very high	93.4	Very high	13 Å²	13	29.7 Å²	29.7	9%	0.091	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	25.5	-177.3	-68	0	0	0	0	112.4	C644 A645 L646 I650 L754 K759	C644-S648 WeakPolarHBondContact O-CB 3.28Å; C644-S648 PolarHBondContact O-N 2.89Å; C644-S648 PolarHBondContact O-OG 3.49Å; A645-S648 CarbonylContact O-C 3.36Å; A645-S648 PolarHBondContact O-N 3.43Å; L646-S648 PolarHBondContact O-N 2.99Å; S648-I650 VanDerWaalsContact C-N 3.32Å; S648-I650 PolarHBondContact O-N 3.04Å; S648-L754 VanDerWaalsContact CB-CD2 3.44Å; S648-K759 PolarHBondContact O-NZ 3.04Å
649	D	90.6	Very high	93.2	Very high	137 Å²	137	37.4 Å²	37.4	73%	0.733	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	32.3	178.7	-53	-48.5	0	0	0	114.3
650	I	94.8	Very high	93	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.189	C	C	.	.			trans	-108.9	110	168.3	-55.3	174.5	0	0	0	107.3	L609 A645 L646 S648 L753 L754	L609-I650 HydrophobicContact CB-CG2 4.26Å; A645-I650 CarbonylContact C-O 3.56Å; A645-I650 HydrophobicContact CB-CB 4.16Å; A645-I650 HydrophobicContact CB-CG2 4.45Å; A645-I650 WeakPolarHBondContact O-CB 2.95Å; A645-I650 PolarHBondContact O-N 2.97Å; A645-I650 VanDerWaalsContact O-N 3.08Å; L646-I650 WeakPolarHBondContact CA-O 3.32Å; S648-I650 VanDerWaalsContact C-N 3.32Å; S648-I650 PolarHBondContact O-N 3.04Å; I650-L753 HydrophobicContact CD1-CB 4.03Å; I650-L753 HydrophobicContact CG2-CD1 4.5Å; I650-L754 HydrophobicContact CD1-CD2 4.25Å
651	E	96.4	Very high	92.9	Very high	76 Å²	76	41.9 Å²	41.9	36%	0.355	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	145.8	174.5	-71.2	-63.4	161.5	0	0	110.1	R607 L608 L609 H674 L693	R607-E651 PolarHBondContact O-N 3.14Å; L608-E651 CarbonylContact C-O 3.58Å; L608-E651 WeakPolarHBondContact CA-O 3.41Å; L608-E651 HydrophobicContact CD1-CB 3.82Å; L609-E651 PolarHBondContact N-O 2.91Å; E651-H674 IonicContact OE2-CD2 3.81Å; E651-H674 IonicContact OE2-NE2 4Å; E651-L693 HydrophobicContact CB-CD1 4.4Å
652	V	97.4	Very high	92.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.7	177.6	-177.8	0	0	0	0	109.2	L609 L611 I642 A645 L646 I672	L609-V652 HydrophobicContact CB-CG2 4.42Å; L609-V652 CarbonylContact O-C 3.52Å; L609-V652 WeakPolarHBondContact O-CA 3.43Å; L611-V652 HydrophobicContact CD1-CG1 3.96Å; L611-V652 HydrophobicContact CG-CG1 4.49Å; I642-V652 HydrophobicContact CG2-CB 4.5Å; I642-V652 HydrophobicContact CG2-CG1 4.24Å; I642-V652 HydrophobicContact CG2-CG2 4.33Å; A645-V652 HydrophobicContact CB-CG2 4.24Å; L646-V652 HydrophobicContact CD2-CB 3.96Å; L646-V652 HydrophobicContact CD2-CG2 3.86Å; L646-V652 HydrophobicContact CG-CB 4.29Å; L646-V652 HydrophobicContact CG-CG2 3.88Å; V652-I672 HydrophobicContact CB-CG1 4.4Å; V652-I672 HydrophobicContact CG1-CD1 4.02Å; V652-I672 HydrophobicContact CG1-CG1 4.15Å; V652-I672 WeakPolarHBondContact O-CG2 3.46Å
653	A	97.7	Very high	92.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153	175.9	0	0	0	0	0	111.5	L608 L609 I610 L611 H674 L689	L608-A653 HydrophobicContact CD1-CB 4.01Å; L609-A653 PolarHBondContact O-N 3.44Å; I610-A653 CarbonylContact C-O 3.58Å; I610-A653 WeakPolarHBondContact CA-O 3.36Å; I610-A653 HydrophobicContact CG1-CB 4.39Å; L611-A653 PolarHBondContact N-O 2.85Å; A653-H674 CarbonylContact C-O 3.58Å; A653-H674 VanDerWaalsContact CA-O 3.3Å; A653-H674 WeakPolarHBondContact CA-O 3.41Å; A653-H674 HydrophobicContact CB-CB 3.6Å; A653-L689 HydrophobicContact CB-CD1 3.76Å; A653-L689 HydrophobicContact CB-CD2 3.93Å
654	I	97.3	Very high	92.6	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.1	175.1	-74.8	166.9	0	0	0	109.7	L611 V613 L617 T656 C667 I672 H674 L675 Y676	L611-I654 HydrophobicContact CB-CG1 4.28Å; L611-I654 WeakPolarHBondContact O-CA 3.41Å; V613-I654 HydrophobicContact CG2-CG2 3.37Å; L617-I654 HydrophobicContact CD1-CD1 3.62Å; L617-I654 HydrophobicContact CD1-CG1 4.02Å; I654-T656 HydrophobicContact CG2-CG2 4.31Å; I654-C667 WeakPolarHBondContact CD1-SG 3.47Å; I654-I672 HydrophobicContact CD1-CD1 3.54Å; I654-I672 HydrophobicContact CD1-CG2 4.44Å; I654-I672 HydrophobicContact CG1-CD1 4.27Å; I654-H674 PolarHBondContact N-O 3.39Å; I654-L675 HydrophobicContact CB-CD1 3.86Å; I654-L675 HydrophobicContact CG2-CD1 3.59Å; I654-Y676 PolarHBondContact O-N 3.12Å
655	I	96.5	Very high	92.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	111.3	172.5	-54.2	178.1	0	0	0	108.8	I610 L611 Y676 Q679 K682 A685 F686 L689 Y702	I610-I655 HydrophobicContact CD1-CD1 4.35Å; I610-I655 HydrophobicContact CG2-CB 4.34Å; I610-I655 HydrophobicContact CG2-CD1 3.69Å; I610-I655 HydrophobicContact CG2-CG1 3.75Å; L611-I655 PolarHBondContact O-N 2.94Å; L611-I655 VanDerWaalsContact O-N 3.09Å; I655-Y676 WeakPolarHBondContact CA-O 3.23Å; I655-Q679 HydrophobicContact CG2-CB 4.12Å; I655-Q679 HydrophobicContact CG2-CG 4.38Å; I655-K682 HydrophobicContact CG2-CB 3.88Å; I655-K682 HydrophobicContact CG2-CD 3.98Å; I655-K682 HydrophobicContact CG2-CG 3.81Å; I655-K682 PolarHBondContact O-NZ 3.34Å; I655-A685 HydrophobicContact CD1-CB 3.95Å; I655-A685 HydrophobicContact CG1-CB 4.16Å; I655-A685 HydrophobicContact CG2-CB 3.97Å; I655-F686 HydrophobicContact CD1-CB 4.47Å; I655-L689 HydrophobicContact CD1-CD1 3.91Å; I655-L689 HydrophobicContact CG1-CD1 4.2Å; I655-Y702 HydrophobicContact CD1-CE2 4.44Å
656	T	93.9	Very high	92.5	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.018	26%	0.255	C	S	.	.			trans	-131.7	145.8	-178.7	-178	0	0	0	0	112.4	V613 I654 R658 Y676 Q677 G678 Q679	V613-T656 HydrophobicContact CG2-CG2 3.93Å; I654-T656 HydrophobicContact CG2-CG2 4.31Å; T656-R658 VanDerWaalsContact C-N 3.35Å; T656-R658 WeakPolarHBondContact CG2-O 3.36Å; T656-R658 PolarHBondContact OG1-N 3.15Å; T656-Y676 PolarHBondContact N-O 2.97Å; T656-Q677 HydrophobicContact CG2-CB 4.38Å; T656-Q677 HydrophobicContact CG2-CG 3.83Å; T656-Q677 CarbonylContact O-C 3.47Å; T656-G678 PolarHBondContact O-N 3.26Å; T656-G678 VanDerWaalsContact O-N 3.09Å; T656-Q679 PolarHBondContact O-N 2.99Å; T656-Q679 VanDerWaalsContact O-N 3.08Å
657	G	89.1	Confident	92.5	Very high	39 Å²	39	49.3 Å²	49.3	40%	0.402	25%	0.247	S	C	.	.	S	Bend	trans	-73.8	-24.1	177.8	0	0	0	0	0	113.7	G678	G657-G678 WeakPolarHBondContact O-CA 3.48Å
658	R	86.2	Confident	92.7	Very high	107 Å²	107	49.7 Å²	49.7	40%	0.404	26%	0.257	S	S	.	.	S	Bend	trans	-92.8	158.6	179.9	-64.7	-175.3	75.7	111.6	-7	111.3	D614 I622 E630 T656 Q677 G678	D614-R658 WeakPolarHBondContact OD2-CD 3.36Å; I622-R658 VanDerWaalsContact CD1-CZ 3.41Å; E630-R658 IonicContact OE1-NH2 2.6Å; E630-R658 PolarHBondContact OE1-NH2 3.41Å; E630-R658 IonicContact OE2-NH2 3.1Å; T656-R658 VanDerWaalsContact C-N 3.35Å; T656-R658 WeakPolarHBondContact CG2-O 3.36Å; T656-R658 PolarHBondContact OG1-N 3.15Å; R658-Q677 WeakPolarHBondContact O-CB 3.46Å; R658-G678 PolarHBondContact O-N 3.35Å
659	K	90.3	Very high	92.7	Very high	163 Å²	163	52.2 Å²	52.2	71%	0.709	27%	0.273	S	S	*	.			trans	-116.2	118.7	170	-172	175.5	-177.7	176.2	0	108.9	Q677	K659-Q677 HydrophobicContact CB-CB 4.35Å; K659-Q677 HydrophobicContact CG-CB 4.27Å
660	A	88.1	Confident	92.8	Very high	11 Å²	11	45.9 Å²	45.9	9%	0.091	24%	0.239	C	C	.	.			trans	-147	127.7	-179.3	0	0	0	0	0	110.7	L662 V663 Q677	A660-L662 HydrophobicContact CB-CD2 4.2Å; A660-L662 HydrophobicContact CB-CG 4.08Å; A660-L662 PolarHBondContact O-N 3.1Å; A660-V663 HydrophobicContact CB-CG2 4.16Å; A660-V663 WeakPolarHBondContact O-CB 3.47Å; A660-V663 PolarHBondContact O-N 3.27Å; A660-Q677 PolarHBondContact O-OE1 3.41Å; A660-Q677 VanDerWaalsContact O-OE1 3.11Å
661	K	89.7	Confident	92.6	Very high	148 Å²	148	47.4 Å²	47.4	64%	0.643	26%	0.255	S	S	*	.	H	α-helix	trans	-56.9	-35.3	179.1	-175	175.7	178.5	-179.1	0	112.8	V663 E664 D665	K661-V663 PolarHBondContact O-N 3.18Å; K661-E664 WeakPolarHBondContact O-CB 3.33Å; K661-E664 PolarHBondContact O-N 3.37Å; K661-E664 VanDerWaalsContact O-N 3.08Å; K661-D665 PolarHBondContact O-N 3.36Å
662	L	90.4	Very high	92.5	Very high	41 Å²	41	44.3 Å²	44.3	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-31.6	177.8	74.8	91	0	0	0	112.8	K632 F634 A660 R666	K632-L662 HydrophobicContact CB-CD1 3.91Å; K632-L662 HydrophobicContact CB-CD2 4.2Å; K632-L662 HydrophobicContact CD-CD1 3.87Å; K632-L662 HydrophobicContact CD-CD2 3.99Å; K632-L662 HydrophobicContact CD-CG 4.48Å; K632-L662 HydrophobicContact CG-CD1 4.33Å; K632-L662 HydrophobicContact CG-CD2 4.08Å; F634-L662 HydrophobicContact CE2-CD1 3.4Å; F634-L662 HydrophobicContact CZ-CD1 3.55Å; A660-L662 HydrophobicContact CB-CD2 4.2Å; A660-L662 HydrophobicContact CB-CG 4.08Å; A660-L662 PolarHBondContact O-N 3.1Å; L662-R666 WeakPolarHBondContact O-CB 3.35Å; L662-R666 PolarHBondContact O-N 2.73Å
663	V	92	Very high	92.3	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-73.5	-39.6	178.5	178.9	0	0	0	0	109.6	V613 F634 A660 K661 R666 C667 L675	V613-V663 HydrophobicContact CG1-CG2 3.93Å; V613-V663 HydrophobicContact CG2-CG1 3.91Å; F634-V663 HydrophobicContact CZ-CG2 4.48Å; A660-V663 HydrophobicContact CB-CG2 4.16Å; A660-V663 WeakPolarHBondContact O-CB 3.47Å; A660-V663 PolarHBondContact O-N 3.27Å; K661-V663 PolarHBondContact O-N 3.18Å; V663-R666 PolarHBondContact O-N 3.47Å; V663-C667 WeakPolarHBondContact O-CB 3.34Å; V663-C667 PolarHBondContact O-N 3.35Å; V663-C667 PolarHBondContact O-SG 3.5Å; V663-L675 HydrophobicContact CG1-CD1 3.92Å
664	E	93.3	Very high	92.2	Very high	83 Å²	83	51 Å²	51	39%	0.388	28%	0.279	S	S	.	.	H	α-helix	trans	-58.6	-48.9	173.1	-60.1	174.2	-173.3	0	0	110.8	K661 R666 C667 A668 L675 Q677	K661-E664 WeakPolarHBondContact O-CB 3.33Å; K661-E664 PolarHBondContact O-N 3.37Å; K661-E664 VanDerWaalsContact O-N 3.08Å; E664-R666 VanDerWaalsContact C-N 3.32Å; E664-R666 PolarHBondContact O-N 3.29Å; E664-C667 PolarHBondContact O-N 2.84Å; E664-A668 WeakPolarHBondContact O-CB 3.36Å; E664-A668 PolarHBondContact O-N 3.31Å; E664-L675 HydrophobicContact CB-CD2 4.2Å; E664-L675 HydrophobicContact CG-CD2 3.73Å; E664-Q677 PolarHBondContact OE1-NE2 2.89Å
