A0A077ZHY5_TRITR Loading...

ThiI and THUMP domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHY5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 396 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	92.1	Very high	85.9	Confident	28 Å²	28	44.7 Å²	44.7	14%	0.138	27%	0.271	C	S	.	.				0	134.1	0	177.5	179.7	56.6	0	0	111.6	R43 F69 S70 R149	M1-R43 HydrophobicContact CG-CB 4.21Å; M1-R43 HydrophobicContact CG-CG 4.39Å; M1-R43 HydrophobicContact SD-CB 4.27Å; M1-R43 HydrophobicContact SD-CG 3.91Å; M1-F69 CarbonylContact O-C 3.47Å; M1-F69 WeakPolarHBondContact O-CA 3.44Å; M1-F69 WeakPolarHBondContact O-CB 3.48Å; M1-S70 PolarHBondContact N-O 3.24Å; M1-S70 PolarHBondContact O-N 2.89Å; M1-R149 PolarHBondContact SD-NH2 3.42Å
2	V	94.7	Very high	85.8	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.7	-179	176.2	0	0	0	0	111.3	R43 M44 I46 L60 I66 F69	V2-R43 WeakPolarHBondContact O-CA 3.47Å; V2-M44 HydrophobicContact CB-CB 4.03Å; V2-M44 HydrophobicContact CG1-CB 4.47Å; V2-M44 PolarHBondContact N-O 2.84Å; V2-M44 PolarHBondContact O-N 3.02Å; V2-M44 VanDerWaalsContact O-N 3.09Å; V2-I46 HydrophobicContact CG2-CD1 3.82Å; V2-I46 HydrophobicContact CG2-CG1 4.23Å; V2-L60 HydrophobicContact CG2-CD1 4.49Å; V2-L60 HydrophobicContact CG2-CD2 3.93Å; V2-I66 HydrophobicContact CG1-CB 4.33Å; V2-I66 HydrophobicContact CG1-CD1 3.85Å; V2-I66 HydrophobicContact CG1-CG1 3.83Å; V2-I66 HydrophobicContact CG1-CG2 3.79Å; V2-F69 HydrophobicContact CB-CB 4.43Å; V2-F69 HydrophobicContact CG2-CB 3.99Å
3	R	93.8	Very high	85.8	Confident	33 Å²	33	62.2 Å²	62.2	13%	0.125	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	176.7	-51.3	-172.4	-177.1	75.7	2.4	110	Q67 T68 S70	R3-Q67 PolarHBondContact O-N 2.56Å; R3-T68 WeakPolarHBondContact CA-O 3.46Å; R3-T68 WeakPolarHBondContact CB-O 3.32Å; R3-T68 WeakPolarHBondContact CD-OG1 3.42Å; R3-T68 PolarHBondContact N-O 2.87Å; R3-T68 PolarHBondContact NH1-OG1 3.34Å; R3-T68 PolarHBondContact O-N 3.3Å; R3-S70 PolarHBondContact NH1-OG 3.49Å; R3-S70 PolarHBondContact NH2-OG 2.89Å
4	Y	93.3	Very high	86.1	Confident	16 Å²	16	61 Å²	61	6%	0.063	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	144.2	-174.7	-47	-41.5	0	0	0	113.2	L7 I18 L21 D40 R43 M44	Y4-L7 HydrophobicContact CD1-CD1 4.47Å; Y4-L7 HydrophobicContact CD2-CD1 3.87Å; Y4-L7 HydrophobicContact CG-CD1 3.74Å; Y4-L7 HydrophobicContact CG-CG 4.47Å; Y4-I18 HydrophobicContact CD2-CD1 4.4Å; Y4-I18 HydrophobicContact CD2-CG1 4.16Å; Y4-I18 HydrophobicContact CE2-CD1 3.89Å; Y4-I18 HydrophobicContact CE2-CG1 3.78Å; Y4-I18 HydrophobicContact CE2-CG2 4.32Å; Y4-L21 HydrophobicContact CD1-CD2 3.41Å; Y4-L21 VanDerWaalsContact CD1-CD2 3.41Å; Y4-L21 HydrophobicContact CE1-CD2 3.85Å; Y4-L21 HydrophobicContact CG-CD2 4.27Å; Y4-D40 VanDerWaalsContact CE2-O 3.29Å; Y4-D40 WeakPolarHBondContact CE2-O 3.31Å; Y4-D40 PolarHBondContact OH-O 2.95Å; Y4-R43 VanDerWaalsContact CZ-C 3.49Å; Y4-R43 PolarHBondContact OH-O 3.42Å; Y4-M44 HydrophobicContact CE1-CB 3.63Å; Y4-M44 HydrophobicContact CE1-CE 4.27Å; Y4-M44 WeakPolarHBondContact OH-CB 3.36Å; Y4-M44 PolarHBondContact OH-N 2.76Å
5	G	85.9	Confident	86.5	Confident	3 Å²	3	70.5 Å²	70.5	3%	0.031	36%	0.36	C	S	.	.	S	Bend	trans	-90.3	138	171.2	0	0	0	0	0	112.3	L7 G65	G5-L7 WeakPolarHBondContact O-CG 3.42Å; G5-L7 PolarHBondContact O-N 3.03Å; G5-G65 PolarHBondContact N-O 3.44Å
6	E	86.1	Confident	86.9	Confident	83 Å²	83	70.4 Å²	70.4	39%	0.388	37%	0.368	S	S	.	.	S	Bend	trans	53.8	11.8	171.1	-66.3	-179.4	-125.6	0	0	117.1	T9 L166 R194	E6-T9 PolarHBondContact O-OG1 3.44Å; E6-L166 HydrophobicContact CB-CD2 3.79Å; E6-R194 IonicContact OE1-CZ 3.66Å; E6-R194 IonicContact OE1-NH1 3.21Å; E6-R194 PolarHBondContact OE1-NH1 3.28Å; E6-R194 IonicContact OE2-CZ 2.79Å; E6-R194 IonicContact OE2-NH1 3.82Å; E6-R194 PolarHBondContact OE2-NH1 2.69Å; E6-R194 IonicContact OE2-NH2 2.74Å; E6-R194 PolarHBondContact OE2-NH2 2.87Å
7	L	82.2	Confident	87.3	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.016	35%	0.352	C	S	.	.			trans	-84	-17.5	-177	-61.7	-163.4	0	0	0	114.1	Y4 G5 T9 K10 R14 F17 I18	Y4-L7 HydrophobicContact CD1-CD1 4.47Å; Y4-L7 HydrophobicContact CD2-CD1 3.87Å; Y4-L7 HydrophobicContact CG-CD1 3.74Å; Y4-L7 HydrophobicContact CG-CG 4.47Å; G5-L7 WeakPolarHBondContact O-CG 3.42Å; G5-L7 PolarHBondContact O-N 3.03Å; L7-T9 PolarHBondContact O-N 2.78Å; L7-K10 HydrophobicContact CD2-CG 4.48Å; L7-K10 PolarHBondContact O-N 2.93Å; L7-R14 HydrophobicContact CB-CG 4.45Å; L7-R14 WeakPolarHBondContact O-CD 3.49Å; L7-F17 HydrophobicContact CD1-CB 4.26Å; L7-F17 HydrophobicContact CD2-CB 3.61Å; L7-F17 HydrophobicContact CD2-CD1 3.61Å; L7-F17 HydrophobicContact CD2-CG 4Å; L7-I18 HydrophobicContact CD1-CG1 3.68Å
8	S	74.9	Confident	87.8	Confident	99 Å²	99	64.4 Å²	64.4	69%	0.692	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64	-28.6	179.5	52.9	0	0	0	0	112.8
9	T	77.8	Confident	88.2	Confident	109 Å²	109	66.4 Å²	66.4	67%	0.669	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-86.2	-3.4	-178.1	59.1	0	0	0	0	113.7	E6 L7	E6-T9 PolarHBondContact O-OG1 3.44Å; L7-T9 PolarHBondContact O-N 2.78Å
10	K	80.8	Confident	88.5	Confident	58 Å²	58	66.2 Å²	66.2	25%	0.252	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-88.6	-0.2	-170.8	-56.9	-58.2	178.1	-176.4	0	115.2	L7 K12 N13 R14 F17	L7-K10 HydrophobicContact CD2-CG 4.48Å; L7-K10 PolarHBondContact O-N 2.93Å; K10-K12 PolarHBondContact O-N 3.03Å; K10-N13 PolarHBondContact O-N 3.44Å; K10-R14 HydrophobicContact CB-CB 4.38Å; K10-F17 HydrophobicContact CD-CE1 4.17Å; K10-F17 HydrophobicContact CD-CZ 4.25Å; K10-F17 HydrophobicContact CG-CD1 4.29Å; K10-F17 HydrophobicContact CG-CE1 4.31Å
11	G	83.7	Confident	88.9	Confident	58 Å²	58	63 Å²	63	60%	0.598	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	49.4	-122.5	173.8	0	0	0	0	0	113.2	N13 R14	G11-N13 VanDerWaalsContact C-N 3.29Å; G11-N13 PolarHBondContact O-N 3.03Å; G11-R14 VanDerWaalsContact O-CB 3.27Å; G11-R14 WeakPolarHBondContact O-CB 3.39Å; G11-R14 PolarHBondContact O-N 2.74Å
12	K	83.9	Confident	89.1	Confident	211 Å²	211	61.7 Å²	61.7	92%	0.917	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-64.9	-27.6	-179	-65.4	-176.3	180	179.9	0	113.7	K10 R14	K10-K12 PolarHBondContact O-N 3.03Å; K12-R14 VanDerWaalsContact C-N 3.26Å; K12-R14 PolarHBondContact O-N 3.48Å
13	N	86.4	Confident	89.2	Confident	106 Å²	106	66.7 Å²	66.7	57%	0.567	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-80.8	-5.7	-179.6	-64.7	-19.7	0	0	0	112.8	K10 G11 R15 S16 F17	K10-N13 PolarHBondContact O-N 3.44Å; G11-N13 VanDerWaalsContact C-N 3.29Å; G11-N13 PolarHBondContact O-N 3.03Å; N13-R15 PolarHBondContact O-N 2.9Å; N13-R15 VanDerWaalsContact O-N 3.11Å; N13-S16 PolarHBondContact O-N 3.12Å; N13-S16 VanDerWaalsContact O-N 3.14Å; N13-S16 PolarHBondContact O-OG 3.01Å; N13-F17 HydrophobicContact CB-CD2 4.34Å; N13-F17 HydrophobicContact CB-CE2 4.18Å; N13-F17 VanDerWaalsContact O-CD2 3.29Å; N13-F17 WeakPolarHBondContact O-CD2 3.34Å; N13-F17 PolarHBondContact O-N 2.97Å
14	R	89.6	Confident	89.3	Confident	45 Å²	45	66.5 Å²	66.5	17%	0.17	34%	0.341	C	S	.	.	H	α-helix	trans	-54.7	-36.4	-176.5	-177.2	171.2	174.8	-175.6	-4.3	113.2	L7 K10 G11 K12 F17 I18 R41 D42	L7-R14 HydrophobicContact CB-CG 4.45Å; L7-R14 WeakPolarHBondContact O-CD 3.49Å; K10-R14 HydrophobicContact CB-CB 4.38Å; G11-R14 VanDerWaalsContact O-CB 3.27Å; G11-R14 WeakPolarHBondContact O-CB 3.39Å; G11-R14 PolarHBondContact O-N 2.74Å; K12-R14 VanDerWaalsContact C-N 3.26Å; K12-R14 PolarHBondContact O-N 3.48Å; R14-F17 PolarHBondContact O-N 2.78Å; R14-I18 HydrophobicContact CG-CD1 3.85Å; R14-I18 HydrophobicContact CG-CG1 4.43Å; R14-I18 VanDerWaalsContact O-CG1 3.3Å; R14-I18 WeakPolarHBondContact O-CG1 2.9Å; R14-I18 PolarHBondContact O-N 3.15Å; R14-R41 PolarHBondContact NE-O 3Å; R14-R41 PolarHBondContact NH2-O 3.26Å; R14-D42 IonicContact CZ-OD1 3.9Å; R14-D42 IonicContact NH1-OD1 2.81Å; R14-D42 IonicContact NH2-OD1 3.51Å; R14-D42 PolarHBondContact NH2-OD1 2.76Å
15	R	91.7	Very high	89.5	Confident	204 Å²	204	65.8 Å²	65.8	77%	0.77	34%	0.338	S	S	*	.	H	α-helix	trans	-63.7	-43.6	179.8	-172.4	177.3	-178.9	175.8	0	112.3	N13 F17 I18 M19	N13-R15 PolarHBondContact O-N 2.9Å; N13-R15 VanDerWaalsContact O-N 3.11Å; R15-F17 VanDerWaalsContact C-N 3.33Å; R15-F17 PolarHBondContact O-N 3.3Å; R15-I18 PolarHBondContact O-N 2.86Å; R15-M19 WeakPolarHBondContact O-CG 3.47Å; R15-M19 PolarHBondContact O-N 3.37Å
16	S	93.2	Very high	90	Very high	68 Å²	68	71.2 Å²	71.2	48%	0.476	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-37.6	179.9	59.1	0	0	0	0	111.7	N13 M19 R20	N13-S16 PolarHBondContact O-N 3.12Å; N13-S16 VanDerWaalsContact O-N 3.14Å; N13-S16 PolarHBondContact O-OG 3.01Å; S16-M19 PolarHBondContact O-N 2.86Å; S16-R20 WeakPolarHBondContact O-CB 3.29Å; S16-R20 PolarHBondContact O-N 3.14Å