665	D	91.8	Very high	92.1	Very high	86 Å²	86	53.1 Å²	53.1	46%	0.46	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-39.8	179.2	-65.5	-25.5	0	0	0	111.3	K661 T669	K661-D665 PolarHBondContact O-N 3.36Å; D665-T669 WeakPolarHBondContact O-CB 3.4Å; D665-T669 PolarHBondContact O-N 2.94Å; D665-T669 PolarHBondContact O-OG1 3.03Å
666	R	92.7	Very high	92.1	Very high	42 Å²	42	54.5 Å²	54.5	16%	0.158	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-42.4	176.4	-171.5	61	176.7	165.3	5.3	112.1	F634 L662 V663 E664 T669 L670 I768	F634-R666 HydrophobicContact CD1-CG 4.47Å; F634-R666 HydrophobicContact CD2-CG 4.03Å; F634-R666 HydrophobicContact CE2-CB 4.19Å; F634-R666 HydrophobicContact CE2-CG 4.13Å; F634-R666 HydrophobicContact CG-CG 4.2Å; F634-R666 HydrophobicContact CZ-CB 4.49Å; F634-R666 HydrophobicContact CZ-CG 4.41Å; L662-R666 WeakPolarHBondContact O-CB 3.35Å; L662-R666 PolarHBondContact O-N 2.73Å; V663-R666 PolarHBondContact O-N 3.47Å; E664-R666 VanDerWaalsContact C-N 3.32Å; E664-R666 PolarHBondContact O-N 3.29Å; R666-T669 WeakPolarHBondContact O-CB 2.98Å; R666-T669 PolarHBondContact O-N 3.16Å; R666-L670 HydrophobicContact CG-CD1 4.17Å; R666-L670 WeakPolarHBondContact O-CG 3.4Å; R666-L670 PolarHBondContact O-N 3.2Å; R666-I768 VanDerWaalsContact NH1-C 3.27Å; R666-I768 PolarHBondContact NH1-O 2.88Å; R666-I768 VanDerWaalsContact NH1-O 3.12Å; R666-I768 PolarHBondContact NH1-OXT 2.94Å; R666-I768 PolarHBondContact NH2-O 3.39Å
667	C	93.8	Very high	92.2	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.027	30%	0.301	C	S	.	.	H	α-helix	trans	-60.5	-46.8	175.7	-68.1	0	0	0	0	111.3	I654 V663 E664 T669 L670 G671 I672 L675	I654-C667 WeakPolarHBondContact CD1-SG 3.47Å; V663-C667 WeakPolarHBondContact O-CB 3.34Å; V663-C667 PolarHBondContact O-N 3.35Å; V663-C667 PolarHBondContact O-SG 3.5Å; E664-C667 PolarHBondContact O-N 2.84Å; C667-T669 VanDerWaalsContact C-N 3.28Å; C667-T669 PolarHBondContact O-N 2.87Å; C667-L670 CarbonylContact O-C 3.55Å; C667-L670 PolarHBondContact O-N 3.1Å; C667-G671 PolarHBondContact O-N 2.83Å; C667-I672 HydrophobicContact CB-CB 4.06Å; C667-I672 HydrophobicContact CB-CG2 4.49Å; C667-I672 PolarHBondContact O-N 2.92Å; C667-L675 HydrophobicContact CB-CD2 4.24Å
668	A	92.6	Very high	92.2	Very high	78 Å²	78	56 Å²	56	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-59.1	-41.8	177.2	0	0	0	0	0	111.5	E664 L670 G671	E664-A668 WeakPolarHBondContact O-CB 3.36Å; E664-A668 PolarHBondContact O-N 3.31Å; A668-L670 PolarHBondContact O-N 3.44Å; A668-G671 PolarHBondContact O-N 3.34Å
669	T	91.4	Very high	92.3	Very high	67 Å²	67	53.2 Å²	53.2	41%	0.411	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-38.3	177.6	-58.9	0	0	0	0	112.6	D665 R666 C667 I768	D665-T669 WeakPolarHBondContact O-CB 3.4Å; D665-T669 PolarHBondContact O-N 2.94Å; D665-T669 PolarHBondContact O-OG1 3.03Å; R666-T669 WeakPolarHBondContact O-CB 2.98Å; R666-T669 PolarHBondContact O-N 3.16Å; C667-T669 VanDerWaalsContact C-N 3.28Å; C667-T669 PolarHBondContact O-N 2.87Å; T669-I768 HydrophobicContact CG2-CB 4.19Å; T669-I768 HydrophobicContact CG2-CG2 3.24Å
670	L	92.6	Very high	91.8	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-85.4	-7.5	178.8	-64.4	177.4	0	0	0	113.4	G639 I642 R643 L646 R666 C667 A668 I672	G639-L670 VanDerWaalsContact CA-CD2 3.47Å; I642-L670 HydrophobicContact CD1-CD1 3.85Å; I642-L670 HydrophobicContact CG2-CB 4.25Å; I642-L670 HydrophobicContact CG2-CD1 4.48Å; R643-L670 WeakPolarHBondContact CD-O 3.39Å; R643-L670 HydrophobicContact CG-CD2 4.47Å; R643-L670 PolarHBondContact NH1-O 3.42Å; L646-L670 WeakPolarHBondContact CD1-O 3.36Å; R666-L670 HydrophobicContact CG-CD1 4.17Å; R666-L670 WeakPolarHBondContact O-CG 3.4Å; R666-L670 PolarHBondContact O-N 3.2Å; C667-L670 CarbonylContact O-C 3.55Å; C667-L670 PolarHBondContact O-N 3.1Å; A668-L670 PolarHBondContact O-N 3.44Å; L670-I672 HydrophobicContact CB-CD1 4.26Å; L670-I672 HydrophobicContact CB-CG1 4.18Å; L670-I672 HydrophobicContact CD1-CD1 4.35Å
671	G	91.5	Very high	91.9	Very high	33 Å²	33	53.5 Å²	53.5	34%	0.34	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	27	-176.1	0	0	0	0	0	114.2	C667 A668	C667-G671 PolarHBondContact O-N 2.83Å; A668-G671 PolarHBondContact O-N 3.34Å
672	I	94.6	Very high	92.1	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.051	28%	0.282	C	S	.	.			trans	-81.5	116	172.4	-61.2	173	0	0	0	108.1	I642 L646 V652 I654 C667 L670	I642-I672 HydrophobicContact CD1-CD1 4.39Å; I642-I672 HydrophobicContact CG2-CD1 3.98Å; I642-I672 HydrophobicContact CG2-CG1 3.98Å; L646-I672 HydrophobicContact CD1-CG1 4.46Å; V652-I672 HydrophobicContact CB-CG1 4.4Å; V652-I672 HydrophobicContact CG1-CD1 4.02Å; V652-I672 HydrophobicContact CG1-CG1 4.15Å; V652-I672 WeakPolarHBondContact O-CG2 3.46Å; I654-I672 HydrophobicContact CD1-CD1 3.54Å; I654-I672 HydrophobicContact CD1-CG2 4.44Å; I654-I672 HydrophobicContact CG1-CD1 4.27Å; C667-I672 HydrophobicContact CB-CB 4.06Å; C667-I672 HydrophobicContact CB-CG2 4.49Å; C667-I672 PolarHBondContact O-N 2.92Å; L670-I672 HydrophobicContact CB-CD1 4.26Å; L670-I672 HydrophobicContact CB-CG1 4.18Å; L670-I672 HydrophobicContact CD1-CD1 4.35Å
673	T	91.9	Very high	92.3	Very high	106 Å²	106	46.9 Å²	46.9	65%	0.65	28%	0.282	S	S	*	.			trans	-89.9	-20.5	-179.1	51.3	0	0	0	0	112.9
674	H	96.2	Very high	92.4	Very high	36 Å²	36	51.6 Å²	51.6	17%	0.167	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	84.5	-173.3	-60.9	-61.2	0	0	0	112	E651 A653 I654 L689	E651-H674 IonicContact OE2-CD2 3.81Å; E651-H674 IonicContact OE2-NE2 4Å; A653-H674 CarbonylContact C-O 3.58Å; A653-H674 VanDerWaalsContact CA-O 3.3Å; A653-H674 WeakPolarHBondContact CA-O 3.41Å; A653-H674 HydrophobicContact CB-CB 3.6Å; I654-H674 PolarHBondContact N-O 3.39Å; H674-L689 HydrophobicContact CB-CD2 3.9Å
675	L	96.4	Very high	92.5	Very high	48 Å²	48	47.8 Å²	47.8	25%	0.251	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.6	-179.9	175.6	60.1	0	0	0	111.9	I654 V663 E664 C667 Q677	I654-L675 HydrophobicContact CB-CD1 3.86Å; I654-L675 HydrophobicContact CG2-CD1 3.59Å; V663-L675 HydrophobicContact CG1-CD1 3.92Å; E664-L675 HydrophobicContact CB-CD2 4.2Å; E664-L675 HydrophobicContact CG-CD2 3.73Å; C667-L675 HydrophobicContact CB-CD2 4.24Å; L675-Q677 HydrophobicContact CD1-CG 3.81Å; L675-Q677 HydrophobicContact CD2-CG 4.32Å; L675-Q677 HydrophobicContact CG-CG 4Å
676	Y	96.2	Very high	92.7	Very high	29 Å²	29	43.9 Å²	43.9	11%	0.114	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	106.6	175.4	-64	-96.3	0	0	0	110.1	I654 I655 T656 A685 D688 L689 K692	I654-Y676 PolarHBondContact O-N 3.12Å; I655-Y676 WeakPolarHBondContact CA-O 3.23Å; T656-Y676 PolarHBondContact N-O 2.97Å; Y676-A685 HydrophobicContact CD1-CB 3.71Å; Y676-A685 HydrophobicContact CD2-CB 4.41Å; Y676-A685 HydrophobicContact CE1-CB 4.41Å; Y676-A685 HydrophobicContact CG-CB 3.72Å; Y676-D688 WeakPolarHBondContact CE1-OD2 3.34Å; Y676-D688 PolarHBondContact OH-OD2 2.86Å; Y676-L689 HydrophobicContact CD2-CD1 4.22Å; Y676-L689 HydrophobicContact CD2-CG 4.31Å; Y676-L689 HydrophobicContact CE2-CD1 3.95Å; Y676-L689 HydrophobicContact CE2-CD2 3.65Å; Y676-L689 HydrophobicContact CE2-CG 3.56Å; Y676-K692 PolarHBondContact OH-NZ 2.92Å; Y676-K692 VanDerWaalsContact OH-NZ 3.08Å
677	Q	94.4	Very high	92.8	Very high	30 Å²	30	45.2 Å²	45.2	14%	0.14	28%	0.284	C	S	.	.			trans	-106.3	158.3	177.8	-69.1	-177.2	89.5	0	0	111.7	T656 R658 K659 A660 E664 L675 Q679	T656-Q677 HydrophobicContact CG2-CB 4.38Å; T656-Q677 HydrophobicContact CG2-CG 3.83Å; T656-Q677 CarbonylContact O-C 3.47Å; R658-Q677 WeakPolarHBondContact O-CB 3.46Å; K659-Q677 HydrophobicContact CB-CB 4.35Å; K659-Q677 HydrophobicContact CG-CB 4.27Å; A660-Q677 PolarHBondContact O-OE1 3.41Å; A660-Q677 VanDerWaalsContact O-OE1 3.11Å; E664-Q677 PolarHBondContact OE1-NE2 2.89Å; L675-Q677 HydrophobicContact CD1-CG 3.81Å; L675-Q677 HydrophobicContact CD2-CG 4.32Å; L675-Q677 HydrophobicContact CG-CG 4Å; Q677-Q679 VanDerWaalsContact C-N 3.28Å; Q677-Q679 PolarHBondContact O-N 3.34Å; Q677-Q679 PolarHBondContact O-NE2 3.46Å
678	G	90.7	Very high	92.9	Very high	43 Å²	43	47.6 Å²	47.6	44%	0.443	30%	0.296	S	S	.	.	S	Bend	trans	71	21.9	178.4	0	0	0	0	0	113.9	T656 G657 R658 S680	T656-G678 PolarHBondContact O-N 3.26Å; T656-G678 VanDerWaalsContact O-N 3.09Å; G657-G678 WeakPolarHBondContact O-CA 3.48Å; R658-G678 PolarHBondContact O-N 3.35Å; G678-S680 PolarHBondContact O-N 3.12Å
679	Q	87	Confident	93.1	Very high	48 Å²	48	43.9 Å²	43.9	22%	0.224	27%	0.265	C	S	.	.			trans	-92.4	92.9	-174.9	-61.2	-60.3	-35.1	0	0	110.9	I655 T656 Q677 N681 A685	I655-Q679 HydrophobicContact CG2-CB 4.12Å; I655-Q679 HydrophobicContact CG2-CG 4.38Å; T656-Q679 PolarHBondContact O-N 2.99Å; T656-Q679 VanDerWaalsContact O-N 3.08Å; Q677-Q679 VanDerWaalsContact C-N 3.28Å; Q677-Q679 PolarHBondContact O-N 3.34Å; Q677-Q679 PolarHBondContact O-NE2 3.46Å; Q679-N681 VanDerWaalsContact C-N 3.32Å; Q679-A685 HydrophobicContact CG-CB 4.02Å
680	S	81.1	Confident	93.3	Very high	106 Å²	106	42 Å²	42	74%	0.741	25%	0.253	S	S	*	.	S	Bend	trans	-70	-30.5	172.4	55.4	0	0	0	0	112.5	G678	G678-S680 PolarHBondContact O-N 3.12Å
681	N	90	Very high	93.4	Very high	75 Å²	75	49.6 Å²	49.6	40%	0.401	29%	0.288	S	S	.	.	S	Bend	trans	-110	95.5	169.7	-175.7	-1.2	0	0	0	109.9	Q679 L683 I684	Q679-N681 VanDerWaalsContact C-N 3.32Å; N681-L683 PolarHBondContact O-N 3.02Å; N681-L683 VanDerWaalsContact O-N 3.15Å; N681-L683 WeakPolarHBondContact OD1-CB 3.49Å; N681-L683 PolarHBondContact OD1-N 2.81Å; N681-I684 HydrophobicContact CB-CD1 4.2Å; N681-I684 HydrophobicContact CB-CG1 4.43Å; N681-I684 PolarHBondContact O-N 3.36Å