17	F	94.8	Very high	90.4	Very high	23 Å²	23	69.7 Å²	69.7	10%	0.101	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-42.4	175.6	-78.8	-118.7	0	0	0	112	L7 K10 N13 R14 R15 R20 L21 L166 T170	L7-F17 HydrophobicContact CD1-CB 4.26Å; L7-F17 HydrophobicContact CD2-CB 3.61Å; L7-F17 HydrophobicContact CD2-CD1 3.61Å; L7-F17 HydrophobicContact CD2-CG 4Å; K10-F17 HydrophobicContact CD-CE1 4.17Å; K10-F17 HydrophobicContact CD-CZ 4.25Å; K10-F17 HydrophobicContact CG-CD1 4.29Å; K10-F17 HydrophobicContact CG-CE1 4.31Å; N13-F17 HydrophobicContact CB-CD2 4.34Å; N13-F17 HydrophobicContact CB-CE2 4.18Å; N13-F17 VanDerWaalsContact O-CD2 3.29Å; N13-F17 WeakPolarHBondContact O-CD2 3.34Å; N13-F17 PolarHBondContact O-N 2.97Å; R14-F17 PolarHBondContact O-N 2.78Å; R15-F17 VanDerWaalsContact C-N 3.33Å; R15-F17 PolarHBondContact O-N 3.3Å; F17-R20 PolarHBondContact O-N 3.46Å; F17-L21 WeakPolarHBondContact O-CB 3.4Å; F17-L21 PolarHBondContact O-N 2.58Å; F17-L166 HydrophobicContact CD1-CD2 4.45Å; F17-L166 HydrophobicContact CE1-CD1 4.39Å; F17-L166 HydrophobicContact CE1-CD2 4.14Å; F17-T170 HydrophobicContact CB-CG2 4.36Å; F17-T170 HydrophobicContact CD1-CG2 3.68Å; F17-T170 HydrophobicContact CD2-CG2 4.23Å; F17-T170 VanDerWaalsContact CE1-CB 3.49Å; F17-T170 HydrophobicContact CE1-CG2 3.92Å; F17-T170 WeakPolarHBondContact CE1-OG1 3.45Å; F17-T170 HydrophobicContact CE2-CG2 4.45Å; F17-T170 HydrophobicContact CG-CG2 3.84Å; F17-T170 HydrophobicContact CZ-CG2 4.3Å
18	I	95.1	Very high	90.9	Very high	10 Å²	10	71 Å²	71	5%	0.051	38%	0.375	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176.1	-68	167.5	0	0	0	110.7	Y4 L7 R14 R15 L21 A22 A39 R41	Y4-I18 HydrophobicContact CD2-CD1 4.4Å; Y4-I18 HydrophobicContact CD2-CG1 4.16Å; Y4-I18 HydrophobicContact CE2-CD1 3.89Å; Y4-I18 HydrophobicContact CE2-CG1 3.78Å; Y4-I18 HydrophobicContact CE2-CG2 4.32Å; L7-I18 HydrophobicContact CD1-CG1 3.68Å; R14-I18 HydrophobicContact CG-CD1 3.85Å; R14-I18 HydrophobicContact CG-CG1 4.43Å; R14-I18 VanDerWaalsContact O-CG1 3.3Å; R14-I18 WeakPolarHBondContact O-CG1 2.9Å; R14-I18 PolarHBondContact O-N 3.15Å; R15-I18 PolarHBondContact O-N 2.86Å; I18-L21 PolarHBondContact O-N 3.49Å; I18-A22 WeakPolarHBondContact O-CB 3.44Å; I18-A22 PolarHBondContact O-N 2.98Å; I18-A39 HydrophobicContact CG2-CB 3.84Å; I18-R41 VanDerWaalsContact CD1-O 3.25Å; I18-R41 WeakPolarHBondContact CD1-O 3.46Å
19	M	94.9	Very high	91.9	Very high	102 Å²	102	66.5 Å²	66.5	50%	0.502	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-42.8	177.8	-70.3	-58.7	-60.5	0	0	111.9	R15 S16 A22 Q23	R15-M19 WeakPolarHBondContact O-CG 3.47Å; R15-M19 PolarHBondContact O-N 3.37Å; S16-M19 PolarHBondContact O-N 2.86Å; M19-A22 PolarHBondContact O-N 2.95Å; M19-Q23 PolarHBondContact O-N 2.85Å
20	R	95.5	Very high	92.6	Very high	62 Å²	62	64.9 Å²	64.9	23%	0.234	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-42.9	175.5	-175.9	56.4	175.2	-157.8	-7.5	111.7	S16 F17 A22 Q23 N24 P167 V168 T170 E197	S16-R20 WeakPolarHBondContact O-CB 3.29Å; S16-R20 PolarHBondContact O-N 3.14Å; F17-R20 PolarHBondContact O-N 3.46Å; R20-A22 VanDerWaalsContact C-N 3.32Å; R20-A22 PolarHBondContact O-N 3.42Å; R20-Q23 WeakPolarHBondContact O-CB 3.28Å; R20-Q23 PolarHBondContact O-N 3.11Å; R20-Q23 VanDerWaalsContact O-N 3.14Å; R20-N24 PolarHBondContact NE-OD1 2.99Å; R20-N24 VanDerWaalsContact O-CG 3.26Å; R20-N24 PolarHBondContact O-N 3.11Å; R20-N24 PolarHBondContact O-OD1 2.84Å; R20-P167 HydrophobicContact CG-CB 4.29Å; R20-V168 WeakPolarHBondContact CG-O 3.18Å; R20-V168 PolarHBondContact NE-O 3.18Å; R20-V168 PolarHBondContact NH2-O 2.9Å; R20-T170 HydrophobicContact CB-CG2 3.98Å; R20-T170 HydrophobicContact CG-CG2 3.95Å; R20-E197 IonicContact NH2-OE2 3Å; R20-E197 PolarHBondContact NH2-OE2 2.85Å
21	L	96.8	Very high	93.1	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-43.8	174.3	-175.9	55.4	0	0	0	111.8	Y4 F17 I18 Q23 N24 V25 M44 V63 F64 I66 P167	Y4-L21 HydrophobicContact CD1-CD2 3.41Å; Y4-L21 VanDerWaalsContact CD1-CD2 3.41Å; Y4-L21 HydrophobicContact CE1-CD2 3.85Å; Y4-L21 HydrophobicContact CG-CD2 4.27Å; F17-L21 WeakPolarHBondContact O-CB 3.4Å; F17-L21 PolarHBondContact O-N 2.58Å; I18-L21 PolarHBondContact O-N 3.49Å; L21-Q23 VanDerWaalsContact C-N 3.29Å; L21-Q23 PolarHBondContact O-N 2.87Å; L21-N24 PolarHBondContact O-N 2.88Å; L21-V25 HydrophobicContact CD1-CG2 4.26Å; L21-V25 HydrophobicContact CG-CG2 4.47Å; L21-V25 VanDerWaalsContact O-CG2 3.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.44Å; L21-V25 PolarHBondContact O-N 3.43Å; L21-M44 HydrophobicContact CG-CE 4.08Å; L21-V63 HydrophobicContact CD1-CG1 3.9Å; L21-F64 WeakPolarHBondContact CD1-O 3.45Å; L21-I66 HydrophobicContact CD1-CG1 4.05Å; L21-P167 HydrophobicContact CB-CB 4Å; L21-P167 HydrophobicContact CB-CG 3.74Å; L21-P167 HydrophobicContact CD1-CB 4.27Å; L21-P167 HydrophobicContact CD1-CG 4.24Å; L21-P167 HydrophobicContact CG-CG 4.38Å
22	A	96.5	Very high	93.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-38	176.1	0	0	0	0	0	112.3	I18 M19 R20 R26 A39 M44	I18-A22 WeakPolarHBondContact O-CB 3.44Å; I18-A22 PolarHBondContact O-N 2.98Å; M19-A22 PolarHBondContact O-N 2.95Å; R20-A22 VanDerWaalsContact C-N 3.32Å; R20-A22 PolarHBondContact O-N 3.42Å; A22-R26 VanDerWaalsContact O-CG 3.31Å; A22-R26 WeakPolarHBondContact O-CG 3.42Å; A22-R26 PolarHBondContact O-N 3.23Å; A22-A39 HydrophobicContact CB-CB 3.75Å; A22-M44 VanDerWaalsContact CA-CE 3.47Å; A22-M44 HydrophobicContact CB-CE 3.81Å
23	Q	95.9	Very high	94.1	Very high	108 Å²	108	59.2 Å²	59.2	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-47	173.2	-174.7	-179.8	16.5	0	0	111.6	M19 R20 L21 V25 R26 G27	M19-Q23 PolarHBondContact O-N 2.85Å; R20-Q23 WeakPolarHBondContact O-CB 3.28Å; R20-Q23 PolarHBondContact O-N 3.11Å; R20-Q23 VanDerWaalsContact O-N 3.14Å; L21-Q23 VanDerWaalsContact C-N 3.29Å; L21-Q23 PolarHBondContact O-N 2.87Å; Q23-V25 VanDerWaalsContact C-N 3.34Å; Q23-V25 PolarHBondContact O-N 3.34Å; Q23-R26 PolarHBondContact O-N 3.42Å; Q23-G27 PolarHBondContact O-N 3.33Å
24	N	96.8	Very high	94.5	Very high	29 Å²	29	58.6 Å²	58.6	16%	0.155	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-42	179.2	-63.1	-0.3	0	0	0	111.5	R20 L21 G27 A28 V63 V168	R20-N24 PolarHBondContact NE-OD1 2.99Å; R20-N24 VanDerWaalsContact O-CG 3.26Å; R20-N24 PolarHBondContact O-N 3.11Å; R20-N24 PolarHBondContact O-OD1 2.84Å; L21-N24 PolarHBondContact O-N 2.88Å; N24-G27 PolarHBondContact O-N 2.96Å; N24-A28 WeakPolarHBondContact O-CB 3.14Å; N24-A28 PolarHBondContact O-N 3.26Å; N24-V63 HydrophobicContact CB-CG1 4.2Å; N24-V168 PolarHBondContact ND2-N 2.7Å; N24-V168 PolarHBondContact ND2-O 3.15Å
25	V	96.9	Very high	94.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.1	-43.1	175.1	173.2	0	0	0	0	111.3	L21 Q23 G27 A28 L29 I37 M44 I46 L60 V63 I66	L21-V25 HydrophobicContact CD1-CG2 4.26Å; L21-V25 HydrophobicContact CG-CG2 4.47Å; L21-V25 VanDerWaalsContact O-CG2 3.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.44Å; L21-V25 PolarHBondContact O-N 3.43Å; Q23-V25 VanDerWaalsContact C-N 3.34Å; Q23-V25 PolarHBondContact O-N 3.34Å; V25-G27 VanDerWaalsContact C-N 3.33Å; V25-G27 PolarHBondContact O-N 3.37Å; V25-A28 PolarHBondContact O-N 2.9Å; V25-L29 HydrophobicContact CG1-CD1 3.76Å; V25-L29 HydrophobicContact CG1-CG 4.41Å; V25-L29 WeakPolarHBondContact O-CB 3.34Å; V25-L29 WeakPolarHBondContact O-CG 3.41Å; V25-L29 PolarHBondContact O-N 3.07Å; V25-I37 HydrophobicContact CG1-CD1 3.86Å; V25-I37 HydrophobicContact CG1-CG1 4.4Å; V25-I37 HydrophobicContact CG1-CG2 4.49Å; V25-M44 HydrophobicContact CB-SD 4.14Å; V25-M44 HydrophobicContact CG1-SD 4.02Å; V25-M44 HydrophobicContact CG2-CE 4.18Å; V25-M44 HydrophobicContact CG2-SD 3.95Å; V25-I46 HydrophobicContact CG1-CD1 3.78Å; V25-L60 HydrophobicContact CG1-CD1 4.04Å; V25-L60 HydrophobicContact CG2-CD1 4.25Å; V25-V63 HydrophobicContact CG2-CG1 3.96Å; V25-I66 HydrophobicContact CG2-CD1 3.93Å
26	R	95.6	Very high	95	Very high	118 Å²	118	53.7 Å²	53.7	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-42.1	174.8	-75.8	179.5	-159.6	113.1	1.4	112.2	A22 Q23 L29 A30 I37	A22-R26 VanDerWaalsContact O-CG 3.31Å; A22-R26 WeakPolarHBondContact O-CG 3.42Å; A22-R26 PolarHBondContact O-N 3.23Å; Q23-R26 PolarHBondContact O-N 3.42Å; R26-L29 CarbonylContact O-C 3.59Å; R26-L29 PolarHBondContact O-N 2.95Å; R26-A30 WeakPolarHBondContact O-CA 3.25Å; R26-A30 PolarHBondContact O-N 2.87Å; R26-I37 HydrophobicContact CB-CD1 4.27Å; R26-I37 HydrophobicContact CG-CB 4.47Å; R26-I37 HydrophobicContact CG-CD1 3.5Å
27	G	94.5	Very high	95.2	Very high	50 Å²	50	51.5 Å²	51.5	52%	0.515	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-47	177.1	0	0	0	0	0	112.3	Q23 N24 V25 L29 A30	Q23-G27 PolarHBondContact O-N 3.33Å; N24-G27 PolarHBondContact O-N 2.96Å; V25-G27 VanDerWaalsContact C-N 3.33Å; V25-G27 PolarHBondContact O-N 3.37Å; G27-L29 PolarHBondContact O-N 3.32Å; G27-A30 WeakPolarHBondContact O-CB 3.38Å; G27-A30 PolarHBondContact O-N 3.02Å
28	A	94.5	Very high	95.1	Very high	30 Å²	30	56.1 Å²	56.1	25%	0.248	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-26.6	178.8	0	0	0	0	0	113.4	N24 V25 K59 V63	N24-A28 WeakPolarHBondContact O-CB 3.14Å; N24-A28 PolarHBondContact O-N 3.26Å; V25-A28 PolarHBondContact O-N 2.9Å; A28-K59 WeakPolarHBondContact O-CD 3.41Å; A28-V63 HydrophobicContact CB-CG2 3.69Å
29	L	95	Very high	95.1	Very high	5 Å²	5	57 Å²	57	3%	0.026	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	19	-177.6	-57.3	-178.9	0	0	0	113.1	V25 R26 G27 E31 F32 L35 I46 V56 K59 L60	V25-L29 HydrophobicContact CG1-CD1 3.76Å; V25-L29 HydrophobicContact CG1-CG 4.41Å; V25-L29 WeakPolarHBondContact O-CB 3.34Å; V25-L29 WeakPolarHBondContact O-CG 3.41Å; V25-L29 PolarHBondContact O-N 3.07Å; R26-L29 CarbonylContact O-C 3.59Å; R26-L29 PolarHBondContact O-N 2.95Å; G27-L29 PolarHBondContact O-N 3.32Å; L29-E31 PolarHBondContact O-N 3.44Å; L29-E31 VanDerWaalsContact O-N 3.11Å; L29-F32 HydrophobicContact CB-CD2 4.18Å; L29-F32 HydrophobicContact CD2-CD2 4.12Å; L29-F32 HydrophobicContact CD2-CE2 4.14Å; L29-F32 PolarHBondContact O-N 2.91Å; L29-L35 HydrophobicContact CB-CD1 3.82Å; L29-L35 HydrophobicContact CD1-CD1 3.73Å; L29-L35 HydrophobicContact CG-CD1 4.28Å; L29-I46 HydrophobicContact CD1-CD1 4.07Å; L29-V56 HydrophobicContact CD1-CG1 4.07Å; L29-V56 HydrophobicContact CD2-CG1 3.94Å; L29-K59 HydrophobicContact CD2-CB 3.79Å; L29-L60 HydrophobicContact CD1-CD1 4.39Å
30	A	92.4	Very high	94.8	Very high	76 Å²	76	56.2 Å²	56.2	63%	0.628	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.7	-175.1	0	0	0	0	0	114	R26 G27 F32	R26-A30 WeakPolarHBondContact O-CA 3.25Å; R26-A30 PolarHBondContact O-N 2.87Å; G27-A30 WeakPolarHBondContact O-CB 3.38Å; G27-A30 PolarHBondContact O-N 3.02Å; A30-F32 VanDerWaalsContact C-N 3.25Å; A30-F32 PolarHBondContact O-N 3.3Å
31	E	91.8	Very high	94.4	Very high	86 Å²	86	61.8 Å²	61.8	40%	0.402	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.3	176.1	72.5	-171.8	171.3	0	0	114.1	L29 P33 K59	L29-E31 PolarHBondContact O-N 3.44Å; L29-E31 VanDerWaalsContact O-N 3.11Å; E31-P33 WeakPolarHBondContact O-CD 3.24Å; E31-K59 WeakPolarHBondContact OE1-CD 3.35Å; E31-K59 WeakPolarHBondContact OE1-CE 3.25Å; E31-K59 IonicContact OE1-NZ 2.69Å; E31-K59 PolarHBondContact OE1-NZ 3.26Å; E31-K59 IonicContact OE2-NZ 3.99Å; E31-K59 PolarHBondContact OE2-NZ 3.36Å
32	F	95.2	Very high	93.8	Very high	15 Å²	15	65.7 Å²	65.7	7%	0.066	35%	0.348	C	S	.	.			trans	-112.7	79.2	-179.5	-52.6	-72.8	0	0	0	109.6	L29 A30 D34 L35 E51 L55 V56 K59	L29-F32 HydrophobicContact CB-CD2 4.18Å; L29-F32 HydrophobicContact CD2-CD2 4.12Å; L29-F32 HydrophobicContact CD2-CE2 4.14Å; L29-F32 PolarHBondContact O-N 2.91Å; A30-F32 VanDerWaalsContact C-N 3.25Å; A30-F32 PolarHBondContact O-N 3.3Å; F32-D34 PolarHBondContact O-N 3.25Å; F32-L35 HydrophobicContact CB-CD1 3.53Å; F32-L35 HydrophobicContact CB-CD2 4.44Å; F32-L35 HydrophobicContact CB-CG 3.55Å; F32-L35 HydrophobicContact CD2-CD1 4.12Å; F32-L35 HydrophobicContact CG-CD1 4.14Å; F32-L35 WeakPolarHBondContact O-CG 3.37Å; F32-L35 PolarHBondContact O-N 3.02Å; F32-E51 VanDerWaalsContact CA-OE1 3.29Å; F32-E51 WeakPolarHBondContact CA-OE1 3.39Å; F32-E51 HydrophobicContact CB-CG 4.08Å; F32-L55 HydrophobicContact CE1-CB 3.72Å; F32-L55 HydrophobicContact CE1-CD1 4.38Å; F32-L55 HydrophobicContact CZ-CB 3.64Å; F32-V56 HydrophobicContact CD1-CG2 4.11Å; F32-V56 HydrophobicContact CD2-CG2 3.86Å; F32-V56 HydrophobicContact CE1-CG2 4.11Å; F32-V56 HydrophobicContact CE2-CB 4.47Å; F32-V56 HydrophobicContact CE2-CG2 3.85Å; F32-V56 HydrophobicContact CG-CG2 3.99Å; F32-V56 HydrophobicContact CZ-CG2 3.99Å; F32-K59 HydrophobicContact CE2-CD 4.34Å
33	P	92.5	Very high	93.5	Very high	107 Å²	107	70 Å²	70	70%	0.695	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.1	-170.8	27.7	-36.4	0	0	0	113.3	E31 L35	E31-P33 WeakPolarHBondContact O-CD 3.24Å; P33-L35 VanDerWaalsContact C-N 3.27Å; P33-L35 PolarHBondContact O-N 2.9Å
34	D	95.9	Very high	93.4	Very high	93 Å²	93	64.9 Å²	64.9	50%	0.497	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-11.7	-177.9	-68.7	-33.9	0	0	0	112.6	F32 K36 N49 E51	F32-D34 PolarHBondContact O-N 3.25Å; D34-K36 PolarHBondContact O-N 2.9Å; D34-N49 HydrophobicContact CB-CB 4.23Å; D34-N49 WeakPolarHBondContact O-CB 3.27Å; D34-N49 PolarHBondContact O-ND2 2.85Å; D34-E51 HydrophobicContact CB-CG 3.95Å
35	L	96.2	Very high	93.3	Very high	20 Å²	20	65.2 Å²	65.2	11%	0.105	34%	0.341	C	S	.	.			trans	-64.7	133.5	178.7	-62.3	-175.1	0	0	0	112.6	L29 F32 P33 I46 L47 L48 E51 V56	L29-L35 HydrophobicContact CB-CD1 3.82Å; L29-L35 HydrophobicContact CD1-CD1 3.73Å; L29-L35 HydrophobicContact CG-CD1 4.28Å; F32-L35 HydrophobicContact CB-CD1 3.53Å; F32-L35 HydrophobicContact CB-CD2 4.44Å; F32-L35 HydrophobicContact CB-CG 3.55Å; F32-L35 HydrophobicContact CD2-CD1 4.12Å; F32-L35 HydrophobicContact CG-CD1 4.14Å; F32-L35 WeakPolarHBondContact O-CG 3.37Å; F32-L35 PolarHBondContact O-N 3.02Å; P33-L35 VanDerWaalsContact C-N 3.27Å; P33-L35 PolarHBondContact O-N 2.9Å; L35-I46 HydrophobicContact CB-CG2 4.42Å; L35-I46 HydrophobicContact CD1-CG2 4.22Å; L35-I46 HydrophobicContact CD2-CG2 4.25Å; L35-L47 WeakPolarHBondContact CA-O 3.37Å; L35-L48 HydrophobicContact CD2-CB 4.38Å; L35-L48 HydrophobicContact CD2-CD2 3.71Å; L35-E51 HydrophobicContact CD2-CB 3.86Å; L35-E51 HydrophobicContact CD2-CG 3.9Å; L35-E51 HydrophobicContact CG-CG 4.26Å; L35-V56 HydrophobicContact CD1-CG1 4.28Å; L35-V56 HydrophobicContact CD1-CG2 4.2Å; L35-V56 HydrophobicContact CD2-CG2 4.43Å
36	K	95.9	Very high	93.2	Very high	125 Å²	125	66.6 Å²	66.6	54%	0.543	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.7	169.2	-68.1	174.1	-173.3	172.1	0	110.8	D34 I46 L47 N49	D34-K36 PolarHBondContact O-N 2.9Å; K36-I46 WeakPolarHBondContact O-CA 3.11Å; K36-L47 HydrophobicContact CB-CB 4.18Å; K36-L47 HydrophobicContact CB-CD1 4.25Å; K36-L47 PolarHBondContact N-O 3.03Å; K36-L47 PolarHBondContact O-N 2.94Å; K36-N49 WeakPolarHBondContact CD-ND2 3.34Å; K36-N49 WeakPolarHBondContact CG-ND2 3.42Å
37	I	96.1	Very high	93.2	Very high	23 Å²	23	64.8 Å²	64.8	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.1	-177.6	-62.3	159.3	0	0	0	110.2	V25 R26 M44 H45 I46	V25-I37 HydrophobicContact CG1-CD1 3.86Å; V25-I37 HydrophobicContact CG1-CG1 4.4Å; V25-I37 HydrophobicContact CG1-CG2 4.49Å; R26-I37 HydrophobicContact CB-CD1 4.27Å; R26-I37 HydrophobicContact CG-CB 4.47Å; R26-I37 HydrophobicContact CG-CD1 3.5Å; I37-M44 HydrophobicContact CG2-CE 4.45Å; I37-M44 HydrophobicContact CG2-CG 3.94Å; I37-M44 HydrophobicContact CG2-SD 3.68Å; I37-H45 WeakPolarHBondContact CA-O 3.4Å; I37-I46 HydrophobicContact CG1-CG1 4.23Å; I37-I46 HydrophobicContact CG1-CG2 4.16Å
38	H	94.1	Very high	93.2	Very high	119 Å²	119	65.3 Å²	65.3	55%	0.551	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.6	174.4	-94.2	-97.4	0	0	0	110.5	M44 H45	H38-M44 CarbonylContact O-C 3.58Å; H38-M44 VanDerWaalsContact O-CA 3.27Å; H38-M44 WeakPolarHBondContact O-CA 3.43Å; H38-M44 WeakPolarHBondContact O-CG 3.39Å; H38-H45 HydrophobicContact CB-CB 4.49Å; H38-H45 PolarHBondContact N-O 3.34Å; H38-H45 PolarHBondContact O-N 2.68Å
39	A	93.5	Very high	93.2	Very high	30 Å²	30	67.6 Å²	67.6	25%	0.248	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	105.5	-179.6	0	0	0	0	0	110.7	I18 A22 M44	I18-A39 HydrophobicContact CG2-CB 3.84Å; A22-A39 HydrophobicContact CB-CB 3.75Å; A39-M44 HydrophobicContact CB-CB 4.38Å; A39-M44 HydrophobicContact CB-CE 3.95Å; A39-M44 HydrophobicContact CB-CG 4.28Å
40	D	89.6	Confident	93.1	Very high	84 Å²	84	71.2 Å²	71.2	45%	0.449	38%	0.384	S	S	.	.			trans	-94.5	174	175.4	-59.9	-52.5	0	0	0	111.1	Y4 D42 R43 H45	Y4-D40 VanDerWaalsContact CE2-O 3.29Å; Y4-D40 WeakPolarHBondContact CE2-O 3.31Å; Y4-D40 PolarHBondContact OH-O 2.95Å; D40-D42 VanDerWaalsContact C-N 3.26Å; D40-D42 PolarHBondContact O-N 3.26Å; D40-R43 CarbonylContact C-O 3.58Å; D40-R43 WeakPolarHBondContact CA-O 3.33Å; D40-R43 WeakPolarHBondContact CB-O 3.31Å; D40-R43 PolarHBondContact N-O 2.94Å; D40-H45 IonicContact OD2-CE1 3.57Å; D40-H45 IonicContact OD2-ND1 3.78Å
41	R	86.5	Confident	93.2	Very high	180 Å²	180	69.6 Å²	69.6	68%	0.679	36%	0.363	S	S	*	.	S	Bend	trans	-53.3	-42.5	-179.7	-174.7	-178.1	-179.8	-147.6	2.3	112.8	R14 I18	R14-R41 PolarHBondContact NE-O 3Å; R14-R41 PolarHBondContact NH2-O 3.26Å; I18-R41 VanDerWaalsContact CD1-O 3.25Å; I18-R41 WeakPolarHBondContact CD1-O 3.46Å
42	D	85.5	Confident	93.2	Very high	81 Å²	81	67.8 Å²	67.8	43%	0.433	36%	0.357	S	S	.	.	S	Bend	trans	-104.7	-28.3	-170.5	-64.5	-51.2	0	0	0	114.1	R14 D40	R14-D42 IonicContact CZ-OD1 3.9Å; R14-D42 IonicContact NH1-OD1 2.81Å; R14-D42 IonicContact NH2-OD1 3.51Å; R14-D42 PolarHBondContact NH2-OD1 2.76Å; D40-D42 VanDerWaalsContact C-N 3.26Å; D40-D42 PolarHBondContact O-N 3.26Å
43	R	89	Confident	93.1	Very high	92 Å²	92	69.1 Å²	69.1	35%	0.347	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	155	-174.6	-59.3	-65.8	175.6	-114.3	4	110.2	M1 V2 Y4 D40	M1-R43 HydrophobicContact CG-CB 4.21Å; M1-R43 HydrophobicContact CG-CG 4.39Å; M1-R43 HydrophobicContact SD-CB 4.27Å; M1-R43 HydrophobicContact SD-CG 3.91Å; V2-R43 WeakPolarHBondContact O-CA 3.47Å; Y4-R43 VanDerWaalsContact CZ-C 3.49Å; Y4-R43 PolarHBondContact OH-O 3.42Å; D40-R43 CarbonylContact C-O 3.58Å; D40-R43 WeakPolarHBondContact CA-O 3.33Å; D40-R43 WeakPolarHBondContact CB-O 3.31Å; D40-R43 PolarHBondContact N-O 2.94Å