682	K	94	Very high	93.5	Very high	6 Å²	6	54 Å²	54	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-20.6	-176.9	-59.3	-163.3	-178.7	-169.6	0	113.6	D612 I655 I684 A685 F686 Y702 D709 V712	D612-K682 IonicContact OD1-NZ 3.31Å; D612-K682 PolarHBondContact OD1-NZ 3.11Å; D612-K682 IonicContact OD2-NZ 2.66Å; D612-K682 PolarHBondContact OD2-NZ 3.4Å; I655-K682 HydrophobicContact CG2-CB 3.88Å; I655-K682 HydrophobicContact CG2-CD 3.98Å; I655-K682 HydrophobicContact CG2-CG 3.81Å; I655-K682 PolarHBondContact O-NZ 3.34Å; K682-I684 VanDerWaalsContact C-N 3.28Å; K682-I684 PolarHBondContact O-N 3.05Å; K682-A685 PolarHBondContact O-N 3.35Å; K682-F686 WeakPolarHBondContact O-CB 3.35Å; K682-F686 PolarHBondContact O-N 3.1Å; K682-Y702 WeakPolarHBondContact CD-OH 3.25Å; K682-Y702 PolarHBondContact NZ-OH 3.26Å; K682-D709 WeakPolarHBondContact CE-OD1 3.39Å; K682-D709 IonicContact NZ-OD1 3.85Å; K682-D709 PolarHBondContact NZ-OD1 2.6Å; K682-V712 HydrophobicContact CB-CG2 3.71Å
683	L	94	Very high	93.5	Very high	43 Å²	43	55.6 Å²	55.6	23%	0.225	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-32.3	177.5	-75.8	171.6	0	0	0	113.4	N681 F686 S687 P711 V712 K715	N681-L683 PolarHBondContact O-N 3.02Å; N681-L683 VanDerWaalsContact O-N 3.15Å; N681-L683 WeakPolarHBondContact OD1-CB 3.49Å; N681-L683 PolarHBondContact OD1-N 2.81Å; L683-F686 HydrophobicContact CD2-CD1 4.44Å; L683-F686 PolarHBondContact O-N 3.37Å; L683-S687 PolarHBondContact O-N 3.26Å; L683-S687 PolarHBondContact O-OG 2.92Å; L683-P711 HydrophobicContact CD1-CB 4Å; L683-P711 HydrophobicContact CD2-CB 4.4Å; L683-P711 WeakPolarHBondContact CD2-O 3.29Å; L683-P711 HydrophobicContact CG-CB 4.05Å; L683-V712 HydrophobicContact CD2-CG2 4.16Å; L683-V712 HydrophobicContact CG-CG2 4.44Å; L683-K715 HydrophobicContact CD2-CD 3.95Å
684	I	94.4	Very high	93.6	Very high	107 Å²	107	55 Å²	55	55%	0.549	31%	0.312	S	S	.	.	H	α-helix	trans	-66.1	-49.3	-179.1	-60.7	174.2	0	0	0	109.7	N681 K682 F686 S687 D688	N681-I684 HydrophobicContact CB-CD1 4.2Å; N681-I684 HydrophobicContact CB-CG1 4.43Å; N681-I684 PolarHBondContact O-N 3.36Å; K682-I684 VanDerWaalsContact C-N 3.28Å; K682-I684 PolarHBondContact O-N 3.05Å; I684-F686 VanDerWaalsContact C-N 3.3Å; I684-F686 PolarHBondContact O-N 3.25Å; I684-S687 PolarHBondContact O-N 3.01Å; I684-D688 PolarHBondContact O-N 2.88Å; I684-D688 VanDerWaalsContact O-N 3.13Å
685	A	94.3	Very high	93.5	Very high	2 Å²	2	54.3 Å²	54.3	2%	0.017	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-37.2	175.9	0	0	0	0	0	112.1	I655 Y676 Q679 K682 L689	I655-A685 HydrophobicContact CD1-CB 3.95Å; I655-A685 HydrophobicContact CG1-CB 4.16Å; I655-A685 HydrophobicContact CG2-CB 3.97Å; Y676-A685 HydrophobicContact CD1-CB 3.71Å; Y676-A685 HydrophobicContact CD2-CB 4.41Å; Y676-A685 HydrophobicContact CE1-CB 4.41Å; Y676-A685 HydrophobicContact CG-CB 3.72Å; Q679-A685 HydrophobicContact CG-CB 4.02Å; K682-A685 PolarHBondContact O-N 3.35Å; A685-L689 WeakPolarHBondContact O-CB 3.49Å; A685-L689 WeakPolarHBondContact O-CG 3.44Å; A685-L689 PolarHBondContact O-N 2.9Å
686	F	97	Very high	93.4	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-48.6	174.9	177.9	-118.8	0	0	0	112.4	I610 I655 K682 L683 I684 D688 L689 L690 P697 V700 V712 K715 V716	I610-F686 HydrophobicContact CD1-CD2 3.68Å; I610-F686 HydrophobicContact CD1-CE2 4.06Å; I655-F686 HydrophobicContact CD1-CB 4.47Å; K682-F686 WeakPolarHBondContact O-CB 3.35Å; K682-F686 PolarHBondContact O-N 3.1Å; L683-F686 HydrophobicContact CD2-CD1 4.44Å; L683-F686 PolarHBondContact O-N 3.37Å; I684-F686 VanDerWaalsContact C-N 3.3Å; I684-F686 PolarHBondContact O-N 3.25Å; F686-D688 VanDerWaalsContact C-N 3.35Å; F686-D688 PolarHBondContact O-N 3.25Å; F686-L689 WeakPolarHBondContact O-CB 3.16Å; F686-L689 PolarHBondContact O-N 3.44Å; F686-L690 HydrophobicContact CD1-CD1 4.19Å; F686-L690 HydrophobicContact CD2-CG 4.42Å; F686-L690 HydrophobicContact CE1-CD1 3.69Å; F686-L690 HydrophobicContact CE1-CG 4.44Å; F686-L690 HydrophobicContact CE2-CD1 4.17Å; F686-L690 HydrophobicContact CE2-CD2 3.94Å; F686-L690 HydrophobicContact CE2-CG 4.08Å; F686-L690 HydrophobicContact CZ-CD1 3.68Å; F686-L690 HydrophobicContact CZ-CD2 4.06Å; F686-L690 HydrophobicContact CZ-CG 4.11Å; F686-L690 WeakPolarHBondContact O-CG 3.29Å; F686-L690 PolarHBondContact O-N 3.36Å; F686-L690 VanDerWaalsContact O-N 3.07Å; F686-P697 HydrophobicContact CZ-CB 4.3Å; F686-V700 HydrophobicContact CE2-CB 4.47Å; F686-V700 HydrophobicContact CE2-CG1 4.15Å; F686-V700 HydrophobicContact CE2-CG2 4.43Å; F686-V712 HydrophobicContact CB-CG1 4.03Å; F686-V712 HydrophobicContact CB-CG2 4.13Å; F686-V712 HydrophobicContact CD1-CG1 4.16Å; F686-V712 HydrophobicContact CD2-CG1 3.67Å; F686-V712 HydrophobicContact CE2-CG1 4.11Å; F686-V712 HydrophobicContact CG-CG1 3.69Å; F686-K715 HydrophobicContact CE1-CB 3.95Å; F686-K715 HydrophobicContact CE1-CD 4.31Å; F686-K715 HydrophobicContact CZ-CB 4.39Å; F686-V716 HydrophobicContact CE2-CG1 3.71Å; F686-V716 HydrophobicContact CZ-CG1 3.77Å
687	S	95.5	Very high	93.3	Very high	71 Å²	71	54.5 Å²	54.5	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177.9	-69	0	0	0	0	112.8	L683 I684 L689 L690 E691	L683-S687 PolarHBondContact O-N 3.26Å; L683-S687 PolarHBondContact O-OG 2.92Å; I684-S687 PolarHBondContact O-N 3.01Å; S687-L689 VanDerWaalsContact C-N 3.35Å; S687-L689 PolarHBondContact O-N 2.87Å; S687-L690 PolarHBondContact O-N 3.05Å; S687-E691 PolarHBondContact O-N 3.23Å; S687-E691 VanDerWaalsContact O-N 3.12Å
688	D	95.7	Very high	93.4	Very high	54 Å²	54	58.7 Å²	58.7	29%	0.289	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-37.7	176.5	-176.4	42.5	0	0	0	112.1	Y676 I684 F686 K692	Y676-D688 WeakPolarHBondContact CE1-OD2 3.34Å; Y676-D688 PolarHBondContact OH-OD2 2.86Å; I684-D688 PolarHBondContact O-N 2.88Å; I684-D688 VanDerWaalsContact O-N 3.13Å; F686-D688 VanDerWaalsContact C-N 3.35Å; F686-D688 PolarHBondContact O-N 3.25Å; D688-K692 VanDerWaalsContact CG-NZ 3.35Å; D688-K692 VanDerWaalsContact O-CB 3.31Å; D688-K692 WeakPolarHBondContact O-CB 3.34Å; D688-K692 VanDerWaalsContact O-CG 3.28Å; D688-K692 WeakPolarHBondContact O-CG 3.49Å; D688-K692 PolarHBondContact O-N 3.35Å; D688-K692 WeakPolarHBondContact OD1-CE 3.32Å; D688-K692 IonicContact OD1-NZ 3.67Å; D688-K692 PolarHBondContact OD1-NZ 3.32Å; D688-K692 WeakPolarHBondContact OD2-CE 3.5Å; D688-K692 IonicContact OD2-NZ 2.76Å; D688-K692 PolarHBondContact OD2-NZ 3.04Å
689	L	95.5	Very high	93.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-46.7	173.4	-85.3	168	0	0	0	112.9	L608 I610 A653 I655 H674 Y676 A685 F686 S687 E691 K692 L693	L608-L689 HydrophobicContact CD2-CB 4.49Å; I610-L689 HydrophobicContact CD1-CD1 4.02Å; I610-L689 HydrophobicContact CG1-CD1 4.49Å; A653-L689 HydrophobicContact CB-CD1 3.76Å; A653-L689 HydrophobicContact CB-CD2 3.93Å; I655-L689 HydrophobicContact CD1-CD1 3.91Å; I655-L689 HydrophobicContact CG1-CD1 4.2Å; H674-L689 HydrophobicContact CB-CD2 3.9Å; Y676-L689 HydrophobicContact CD2-CD1 4.22Å; Y676-L689 HydrophobicContact CD2-CG 4.31Å; Y676-L689 HydrophobicContact CE2-CD1 3.95Å; Y676-L689 HydrophobicContact CE2-CD2 3.65Å; Y676-L689 HydrophobicContact CE2-CG 3.56Å; A685-L689 WeakPolarHBondContact O-CB 3.49Å; A685-L689 WeakPolarHBondContact O-CG 3.44Å; A685-L689 PolarHBondContact O-N 2.9Å; F686-L689 WeakPolarHBondContact O-CB 3.16Å; F686-L689 PolarHBondContact O-N 3.44Å; S687-L689 VanDerWaalsContact C-N 3.35Å; S687-L689 PolarHBondContact O-N 2.87Å; L689-E691 VanDerWaalsContact C-N 3.32Å; L689-E691 PolarHBondContact O-N 2.9Å; L689-K692 PolarHBondContact O-N 3.38Å; L689-L693 HydrophobicContact CD2-CD1 4.27Å; L689-L693 WeakPolarHBondContact O-CB 3.42Å; L689-L693 PolarHBondContact O-N 3.28Å
690	L	95.9	Very high	94.2	Very high	28 Å²	28	56.4 Å²	56.4	15%	0.147	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-42.9	179.4	-65.3	177	0	0	0	111.3	F686 S687 A694 I695 P697 V700	F686-L690 HydrophobicContact CD1-CD1 4.19Å; F686-L690 HydrophobicContact CD2-CG 4.42Å; F686-L690 HydrophobicContact CE1-CD1 3.69Å; F686-L690 HydrophobicContact CE1-CG 4.44Å; F686-L690 HydrophobicContact CE2-CD1 4.17Å; F686-L690 HydrophobicContact CE2-CD2 3.94Å; F686-L690 HydrophobicContact CE2-CG 4.08Å; F686-L690 HydrophobicContact CZ-CD1 3.68Å; F686-L690 HydrophobicContact CZ-CD2 4.06Å; F686-L690 HydrophobicContact CZ-CG 4.11Å; F686-L690 WeakPolarHBondContact O-CG 3.29Å; F686-L690 PolarHBondContact O-N 3.36Å; F686-L690 VanDerWaalsContact O-N 3.07Å; S687-L690 PolarHBondContact O-N 3.05Å; L690-A694 VanDerWaalsContact O-CA 3.31Å; L690-A694 WeakPolarHBondContact O-CA 3.19Å; L690-A694 PolarHBondContact O-N 3.01Å; L690-I695 VanDerWaalsContact CD2-O 3.27Å; L690-I695 WeakPolarHBondContact CD2-O 3.3Å; L690-I695 PolarHBondContact O-N 3.44Å; L690-P697 HydrophobicContact CD1-CG 3.83Å; L690-V700 HydrophobicContact CD2-CG2 3.72Å
691	E	94.6	Very high	95	Very high	162 Å²	162	51.4 Å²	51.4	76%	0.757	28%	0.283	S	S	*	.	H	α-helix	trans	-66.3	-48	178.2	-172.1	175.3	-179.3	0	0	111.5	S687 L689 L693 A694	S687-E691 PolarHBondContact O-N 3.23Å; S687-E691 VanDerWaalsContact O-N 3.12Å; L689-E691 VanDerWaalsContact C-N 3.32Å; L689-E691 PolarHBondContact O-N 2.9Å; E691-L693 PolarHBondContact O-N 3.05Å; E691-A694 PolarHBondContact O-N 3.06Å
692	K	94.2	Very high	95.4	Very high	126 Å²	126	47.8 Å²	47.8	55%	0.548	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-40	-179.2	-79.4	172.3	175.7	164.6	0	113.5	Y676 D688 L689	Y676-K692 PolarHBondContact OH-NZ 2.92Å; Y676-K692 VanDerWaalsContact OH-NZ 3.08Å; D688-K692 VanDerWaalsContact CG-NZ 3.35Å; D688-K692 VanDerWaalsContact O-CB 3.31Å; D688-K692 WeakPolarHBondContact O-CB 3.34Å; D688-K692 VanDerWaalsContact O-CG 3.28Å; D688-K692 WeakPolarHBondContact O-CG 3.49Å; D688-K692 PolarHBondContact O-N 3.35Å; D688-K692 WeakPolarHBondContact OD1-CE 3.32Å; D688-K692 IonicContact OD1-NZ 3.67Å; D688-K692 PolarHBondContact OD1-NZ 3.32Å; D688-K692 WeakPolarHBondContact OD2-CE 3.5Å; D688-K692 IonicContact OD2-NZ 2.76Å; D688-K692 PolarHBondContact OD2-NZ 3.04Å; L689-K692 PolarHBondContact O-N 3.38Å