44	M	94	Very high	93.1	Very high	0 Å²	0	73 Å²	73	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.8	167	171.5	-166.6	-59.4	0	0	109.4	V2 Y4 L21 A22 V25 I37 H38 A39 I46	V2-M44 HydrophobicContact CB-CB 4.03Å; V2-M44 HydrophobicContact CG1-CB 4.47Å; V2-M44 PolarHBondContact N-O 2.84Å; V2-M44 PolarHBondContact O-N 3.02Å; V2-M44 VanDerWaalsContact O-N 3.09Å; Y4-M44 HydrophobicContact CE1-CB 3.63Å; Y4-M44 HydrophobicContact CE1-CE 4.27Å; Y4-M44 WeakPolarHBondContact OH-CB 3.36Å; Y4-M44 PolarHBondContact OH-N 2.76Å; L21-M44 HydrophobicContact CG-CE 4.08Å; A22-M44 VanDerWaalsContact CA-CE 3.47Å; A22-M44 HydrophobicContact CB-CE 3.81Å; V25-M44 HydrophobicContact CB-SD 4.14Å; V25-M44 HydrophobicContact CG1-SD 4.02Å; V25-M44 HydrophobicContact CG2-CE 4.18Å; V25-M44 HydrophobicContact CG2-SD 3.95Å; I37-M44 HydrophobicContact CG2-CE 4.45Å; I37-M44 HydrophobicContact CG2-CG 3.94Å; I37-M44 HydrophobicContact CG2-SD 3.68Å; H38-M44 CarbonylContact O-C 3.58Å; H38-M44 VanDerWaalsContact O-CA 3.27Å; H38-M44 WeakPolarHBondContact O-CA 3.43Å; H38-M44 WeakPolarHBondContact O-CG 3.39Å; A39-M44 HydrophobicContact CB-CB 4.38Å; A39-M44 HydrophobicContact CB-CE 3.95Å; A39-M44 HydrophobicContact CB-CG 4.28Å; M44-I46 HydrophobicContact CG-CG1 4.4Å; M44-I46 HydrophobicContact SD-CG1 4.41Å
45	H	93.8	Very high	93	Very high	36 Å²	36	73.4 Å²	73.4	17%	0.167	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.9	175.7	-59.9	100.7	0	0	0	108.5	I37 H38 D40 R149	I37-H45 WeakPolarHBondContact CA-O 3.4Å; H38-H45 HydrophobicContact CB-CB 4.49Å; H38-H45 PolarHBondContact N-O 3.34Å; H38-H45 PolarHBondContact O-N 2.68Å; D40-H45 IonicContact OD2-CE1 3.57Å; D40-H45 IonicContact OD2-ND1 3.78Å; H45-R149 PolarHBondContact CE1-NH1 3.28Å; H45-R149 VanDerWaalsContact CE1-NH1 3.34Å; H45-R149 PolarHBondContact NE2-NH1 2.9Å
46	I	96.1	Very high	92.9	Very high	28 Å²	28	72.6 Å²	72.6	14%	0.144	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.7	175	-52.8	179.7	0	0	0	104.6	V2 V25 L29 L35 K36 I37 M44 L60	V2-I46 HydrophobicContact CG2-CD1 3.82Å; V2-I46 HydrophobicContact CG2-CG1 4.23Å; V25-I46 HydrophobicContact CG1-CD1 3.78Å; L29-I46 HydrophobicContact CD1-CD1 4.07Å; L35-I46 HydrophobicContact CB-CG2 4.42Å; L35-I46 HydrophobicContact CD1-CG2 4.22Å; L35-I46 HydrophobicContact CD2-CG2 4.25Å; K36-I46 WeakPolarHBondContact O-CA 3.11Å; I37-I46 HydrophobicContact CG1-CG1 4.23Å; I37-I46 HydrophobicContact CG1-CG2 4.16Å; M44-I46 HydrophobicContact CG-CG1 4.4Å; M44-I46 HydrophobicContact SD-CG1 4.41Å; I46-L60 HydrophobicContact CD1-CD1 3.79Å; I46-L60 HydrophobicContact CD1-CD2 3.98Å
47	L	95.2	Very high	92.9	Very high	80 Å²	80	68.2 Å²	68.2	42%	0.419	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.9	174.2	-59.7	172.7	0	0	0	107.9	L35 K36	L35-L47 WeakPolarHBondContact CA-O 3.37Å; K36-L47 HydrophobicContact CB-CB 4.18Å; K36-L47 HydrophobicContact CB-CD1 4.25Å; K36-L47 PolarHBondContact N-O 3.03Å; K36-L47 PolarHBondContact O-N 2.94Å
48	L	95.1	Very high	92.9	Very high	61 Å²	61	70.2 Å²	70.2	32%	0.319	36%	0.363	S	S	.	.			trans	-73.1	-32.2	-175.6	-65.1	176.1	0	0	0	113.3	L35 G50 E51 V56	L35-L48 HydrophobicContact CD2-CB 4.38Å; L35-L48 HydrophobicContact CD2-CD2 3.71Å; L48-G50 PolarHBondContact O-N 2.89Å; L48-G50 VanDerWaalsContact O-N 3.1Å; L48-E51 VanDerWaalsContact O-CB 3.28Å; L48-E51 WeakPolarHBondContact O-CB 3.12Å; L48-E51 VanDerWaalsContact O-CG 3.27Å; L48-E51 WeakPolarHBondContact O-CG 3.47Å; L48-E51 PolarHBondContact O-N 2.79Å; L48-V56 HydrophobicContact CD2-CB 4.36Å; L48-V56 HydrophobicContact CD2-CG1 4.28Å; L48-V56 HydrophobicContact CD2-CG2 4.11Å
49	N	94.3	Very high	92.9	Very high	79 Å²	79	67.2 Å²	67.2	42%	0.422	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	35.9	-179.1	-60.5	-30.4	0	0	0	114.7	D34 K36	D34-N49 HydrophobicContact CB-CB 4.23Å; D34-N49 WeakPolarHBondContact O-CB 3.27Å; D34-N49 PolarHBondContact O-ND2 2.85Å; K36-N49 WeakPolarHBondContact CD-ND2 3.34Å; K36-N49 WeakPolarHBondContact CG-ND2 3.42Å
50	G	92.6	Very high	93	Very high	81 Å²	81	66.1 Å²	66.1	84%	0.835	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.2	-14.6	179.7	0	0	0	0	0	114.3	L48	L48-G50 PolarHBondContact O-N 2.89Å; L48-G50 VanDerWaalsContact O-N 3.1Å
51	E	93.9	Very high	93.3	Very high	41 Å²	41	66.2 Å²	66.2	19%	0.192	34%	0.336	C	S	.	.			trans	-64.4	141.5	175.8	-64	-75.2	-164	0	0	111.8	F32 D34 L35 L48 S53	F32-E51 VanDerWaalsContact CA-OE1 3.29Å; F32-E51 WeakPolarHBondContact CA-OE1 3.39Å; F32-E51 HydrophobicContact CB-CG 4.08Å; D34-E51 HydrophobicContact CB-CG 3.95Å; L35-E51 HydrophobicContact CD2-CB 3.86Å; L35-E51 HydrophobicContact CD2-CG 3.9Å; L35-E51 HydrophobicContact CG-CG 4.26Å; L48-E51 VanDerWaalsContact O-CB 3.28Å; L48-E51 WeakPolarHBondContact O-CB 3.12Å; L48-E51 VanDerWaalsContact O-CG 3.27Å; L48-E51 WeakPolarHBondContact O-CG 3.47Å; L48-E51 PolarHBondContact O-N 2.79Å; E51-S53 PolarHBondContact O-N 2.92Å; E51-S53 VanDerWaalsContact O-N 3.17Å
52	D	92.7	Very high	93.8	Very high	49 Å²	49	61.6 Å²	61.6	26%	0.262	32%	0.321	S	S	.	.			trans	-70.8	112.5	179.7	-172.1	-10.5	0	0	0	110.7	R54 L55 V56	D52-R54 PolarHBondContact O-N 3.05Å; D52-R54 VanDerWaalsContact O-N 3.11Å; D52-R54 VanDerWaalsContact OD1-CB 3.3Å; D52-R54 WeakPolarHBondContact OD1-CB 3.33Å; D52-R54 WeakPolarHBondContact OD1-CG 3.45Å; D52-R54 IonicContact OD1-CZ 3.33Å; D52-R54 PolarHBondContact OD1-N 2.96Å; D52-R54 IonicContact OD1-NE 3.63Å; D52-R54 PolarHBondContact OD1-NE 2.91Å; D52-R54 VanDerWaalsContact OD1-NE 3.09Å; D52-R54 IonicContact OD2-CZ 3.64Å; D52-R54 IonicContact OD2-NE 3.03Å; D52-R54 PolarHBondContact OD2-NE 3.02Å; D52-R54 IonicContact OD2-NH2 2.9Å; D52-R54 PolarHBondContact OD2-NH2 2.72Å; D52-L55 HydrophobicContact CB-CD1 4.26Å; D52-L55 HydrophobicContact CB-CG 4.24Å; D52-L55 PolarHBondContact O-N 3.23Å; D52-L55 VanDerWaalsContact O-N 3.08Å; D52-V56 PolarHBondContact O-N 2.72Å
53	S	91.9	Very high	94.4	Very high	42 Å²	42	57.9 Å²	57.9	29%	0.294	30%	0.301	S	S	.	.	H	α-helix	trans	-52.5	-33.8	175.2	62.8	0	0	0	0	113.2	E51 L55 V56 L57	E51-S53 PolarHBondContact O-N 2.92Å; E51-S53 VanDerWaalsContact O-N 3.17Å; S53-L55 PolarHBondContact O-N 2.81Å; S53-V56 PolarHBondContact O-N 3.32Å; S53-V56 VanDerWaalsContact O-N 3.08Å; S53-L57 WeakPolarHBondContact O-CG 3.46Å; S53-L57 PolarHBondContact O-N 3.34Å
54	R	92.3	Very high	94.8	Very high	188 Å²	188	53.6 Å²	53.6	71%	0.709	29%	0.285	S	S	*	.	H	α-helix	trans	-63.2	-27.1	-177.5	-60.9	173.6	-64.2	178.6	4.1	112.4	D52 P58	D52-R54 PolarHBondContact O-N 3.05Å; D52-R54 VanDerWaalsContact O-N 3.11Å; D52-R54 VanDerWaalsContact OD1-CB 3.3Å; D52-R54 WeakPolarHBondContact OD1-CB 3.33Å; D52-R54 WeakPolarHBondContact OD1-CG 3.45Å; D52-R54 IonicContact OD1-CZ 3.33Å; D52-R54 PolarHBondContact OD1-N 2.96Å; D52-R54 IonicContact OD1-NE 3.63Å; D52-R54 PolarHBondContact OD1-NE 2.91Å; D52-R54 VanDerWaalsContact OD1-NE 3.09Å; D52-R54 IonicContact OD2-CZ 3.64Å; D52-R54 IonicContact OD2-NE 3.03Å; D52-R54 PolarHBondContact OD2-NE 3.02Å; D52-R54 IonicContact OD2-NH2 2.9Å; D52-R54 PolarHBondContact OD2-NH2 2.72Å; R54-P58 WeakPolarHBondContact O-CD 3.41Å; R54-P58 WeakPolarHBondContact O-CG 3.36Å
55	L	94.2	Very high	94.9	Very high	102 Å²	102	53.6 Å²	53.6	53%	0.534	29%	0.285	S	S	.	.	H	α-helix	trans	-86.7	-32.9	175.6	-57.4	179.7	0	0	0	112	F32 D52 S53	F32-L55 HydrophobicContact CE1-CB 3.72Å; F32-L55 HydrophobicContact CE1-CD1 4.38Å; F32-L55 HydrophobicContact CZ-CB 3.64Å; D52-L55 HydrophobicContact CB-CD1 4.26Å; D52-L55 HydrophobicContact CB-CG 4.24Å; D52-L55 PolarHBondContact O-N 3.23Å; D52-L55 VanDerWaalsContact O-N 3.08Å; S53-L55 PolarHBondContact O-N 2.81Å
56	V	95.5	Very high	95	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-75	-42.6	-178.7	175.9	0	0	0	0	112.5	L29 F32 L35 L48 D52 S53 K59 L60	L29-V56 HydrophobicContact CD1-CG1 4.07Å; L29-V56 HydrophobicContact CD2-CG1 3.94Å; F32-V56 HydrophobicContact CD1-CG2 4.11Å; F32-V56 HydrophobicContact CD2-CG2 3.86Å; F32-V56 HydrophobicContact CE1-CG2 4.11Å; F32-V56 HydrophobicContact CE2-CB 4.47Å; F32-V56 HydrophobicContact CE2-CG2 3.85Å; F32-V56 HydrophobicContact CG-CG2 3.99Å; F32-V56 HydrophobicContact CZ-CG2 3.99Å; L35-V56 HydrophobicContact CD1-CG1 4.28Å; L35-V56 HydrophobicContact CD1-CG2 4.2Å; L35-V56 HydrophobicContact CD2-CG2 4.43Å; L48-V56 HydrophobicContact CD2-CB 4.36Å; L48-V56 HydrophobicContact CD2-CG1 4.28Å; L48-V56 HydrophobicContact CD2-CG2 4.11Å; D52-V56 PolarHBondContact O-N 2.72Å; S53-V56 PolarHBondContact O-N 3.32Å; S53-V56 VanDerWaalsContact O-N 3.08Å; V56-K59 PolarHBondContact O-N 2.74Å; V56-L60 PolarHBondContact O-N 3.43Å; V56-L60 VanDerWaalsContact O-N 3.13Å