693	L	93.9	Very high	95.6	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.225	26%	0.263	C	S	.	.	H	α-helix	trans	-92.6	-8.2	-177.1	-66	175.5	0	0	0	113.2	L608 E651 L689 E691 I695	L608-L693 HydrophobicContact CD1-CD1 3.87Å; L608-L693 HydrophobicContact CD2-CD1 4.03Å; L608-L693 HydrophobicContact CG-CD1 4.46Å; E651-L693 HydrophobicContact CB-CD1 4.4Å; L689-L693 HydrophobicContact CD2-CD1 4.27Å; L689-L693 WeakPolarHBondContact O-CB 3.42Å; L689-L693 PolarHBondContact O-N 3.28Å; E691-L693 PolarHBondContact O-N 3.05Å; L693-I695 HydrophobicContact CB-CB 4.42Å; L693-I695 HydrophobicContact CB-CD1 3.76Å; L693-I695 HydrophobicContact CB-CG1 3.87Å; L693-I695 HydrophobicContact CD1-CD1 4.16Å; L693-I695 PolarHBondContact O-N 2.7Å
694	A	94.7	Very high	95.7	Very high	93 Å²	93	45.5 Å²	45.5	77%	0.769	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	41.4	-172.4	0	0	0	0	0	112.5	L690 E691	L690-A694 VanDerWaalsContact O-CA 3.31Å; L690-A694 WeakPolarHBondContact O-CA 3.19Å; L690-A694 PolarHBondContact O-N 3.01Å; E691-A694 PolarHBondContact O-N 3.06Å
695	I	93.2	Very high	95.8	Very high	23 Å²	23	42.1 Å²	42.1	12%	0.118	24%	0.235	C	C	.	.			trans	-104.1	136.2	179.3	-67	175	0	0	0	108.8	R607 L608 L690 L693 N699 V700	R607-I695 HydrophobicContact CB-CD1 4.01Å; L608-I695 HydrophobicContact CB-CD1 3.93Å; L690-I695 VanDerWaalsContact CD2-O 3.27Å; L690-I695 WeakPolarHBondContact CD2-O 3.3Å; L690-I695 PolarHBondContact O-N 3.44Å; L693-I695 HydrophobicContact CB-CB 4.42Å; L693-I695 HydrophobicContact CB-CD1 3.76Å; L693-I695 HydrophobicContact CB-CG1 3.87Å; L693-I695 HydrophobicContact CD1-CD1 4.16Å; L693-I695 PolarHBondContact O-N 2.7Å; I695-N699 HydrophobicContact CG2-CB 3.88Å; I695-V700 HydrophobicContact CG2-CG2 3.85Å
696	A	94.6	Very high	95.7	Very high	33 Å²	33	45.3 Å²	45.3	27%	0.273	25%	0.252	S	S	.	.			trans	-77.1	145.2	174.1	0	0	0	0	0	111	E698 N699	A696-E698 HydrophobicContact CB-CG 4.07Å; A696-E698 WeakPolarHBondContact CB-OE1 3.5Å; A696-E698 WeakPolarHBondContact CB-OE2 3.27Å; A696-E698 PolarHBondContact O-N 3.42Å; A696-E698 VanDerWaalsContact O-N 3.12Å; A696-N699 PolarHBondContact O-N 2.92Å
697	P	95.5	Very high	95.5	Very high	47 Å²	47	48.2 Å²	48.2	31%	0.305	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-51.3	-36.9	-178	-24.6	30.4	0	0	0	114.6	F686 L690 N699 V700 K715 V716 G717	F686-P697 HydrophobicContact CZ-CB 4.3Å; L690-P697 HydrophobicContact CD1-CG 3.83Å; P697-N699 PolarHBondContact O-N 3.38Å; P697-V700 WeakPolarHBondContact O-CB 3.43Å; P697-V700 PolarHBondContact O-N 3.24Å; P697-V700 VanDerWaalsContact O-N 3.09Å; P697-K715 WeakPolarHBondContact CB-O 3.39Å; P697-V716 CarbonylContact O-C 3.59Å; P697-V716 WeakPolarHBondContact O-CA 3.37Å; P697-G717 PolarHBondContact O-N 3.4Å
698	E	94.7	Very high	95.3	Very high	119 Å²	119	48.9 Å²	48.9	56%	0.556	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-62.9	-16.3	177.4	57.6	-94.5	-147.4	0	0	114.7	A696 G717	A696-E698 HydrophobicContact CB-CG 4.07Å; A696-E698 WeakPolarHBondContact CB-OE1 3.5Å; A696-E698 WeakPolarHBondContact CB-OE2 3.27Å; A696-E698 PolarHBondContact O-N 3.42Å; A696-E698 VanDerWaalsContact O-N 3.12Å; E698-G717 VanDerWaalsContact O-CA 3.32Å; E698-G717 WeakPolarHBondContact O-CA 3.4Å
699	N	96.9	Very high	95.3	Very high	43 Å²	43	46.3 Å²	46.3	23%	0.23	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-102.5	16.4	177	-63.7	-28.7	0	0	0	112.3	N605 I606 R607 L608 I695 A696 P697	N605-N699 WeakPolarHBondContact O-CB 3.43Å; N605-N699 PolarHBondContact O-OD1 2.91Å; I606-N699 WeakPolarHBondContact CA-O 3.43Å; R607-N699 PolarHBondContact N-O 3.15Å; L608-N699 PolarHBondContact N-O 3.24Å; I695-N699 HydrophobicContact CG2-CB 3.88Å; A696-N699 PolarHBondContact O-N 2.92Å; P697-N699 PolarHBondContact O-N 3.38Å
700	V	98.1	Very high	95.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.2	178.6	-174.3	0	0	0	0	110.3	I606 L608 I610 F686 L690 I695 P697 V716 G717 L718	I606-V700 WeakPolarHBondContact CD1-O 3.5Å; L608-V700 HydrophobicContact CB-CG1 4.31Å; L608-V700 HydrophobicContact CB-CG2 4.23Å; L608-V700 HydrophobicContact CD2-CG1 4.06Å; L608-V700 HydrophobicContact CD2-CG2 4.09Å; L608-V700 HydrophobicContact CG-CG1 4.15Å; L608-V700 CarbonylContact O-C 3.56Å; L608-V700 WeakPolarHBondContact O-CA 3.45Å; I610-V700 HydrophobicContact CD1-CG1 3.63Å; I610-V700 HydrophobicContact CG1-CG1 3.84Å; F686-V700 HydrophobicContact CE2-CB 4.47Å; F686-V700 HydrophobicContact CE2-CG1 4.15Å; F686-V700 HydrophobicContact CE2-CG2 4.43Å; L690-V700 HydrophobicContact CD2-CG2 3.72Å; I695-V700 HydrophobicContact CG2-CG2 3.85Å; P697-V700 WeakPolarHBondContact O-CB 3.43Å; P697-V700 PolarHBondContact O-N 3.24Å; P697-V700 VanDerWaalsContact O-N 3.09Å; V700-V716 HydrophobicContact CB-CB 4.19Å; V700-V716 HydrophobicContact CB-CG1 3.96Å; V700-V716 HydrophobicContact CG1-CB 4.4Å; V700-V716 HydrophobicContact CG1-CG1 3.81Å; V700-V716 WeakPolarHBondContact O-CB 3.46Å; V700-G717 PolarHBondContact O-N 2.92Å; V700-L718 PolarHBondContact O-N 3.5Å; V700-L718 VanDerWaalsContact O-N 3.1Å
701	A	98	Very high	95.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	141.7	166	0	0	0	0	0	109.6	I606 L608 L609 I610 L718	I606-A701 HydrophobicContact CD1-CB 4.15Å; I606-A701 HydrophobicContact CG1-CB 4.21Å; I606-A701 HydrophobicContact CG2-CB 3.71Å; L608-A701 PolarHBondContact O-N 3.44Å; L609-A701 HydrophobicContact CD1-CB 4.03Å; I610-A701 PolarHBondContact N-O 2.99Å; A701-L718 CarbonylContact C-O 3.53Å; A701-L718 WeakPolarHBondContact CA-O 3.41Å; A701-L718 HydrophobicContact CB-CB 4.02Å; A701-L718 HydrophobicContact CB-CD2 4.21Å; A701-L718 HydrophobicContact CB-CG 4.41Å
702	Y	98.2	Very high	95.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.9	176.9	-169.4	-73.4	0	0	0	110.5	I610 I655 K682 D709 V712 M713 L718 V720	I610-Y702 HydrophobicContact CB-CD2 3.57Å; I610-Y702 HydrophobicContact CB-CE2 4.1Å; I610-Y702 HydrophobicContact CB-CG 4.31Å; I610-Y702 HydrophobicContact CD1-CD2 4.29Å; I610-Y702 HydrophobicContact CG1-CD2 4.48Å; I610-Y702 HydrophobicContact CG2-CD2 3.44Å; I610-Y702 VanDerWaalsContact CG2-CD2 3.44Å; I610-Y702 HydrophobicContact CG2-CE2 3.4Å; I610-Y702 HydrophobicContact CG2-CG 4.47Å; I610-Y702 WeakPolarHBondContact O-CA 3.23Å; I655-Y702 HydrophobicContact CD1-CE2 4.44Å; K682-Y702 WeakPolarHBondContact CD-OH 3.25Å; K682-Y702 PolarHBondContact NZ-OH 3.26Å; Y702-D709 HydrophobicContact CD1-CB 4.46Å; Y702-D709 HydrophobicContact CE1-CB 3.65Å; Y702-D709 WeakPolarHBondContact CE1-OD1 3.29Å; Y702-D709 PolarHBondContact OH-OD1 2.88Å; Y702-V712 HydrophobicContact CD2-CB 4.06Å; Y702-V712 HydrophobicContact CD2-CG1 3.39Å; Y702-V712 HydrophobicContact CE2-CB 4.02Å; Y702-V712 HydrophobicContact CE2-CG1 3.7Å; Y702-V712 HydrophobicContact CG-CG1 4.15Å; Y702-M713 HydrophobicContact CD1-CG 3.39Å; Y702-M713 HydrophobicContact CD1-SD 4.14Å; Y702-M713 HydrophobicContact CE1-CG 4.07Å; Y702-M713 HydrophobicContact CG-CG 4.02Å; Y702-L718 PolarHBondContact N-O 3.3Å; Y702-V720 PolarHBondContact O-N 3.42Å
703	V	98.1	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.4	175.4	-167.6	0	0	0	0	110	L609 I610 L611 D612 V616 V720 V722 V749	L609-V703 HydrophobicContact CD1-CG2 3.81Å; I610-V703 PolarHBondContact O-N 2.83Å; L611-V703 HydrophobicContact CD2-CB 3.79Å; L611-V703 HydrophobicContact CD2-CG2 3.56Å; D612-V703 PolarHBondContact N-O 3.46Å; V616-V703 HydrophobicContact CG1-CB 4.04Å; V616-V703 HydrophobicContact CG1-CG1 3.59Å; V616-V703 HydrophobicContact CG2-CG1 4.47Å; V703-V720 WeakPolarHBondContact CA-O 3.38Å; V703-V720 HydrophobicContact CB-CB 4.43Å; V703-V720 HydrophobicContact CG1-CB 4.38Å; V703-V720 HydrophobicContact CG1-CG1 4.23Å; V703-V720 HydrophobicContact CG2-CB 4.05Å; V703-V720 HydrophobicContact CG2-CG1 4.4Å; V703-V720 HydrophobicContact CG2-CG2 4.49Å; V703-V722 HydrophobicContact CG1-CG1 3.9Å; V703-V749 HydrophobicContact CG2-CB 4.33Å; V703-V749 HydrophobicContact CG2-CG1 3.91Å; V703-V749 HydrophobicContact CG2-CG2 4.05Å
704	G	96.5	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	166.2	-179.8	0	0	0	0	0	113.6	D709 V720 A721 V722	G704-D709 VanDerWaalsContact CA-OD2 3.3Å; G704-D709 WeakPolarHBondContact CA-OD2 3.49Å; G704-V720 PolarHBondContact N-O 2.91Å; G704-A721 WeakPolarHBondContact O-CA 3.41Å; G704-V722 PolarHBondContact O-N 3.17Å; G704-V722 VanDerWaalsContact O-N 3.14Å
705	D	95.9	Very high	95.5	Very high	37 Å²	37	41.1 Å²	41.1	20%	0.198	21%	0.211	C	C	.	.	S	Bend	trans	-122.6	-18.4	177.7	76	-51.2	0	0	0	113.4	G615 V616 D709 V722 A725 H726	G615-D705 WeakPolarHBondContact CA-OD2 3.32Å; V616-D705 HydrophobicContact CG2-CB 3.95Å; D705-D709 PolarHBondContact N-OD2 3.13Å; D705-D709 VanDerWaalsContact N-OD2 3.07Å; D705-V722 HydrophobicContact CB-CG2 3.64Å; D705-A725 CarbonylContact O-C 3.48Å; D705-A725 VanDerWaalsContact O-CA 3.22Å; D705-A725 WeakPolarHBondContact O-CA 3.15Å; D705-A725 VanDerWaalsContact O-CB 3.31Å; D705-A725 WeakPolarHBondContact O-CB 3.33Å; D705-H726 PolarHBondContact O-N 3.41Å
706	D	94	Very high	95.6	Very high	69 Å²	69	40.7 Å²	40.7	37%	0.369	21%	0.21	S	C	.	.	S	Bend	trans	-136.7	169.4	-175.3	-154.7	-8	0	0	0	113.6	I708 D709 H726	D706-I708 HydrophobicContact CB-CG2 4.37Å; D706-I708 PolarHBondContact O-N 3.46Å; D706-I708 VanDerWaalsContact O-N 3.08Å; D706-D709 PolarHBondContact N-OD2 3.42Å; D706-D709 VanDerWaalsContact N-OD2 3.16Å; D706-D709 VanDerWaalsContact O-CB 3.32Å; D706-D709 WeakPolarHBondContact O-CB 3.49Å; D706-D709 PolarHBondContact O-N 2.88Å; D706-H726 WeakPolarHBondContact OD1-CB 3.31Å; D706-H726 IonicContact OD1-CD2 3.35Å; D706-H726 IonicContact OD1-CG 3.54Å