57	L	95.3	Very high	95	Very high	32 Å²	32	56 Å²	56	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-47.4	-171.7	-62.5	168	0	0	0	112.6	S53 K59 L60 E61 F69 P71 I160	S53-L57 WeakPolarHBondContact O-CG 3.46Å; S53-L57 PolarHBondContact O-N 3.34Å; L57-K59 VanDerWaalsContact C-N 3.28Å; L57-K59 PolarHBondContact O-N 3.4Å; L57-L60 WeakPolarHBondContact O-CB 3.29Å; L57-L60 PolarHBondContact O-N 3.1Å; L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 3.21Å; L57-F69 HydrophobicContact CB-CE2 4.22Å; L57-F69 HydrophobicContact CD2-CD2 3.82Å; L57-F69 HydrophobicContact CD2-CE2 3.45Å; L57-F69 VanDerWaalsContact CD2-CE2 3.45Å; L57-F69 HydrophobicContact CG-CE2 4.37Å; L57-P71 HydrophobicContact CD1-CG 3.99Å; L57-P71 HydrophobicContact CD2-CG 3.9Å; L57-I160 HydrophobicContact CD1-CD1 4.01Å; L57-I160 HydrophobicContact CD2-CD1 4.2Å; L57-I160 HydrophobicContact CG-CD1 4.47Å
58	P	94.9	Very high	95.1	Very high	66 Å²	66	53.3 Å²	53.3	43%	0.429	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-33.8	179.6	-25.3	35.7	0	0	0	113.9	R54	R54-P58 WeakPolarHBondContact O-CD 3.41Å; R54-P58 WeakPolarHBondContact O-CG 3.36Å
59	K	95.4	Very high	95.1	Very high	55 Å²	55	50.5 Å²	50.5	24%	0.239	27%	0.268	C	S	.	.	H	α-helix	trans	-70.3	-39.6	175.2	-63.4	-153.6	170.6	-168	0	111.5	A28 L29 E31 F32 V56 L57 E61 K62	A28-K59 WeakPolarHBondContact O-CD 3.41Å; L29-K59 HydrophobicContact CD2-CB 3.79Å; E31-K59 WeakPolarHBondContact OE1-CD 3.35Å; E31-K59 WeakPolarHBondContact OE1-CE 3.25Å; E31-K59 IonicContact OE1-NZ 2.69Å; E31-K59 PolarHBondContact OE1-NZ 3.26Å; E31-K59 IonicContact OE2-NZ 3.99Å; E31-K59 PolarHBondContact OE2-NZ 3.36Å; F32-K59 HydrophobicContact CE2-CD 4.34Å; V56-K59 PolarHBondContact O-N 2.74Å; L57-K59 VanDerWaalsContact C-N 3.28Å; L57-K59 PolarHBondContact O-N 3.4Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 3.04Å; K59-K62 PolarHBondContact O-N 3.44Å
60	L	95.7	Very high	95.2	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-31.8	177.9	-163.3	64.8	0	0	0	112.7	V2 V25 L29 I46 V56 L57 K62 V63 I66 F69	V2-L60 HydrophobicContact CG2-CD1 4.49Å; V2-L60 HydrophobicContact CG2-CD2 3.93Å; V25-L60 HydrophobicContact CG1-CD1 4.04Å; V25-L60 HydrophobicContact CG2-CD1 4.25Å; L29-L60 HydrophobicContact CD1-CD1 4.39Å; I46-L60 HydrophobicContact CD1-CD1 3.79Å; I46-L60 HydrophobicContact CD1-CD2 3.98Å; V56-L60 PolarHBondContact O-N 3.43Å; V56-L60 VanDerWaalsContact O-N 3.13Å; L57-L60 WeakPolarHBondContact O-CB 3.29Å; L57-L60 PolarHBondContact O-N 3.1Å; L60-K62 PolarHBondContact O-N 2.98Å; L60-V63 PolarHBondContact O-N 2.73Å; L60-I66 HydrophobicContact CD1-CD1 3.3Å; L60-I66 HydrophobicContact CG-CD1 3.74Å; L60-F69 HydrophobicContact CB-CE1 4.37Å; L60-F69 HydrophobicContact CB-CE2 4.48Å; L60-F69 HydrophobicContact CB-CZ 4.18Å; L60-F69 HydrophobicContact CD2-CB 4.19Å; L60-F69 HydrophobicContact CD2-CD1 4.07Å; L60-F69 HydrophobicContact CD2-CD2 3.72Å; L60-F69 HydrophobicContact CD2-CE1 4.36Å; L60-F69 HydrophobicContact CD2-CE2 4.02Å; L60-F69 HydrophobicContact CD2-CG 3.72Å; L60-F69 HydrophobicContact CD2-CZ 4.32Å; L60-F69 HydrophobicContact CG-CD1 4.18Å; L60-F69 HydrophobicContact CG-CE1 4.2Å; L60-F69 HydrophobicContact CG-CG 4.34Å; L60-F69 HydrophobicContact CG-CZ 4.37Å
61	E	96.2	Very high	95.3	Very high	87 Å²	87	45 Å²	45	41%	0.407	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-34.1	175.2	-68.9	-175.4	-174	0	0	113	L57 K59 F69 I160 G162 A163	L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 3.21Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 3.04Å; E61-F69 HydrophobicContact CB-CZ 4.49Å; E61-F69 HydrophobicContact CG-CE1 3.97Å; E61-F69 HydrophobicContact CG-CZ 3.51Å; E61-I160 HydrophobicContact CG-CG2 3.91Å; E61-I160 VanDerWaalsContact OE1-CG2 3.23Å; E61-I160 WeakPolarHBondContact OE1-CG2 3.47Å; E61-G162 CarbonylContact O-C 3.59Å; E61-A163 WeakPolarHBondContact O-CB 3.49Å; E61-A163 PolarHBondContact O-N 2.83Å
62	K	96.6	Very high	95.3	Very high	82 Å²	82	45.4 Å²	45.4	36%	0.357	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-11	-176.2	-61.5	-173.8	-177.1	-175.8	0	113.7	K59 L60 F64 P226 Y227	K59-K62 PolarHBondContact O-N 3.44Å; L60-K62 PolarHBondContact O-N 2.98Å; K62-F64 PolarHBondContact O-N 3.21Å; K62-P226 HydrophobicContact CD-CB 3.7Å; K62-Y227 HydrophobicContact CB-CD1 3.84Å; K62-Y227 HydrophobicContact CB-CE1 3.93Å; K62-Y227 HydrophobicContact CD-CE1 4.37Å; K62-Y227 HydrophobicContact CG-CD1 4.41Å; K62-Y227 HydrophobicContact CG-CE1 4Å; K62-Y227 VanDerWaalsContact O-CD1 3.27Å; K62-Y227 WeakPolarHBondContact O-CD1 3.27Å
63	V	97.2	Very high	95.4	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.024	23%	0.234	C	C	.	.			trans	-78.2	112.3	-176.3	-176.4	0	0	0	0	111.5	L21 N24 V25 A28 L60 I66	L21-V63 HydrophobicContact CD1-CG1 3.9Å; N24-V63 HydrophobicContact CB-CG1 4.2Å; V25-V63 HydrophobicContact CG2-CG1 3.96Å; A28-V63 HydrophobicContact CB-CG2 3.69Å; L60-V63 PolarHBondContact O-N 2.73Å; V63-I66 HydrophobicContact CB-CD1 3.84Å; V63-I66 HydrophobicContact CB-CG1 4.24Å; V63-I66 HydrophobicContact CG1-CD1 4.14Å; V63-I66 HydrophobicContact CG1-CG1 4.27Å; V63-I66 PolarHBondContact O-N 3.45Å
64	F	97.4	Very high	95.5	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	142.3	171.5	-66.2	-60.8	0	0	0	112.1	L21 K62 A163 G164 L166 P167 V168 Y189 M192 K193 Y227	L21-F64 WeakPolarHBondContact CD1-O 3.45Å; K62-F64 PolarHBondContact O-N 3.21Å; F64-A163 HydrophobicContact CD1-CB 3.48Å; F64-A163 VanDerWaalsContact CD1-CB 3.48Å; F64-A163 HydrophobicContact CE1-CB 3.76Å; F64-A163 HydrophobicContact CG-CB 4.26Å; F64-G164 CarbonylContact C-O 3.52Å; F64-G164 WeakPolarHBondContact CA-O 3.33Å; F64-L166 WeakPolarHBondContact CB-O 3.28Å; F64-P167 WeakPolarHBondContact O-CA 3.27Å; F64-V168 HydrophobicContact CB-CG2 4.09Å; F64-V168 HydrophobicContact CD2-CG2 3.73Å; F64-V168 HydrophobicContact CG-CG2 4.38Å; F64-Y189 HydrophobicContact CE1-CE2 4.04Å; F64-Y189 HydrophobicContact CE2-CD2 4.38Å; F64-Y189 HydrophobicContact CE2-CE2 4.36Å; F64-Y189 AromaticContact CZ-CD2 3.71Å; F64-Y189 HydrophobicContact CZ-CD2 3.71Å; F64-Y189 HydrophobicContact CZ-CE1 4.46Å; F64-Y189 AromaticContact CZ-CE2 3.4Å; F64-Y189 HydrophobicContact CZ-CE2 3.4Å; F64-Y189 HydrophobicContact CZ-CG 4.37Å; F64-Y189 AromaticContact CZ-CZ 3.83Å; F64-M192 HydrophobicContact CD2-CB 4.03Å; F64-M192 HydrophobicContact CE2-CB 3.62Å; F64-K193 HydrophobicContact CD1-CB 3.86Å; F64-K193 HydrophobicContact CD1-CG 3.84Å; F64-K193 HydrophobicContact CE1-CB 3.4Å; F64-K193 HydrophobicContact CE1-CD 4.19Å; F64-K193 HydrophobicContact CE1-CG 3.57Å; F64-K193 HydrophobicContact CE2-CB 4.37Å; F64-K193 HydrophobicContact CZ-CB 3.67Å; F64-K193 HydrophobicContact CZ-CG 4.34Å; F64-Y227 HydrophobicContact CE2-CD1 4.13Å; F64-Y227 HydrophobicContact CE2-CG 4.26Å; F64-Y227 HydrophobicContact CZ-CD1 4.2Å
65	G	96.1	Very high	95.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-12.2	-170.7	0	0	0	0	0	114	G5 G164 G165	G5-G65 PolarHBondContact N-O 3.44Å; G65-G164 PolarHBondContact N-O 2.96Å; G65-G165 WeakPolarHBondContact CA-O 3.43Å
66	I	96.9	Very high	95.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.1	172.1	-58.3	-173.9	0	0	0	109.7	V2 L21 V25 L60 V63 F69 G162 G164	V2-I66 HydrophobicContact CG1-CB 4.33Å; V2-I66 HydrophobicContact CG1-CD1 3.85Å; V2-I66 HydrophobicContact CG1-CG1 3.83Å; V2-I66 HydrophobicContact CG1-CG2 3.79Å; L21-I66 HydrophobicContact CD1-CG1 4.05Å; V25-I66 HydrophobicContact CG2-CD1 3.93Å; L60-I66 HydrophobicContact CD1-CD1 3.3Å; L60-I66 HydrophobicContact CG-CD1 3.74Å; V63-I66 HydrophobicContact CB-CD1 3.84Å; V63-I66 HydrophobicContact CB-CG1 4.24Å; V63-I66 HydrophobicContact CG1-CD1 4.14Å; V63-I66 HydrophobicContact CG1-CG1 4.27Å; V63-I66 PolarHBondContact O-N 3.45Å; I66-F69 HydrophobicContact CG2-CD1 3.75Å; I66-F69 HydrophobicContact CG2-CE1 4.5Å; I66-G162 CarbonylContact O-C 3.54Å; I66-G162 WeakPolarHBondContact O-CA 3.35Å; I66-G164 VanDerWaalsContact O-CA 3.27Å; I66-G164 WeakPolarHBondContact O-CA 3.36Å; I66-G164 PolarHBondContact O-N 2.93Å
67	Q	96.3	Very high	95.6	Very high	114 Å²	114	44.1 Å²	44.1	53%	0.533	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-52.4	175.6	-171.3	-178	28.9	0	0	111.1	R3 G162	R3-Q67 PolarHBondContact O-N 2.56Å; Q67-G162 PolarHBondContact O-N 3.26Å
68	T	96.6	Very high	95.6	Very high	24 Å²	24	45.2 Å²	45.2	15%	0.147	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	161.3	177.1	58.6	0	0	0	0	109.4	R3 T159 I160	R3-T68 WeakPolarHBondContact CA-O 3.46Å; R3-T68 WeakPolarHBondContact CB-O 3.32Å; R3-T68 WeakPolarHBondContact CD-OG1 3.42Å; R3-T68 PolarHBondContact N-O 2.87Å; R3-T68 PolarHBondContact NH1-OG1 3.34Å; R3-T68 PolarHBondContact O-N 3.3Å; T68-T159 HydrophobicContact CG2-CG2 3.88Å; T68-I160 CarbonylContact C-O 3.55Å; T68-I160 WeakPolarHBondContact CA-O 3.23Å; T68-I160 VanDerWaalsContact CB-O 3.28Å; T68-I160 WeakPolarHBondContact CB-O 3.47Å
69	F	96.3	Very high	95.6	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	159.4	167.7	53.8	-83.9	0	0	0	109.7	M1 V2 L57 L60 E61 I66 T159 I160	M1-F69 CarbonylContact O-C 3.47Å; M1-F69 WeakPolarHBondContact O-CA 3.44Å; M1-F69 WeakPolarHBondContact O-CB 3.48Å; V2-F69 HydrophobicContact CB-CB 4.43Å; V2-F69 HydrophobicContact CG2-CB 3.99Å; L57-F69 HydrophobicContact CB-CE2 4.22Å; L57-F69 HydrophobicContact CD2-CD2 3.82Å; L57-F69 HydrophobicContact CD2-CE2 3.45Å; L57-F69 VanDerWaalsContact CD2-CE2 3.45Å; L57-F69 HydrophobicContact CG-CE2 4.37Å; L60-F69 HydrophobicContact CB-CE1 4.37Å; L60-F69 HydrophobicContact CB-CE2 4.48Å; L60-F69 HydrophobicContact CB-CZ 4.18Å; L60-F69 HydrophobicContact CD2-CB 4.19Å; L60-F69 HydrophobicContact CD2-CD1 4.07Å; L60-F69 HydrophobicContact CD2-CD2 3.72Å; L60-F69 HydrophobicContact CD2-CE1 4.36Å; L60-F69 HydrophobicContact CD2-CE2 4.02Å; L60-F69 HydrophobicContact CD2-CG 3.72Å; L60-F69 HydrophobicContact CD2-CZ 4.32Å; L60-F69 HydrophobicContact CG-CD1 4.18Å; L60-F69 HydrophobicContact CG-CE1 4.2Å; L60-F69 HydrophobicContact CG-CG 4.34Å; L60-F69 HydrophobicContact CG-CZ 4.37Å; E61-F69 HydrophobicContact CB-CZ 4.49Å; E61-F69 HydrophobicContact CG-CE1 3.97Å; E61-F69 HydrophobicContact CG-CZ 3.51Å; I66-F69 HydrophobicContact CG2-CD1 3.75Å; I66-F69 HydrophobicContact CG2-CE1 4.5Å; F69-T159 CarbonylContact O-C 3.51Å; F69-T159 WeakPolarHBondContact O-CA 3.41Å; F69-I160 HydrophobicContact CD2-CB 4.07Å; F69-I160 HydrophobicContact CD2-CD1 4.27Å; F69-I160 HydrophobicContact CE1-CB 4.2Å; F69-I160 HydrophobicContact CE1-CG2 3.89Å; F69-I160 HydrophobicContact CE2-CB 3.64Å; F69-I160 HydrophobicContact CE2-CD1 3.65Å; F69-I160 HydrophobicContact CE2-CG1 4.23Å; F69-I160 HydrophobicContact CE2-CG2 3.76Å; F69-I160 HydrophobicContact CZ-CB 3.73Å; F69-I160 HydrophobicContact CZ-CD1 4.35Å; F69-I160 HydrophobicContact CZ-CG2 3.36Å; F69-I160 PolarHBondContact N-O 3.26Å; F69-I160 PolarHBondContact O-N 2.83Å
70	S	95	Very high	95.7	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.014	23%	0.225	C	C	.	.			trans	-131.3	116.6	-179.5	-67.1	0	0	0	0	107.3	M1 R3 S72 E158 T159	M1-S70 PolarHBondContact N-O 3.24Å; M1-S70 PolarHBondContact O-N 2.89Å; R3-S70 PolarHBondContact NH1-OG 3.49Å; R3-S70 PolarHBondContact NH2-OG 2.89Å; S70-S72 PolarHBondContact O-N 3.41Å; S70-E158 VanDerWaalsContact CB-O 3.24Å; S70-E158 WeakPolarHBondContact CB-O 3.18Å; S70-E158 PolarHBondContact OG-O 2.98Å; S70-T159 PolarHBondContact OG-OG1 3.18Å
71	P	94.9	Very high	95.8	Very high	42 Å²	42	47.4 Å²	47.4	27%	0.273	24%	0.237	S	C	.	.			trans	-50.6	136.9	158.6	-21.8	33	0	0	0	108.7	L57 S156 I160	L57-P71 HydrophobicContact CD1-CG 3.99Å; L57-P71 HydrophobicContact CD2-CG 3.9Å; P71-S156 WeakPolarHBondContact O-CB 3.38Å; P71-I160 HydrophobicContact CG-CD1 4.06Å
72	S	93.7	Very high	95.8	Very high	49 Å²	49	43.2 Å²	43.2	34%	0.343	22%	0.218	S	C	.	.			trans	-147.4	132.7	-174.9	57.1	0	0	0	0	110.9	S70 L155	S70-S72 PolarHBondContact O-N 3.41Å; S72-L155 CarbonylContact C-O 3.57Å; S72-L155 WeakPolarHBondContact CA-O 3.21Å
73	I	94.5	Very high	95.9	Very high	70 Å²	70	42 Å²	42	36%	0.359	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.1	175.4	-59	169.1	0	0	0	107.9	V75 M85 I89 Y154 L155	I73-V75 HydrophobicContact CG2-CG1 4.23Å; I73-M85 HydrophobicContact CB-SD 4.41Å; I73-M85 HydrophobicContact CD1-SD 3.81Å; I73-M85 HydrophobicContact CG2-CE 3.83Å; I73-M85 HydrophobicContact CG2-CG 4.1Å; I73-M85 HydrophobicContact CG2-SD 3.76Å; I73-I89 HydrophobicContact CD1-CD1 3.99Å; I73-I89 HydrophobicContact CD1-CG1 4Å; I73-Y154 WeakPolarHBondContact O-CA 3.38Å; I73-L155 PolarHBondContact N-O 3.28Å; I73-L155 PolarHBondContact O-N 3.02Å
74	R	93.9	Very high	95.9	Very high	116 Å²	116	46.6 Å²	46.6	44%	0.438	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.6	172.6	-179.2	-174.7	170.3	-77.9	-5.5	108.6	E76 D151 A153 Y154	R74-E76 IonicContact CZ-OE1 2.91Å; R74-E76 IonicContact NH1-OE1 2.67Å; R74-E76 PolarHBondContact NH1-OE1 2.77Å; R74-E76 IonicContact NH2-OE1 2.69Å; R74-E76 PolarHBondContact NH2-OE1 3.15Å; R74-E76 IonicContact NH2-OE2 3.49Å; R74-D151 PolarHBondContact NE-O 2.75Å; R74-D151 PolarHBondContact NH2-O 2.76Å; R74-A153 WeakPolarHBondContact CA-O 3.49Å; R74-Y154 HydrophobicContact CB-CD1 4.06Å; R74-Y154 HydrophobicContact CB-CE1 3.8Å; R74-Y154 HydrophobicContact CG-CD1 4.43Å; R74-Y154 HydrophobicContact CG-CE1 3.93Å
75	V	96.3	Very high	96	Very high	14 Å²	14	48 Å²	48	9%	0.085	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	166.2	169.7	-58.3	0	0	0	0	110.5	I73 D81 L82 M85 A153 L155	I73-V75 HydrophobicContact CG2-CG1 4.23Å; V75-D81 HydrophobicContact CB-CB 4.18Å; V75-D81 HydrophobicContact CG2-CB 4.3Å; V75-L82 HydrophobicContact CG2-CD2 4.1Å; V75-L82 HydrophobicContact CG2-CG 4.49Å; V75-M85 HydrophobicContact CG1-CB 3.72Å; V75-M85 HydrophobicContact CG1-CE 3.95Å; V75-M85 HydrophobicContact CG1-CG 3.69Å; V75-A153 HydrophobicContact CG2-CB 3.91Å; V75-A153 PolarHBondContact N-O 2.92Å; V75-A153 PolarHBondContact O-N 3.39Å; V75-L155 HydrophobicContact CG1-CD1 4.24Å; V75-L155 HydrophobicContact CG2-CD1 3.58Å
76	E	95.8	Very high	96.1	Very high	97 Å²	97	48 Å²	48	45%	0.453	24%	0.241	S	C	.	.			trans	-67	154.8	173.2	-68.9	-54.1	131.9	0	0	111.2	R74 T78 D81	R74-E76 IonicContact CZ-OE1 2.91Å; R74-E76 IonicContact NH1-OE1 2.67Å; R74-E76 PolarHBondContact NH1-OE1 2.77Å; R74-E76 IonicContact NH2-OE1 2.69Å; R74-E76 PolarHBondContact NH2-OE1 3.15Å; R74-E76 IonicContact NH2-OE2 3.49Å; E76-T78 PolarHBondContact O-N 2.95Å; E76-D81 WeakPolarHBondContact CB-OD2 3.43Å
77	K	92.6	Very high	96.1	Very high	62 Å²	62	49.7 Å²	49.7	27%	0.27	25%	0.248	S	C	.	.	S	Bend	trans	-84.4	60.9	-172.3	-60.2	-170.7	-57.4	173.5	0	111.4	D108 F111 I148 R149 R150 G152 A153	K77-D108 IonicContact NZ-OD2 3.98Å; K77-D108 PolarHBondContact NZ-OD2 2.88Å; K77-F111 HydrophobicContact CB-CD2 4.48Å; K77-F111 HydrophobicContact CB-CE2 4.3Å; K77-F111 WeakPolarHBondContact O-CE2 3.39Å; K77-I148 HydrophobicContact CD-CG2 4.4Å; K77-R149 WeakPolarHBondContact CD-O 3.13Å; K77-R149 PolarHBondContact NZ-O 3.16Å; K77-R150 WeakPolarHBondContact CE-O 3.49Å; K77-R150 VanDerWaalsContact NZ-C 3.31Å; K77-R150 PolarHBondContact NZ-O 2.79Å; K77-G152 VanDerWaalsContact CG-CA 3.5Å; K77-A153 HydrophobicContact CG-CB 4.42Å
78	T	95.3	Very high	96.2	Very high	55 Å²	55	49.4 Å²	49.4	34%	0.337	25%	0.247	S	C	.	.	S	Bend	trans	-125.1	154.2	173.6	82.3	0	0	0	0	109.5	E76 D80 D81 L82	E76-T78 PolarHBondContact O-N 2.95Å; T78-D80 PolarHBondContact O-N 3.31Å; T78-D80 PolarHBondContact OG1-N 3.35Å; T78-D81 WeakPolarHBondContact CB-OD2 3.43Å; T78-D81 WeakPolarHBondContact CG2-OD2 3.48Å; T78-D81 WeakPolarHBondContact OG1-CB 3.36Å; T78-D81 VanDerWaalsContact OG1-CG 3.28Å; T78-D81 PolarHBondContact OG1-N 3.01Å; T78-D81 PolarHBondContact OG1-OD2 3.34Å; T78-L82 WeakPolarHBondContact O-CB 3.46Å; T78-L82 WeakPolarHBondContact O-CG 3.47Å; T78-L82 PolarHBondContact O-N 3.47Å; T78-L82 VanDerWaalsContact O-N 3.15Å
79	L	95.5	Very high	96.2	Very high	29 Å²	29	48.5 Å²	48.5	15%	0.152	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-34.3	173.7	-72.4	171.9	0	0	0	112.1	L82 K83 F111 E112 L113 Y121	L79-L82 PolarHBondContact O-N 3.47Å; L79-K83 VanDerWaalsContact O-CB 3.28Å; L79-K83 WeakPolarHBondContact O-CB 3.48Å; L79-K83 PolarHBondContact O-N 3.47Å; L79-F111 HydrophobicContact CD2-CE1 4.16Å; L79-F111 HydrophobicContact CD2-CZ 4.1Å; L79-F111 HydrophobicContact CG-CZ 4.4Å; L79-E112 HydrophobicContact CD1-CG 4.02Å; L79-E112 VanDerWaalsContact CD1-OE1 3.29Å; L79-E112 WeakPolarHBondContact CD1-OE1 3.36Å; L79-E112 HydrophobicContact CG-CG 4.25Å; L79-E112 WeakPolarHBondContact CG-OE1 3.31Å; L79-L113 HydrophobicContact CD1-CD1 4.06Å; L79-L113 HydrophobicContact CD1-CG 4.23Å; L79-L113 HydrophobicContact CD2-CD1 3.49Å; L79-L113 VanDerWaalsContact CD2-CD1 3.49Å; L79-L113 HydrophobicContact CD2-CG 4.05Å; L79-L113 HydrophobicContact CG-CD1 4.44Å; L79-Y121 HydrophobicContact CB-CE1 3.8Å; L79-Y121 HydrophobicContact CD2-CD1 3.72Å; L79-Y121 HydrophobicContact CD2-CE1 3.83Å; L79-Y121 HydrophobicContact CD2-CG 4.23Å; L79-Y121 HydrophobicContact CG-CE1 4.33Å; L79-Y121 WeakPolarHBondContact O-CE1 3.46Å; L79-Y121 PolarHBondContact O-OH 2.89Å
80	D	97	Very high	96.2	Very high	91 Å²	91	48.4 Å²	48.4	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-49.1	-179.9	-172.6	48.3	0	0	0	111.8	T78 L82 K83 Q84	T78-D80 PolarHBondContact O-N 3.31Å; T78-D80 PolarHBondContact OG1-N 3.35Å; D80-L82 VanDerWaalsContact C-N 3.31Å; D80-L82 PolarHBondContact O-N 2.87Å; D80-K83 PolarHBondContact O-N 3.09Å; D80-K83 VanDerWaalsContact O-N 3.14Å; D80-Q84 WeakPolarHBondContact O-CG 3.33Å; D80-Q84 PolarHBondContact O-N 2.67Å; D80-Q84 PolarHBondContact OD1-NE2 3.07Å; D80-Q84 VanDerWaalsContact OD1-NE2 3.12Å; D80-Q84 PolarHBondContact OD2-NE2 3.11Å
81	D	97.4	Very high	96.3	Very high	53 Å²	53	54.1 Å²	54.1	28%	0.283	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-42	175.8	-70.1	-69.3	0	0	0	111.7	V75 E76 T78 M85	V75-D81 HydrophobicContact CB-CB 4.18Å; V75-D81 HydrophobicContact CG2-CB 4.3Å; E76-D81 WeakPolarHBondContact CB-OD2 3.43Å; T78-D81 WeakPolarHBondContact CB-OD2 3.43Å; T78-D81 WeakPolarHBondContact CG2-OD2 3.48Å; T78-D81 WeakPolarHBondContact OG1-CB 3.36Å; T78-D81 VanDerWaalsContact OG1-CG 3.28Å; T78-D81 PolarHBondContact OG1-N 3.01Å; T78-D81 PolarHBondContact OG1-OD2 3.34Å; D81-M85 VanDerWaalsContact O-CB 3.31Å; D81-M85 WeakPolarHBondContact O-CB 3.48Å; D81-M85 PolarHBondContact O-N 3.03Å