707	L	92.2	Very high	95.6	Very high	64 Å²	64	39.7 Å²	39.7	34%	0.335	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.7	-178.1	-70.1	175.9	0	0	0	113.8	D709 W710 L728	L707-D709 PolarHBondContact O-N 3.27Å; L707-W710 WeakPolarHBondContact O-CB 3.47Å; L707-W710 PolarHBondContact O-N 3.34Å; L707-L728 HydrophobicContact CD1-CB 4.36Å; L707-L728 HydrophobicContact CD1-CD1 4.22Å; L707-L728 HydrophobicContact CD2-CB 3.94Å
708	I	91.5	Very high	95.5	Very high	86 Å²	86	37.4 Å²	37.4	44%	0.441	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.2	174.5	-163.7	166.9	0	0	0	112.5	D706 P711	D706-I708 HydrophobicContact CB-CG2 4.37Å; D706-I708 PolarHBondContact O-N 3.46Å; D706-I708 VanDerWaalsContact O-N 3.08Å; I708-P711 WeakPolarHBondContact O-CD 3.49Å
709	D	94.9	Very high	95.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-26.9	176.4	-63.7	-55.1	0	0	0	113	K682 Y702 G704 D705 D706 L707 P711 V712 M713	K682-D709 WeakPolarHBondContact CE-OD1 3.39Å; K682-D709 IonicContact NZ-OD1 3.85Å; K682-D709 PolarHBondContact NZ-OD1 2.6Å; Y702-D709 HydrophobicContact CD1-CB 4.46Å; Y702-D709 HydrophobicContact CE1-CB 3.65Å; Y702-D709 WeakPolarHBondContact CE1-OD1 3.29Å; Y702-D709 PolarHBondContact OH-OD1 2.88Å; G704-D709 VanDerWaalsContact CA-OD2 3.3Å; G704-D709 WeakPolarHBondContact CA-OD2 3.49Å; D705-D709 PolarHBondContact N-OD2 3.13Å; D705-D709 VanDerWaalsContact N-OD2 3.07Å; D706-D709 PolarHBondContact N-OD2 3.42Å; D706-D709 VanDerWaalsContact N-OD2 3.16Å; D706-D709 VanDerWaalsContact O-CB 3.32Å; D706-D709 WeakPolarHBondContact O-CB 3.49Å; D706-D709 PolarHBondContact O-N 2.88Å; L707-D709 PolarHBondContact O-N 3.27Å; D709-P711 VanDerWaalsContact C-CD 3.42Å; D709-V712 PolarHBondContact O-N 3.13Å; D709-M713 HydrophobicContact CB-CG 4.18Å; D709-M713 HydrophobicContact CB-SD 3.64Å; D709-M713 PolarHBondContact O-N 3.29Å
710	W	94.6	Very high	95.5	Very high	49 Å²	49	29.9 Å²	29.9	19%	0.186	15%	0.152	C	C	.	.	H	α-helix	trans	-51.5	-44.1	-171.8	179.8	-108.9	0	0	0	114.4	L707 V712 M713 E714 L729 R732	L707-W710 WeakPolarHBondContact O-CB 3.47Å; L707-W710 PolarHBondContact O-N 3.34Å; W710-V712 PolarHBondContact O-N 3.03Å; W710-V712 VanDerWaalsContact O-N 3.13Å; W710-M713 HydrophobicContact CE3-CB 4.01Å; W710-M713 HydrophobicContact CZ3-CB 4.3Å; W710-M713 PolarHBondContact O-N 3.49Å; W710-M713 VanDerWaalsContact O-N 3.12Å; W710-E714 HydrophobicContact CD2-CB 4.4Å; W710-E714 HydrophobicContact CH2-CB 4.17Å; W710-E714 HydrophobicContact CH2-CG 4.47Å; W710-E714 HydrophobicContact CZ2-CB 3.78Å; W710-E714 HydrophobicContact CZ2-CG 3.87Å; W710-E714 WeakPolarHBondContact O-CB 3.05Å; W710-E714 PolarHBondContact O-N 2.88Å; W710-L729 HydrophobicContact CB-CD1 4.12Å; W710-L729 HydrophobicContact CE3-CD1 4.05Å; W710-R732 HydrophobicContact CD2-CB 4.5Å; W710-R732 HydrophobicContact CE3-CB 3.84Å; W710-R732 HydrophobicContact CH2-CB 3.63Å; W710-R732 HydrophobicContact CH2-CG 4.45Å; W710-R732 HydrophobicContact CZ2-CB 4.29Å; W710-R732 HydrophobicContact CZ3-CB 3.37Å; W710-R732 HydrophobicContact CZ3-CG 4.42Å; W710-R732 WeakPolarHBondContact CZ3-O 3.3Å
711	P	95.2	Very high	95.3	Very high	50 Å²	50	29.9 Å²	29.9	33%	0.325	15%	0.152	S	C	.	.	H	α-helix	trans	-58.2	-29.3	-180	-25.9	36	0	0	0	114.4	L683 I708 D709	L683-P711 HydrophobicContact CD1-CB 4Å; L683-P711 HydrophobicContact CD2-CB 4.4Å; L683-P711 WeakPolarHBondContact CD2-O 3.29Å; L683-P711 HydrophobicContact CG-CB 4.05Å; I708-P711 WeakPolarHBondContact O-CD 3.49Å; D709-P711 VanDerWaalsContact C-CD 3.42Å
712	V	96.4	Very high	95.2	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-84.8	-46.4	173.3	-177.6	0	0	0	0	109.9	K682 L683 F686 Y702 D709 W710 E714 K715 V716	K682-V712 HydrophobicContact CB-CG2 3.71Å; L683-V712 HydrophobicContact CD2-CG2 4.16Å; L683-V712 HydrophobicContact CG-CG2 4.44Å; F686-V712 HydrophobicContact CB-CG1 4.03Å; F686-V712 HydrophobicContact CB-CG2 4.13Å; F686-V712 HydrophobicContact CD1-CG1 4.16Å; F686-V712 HydrophobicContact CD2-CG1 3.67Å; F686-V712 HydrophobicContact CE2-CG1 4.11Å; F686-V712 HydrophobicContact CG-CG1 3.69Å; Y702-V712 HydrophobicContact CD2-CB 4.06Å; Y702-V712 HydrophobicContact CD2-CG1 3.39Å; Y702-V712 HydrophobicContact CE2-CB 4.02Å; Y702-V712 HydrophobicContact CE2-CG1 3.7Å; Y702-V712 HydrophobicContact CG-CG1 4.15Å; D709-V712 PolarHBondContact O-N 3.13Å; W710-V712 PolarHBondContact O-N 3.03Å; W710-V712 VanDerWaalsContact O-N 3.13Å; V712-E714 PolarHBondContact O-N 3.07Å; V712-K715 PolarHBondContact O-N 3.13Å; V712-V716 HydrophobicContact CG1-CG1 4.22Å; V712-V716 PolarHBondContact O-N 3.49Å
713	M	96.1	Very high	94.7	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-34.4	-179.7	-70	176.9	69.2	0	0	113.4	Y702 D709 W710 K715 V716 S719 V720 L729 A733	Y702-M713 HydrophobicContact CD1-CG 3.39Å; Y702-M713 HydrophobicContact CD1-SD 4.14Å; Y702-M713 HydrophobicContact CE1-CG 4.07Å; Y702-M713 HydrophobicContact CG-CG 4.02Å; D709-M713 HydrophobicContact CB-CG 4.18Å; D709-M713 HydrophobicContact CB-SD 3.64Å; D709-M713 PolarHBondContact O-N 3.29Å; W710-M713 HydrophobicContact CE3-CB 4.01Å; W710-M713 HydrophobicContact CZ3-CB 4.3Å; W710-M713 PolarHBondContact O-N 3.49Å; W710-M713 VanDerWaalsContact O-N 3.12Å; M713-K715 PolarHBondContact O-N 3.02Å; M713-V716 WeakPolarHBondContact O-CG2 3.44Å; M713-S719 WeakPolarHBondContact O-CB 3.42Å; M713-V720 VanDerWaalsContact CE-O 3.27Å; M713-V720 WeakPolarHBondContact CE-O 3.28Å; M713-L729 HydrophobicContact CE-CD1 4.2Å; M713-L729 HydrophobicContact CE-CD2 4.34Å; M713-L729 HydrophobicContact CE-CG 4.34Å; M713-L729 HydrophobicContact SD-CD1 3.83Å; M713-L729 HydrophobicContact SD-CD2 4.01Å; M713-L729 HydrophobicContact SD-CG 4.32Å; M713-A733 HydrophobicContact CE-CB 3.99Å
714	E	95.2	Very high	94.2	Very high	128 Å²	128	36 Å²	36	60%	0.598	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.6	177.1	-175.2	174.3	-136.3	0	0	113.2	W710 V712	W710-E714 HydrophobicContact CD2-CB 4.4Å; W710-E714 HydrophobicContact CH2-CB 4.17Å; W710-E714 HydrophobicContact CH2-CG 4.47Å; W710-E714 HydrophobicContact CZ2-CB 3.78Å; W710-E714 HydrophobicContact CZ2-CG 3.87Å; W710-E714 WeakPolarHBondContact O-CB 3.05Å; W710-E714 PolarHBondContact O-N 2.88Å; V712-E714 PolarHBondContact O-N 3.07Å
715	K	95.5	Very high	94.1	Very high	112 Å²	112	36.3 Å²	36.3	49%	0.487	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-13.5	-173.6	-63.2	-171.4	177.5	-164.5	0	114.4	L683 F686 P697 V712 M713	L683-K715 HydrophobicContact CD2-CD 3.95Å; F686-K715 HydrophobicContact CE1-CB 3.95Å; F686-K715 HydrophobicContact CE1-CD 4.31Å; F686-K715 HydrophobicContact CZ-CB 4.39Å; P697-K715 WeakPolarHBondContact CB-O 3.39Å; V712-K715 PolarHBondContact O-N 3.13Å; M713-K715 PolarHBondContact O-N 3.02Å
716	V	96.6	Very high	93.9	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.085	20%	0.198	C	C	.	.	S	Bend	trans	-88.3	162.2	-174.7	-62.3	0	0	0	0	111.8	F686 P697 V700 V712 M713 L718	F686-V716 HydrophobicContact CE2-CG1 3.71Å; F686-V716 HydrophobicContact CZ-CG1 3.77Å; P697-V716 CarbonylContact O-C 3.59Å; P697-V716 WeakPolarHBondContact O-CA 3.37Å; V700-V716 HydrophobicContact CB-CB 4.19Å; V700-V716 HydrophobicContact CB-CG1 3.96Å; V700-V716 HydrophobicContact CG1-CB 4.4Å; V700-V716 HydrophobicContact CG1-CG1 3.81Å; V700-V716 WeakPolarHBondContact O-CB 3.46Å; V712-V716 HydrophobicContact CG1-CG1 4.22Å; V712-V716 PolarHBondContact O-N 3.49Å; M713-V716 WeakPolarHBondContact O-CG2 3.44Å; V716-L718 WeakPolarHBondContact CG2-O 3.42Å
717	G	92.8	Very high	93.5	Very high	12 Å²	12	39.4 Å²	39.4	12%	0.124	21%	0.212	C	C	.	.	S	Bend	trans	-67.4	-36.6	176.4	0	0	0	0	0	114	K602 P697 E698 V700	K602-G717 VanDerWaalsContact CD-O 3.23Å; K602-G717 WeakPolarHBondContact CD-O 3.48Å; K602-G717 WeakPolarHBondContact CG-O 3.38Å; P697-G717 PolarHBondContact O-N 3.4Å; E698-G717 VanDerWaalsContact O-CA 3.32Å; E698-G717 WeakPolarHBondContact O-CA 3.4Å; V700-G717 PolarHBondContact O-N 2.92Å
718	L	95	Very high	93.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	107.5	178.2	-178.9	66.3	0	0	0	111.4	V599 K602 A603 I606 V700 A701 Y702 V716 V720 D734 L753	V599-L718 HydrophobicContact CG1-CD1 4.06Å; K602-L718 HydrophobicContact CB-CB 4.33Å; K602-L718 HydrophobicContact CB-CD1 4.08Å; K602-L718 HydrophobicContact CD-CD1 4.47Å; A603-L718 HydrophobicContact CB-CD2 4.09Å; I606-L718 HydrophobicContact CD1-CB 3.9Å; I606-L718 HydrophobicContact CG1-CB 4.34Å; I606-L718 HydrophobicContact CG1-CD2 4.49Å; V700-L718 PolarHBondContact O-N 3.5Å; V700-L718 VanDerWaalsContact O-N 3.1Å; A701-L718 CarbonylContact C-O 3.53Å; A701-L718 WeakPolarHBondContact CA-O 3.41Å; A701-L718 HydrophobicContact CB-CB 4.02Å; A701-L718 HydrophobicContact CB-CD2 4.21Å; A701-L718 HydrophobicContact CB-CG 4.41Å; Y702-L718 PolarHBondContact N-O 3.3Å; V716-L718 WeakPolarHBondContact CG2-O 3.42Å; L718-V720 HydrophobicContact CD2-CG2 4.29Å; L718-V720 HydrophobicContact CG-CG2 4Å; L718-D734 HydrophobicContact CD1-CB 3.91Å; L718-L753 HydrophobicContact CD2-CD2 3.79Å
719	S	95.1	Very high	93.1	Very high	4 Å²	4	37 Å²	37	3%	0.028	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.8	174.7	60.1	0	0	0	0	111.2	M713 D734 Y735	M713-S719 WeakPolarHBondContact O-CB 3.42Å; S719-D734 PolarHBondContact N-OD2 3.44Å; S719-D734 WeakPolarHBondContact O-CB 3.2Å; S719-D734 PolarHBondContact O-N 3.49Å; S719-D734 PolarHBondContact OG-N 3.43Å; S719-D734 PolarHBondContact OG-OD2 2.93Å; S719-Y735 PolarHBondContact O-N 3.3Å