82	L	97.6	Very high	96.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-43	175.1	-80	172.6	0	0	0	111.9	V75 T78 L79 D80 T86 F111 L122 V146 I148 A153 L155	V75-L82 HydrophobicContact CG2-CD2 4.1Å; V75-L82 HydrophobicContact CG2-CG 4.49Å; T78-L82 WeakPolarHBondContact O-CB 3.46Å; T78-L82 WeakPolarHBondContact O-CG 3.47Å; T78-L82 PolarHBondContact O-N 3.47Å; T78-L82 VanDerWaalsContact O-N 3.15Å; L79-L82 PolarHBondContact O-N 3.47Å; D80-L82 VanDerWaalsContact C-N 3.31Å; D80-L82 PolarHBondContact O-N 2.87Å; L82-T86 WeakPolarHBondContact O-CB 3.43Å; L82-T86 PolarHBondContact O-N 3.19Å; L82-T86 PolarHBondContact O-OG1 3.17Å; L82-F111 HydrophobicContact CD1-CE1 4.32Å; L82-F111 HydrophobicContact CD1-CZ 3.79Å; L82-L122 HydrophobicContact CB-CD1 4.49Å; L82-L122 HydrophobicContact CB-CD2 3.97Å; L82-V146 HydrophobicContact CD2-CG1 3.73Å; L82-I148 HydrophobicContact CD1-CD1 3.87Å; L82-I148 HydrophobicContact CD2-CD1 4.38Å; L82-A153 HydrophobicContact CD2-CB 3.66Å; L82-A153 HydrophobicContact CG-CB 4.21Å; L82-L155 HydrophobicContact CD2-CD1 3.91Å; L82-L155 HydrophobicContact CD2-CG 4.42Å
83	K	98.1	Very high	96.3	Very high	55 Å²	55	58.3 Å²	58.3	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-54.4	177.8	173.6	163.4	-173.5	165.1	0	110.4	L79 D80 M85 T86 Q87 Y121 A125 D128	L79-K83 VanDerWaalsContact O-CB 3.28Å; L79-K83 WeakPolarHBondContact O-CB 3.48Å; L79-K83 PolarHBondContact O-N 3.47Å; D80-K83 PolarHBondContact O-N 3.09Å; D80-K83 VanDerWaalsContact O-N 3.14Å; K83-M85 PolarHBondContact O-N 2.99Å; K83-T86 PolarHBondContact O-N 3.37Å; K83-Q87 WeakPolarHBondContact O-CB 3.39Å; K83-Q87 WeakPolarHBondContact O-CG 3.3Å; K83-Q87 PolarHBondContact O-N 3.43Å; K83-Y121 HydrophobicContact CB-CE1 3.97Å; K83-A125 HydrophobicContact CD-CB 4.16Å; K83-A125 HydrophobicContact CG-CB 3.82Å; K83-D128 IonicContact NZ-OD2 2.74Å; K83-D128 PolarHBondContact NZ-OD2 2.86Å
84	Q	98	Very high	96.4	Very high	102 Å²	102	57 Å²	57	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-48.6	-177.7	-70	176.5	17.8	0	0	111.5	D80 Q87 Q88	D80-Q84 WeakPolarHBondContact O-CG 3.33Å; D80-Q84 PolarHBondContact O-N 2.67Å; D80-Q84 PolarHBondContact OD1-NE2 3.07Å; D80-Q84 VanDerWaalsContact OD1-NE2 3.12Å; D80-Q84 PolarHBondContact OD2-NE2 3.11Å; Q84-Q87 PolarHBondContact O-N 3.14Å; Q84-Q88 WeakPolarHBondContact O-CB 3.4Å; Q84-Q88 PolarHBondContact O-N 3.34Å
85	M	98	Very high	96.4	Very high	31 Å²	31	56.2 Å²	56.2	15%	0.153	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-37.2	179.6	-174.6	55.6	60.9	0	0	112.5	I73 V75 D81 K83 Q87 Q88 I89 L155	I73-M85 HydrophobicContact CB-SD 4.41Å; I73-M85 HydrophobicContact CD1-SD 3.81Å; I73-M85 HydrophobicContact CG2-CE 3.83Å; I73-M85 HydrophobicContact CG2-CG 4.1Å; I73-M85 HydrophobicContact CG2-SD 3.76Å; V75-M85 HydrophobicContact CG1-CB 3.72Å; V75-M85 HydrophobicContact CG1-CE 3.95Å; V75-M85 HydrophobicContact CG1-CG 3.69Å; D81-M85 VanDerWaalsContact O-CB 3.31Å; D81-M85 WeakPolarHBondContact O-CB 3.48Å; D81-M85 PolarHBondContact O-N 3.03Å; K83-M85 PolarHBondContact O-N 2.99Å; M85-Q87 VanDerWaalsContact C-N 3.33Å; M85-Q88 PolarHBondContact O-N 3.31Å; M85-I89 HydrophobicContact CG-CD1 3.94Å; M85-I89 HydrophobicContact CG-CG1 4.41Å; M85-I89 WeakPolarHBondContact O-CB 3.44Å; M85-I89 VanDerWaalsContact O-CG1 3.23Å; M85-I89 WeakPolarHBondContact O-CG1 3.39Å; M85-I89 PolarHBondContact O-N 3.32Å; M85-I89 HydrophobicContact SD-CD1 4.22Å; M85-I89 HydrophobicContact SD-CG1 4.14Å; M85-L155 HydrophobicContact CB-CD1 4.47Å; M85-L155 HydrophobicContact CB-CD2 4.29Å; M85-L155 HydrophobicContact CG-CD1 4.1Å; M85-L155 HydrophobicContact CG-CD2 4.07Å
86	T	98.3	Very high	96.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-47.6	173.1	-67.5	0	0	0	0	110.6	L82 K83 I89 M90 L122 V126 L144 L155	L82-T86 WeakPolarHBondContact O-CB 3.43Å; L82-T86 PolarHBondContact O-N 3.19Å; L82-T86 PolarHBondContact O-OG1 3.17Å; K83-T86 PolarHBondContact O-N 3.37Å; T86-I89 PolarHBondContact O-N 3.44Å; T86-M90 HydrophobicContact CG2-CG 4.39Å; T86-M90 WeakPolarHBondContact O-CB 3.29Å; T86-M90 WeakPolarHBondContact O-CG 3.32Å; T86-M90 PolarHBondContact O-N 3.48Å; T86-L122 HydrophobicContact CG2-CB 4.4Å; T86-V126 HydrophobicContact CG2-CG2 3.64Å; T86-L144 HydrophobicContact CG2-CD2 3.65Å; T86-L155 WeakPolarHBondContact OG1-CD2 3.45Å
87	Q	98.1	Very high	96.3	Very high	35 Å²	35	61.9 Å²	61.9	16%	0.164	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-45.7	179	-74.3	-179	-30	0	0	111.9	K83 Q84 M85 M90 Q91 A125 V129	K83-Q87 WeakPolarHBondContact O-CB 3.39Å; K83-Q87 WeakPolarHBondContact O-CG 3.3Å; K83-Q87 PolarHBondContact O-N 3.43Å; Q84-Q87 PolarHBondContact O-N 3.14Å; M85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-M90 PolarHBondContact O-N 3.11Å; Q87-Q91 WeakPolarHBondContact O-CB 3.42Å; Q87-Q91 WeakPolarHBondContact O-CG 3.3Å; Q87-Q91 PolarHBondContact O-N 3.47Å; Q87-A125 HydrophobicContact CG-CB 4.33Å; Q87-A125 VanDerWaalsContact CG-O 3.31Å; Q87-A125 WeakPolarHBondContact CG-O 3.45Å; Q87-A125 PolarHBondContact NE2-O 3.21Å; Q87-V129 HydrophobicContact CB-CG1 4.01Å; Q87-V129 HydrophobicContact CB-CG2 4.03Å; Q87-V129 HydrophobicContact CG-CB 4.48Å; Q87-V129 HydrophobicContact CG-CG1 3.78Å; Q87-V129 HydrophobicContact CG-CG2 3.84Å
88	Q	97.5	Very high	96.5	Very high	108 Å²	108	60.8 Å²	60.8	51%	0.505	31%	0.309	S	S	.	.	H	α-helix	trans	-58	-50.8	176.7	-177.4	-177.9	-15.8	0	0	111.8	Q84 M85 M90 Q91 E92	Q84-Q88 WeakPolarHBondContact O-CB 3.4Å; Q84-Q88 PolarHBondContact O-N 3.34Å; M85-Q88 PolarHBondContact O-N 3.31Å; Q88-M90 VanDerWaalsContact C-N 3.33Å; Q88-M90 PolarHBondContact O-N 3.14Å; Q88-Q91 PolarHBondContact O-N 3.41Å; Q88-E92 PolarHBondContact O-N 3Å; Q88-E92 VanDerWaalsContact O-N 3.14Å
89	I	96.3	Very high	96.6	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-58	-47.8	178.2	-69.3	166.4	0	0	0	110.2	I73 M85 T86 Q91 E92 I93 L144 L155 Y157	I73-I89 HydrophobicContact CD1-CD1 3.99Å; I73-I89 HydrophobicContact CD1-CG1 4Å; M85-I89 HydrophobicContact CG-CD1 3.94Å; M85-I89 HydrophobicContact CG-CG1 4.41Å; M85-I89 WeakPolarHBondContact O-CB 3.44Å; M85-I89 VanDerWaalsContact O-CG1 3.23Å; M85-I89 WeakPolarHBondContact O-CG1 3.39Å; M85-I89 PolarHBondContact O-N 3.32Å; M85-I89 HydrophobicContact SD-CD1 4.22Å; M85-I89 HydrophobicContact SD-CG1 4.14Å; T86-I89 PolarHBondContact O-N 3.44Å; I89-Q91 PolarHBondContact O-N 3.42Å; I89-E92 PolarHBondContact O-N 3.21Å; I89-I93 HydrophobicContact CG2-CD1 3.87Å; I89-I93 VanDerWaalsContact O-CG1 3.32Å; I89-I93 WeakPolarHBondContact O-CG1 3.21Å; I89-I93 PolarHBondContact O-N 3.41Å; I89-I93 VanDerWaalsContact O-N 3.11Å; I89-L144 HydrophobicContact CD1-CD1 4.14Å; I89-L144 HydrophobicContact CG2-CD1 4.21Å; I89-L155 HydrophobicContact CD1-CB 3.82Å; I89-L155 HydrophobicContact CD1-CD2 3.97Å; I89-Y157 HydrophobicContact CG2-CD1 3.61Å; I89-Y157 HydrophobicContact CG2-CE1 3.96Å; I89-Y157 HydrophobicContact CG2-CG 4.35Å
90	M	97.2	Very high	96.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-38.5	-176.3	-69.2	-56.8	-51.3	0	0	112.4	T86 Q87 Q88 E92 I93 Y94 F100 V126 I133 I142 L144	T86-M90 HydrophobicContact CG2-CG 4.39Å; T86-M90 WeakPolarHBondContact O-CB 3.29Å; T86-M90 WeakPolarHBondContact O-CG 3.32Å; T86-M90 PolarHBondContact O-N 3.48Å; Q87-M90 PolarHBondContact O-N 3.11Å; Q88-M90 VanDerWaalsContact C-N 3.33Å; Q88-M90 PolarHBondContact O-N 3.14Å; M90-E92 VanDerWaalsContact C-N 3.28Å; M90-E92 PolarHBondContact O-N 3.04Å; M90-I93 PolarHBondContact O-N 3.47Å; M90-I93 HydrophobicContact SD-CD1 4.17Å; M90-Y94 WeakPolarHBondContact O-CB 3.45Å; M90-Y94 PolarHBondContact O-N 3.37Å; M90-F100 HydrophobicContact CE-CB 4.23Å; M90-V126 HydrophobicContact CB-CG1 4.41Å; M90-V126 HydrophobicContact CE-CG1 3.87Å; M90-V126 HydrophobicContact CG-CB 4.42Å; M90-V126 HydrophobicContact CG-CG1 3.97Å; M90-V126 HydrophobicContact CG-CG2 3.78Å; M90-V126 HydrophobicContact SD-CG1 4.45Å; M90-V126 HydrophobicContact SD-CG2 4.46Å; M90-I133 HydrophobicContact CE-CD1 3.36Å; M90-I142 HydrophobicContact CE-CD1 3.96Å; M90-I142 HydrophobicContact CE-CG2 4.28Å; M90-I142 HydrophobicContact SD-CG2 4.05Å; M90-L144 HydrophobicContact SD-CD2 4.46Å
91	Q	96.1	Very high	96.8	Very high	123 Å²	123	56.2 Å²	56.2	58%	0.575	28%	0.28	S	S	*	.	H	α-helix	trans	-64.7	-31.7	174.7	-74.7	177.3	-34.9	0	0	112.9	Q87 Q88 I89 V129	Q87-Q91 WeakPolarHBondContact O-CB 3.42Å; Q87-Q91 WeakPolarHBondContact O-CG 3.3Å; Q87-Q91 PolarHBondContact O-N 3.47Å; Q88-Q91 PolarHBondContact O-N 3.41Å; I89-Q91 PolarHBondContact O-N 3.42Å; Q91-V129 HydrophobicContact CG-CB 4.06Å; Q91-V129 HydrophobicContact CG-CG2 4.17Å
92	E	94.9	Very high	96.8	Very high	149 Å²	149	54.1 Å²	54.1	70%	0.696	27%	0.269	S	S	*	.	H	α-helix	trans	-75.2	-38.8	178.4	-173.1	177	172.1	0	0	112.5	Q88 I89 M90	Q88-E92 PolarHBondContact O-N 3Å; Q88-E92 VanDerWaalsContact O-N 3.14Å; I89-E92 PolarHBondContact O-N 3.21Å; M90-E92 VanDerWaalsContact C-N 3.28Å; M90-E92 PolarHBondContact O-N 3.04Å