720	V	95.7	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.7	-177.9	-172.9	0	0	0	0	110.9	Y702 V703 G704 M713 L718 Y735 T737 V749	Y702-V720 PolarHBondContact O-N 3.42Å; V703-V720 WeakPolarHBondContact CA-O 3.38Å; V703-V720 HydrophobicContact CB-CB 4.43Å; V703-V720 HydrophobicContact CG1-CB 4.38Å; V703-V720 HydrophobicContact CG1-CG1 4.23Å; V703-V720 HydrophobicContact CG2-CB 4.05Å; V703-V720 HydrophobicContact CG2-CG1 4.4Å; V703-V720 HydrophobicContact CG2-CG2 4.49Å; G704-V720 PolarHBondContact N-O 2.91Å; M713-V720 VanDerWaalsContact CE-O 3.27Å; M713-V720 WeakPolarHBondContact CE-O 3.28Å; L718-V720 HydrophobicContact CD2-CG2 4.29Å; L718-V720 HydrophobicContact CG-CG2 4Å; V720-Y735 CarbonylContact C-O 3.52Å; V720-Y735 VanDerWaalsContact CA-O 3.26Å; V720-Y735 WeakPolarHBondContact CA-O 3.46Å; V720-Y735 HydrophobicContact CG1-CD1 3.9Å; V720-T737 HydrophobicContact CG1-CG2 3.8Å; V720-V749 HydrophobicContact CG1-CG2 3.75Å; V720-V749 HydrophobicContact CG2-CG1 4.39Å
721	A	94.8	Very high	91.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.3	169.3	0	0	0	0	0	110.2	G704 A725 L729 A733 Y735 V736 T737	G704-A721 WeakPolarHBondContact O-CA 3.41Å; A721-A725 HydrophobicContact CB-CB 4.03Å; A721-L729 HydrophobicContact CB-CD2 4.26Å; A721-L729 HydrophobicContact CB-CG 4.38Å; A721-A733 HydrophobicContact CB-CB 3.65Å; A721-Y735 PolarHBondContact N-O 2.93Å; A721-V736 HydrophobicContact CB-CG2 4.49Å; A721-V736 CarbonylContact O-C 3.53Å; A721-V736 VanDerWaalsContact O-CA 3.3Å; A721-V736 WeakPolarHBondContact O-CA 3.37Å; A721-T737 PolarHBondContact O-N 3.27Å
722	V	94.3	Very high	91.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.			trans	-71.9	158.8	171.3	-63.1	0	0	0	0	112	G615 V616 V703 G704 D705 D724 A725 T737 A745	G615-V722 WeakPolarHBondContact O-CG2 3.33Å; V616-V722 HydrophobicContact CB-CG1 4.43Å; V616-V722 HydrophobicContact CG1-CG1 4.25Å; V616-V722 HydrophobicContact CG2-CG1 4.09Å; V703-V722 HydrophobicContact CG1-CG1 3.9Å; G704-V722 PolarHBondContact O-N 3.17Å; G704-V722 VanDerWaalsContact O-N 3.14Å; D705-V722 HydrophobicContact CB-CG2 3.64Å; V722-D724 PolarHBondContact O-N 3.24Å; V722-D724 VanDerWaalsContact O-N 3.16Å; V722-A725 HydrophobicContact CG2-CB 3.92Å; V722-A725 WeakPolarHBondContact O-CB 3.34Å; V722-A725 PolarHBondContact O-N 3.29Å; V722-T737 WeakPolarHBondContact CA-OG1 3.46Å; V722-A745 HydrophobicContact CB-CB 4.45Å; V722-A745 HydrophobicContact CG1-CB 3.85Å
723	A	87.3	Confident	90.7	Very high	38 Å²	38	46.2 Å²	46.2	31%	0.314	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-34.1	-173.9	0	0	0	0	0	114.2	T737 R738 I739	A723-T737 VanDerWaalsContact CA-O 3.28Å; A723-T737 WeakPolarHBondContact CA-O 2.94Å; A723-T737 WeakPolarHBondContact CB-O 3.21Å; A723-T737 PolarHBondContact N-OG1 3.48Å; A723-R738 WeakPolarHBondContact CB-O 3.37Å; A723-I739 WeakPolarHBondContact CB-O 3.47Å
724	D	89.5	Confident	90.2	Very high	91 Å²	91	49.1 Å²	49.1	49%	0.487	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	16.8	-179.9	60.1	-31.8	0	0	0	113.2	V722 A740 G741	V722-D724 PolarHBondContact O-N 3.24Å; V722-D724 VanDerWaalsContact O-N 3.16Å; D724-A740 HydrophobicContact CB-CB 4.18Å; D724-A740 WeakPolarHBondContact OD1-CA 3.49Å; D724-A740 WeakPolarHBondContact OD1-CB 3.27Å; D724-G741 PolarHBondContact OD1-N 2.86Å
725	A	92.7	Very high	89.8	Confident	6 Å²	6	44.1 Å²	44.1	5%	0.05	24%	0.24	C	C	.	.	S	Bend	trans	-60.7	162.4	175.6	0	0	0	0	0	112.5	D705 A721 V722 L729 I730	D705-A725 CarbonylContact O-C 3.48Å; D705-A725 VanDerWaalsContact O-CA 3.22Å; D705-A725 WeakPolarHBondContact O-CA 3.15Å; D705-A725 VanDerWaalsContact O-CB 3.31Å; D705-A725 WeakPolarHBondContact O-CB 3.33Å; A721-A725 HydrophobicContact CB-CB 4.03Å; V722-A725 HydrophobicContact CG2-CB 3.92Å; V722-A725 WeakPolarHBondContact O-CB 3.34Å; V722-A725 PolarHBondContact O-N 3.29Å; A725-L729 HydrophobicContact CB-CD2 4.31Å; A725-I730 HydrophobicContact CB-CG1 4.08Å; A725-I730 WeakPolarHBondContact O-CD1 3.33Å
726	H	92.9	Very high	89.4	Confident	70 Å²	70	41.2 Å²	41.2	32%	0.324	23%	0.232	S	C	.	.			trans	-52.6	132.5	177.8	-172.5	-84.5	0	0	0	111.1	D705 D706 L728 L729 I730	D705-H726 PolarHBondContact O-N 3.41Å; D706-H726 WeakPolarHBondContact OD1-CB 3.31Å; D706-H726 IonicContact OD1-CD2 3.35Å; D706-H726 IonicContact OD1-CG 3.54Å; H726-L728 PolarHBondContact ND1-N 3.35Å; H726-L728 PolarHBondContact O-N 3.42Å; H726-L729 HydrophobicContact CB-CB 4.46Å; H726-L729 WeakPolarHBondContact O-CB 3.39Å; H726-L729 PolarHBondContact O-N 3.47Å; H726-I730 PolarHBondContact O-N 2.72Å
727	P	85.7	Confident	88.8	Confident	100 Å²	100	40.8 Å²	40.8	65%	0.649	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.6	-173.4	-29.1	35.2	0	0	0	115.7	P731	P727-P731 WeakPolarHBondContact O-CD 3.45Å
728	L	87.8	Confident	88.1	Confident	100 Å²	100	43.4 Å²	43.4	52%	0.524	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-17	175.5	-64	-179.7	0	0	0	114	L707 H726 R732	L707-L728 HydrophobicContact CD1-CB 4.36Å; L707-L728 HydrophobicContact CD1-CD1 4.22Å; L707-L728 HydrophobicContact CD2-CB 3.94Å; H726-L728 PolarHBondContact ND1-N 3.35Å; H726-L728 PolarHBondContact O-N 3.42Å; L728-R732 PolarHBondContact O-NE 3.23Å
729	L	87.8	Confident	87.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-45	177.2	-173.4	70.1	0	0	0	111.3	W710 M713 A721 A725 H726 P731 R732 A733	W710-L729 HydrophobicContact CB-CD1 4.12Å; W710-L729 HydrophobicContact CE3-CD1 4.05Å; M713-L729 HydrophobicContact CE-CD1 4.2Å; M713-L729 HydrophobicContact CE-CD2 4.34Å; M713-L729 HydrophobicContact CE-CG 4.34Å; M713-L729 HydrophobicContact SD-CD1 3.83Å; M713-L729 HydrophobicContact SD-CD2 4.01Å; M713-L729 HydrophobicContact SD-CG 4.32Å; A721-L729 HydrophobicContact CB-CD2 4.26Å; A721-L729 HydrophobicContact CB-CG 4.38Å; A725-L729 HydrophobicContact CB-CD2 4.31Å; H726-L729 HydrophobicContact CB-CB 4.46Å; H726-L729 WeakPolarHBondContact O-CB 3.39Å; H726-L729 PolarHBondContact O-N 3.47Å; L729-P731 VanDerWaalsContact C-CD 3.49Å; L729-R732 WeakPolarHBondContact O-CA 3.4Å; L729-R732 WeakPolarHBondContact O-CB 3.49Å; L729-R732 PolarHBondContact O-N 2.95Å; L729-A733 PolarHBondContact O-N 3.12Å
730	I	82.1	Confident	87.4	Confident	56 Å²	56	47.5 Å²	47.5	29%	0.287	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-42.9	-53.1	-179	-67.4	177.1	0	0	0	113.7	A725 H726 R732 A733 V736	A725-I730 HydrophobicContact CB-CG1 4.08Å; A725-I730 WeakPolarHBondContact O-CD1 3.33Å; H726-I730 PolarHBondContact O-N 2.72Å; I730-R732 PolarHBondContact O-N 3.35Å; I730-R732 VanDerWaalsContact O-N 3.14Å; I730-A733 PolarHBondContact O-N 2.91Å; I730-V736 HydrophobicContact CG2-CG1 4.25Å; I730-V736 HydrophobicContact CG2-CG2 3.9Å
731	P	74.6	Confident	87.2	Confident	104 Å²	104	47.6 Å²	47.6	68%	0.675	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-71.6	-7.1	-177	28.9	-36.5	0	0	0	114.2	P727 L729	P727-P731 WeakPolarHBondContact O-CD 3.45Å; L729-P731 VanDerWaalsContact C-CD 3.49Å
732	R	85.7	Confident	87	Confident	117 Å²	117	47.9 Å²	47.9	44%	0.442	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-99.6	-16.7	-179.5	-55.1	-176.1	177.6	-172.9	-1.5	113.4	W710 L728 L729 I730	W710-R732 HydrophobicContact CD2-CB 4.5Å; W710-R732 HydrophobicContact CE3-CB 3.84Å; W710-R732 HydrophobicContact CH2-CB 3.63Å; W710-R732 HydrophobicContact CH2-CG 4.45Å; W710-R732 HydrophobicContact CZ2-CB 4.29Å; W710-R732 HydrophobicContact CZ3-CB 3.37Å; W710-R732 HydrophobicContact CZ3-CG 4.42Å; W710-R732 WeakPolarHBondContact CZ3-O 3.3Å; L728-R732 PolarHBondContact O-NE 3.23Å; L729-R732 WeakPolarHBondContact O-CA 3.4Å; L729-R732 WeakPolarHBondContact O-CB 3.49Å; L729-R732 PolarHBondContact O-N 2.95Å; I730-R732 PolarHBondContact O-N 3.35Å; I730-R732 VanDerWaalsContact O-N 3.14Å
733	A	87.6	Confident	87	Confident	17 Å²	17	54.6 Å²	54.6	14%	0.14	29%	0.289	C	S	.	.	S	Bend	trans	-79.7	148	179.6	0	0	0	0	0	111.4	M713 A721 L729 I730 Y735	M713-A733 HydrophobicContact CE-CB 3.99Å; A721-A733 HydrophobicContact CB-CB 3.65Å; L729-A733 PolarHBondContact O-N 3.12Å; I730-A733 PolarHBondContact O-N 2.91Å; A733-Y735 VanDerWaalsContact C-N 3.34Å
734	D	86.2	Confident	87.1	Confident	62 Å²	62	52.9 Å²	52.9	33%	0.332	28%	0.275	S	S	.	.	S	Bend	trans	-68.9	-36.5	173.6	-64	-58.6	0	0	0	111.8	V599 K602 L718 S719	V599-D734 VanDerWaalsContact CG2-O 3.28Å; V599-D734 WeakPolarHBondContact CG2-O 3.41Å; K602-D734 HydrophobicContact CD-CB 4.45Å; K602-D734 IonicContact NZ-OD1 2.71Å; K602-D734 PolarHBondContact NZ-OD1 3.34Å; K602-D734 IonicContact NZ-OD2 3.34Å; K602-D734 PolarHBondContact NZ-OD2 2.85Å; L718-D734 HydrophobicContact CD1-CB 3.91Å; S719-D734 PolarHBondContact N-OD2 3.44Å; S719-D734 WeakPolarHBondContact O-CB 3.2Å; S719-D734 PolarHBondContact O-N 3.49Å; S719-D734 PolarHBondContact OG-N 3.43Å; S719-D734 PolarHBondContact OG-OD2 2.93Å
735	Y	86.5	Confident	87.3	Confident	23 Å²	23	48.5 Å²	48.5	9%	0.09	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.5	177.1	-173.1	-109.8	0	0	0	110.6	V599 S719 V720 A721 A733 T737 E748 L752	V599-Y735 HydrophobicContact CG1-CD2 4.07Å; V599-Y735 HydrophobicContact CG1-CG 4.29Å; S719-Y735 PolarHBondContact O-N 3.3Å; V720-Y735 CarbonylContact C-O 3.52Å; V720-Y735 VanDerWaalsContact CA-O 3.26Å; V720-Y735 WeakPolarHBondContact CA-O 3.46Å; V720-Y735 HydrophobicContact CG1-CD1 3.9Å; A721-Y735 PolarHBondContact N-O 2.93Å; A733-Y735 VanDerWaalsContact C-N 3.34Å; Y735-T737 HydrophobicContact CD1-CG2 4.43Å; Y735-T737 HydrophobicContact CE1-CG2 4.19Å; Y735-E748 PolarHBondContact OH-OE1 3.4Å; Y735-L752 HydrophobicContact CD1-CD2 3.89Å; Y735-L752 HydrophobicContact CD2-CD2 4.36Å; Y735-L752 HydrophobicContact CE1-CD2 4.08Å; Y735-L752 HydrophobicContact CG-CD2 4.06Å
736	V	86	Confident	87.4	Confident	52 Å²	52	48.2 Å²	48.2	32%	0.315	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.5	173.4	-176.3	0	0	0	0	106.9	A721 I730	A721-V736 HydrophobicContact CB-CG2 4.49Å; A721-V736 CarbonylContact O-C 3.53Å; A721-V736 VanDerWaalsContact O-CA 3.3Å; A721-V736 WeakPolarHBondContact O-CA 3.37Å; I730-V736 HydrophobicContact CG2-CG1 4.25Å; I730-V736 HydrophobicContact CG2-CG2 3.9Å
737	T	84.6	Confident	87.5	Confident	4 Å²	4	48 Å²	48	3%	0.025	25%	0.246	C	C	.	.			trans	-64.9	155.1	178.6	69.3	0	0	0	0	110	V720 A721 V722 A723 Y735 I739 A745 E748 V749	V720-T737 HydrophobicContact CG1-CG2 3.8Å; A721-T737 PolarHBondContact O-N 3.27Å; V722-T737 WeakPolarHBondContact CA-OG1 3.46Å; A723-T737 VanDerWaalsContact CA-O 3.28Å; A723-T737 WeakPolarHBondContact CA-O 2.94Å; A723-T737 WeakPolarHBondContact CB-O 3.21Å; A723-T737 PolarHBondContact N-OG1 3.48Å; Y735-T737 HydrophobicContact CD1-CG2 4.43Å; Y735-T737 HydrophobicContact CE1-CG2 4.19Å; T737-I739 PolarHBondContact OG1-O 2.86Å; T737-A745 HydrophobicContact CG2-CB 4.4Å; T737-E748 WeakPolarHBondContact CA-OE1 3.46Å; T737-V749 HydrophobicContact CG2-CG2 3.64Å
738	R	78.9	Confident	87.7	Confident	68 Å²	68	44.4 Å²	44.4	26%	0.257	22%	0.221	S	C	.	.	S	Bend	trans	-85.9	-26.8	171.3	-75.8	174.1	-90.7	169.2	-7	111.9	M587 A723 E748	M587-R738 PolarHBondContact SD-NE 2.69Å; M587-R738 PolarHBondContact SD-NH1 3.27Å; M587-R738 PolarHBondContact SD-NH2 3.07Å; A723-R738 WeakPolarHBondContact CB-O 3.37Å; R738-E748 PolarHBondContact N-OE1 2.91Å; R738-E748 PolarHBondContact N-OE2 3.21Å; R738-E748 IonicContact NE-OE1 3.08Å
739	I	84.1	Confident	88	Confident	60 Å²	60	39.7 Å²	39.7	31%	0.308	20%	0.196	S	C	.	.	S	Bend	trans	-91.4	137.7	179.2	-56.7	170.9	0	0	0	109.8	A723 T737 R743 A745 E748	A723-I739 WeakPolarHBondContact CB-O 3.47Å; T737-I739 PolarHBondContact OG1-O 2.86Å; I739-R743 VanDerWaalsContact CG2-C 3.4Å; I739-R743 HydrophobicContact CG2-CB 3.76Å; I739-R743 VanDerWaalsContact CG2-O 3.32Å; I739-R743 WeakPolarHBondContact CG2-O 3.29Å; I739-A745 HydrophobicContact CB-CB 4.43Å; I739-A745 VanDerWaalsContact O-CB 3.23Å; I739-A745 WeakPolarHBondContact O-CB 3.4Å; I739-E748 HydrophobicContact CD1-CB 4.38Å; I739-E748 WeakPolarHBondContact CG1-OE2 3.44Å; I739-E748 PolarHBondContact N-OE2 3.48Å; I739-E748 VanDerWaalsContact N-OE2 3.08Å
740	A	90.7	Very high	88.4	Confident	30 Å²	30	39.7 Å²	39.7	25%	0.248	20%	0.196	C	C	.	.			trans	-68.6	158	175.8	0	0	0	0	0	113	D724 G742 R743 A745	D724-A740 HydrophobicContact CB-CB 4.18Å; D724-A740 WeakPolarHBondContact OD1-CA 3.49Å; D724-A740 WeakPolarHBondContact OD1-CB 3.27Å; A740-G742 PolarHBondContact O-N 2.91Å; A740-R743 HydrophobicContact CB-CB 4.48Å; A740-R743 HydrophobicContact CB-CG 4.21Å; A740-R743 WeakPolarHBondContact O-CB 3.24Å; A740-R743 PolarHBondContact O-N 3.2Å; A740-A745 WeakPolarHBondContact O-CB 3.4Å
741	G	91.2	Very high	88.7	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.01	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.7	135.2	171.7	0	0	0	0	0	113.7	G615 S618 D619 D724 R743	G615-G741 WeakPolarHBondContact O-CA 3.49Å; S618-G741 CarbonylContact O-C 3.55Å; D619-G741 WeakPolarHBondContact CA-O 3.44Å; D724-G741 PolarHBondContact OD1-N 2.86Å; G741-R743 PolarHBondContact O-N 3.39Å
742	G	92	Very high	89.4	Confident	7 Å²	7	34.2 Å²	34.2	7%	0.072	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	7.3	-179.5	0	0	0	0	0	115.5	V616 L617 S618 N635 A740	V616-G742 PolarHBondContact O-N 3.39Å; L617-G742 WeakPolarHBondContact O-CA 3.41Å; S618-G742 VanDerWaalsContact C-CA 3.46Å; S618-G742 PolarHBondContact O-N 3.45Å; N635-G742 WeakPolarHBondContact CB-O 3.49Å; N635-G742 PolarHBondContact ND2-O 2.91Å; A740-G742 PolarHBondContact O-N 2.91Å
743	R	92.4	Very high	89.8	Confident	140 Å²	140	28.7 Å²	28.7	53%	0.528	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	6.7	179.6	-57.1	-61.5	179	176.2	-8.4	113.8	D619 N635 I739 A740 G741	D619-R743 IonicContact OD2-CZ 2.62Å; D619-R743 IonicContact OD2-NH2 3.44Å; D619-R743 PolarHBondContact OD2-NH2 2.87Å; N635-R743 WeakPolarHBondContact ND2-CA 3.21Å; N635-R743 PolarHBondContact ND2-O 3.35Å; I739-R743 VanDerWaalsContact CG2-C 3.4Å; I739-R743 HydrophobicContact CG2-CB 3.76Å; I739-R743 VanDerWaalsContact CG2-O 3.32Å; I739-R743 WeakPolarHBondContact CG2-O 3.29Å; A740-R743 HydrophobicContact CB-CB 4.48Å; A740-R743 HydrophobicContact CB-CG 4.21Å; A740-R743 WeakPolarHBondContact O-CB 3.24Å; A740-R743 PolarHBondContact O-N 3.2Å; G741-R743 PolarHBondContact O-N 3.39Å
744	G	90.8	Very high	89.9	Confident	2 Å²	2	27.9 Å²	27.9	2%	0.021	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	115.1	9.3	-173.3	0	0	0	0	0	114.4	D638 V746 R747 E748	D638-G744 WeakPolarHBondContact OD1-CA 3.17Å; D638-G744 PolarHBondContact OD2-N 3.03Å; G744-V746 VanDerWaalsContact C-N 3.34Å; G744-V746 PolarHBondContact O-N 3.02Å; G744-R747 WeakPolarHBondContact O-CB 3.22Å; G744-R747 PolarHBondContact O-N 3.33Å; G744-E748 PolarHBondContact O-N 2.9Å
745	A	92.8	Very high	89.9	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-41.9	-179	0	0	0	0	0	112.2	D638 V722 T737 I739 A740 R747 E748 V749	D638-A745 PolarHBondContact OD1-N 3.02Å; V722-A745 HydrophobicContact CB-CB 4.45Å; V722-A745 HydrophobicContact CG1-CB 3.85Å; T737-A745 HydrophobicContact CG2-CB 4.4Å; I739-A745 HydrophobicContact CB-CB 4.43Å; I739-A745 VanDerWaalsContact O-CB 3.23Å; I739-A745 WeakPolarHBondContact O-CB 3.4Å; A740-A745 WeakPolarHBondContact O-CB 3.4Å; A745-R747 VanDerWaalsContact C-N 3.29Å; A745-R747 PolarHBondContact O-N 3.46Å; A745-E748 WeakPolarHBondContact O-CB 3.44Å; A745-E748 PolarHBondContact O-N 3.37Å; A745-V749 WeakPolarHBondContact O-CG2 3.39Å; A745-V749 PolarHBondContact O-N 3.13Å
746	V	96.3	Very high	89.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.6	-35.9	178.7	175.6	0	0	0	0	110.4	L611 V616 L617 D638 I642 G744 E748 V749 C750	L611-V746 HydrophobicContact CD1-CG1 3.66Å; L611-V746 HydrophobicContact CD1-CG2 4.37Å; L611-V746 HydrophobicContact CD2-CG1 3.94Å; L611-V746 HydrophobicContact CD2-CG2 4.03Å; L611-V746 HydrophobicContact CG-CG1 4.48Å; V616-V746 HydrophobicContact CG1-CG2 3.78Å; L617-V746 HydrophobicContact CD2-CB 4.27Å; L617-V746 HydrophobicContact CD2-CG1 4.35Å; L617-V746 HydrophobicContact CD2-CG2 3.76Å; L617-V746 HydrophobicContact CG-CG2 4.26Å; D638-V746 HydrophobicContact CB-CB 3.97Å; D638-V746 WeakPolarHBondContact OD1-CA 3.36Å; D638-V746 WeakPolarHBondContact OD1-CB 3.44Å; D638-V746 PolarHBondContact OD1-N 3.28Å; I642-V746 HydrophobicContact CD1-CG1 4.12Å; I642-V746 HydrophobicContact CG1-CG1 3.91Å; G744-V746 VanDerWaalsContact C-N 3.34Å; G744-V746 PolarHBondContact O-N 3.02Å; V746-E748 VanDerWaalsContact C-N 3.31Å; V746-E748 PolarHBondContact O-N 3.49Å; V746-V749 PolarHBondContact O-N 3.25Å; V746-C750 PolarHBondContact O-N 3.38Å; V746-C750 PolarHBondContact O-SG 3.38Å
747	R	93.7	Very high	89.9	Confident	66 Å²	66	25.7 Å²	25.7	25%	0.249	12%	0.123	C	C	.	.	H	α-helix	trans	-58.2	-44.7	173.2	177.4	57.8	-165.2	-97.2	5.2	112.1	R637 D638 G744 A745 V749 C750 D751	R637-R747 HydrophobicContact CB-CB 4.22Å; R637-R747 HydrophobicContact CB-CG 4.31Å; R637-R747 WeakPolarHBondContact O-CB 3.24Å; R637-R747 WeakPolarHBondContact O-CD 3.36Å; D638-R747 PolarHBondContact OD1-N 3.47Å; G744-R747 WeakPolarHBondContact O-CB 3.22Å; G744-R747 PolarHBondContact O-N 3.33Å; A745-R747 VanDerWaalsContact C-N 3.29Å; A745-R747 PolarHBondContact O-N 3.46Å; R747-V749 VanDerWaalsContact C-N 3.29Å; R747-V749 PolarHBondContact O-N 3.22Å; R747-C750 PolarHBondContact O-N 3.25Å; R747-D751 IonicContact CZ-OD1 3.97Å; R747-D751 IonicContact CZ-OD2 3.31Å; R747-D751 IonicContact NE-OD1 2.96Å; R747-D751 PolarHBondContact NE-OD1 3.47Å; R747-D751 IonicContact NE-OD2 2.64Å; R747-D751 PolarHBondContact NE-OD2 2.87Å; R747-D751 IonicContact NH2-OD1 2.58Å; R747-D751 PolarHBondContact NH2-OD1 3.32Å; R747-D751 VanDerWaalsContact NH2-OD1 3.08Å; R747-D751 IonicContact NH2-OD2 3.92Å; R747-D751 PolarHBondContact NH2-OD2 3.44Å; R747-D751 PolarHBondContact O-N 3.49Å
748	E	90.5	Very high	89.8	Confident	24 Å²	24	28.5 Å²	28.5	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-57.9	-43.5	176.5	-173.1	-176.4	150.1	0	0	111.3	Y735 T737 R738 I739 G744 A745 V746 D751 L752	Y735-E748 PolarHBondContact OH-OE1 3.4Å; T737-E748 WeakPolarHBondContact CA-OE1 3.46Å; R738-E748 PolarHBondContact N-OE1 2.91Å; R738-E748 PolarHBondContact N-OE2 3.21Å; R738-E748 IonicContact NE-OE1 3.08Å; I739-E748 HydrophobicContact CD1-CB 4.38Å; I739-E748 WeakPolarHBondContact CG1-OE2 3.44Å; I739-E748 PolarHBondContact N-OE2 3.48Å; I739-E748 VanDerWaalsContact N-OE2 3.08Å; G744-E748 PolarHBondContact O-N 2.9Å; A745-E748 WeakPolarHBondContact O-CB 3.44Å; A745-E748 PolarHBondContact O-N 3.37Å; V746-E748 VanDerWaalsContact C-N 3.31Å; V746-E748 PolarHBondContact O-N 3.49Å; E748-D751 PolarHBondContact O-N 3.06Å; E748-L752 WeakPolarHBondContact O-CB 3.35Å; E748-L752 PolarHBondContact O-N 3.49Å
749	V	94.6	Very high	90.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-44.5	177.5	-179	0	0	0	0	111.6	L609 V703 V720 T737 A745 V746 R747 D751 L752 L753	L609-V749 HydrophobicContact CD1-CG1 4.01Å; V703-V749 HydrophobicContact CG2-CB 4.33Å; V703-V749 HydrophobicContact CG2-CG1 3.91Å; V703-V749 HydrophobicContact CG2-CG2 4.05Å; V720-V749 HydrophobicContact CG1-CG2 3.75Å; V720-V749 HydrophobicContact CG2-CG1 4.39Å; T737-V749 HydrophobicContact CG2-CG2 3.64Å; A745-V749 WeakPolarHBondContact O-CG2 3.39Å; A745-V749 PolarHBondContact O-N 3.13Å; V746-V749 PolarHBondContact O-N 3.25Å; R747-V749 VanDerWaalsContact C-N 3.29Å; R747-V749 PolarHBondContact O-N 3.22Å; V749-D751 VanDerWaalsContact C-N 3.33Å; V749-D751 PolarHBondContact O-N 2.9Å; V749-L752 WeakPolarHBondContact O-CB 3.3Å; V749-L752 PolarHBondContact O-N 3.43Å; V749-L753 WeakPolarHBondContact O-CG 3.48Å; V749-L753 PolarHBondContact O-N 2.86Å
750	C	94.7	Very high	90	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-43.8	176.8	-66.6	0	0	0	0	111.6	G641 V746 R747 L752 L753 L754	G641-C750 WeakPolarHBondContact O-CB 3.47Å; G641-C750 PolarHBondContact O-SG 3.19Å; V746-C750 PolarHBondContact O-N 3.38Å; V746-C750 PolarHBondContact O-SG 3.38Å; R747-C750 PolarHBondContact O-N 3.25Å; C750-L752 VanDerWaalsContact C-N 3.33Å; C750-L752 PolarHBondContact O-N 2.98Å; C750-L753 PolarHBondContact O-N 3.36Å; C750-L754 WeakPolarHBondContact O-CB 3.43Å; C750-L754 VanDerWaalsContact O-CG 3.23Å; C750-L754 WeakPolarHBondContact O-CG 2.99Å; C750-L754 PolarHBondContact O-N 3.1Å
751	D	90	Very high	89.3	Confident	38 Å²	38	33.5 Å²	33.5	20%	0.203	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-38.5	177.4	-71.5	-17.4	0	0	0	111.4	R747 E748 V749 L755 L760	R747-D751 IonicContact CZ-OD1 3.97Å; R747-D751 IonicContact CZ-OD2 3.31Å; R747-D751 IonicContact NE-OD1 2.96Å; R747-D751 PolarHBondContact NE-OD1 3.47Å; R747-D751 IonicContact NE-OD2 2.64Å; R747-D751 PolarHBondContact NE-OD2 2.87Å; R747-D751 IonicContact NH2-OD1 2.58Å; R747-D751 PolarHBondContact NH2-OD1 3.32Å; R747-D751 VanDerWaalsContact NH2-OD1 3.08Å; R747-D751 IonicContact NH2-OD2 3.92Å; R747-D751 PolarHBondContact NH2-OD2 3.44Å; R747-D751 PolarHBondContact O-N 3.49Å; E748-D751 PolarHBondContact O-N 3.06Å; V749-D751 VanDerWaalsContact C-N 3.33Å; V749-D751 PolarHBondContact O-N 2.9Å; D751-L755 WeakPolarHBondContact O-CB 3.34Å; D751-L755 PolarHBondContact O-N 3.47Å; D751-L760 HydrophobicContact CB-CD1 4.02Å
752	L	88.5	Confident	88.6	Confident	8 Å²	8	41 Å²	41	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-48.5	174	175.6	68.8	0	0	0	111.8	L591 V599 M600 Y735 E748 V749 C750 L755 A756	L591-L752 HydrophobicContact CD1-CD1 4.43Å; V599-L752 HydrophobicContact CG1-CD1 4.47Å; V599-L752 HydrophobicContact CG1-CD2 3.92Å; M600-L752 HydrophobicContact SD-CD1 3.73Å; Y735-L752 HydrophobicContact CD1-CD2 3.89Å; Y735-L752 HydrophobicContact CD2-CD2 4.36Å; Y735-L752 HydrophobicContact CE1-CD2 4.08Å; Y735-L752 HydrophobicContact CG-CD2 4.06Å; E748-L752 WeakPolarHBondContact O-CB 3.35Å; E748-L752 PolarHBondContact O-N 3.49Å; V749-L752 WeakPolarHBondContact O-CB 3.3Å; V749-L752 PolarHBondContact O-N 3.43Å; C750-L752 VanDerWaalsContact C-N 3.33Å; C750-L752 PolarHBondContact O-N 2.98Å; L752-L755 PolarHBondContact O-N 3.45Å; L752-A756 WeakPolarHBondContact O-CB 3.39Å; L752-A756 PolarHBondContact O-N 3.07Å
753	L	93.5	Very high	87.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-47	179.5	-65.8	-178.6	0	0	0	111.7	A603 I606 L609 I650 L718 V749 C750 L755 A756 Q757	A603-L753 HydrophobicContact CB-CD2 3.86Å; I606-L753 HydrophobicContact CB-CD2 3.9Å; I606-L753 HydrophobicContact CG1-CD2 3.82Å; I606-L753 HydrophobicContact CG2-CD1 4.05Å; I606-L753 HydrophobicContact CG2-CD2 4.08Å; L609-L753 HydrophobicContact CB-CD1 4.31Å; L609-L753 HydrophobicContact CD1-CD1 4.25Å; L609-L753 HydrophobicContact CD2-CD1 4.24Å; I650-L753 HydrophobicContact CD1-CB 4.03Å; I650-L753 HydrophobicContact CG2-CD1 4.5Å; L718-L753 HydrophobicContact CD2-CD2 3.79Å; V749-L753 WeakPolarHBondContact O-CG 3.48Å; V749-L753 PolarHBondContact O-N 2.86Å; C750-L753 PolarHBondContact O-N 3.36Å; L753-L755 VanDerWaalsContact C-N 3.31Å; L753-L755 PolarHBondContact O-N 2.79Å; L753-A756 PolarHBondContact O-N 3.04Å; L753-Q757 WeakPolarHBondContact O-CG 3.38Å; L753-Q757 PolarHBondContact O-N 3.48Å
754	L	90	Very high	87.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-37.2	179.4	-68.4	167.8	0	0	0	111.7	C644 S648 I650 C750 Q757 G758 K759 L760 A763	C644-L754 HydrophobicContact CB-CD1 3.7Å; S648-L754 VanDerWaalsContact CB-CD2 3.44Å; I650-L754 HydrophobicContact CD1-CD2 4.25Å; C750-L754 WeakPolarHBondContact O-CB 3.43Å; C750-L754 VanDerWaalsContact O-CG 3.23Å; C750-L754 WeakPolarHBondContact O-CG 2.99Å; C750-L754 PolarHBondContact O-N 3.1Å; L754-Q757 PolarHBondContact O-N 2.69Å; L754-G758 PolarHBondContact O-N 3.08Å; L754-G758 VanDerWaalsContact O-N 3.14Å; L754-K759 HydrophobicContact CD2-CB 4.09Å; L754-K759 PolarHBondContact O-N 3.43Å; L754-L760 HydrophobicContact CB-CB 4.25Å; L754-L760 HydrophobicContact CB-CD1 3.94Å; L754-L760 HydrophobicContact CD1-CD1 4.41Å; L754-L760 PolarHBondContact O-N 3.33Å; L754-A763 HydrophobicContact CD1-CB 3.82Å; L754-A763 HydrophobicContact CD2-CB 4.17Å
755	L	85.3	Confident	86	Confident	31 Å²	31	43.6 Å²	43.6	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-44.7	174.8	-178.7	66	0	0	0	111.3	R592 M600 D751 L752 L753 Q757 G758 L760	R592-L755 HydrophobicContact CG-CD1 4.42Å; R592-L755 HydrophobicContact CG-CD2 4.35Å; M600-L755 HydrophobicContact CE-CD2 4.45Å; M600-L755 HydrophobicContact CE-CG 4.25Å; D751-L755 WeakPolarHBondContact O-CB 3.34Å; D751-L755 PolarHBondContact O-N 3.47Å; L752-L755 PolarHBondContact O-N 3.45Å; L753-L755 VanDerWaalsContact C-N 3.31Å; L753-L755 PolarHBondContact O-N 2.79Å; L755-Q757 PolarHBondContact O-N 3.1Å; L755-G758 PolarHBondContact O-N 2.67Å; L755-G758 VanDerWaalsContact O-N 3.07Å; L755-L760 HydrophobicContact CB-CD2 4.34Å; L755-L760 HydrophobicContact CD1-CD2 4.15Å
756	A	84.6	Confident	84.9	Confident	17 Å²	17	49.9 Å²	49.9	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-31.5	178	0	0	0	0	0	112.7	M600 A603 L752 L753	M600-A756 HydrophobicContact CE-CB 3.81Å; M600-A756 HydrophobicContact SD-CB 4.25Å; A603-A756 HydrophobicContact CB-CB 3.47Å; A603-A756 VanDerWaalsContact CB-CB 3.47Å; L752-A756 WeakPolarHBondContact O-CB 3.39Å; L752-A756 PolarHBondContact O-N 3.07Å; L753-A756 PolarHBondContact O-N 3.04Å
757	Q	89	Confident	83.2	Confident	43 Å²	43	54 Å²	54	20%	0.201	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-0.2	176.3	-65.1	-177.2	17.9	0	0	114	E604 I606 L753 L754 L755 K759	E604-Q757 WeakPolarHBondContact O-CG 3.2Å; I606-Q757 PolarHBondContact O-NE2 3.07Å; L753-Q757 WeakPolarHBondContact O-CG 3.38Å; L753-Q757 PolarHBondContact O-N 3.48Å; L754-Q757 PolarHBondContact O-N 2.69Å; L755-Q757 PolarHBondContact O-N 3.1Å; Q757-K759 HydrophobicContact CB-CD 4.05Å; Q757-K759 HydrophobicContact CB-CG 4.06Å; Q757-K759 PolarHBondContact O-N 2.98Å
758	G	83	Confident	81.5	Confident	64 Å²	64	54.3 Å²	54.3	66%	0.66	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	21.1	-176.2	0	0	0	0	0	114.5	L754 L755	L754-G758 PolarHBondContact O-N 3.08Å; L754-G758 VanDerWaalsContact O-N 3.14Å; L755-G758 PolarHBondContact O-N 2.67Å; L755-G758 VanDerWaalsContact O-N 3.07Å
759	K	87.1	Confident	81.1	Confident	56 Å²	56	55.9 Å²	55.9	24%	0.243	31%	0.306	C	S	.	.			trans	-104.3	-3.4	-175.1	-64.3	178.3	-176.4	167.3	0	114.3	S648 L754 Q757 D761 E762 A763	S648-K759 PolarHBondContact O-NZ 3.04Å; L754-K759 HydrophobicContact CD2-CB 4.09Å; L754-K759 PolarHBondContact O-N 3.43Å; Q757-K759 HydrophobicContact CB-CD 4.05Å; Q757-K759 HydrophobicContact CB-CG 4.06Å; Q757-K759 PolarHBondContact O-N 2.98Å; K759-D761 VanDerWaalsContact C-N 3.3Å; K759-D761 PolarHBondContact O-N 3.28Å; K759-E762 PolarHBondContact O-N 3.45Å; K759-E762 VanDerWaalsContact O-N 3.1Å; K759-A763 PolarHBondContact O-N 2.99Å; K759-A763 VanDerWaalsContact O-N 3.1Å
760	L	80	Confident	80.4	Confident	52 Å²	52	58.8 Å²	58.8	27%	0.272	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-41.4	-171.5	-172	68.1	0	0	0	113.5	D751 L754 L755 E762	D751-L760 HydrophobicContact CB-CD1 4.02Å; L754-L760 HydrophobicContact CB-CB 4.25Å; L754-L760 HydrophobicContact CB-CD1 3.94Å; L754-L760 HydrophobicContact CD1-CD1 4.41Å; L754-L760 PolarHBondContact O-N 3.33Å; L755-L760 HydrophobicContact CB-CD2 4.34Å; L755-L760 HydrophobicContact CD1-CD2 4.15Å; L760-E762 VanDerWaalsContact C-N 3.34Å
761	D	74.9	Confident	79.6	Confident	154 Å²	154	62.1 Å²	62.1	82%	0.824	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.2	-177.3	-62.9	-36.9	0	0	0	113.2	K759	K759-D761 VanDerWaalsContact C-N 3.3Å; K759-D761 PolarHBondContact O-N 3.28Å
762	E	76.5	Confident	79	Confident	159 Å²	159	63.5 Å²	63.5	74%	0.743	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-20.3	-178.9	-61.7	-174.3	172.5	0	0	112.8	K759 L760 K764	K759-E762 PolarHBondContact O-N 3.45Å; K759-E762 VanDerWaalsContact O-N 3.1Å; L760-E762 VanDerWaalsContact C-N 3.34Å; E762-K764 PolarHBondContact O-N 2.91Å
763	A	77.7	Confident	78.4	Confident	12 Å²	12	66.9 Å²	66.9	10%	0.099	37%	0.367	C	S	.	.			trans	-68.6	123.8	-173.2	0	0	0	0	0	112.3	C644 L754 K759	C644-A763 HydrophobicContact CB-CB 3.88Å; L754-A763 HydrophobicContact CD1-CB 3.82Å; L754-A763 HydrophobicContact CD2-CB 4.17Å; K759-A763 PolarHBondContact O-N 2.99Å; K759-A763 VanDerWaalsContact O-N 3.1Å
764	K	74.8	Confident	77.4	Confident	173 Å²	173	71.4 Å²	71.4	75%	0.752	39%	0.392	S	S	*	.			trans	-113.2	108.9	-179.2	-68.2	-176.3	-176.3	176.5	0	111.4	T647 E762	T647-K764 PolarHBondContact OG1-O 3.4Å; E762-K764 PolarHBondContact O-N 2.91Å
765	G	69.5	Low	76.5	Confident	18 Å²	18	76.5 Å²	76.5	19%	0.186	42%	0.42	C	S	.	.			trans	-98.9	154.4	173.6	0	0	0	0	0	112.2	Y640 C644	Y640-G765 VanDerWaalsContact CE2-C 3.45Å; Y640-G765 WeakPolarHBondContact CE2-O 3.5Å; C644-G765 PolarHBondContact SG-N 3.27Å
766	Q	69.4	Low	75.8	Confident	133 Å²	133	80 Å²	80	62%	0.621	44%	0.44	S	S	*	.			trans	-101.2	134.2	157.9	-74.1	-174.7	-4.7	0	0	108	I768	Q766-I768 VanDerWaalsContact C-N 3.28Å; Q766-I768 HydrophobicContact CB-CD1 3.87Å; Q766-I768 HydrophobicContact CB-CG1 3.65Å; Q766-I768 PolarHBondContact O-N 2.95Å
767	S	60.7	Low	75.1	Confident	85 Å²	85	85.3 Å²	85.3	59%	0.594	47%	0.465	S	S	*	.			trans	-79	79.1	177.5	-176.1	0	0	0	0	108.7	V636	V636-S767 WeakPolarHBondContact CG1-OG 3.33Å
768	I	57.9	Low	73.8	Confident	74 Å²	74	89.1 Å²	89.1	38%	0.379	49%	0.489	S	S	.	.			trans	-105	0	-178.3	-40.7	175.3	0	0	0	110.8	R666 T669 Q766	R666-I768 VanDerWaalsContact NH1-C 3.27Å; R666-I768 PolarHBondContact NH1-O 2.88Å; R666-I768 VanDerWaalsContact NH1-O 3.12Å; R666-I768 PolarHBondContact NH1-OXT 2.94Å; R666-I768 PolarHBondContact NH2-O 3.39Å; T669-I768 HydrophobicContact CG2-CB 4.19Å; T669-I768 HydrophobicContact CG2-CG2 3.24Å; Q766-I768 VanDerWaalsContact C-N 3.28Å; Q766-I768 HydrophobicContact CB-CD1 3.87Å; Q766-I768 HydrophobicContact CB-CG1 3.65Å; Q766-I768 PolarHBondContact O-N 2.95Å

Retrieved 768 of 768 residues in 1280.7 ms (Link to these results)

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