93	I	94.5	Very high	96.8	Very high	30 Å²	30	55.6 Å²	55.6	15%	0.154	28%	0.278	C	S	.	.	H	α-helix	trans	-101.2	-20.4	-169.9	72.1	-177.2	0	0	0	114.7	I89 M90 I142 Y157	I89-I93 HydrophobicContact CG2-CD1 3.87Å; I89-I93 VanDerWaalsContact O-CG1 3.32Å; I89-I93 WeakPolarHBondContact O-CG1 3.21Å; I89-I93 PolarHBondContact O-N 3.41Å; I89-I93 VanDerWaalsContact O-N 3.11Å; M90-I93 PolarHBondContact O-N 3.47Å; M90-I93 HydrophobicContact SD-CD1 4.17Å; I93-I142 HydrophobicContact CD1-CD1 3.96Å; I93-I142 HydrophobicContact CD1-CG1 4.22Å; I93-I142 HydrophobicContact CD1-CG2 3.67Å; I93-I142 HydrophobicContact CG1-CD1 3.89Å; I93-Y157 HydrophobicContact CD1-CD1 4.4Å; I93-Y157 HydrophobicContact CD1-CD2 3.84Å; I93-Y157 HydrophobicContact CD1-CE2 4.29Å; I93-Y157 HydrophobicContact CD1-CG 3.92Å; I93-Y157 HydrophobicContact CG2-CD2 4.38Å; I93-Y157 HydrophobicContact CG2-CE1 4.31Å; I93-Y157 HydrophobicContact CG2-CE2 3.77Å
94	Y	95.8	Very high	96.7	Very high	43 Å²	43	53.4 Å²	53.4	17%	0.169	27%	0.27	C	S	.	.			trans	-79.8	121.9	-178.3	179.8	-125.2	0	0	0	110.7	M90 G96 E98 C130 I133	M90-Y94 WeakPolarHBondContact O-CB 3.45Å; M90-Y94 PolarHBondContact O-N 3.37Å; Y94-G96 WeakPolarHBondContact OH-CA 3.32Å; Y94-G96 PolarHBondContact OH-O 2.96Å; Y94-E98 HydrophobicContact CD2-CB 4.15Å; Y94-E98 VanDerWaalsContact CD2-OE2 3.28Å; Y94-E98 WeakPolarHBondContact CD2-OE2 3.35Å; Y94-E98 HydrophobicContact CE2-CB 4.43Å; Y94-C130 HydrophobicContact CD1-CB 3.75Å; Y94-C130 HydrophobicContact CE1-CB 3.93Å; Y94-I133 HydrophobicContact CD2-CD1 3.74Å; Y94-I133 HydrophobicContact CD2-CG1 3.93Å; Y94-I133 HydrophobicContact CE1-CB 4.16Å; Y94-I133 HydrophobicContact CE2-CB 4Å; Y94-I133 HydrophobicContact CE2-CD1 3.95Å; Y94-I133 HydrophobicContact CE2-CG1 3.58Å; Y94-I133 HydrophobicContact CG-CD1 4.11Å; Y94-I133 WeakPolarHBondContact OH-CA 3.31Å; Y94-I133 PolarHBondContact OH-N 3.11Å
95	T	95.2	Very high	96.5	Very high	99 Å²	99	55.2 Å²	55.2	61%	0.607	28%	0.276	S	S	*	.			trans	-103	3.6	-178.9	77.9	0	0	0	0	113.2	E98	T95-E98 PolarHBondContact N-OE2 3.4Å; T95-E98 VanDerWaalsContact OG1-CD 3.27Å; T95-E98 PolarHBondContact OG1-OE1 3.11Å; T95-E98 PolarHBondContact OG1-OE2 3.16Å
96	G	94.1	Very high	96.3	Very high	47 Å²	47	56.3 Å²	56.3	49%	0.485	28%	0.279	S	S	.	.	S	Bend	trans	98.8	-4.3	-176.7	0	0	0	0	0	114.4	Y94 E98	Y94-G96 WeakPolarHBondContact OH-CA 3.32Å; Y94-G96 PolarHBondContact OH-O 2.96Å; G96-E98 PolarHBondContact N-OE2 3.45Å
97	K	94.7	Very high	95.8	Very high	182 Å²	182	59.4 Å²	59.4	79%	0.791	30%	0.3	S	S	*	.	S	Bend	trans	-119.1	-22.3	-170.6	-64.6	179.1	-175.8	171.9	0	113.9
98	E	97.1	Very high	95.5	Very high	40 Å²	40	58.5 Å²	58.5	19%	0.187	30%	0.297	C	S	.	.			trans	-77	146.7	-172.1	-61	74	-163	0	0	111.8	Y94 T95 G96 I133 D141 I142	Y94-E98 HydrophobicContact CD2-CB 4.15Å; Y94-E98 VanDerWaalsContact CD2-OE2 3.28Å; Y94-E98 WeakPolarHBondContact CD2-OE2 3.35Å; Y94-E98 HydrophobicContact CE2-CB 4.43Å; T95-E98 PolarHBondContact N-OE2 3.4Å; T95-E98 VanDerWaalsContact OG1-CD 3.27Å; T95-E98 PolarHBondContact OG1-OE1 3.11Å; T95-E98 PolarHBondContact OG1-OE2 3.16Å; G96-E98 PolarHBondContact N-OE2 3.45Å; E98-I133 WeakPolarHBondContact O-CG1 3.33Å; E98-D141 HydrophobicContact CB-CB 3.91Å; E98-D141 HydrophobicContact CG-CB 4.18Å; E98-I142 HydrophobicContact CB-CD1 3.61Å; E98-I142 HydrophobicContact CB-CG1 4.02Å; E98-I142 HydrophobicContact CG-CD1 3.96Å; E98-I142 HydrophobicContact CG-CG1 4.26Å
99	T	97.5	Very high	95.1	Very high	19 Å²	19	59.7 Å²	59.7	12%	0.117	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	152.6	163.8	62.9	0	0	0	0	110.4	K134 Q136 D141 I142	T99-K134 CarbonylContact C-O 3.57Å; T99-K134 VanDerWaalsContact CA-O 3.25Å; T99-K134 WeakPolarHBondContact CA-O 3.07Å; T99-K134 WeakPolarHBondContact CB-O 3.2Å; T99-K134 HydrophobicContact CG2-CB 4.28Å; T99-Q136 HydrophobicContact CG2-CB 4.19Å; T99-D141 WeakPolarHBondContact CB-OD2 3.48Å; T99-D141 PolarHBondContact N-OD2 2.88Å; T99-D141 PolarHBondContact O-N 3.22Å; T99-D141 VanDerWaalsContact O-N 3.15Å; T99-D141 PolarHBondContact OG1-N 3.11Å; T99-D141 PolarHBondContact OG1-OD2 2.9Å; T99-I142 PolarHBondContact O-N 3.27Å
100	F	97.9	Very high	94.9	Very high	5 Å²	5	67.8 Å²	67.8	2%	0.022	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	161.7	-175.9	88.5	-69.4	0	0	0	114.8	M90 I102 V126 M127 I133 K134 A135 Q136 I142	M90-F100 HydrophobicContact CE-CB 4.23Å; F100-I102 HydrophobicContact CD2-CD1 4.37Å; F100-I102 HydrophobicContact CE2-CD1 4.36Å; F100-I102 HydrophobicContact CE2-CG1 4.18Å; F100-V126 HydrophobicContact CD1-CG1 4.42Å; F100-V126 HydrophobicContact CD2-CB 4.26Å; F100-V126 HydrophobicContact CD2-CG1 3.89Å; F100-V126 HydrophobicContact CD2-CG2 4.08Å; F100-V126 HydrophobicContact CE1-CG1 4.23Å; F100-V126 HydrophobicContact CE2-CB 3.64Å; F100-V126 HydrophobicContact CE2-CG1 3.68Å; F100-V126 HydrophobicContact CE2-CG2 3.67Å; F100-V126 HydrophobicContact CG-CG1 4.25Å; F100-V126 HydrophobicContact CZ-CB 3.91Å; F100-V126 HydrophobicContact CZ-CG1 3.85Å; F100-V126 HydrophobicContact CZ-CG2 4.43Å; F100-M127 HydrophobicContact CE1-CE 4.3Å; F100-M127 HydrophobicContact CZ-CE 4.18Å; F100-I133 HydrophobicContact CB-CD1 3.74Å; F100-I133 HydrophobicContact CB-CG1 4.36Å; F100-I133 HydrophobicContact CD1-CB 4.38Å; F100-I133 HydrophobicContact CD1-CD1 3.76Å; F100-I133 HydrophobicContact CD1-CG1 3.75Å; F100-I133 HydrophobicContact CD1-CG2 3.81Å; F100-I133 HydrophobicContact CE1-CG1 4.48Å; F100-I133 HydrophobicContact CE1-CG2 3.68Å; F100-I133 HydrophobicContact CG-CD1 3.87Å; F100-I133 HydrophobicContact CG-CG1 4.35Å; F100-I133 HydrophobicContact CZ-CG2 4.48Å; F100-K134 PolarHBondContact N-O 2.91Å; F100-A135 HydrophobicContact CD1-CB 4.46Å; F100-A135 HydrophobicContact CE1-CB 3.92Å; F100-A135 HydrophobicContact CZ-CB 4.43Å; F100-A135 CarbonylContact O-C 3.53Å; F100-A135 WeakPolarHBondContact O-CA 3.37Å; F100-Q136 PolarHBondContact O-N 3.06Å; F100-I142 CarbonylContact C-O 3.59Å; F100-I142 VanDerWaalsContact CA-O 3.24Å; F100-I142 WeakPolarHBondContact CA-O 3.07Å; F100-I142 HydrophobicContact CB-CB 4.23Å
101	K	97.9	Very high	94.6	Very high	54 Å²	54	68.6 Å²	68.6	24%	0.235	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140	169	-178.1	-178.5	-178.6	171.4	0	110.3	M137 P140 I142 N143 L144	K101-M137 HydrophobicContact CB-CE 4.44Å; K101-M137 HydrophobicContact CD-SD 4.35Å; K101-M137 HydrophobicContact CG-CE 4.1Å; K101-M137 HydrophobicContact CG-SD 4.15Å; K101-M137 PolarHBondContact NZ-O 3.08Å; K101-P140 HydrophobicContact CB-CB 3.9Å; K101-P140 HydrophobicContact CB-CG 3.69Å; K101-P140 HydrophobicContact CD-CG 4.31Å; K101-I142 PolarHBondContact N-O 3.41Å; K101-N143 CarbonylContact O-C 3.59Å; K101-N143 WeakPolarHBondContact O-CA 2.98Å; K101-N143 PolarHBondContact O-OD1 2.91Å; K101-L144 PolarHBondContact O-N 2.93Å
102	I	98	Very high	94.6	Very high	10 Å²	10	69.1 Å²	69.1	5%	0.051	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.6	164.2	-54.3	-60	0	0	0	109.6	F100 Q119 L122 V126 L144 V146	F100-I102 HydrophobicContact CD2-CD1 4.37Å; F100-I102 HydrophobicContact CE2-CD1 4.36Å; F100-I102 HydrophobicContact CE2-CG1 4.18Å; I102-Q119 HydrophobicContact CB-CG 4.46Å; I102-Q119 HydrophobicContact CG2-CG 4.22Å; I102-L122 HydrophobicContact CD1-CB 4.34Å; I102-L122 HydrophobicContact CG1-CB 4.22Å; I102-L122 HydrophobicContact CG2-CB 4.32Å; I102-V126 HydrophobicContact CD1-CG2 4.06Å; I102-L144 WeakPolarHBondContact CA-O 3.41Å; I102-L144 HydrophobicContact CD1-CB 3.86Å; I102-L144 HydrophobicContact CD1-CD2 3.8Å; I102-L144 HydrophobicContact CD1-CG 4.2Å; I102-V146 HydrophobicContact CG2-CG2 4.37Å
103	T	97.3	Very high	94.6	Very high	31 Å²	31	64.3 Å²	64.3	19%	0.19	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	99.7	170.3	-60.7	0	0	0	0	109.5	N143 L144 R145 V146	T103-N143 WeakPolarHBondContact CB-OD1 3.4Å; T103-N143 PolarHBondContact OG1-ND2 3.14Å; T103-N143 PolarHBondContact OG1-OD1 3.3Å; T103-L144 PolarHBondContact N-O 3.04Å; T103-R145 CarbonylContact O-C 3.54Å; T103-R145 VanDerWaalsContact O-CA 3.3Å; T103-R145 WeakPolarHBondContact O-CA 3.47Å; T103-V146 PolarHBondContact O-N 3.25Å
104	A	96.7	Very high	94.6	Very high	8 Å²	8	67.1 Å²	67.1	7%	0.066	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	137.6	173.8	0	0	0	0	0	112.7	S115 I118 Q119 V146	A104-S115 WeakPolarHBondContact CB-O 3.44Å; A104-I118 HydrophobicContact CB-CB 3.88Å; A104-I118 HydrophobicContact CB-CD1 4.41Å; A104-I118 HydrophobicContact CB-CG2 3.71Å; A104-Q119 HydrophobicContact CB-CG 4.02Å; A104-V146 CarbonylContact C-O 3.6Å; A104-V146 VanDerWaalsContact CA-O 3.31Å; A104-V146 WeakPolarHBondContact CA-O 3.41Å
105	K	93.9	Very high	94.6	Very high	141 Å²	141	66.9 Å²	66.9	61%	0.613	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.3	165.5	-70.7	-171.3	177.9	-173.7	0	109.2	V146 E147 I148	K105-V146 PolarHBondContact N-O 3.02Å; K105-E147 HydrophobicContact CB-CG 4.48Å; K105-E147 CarbonylContact O-C 3.36Å; K105-E147 WeakPolarHBondContact O-CA 3.28Å; K105-I148 PolarHBondContact O-N 3.3Å
106	R	93.4	Very high	94.7	Very high	54 Å²	54	67 Å²	67	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	-179.8	-55.8	-177.5	-57.3	131.1	4.7	109.2	L113 S115 I118 I148	R106-L113 WeakPolarHBondContact CD-O 3.24Å; R106-L113 PolarHBondContact NH1-O 3.33Å; R106-S115 PolarHBondContact NE-OG 3Å; R106-I118 HydrophobicContact CG-CD1 3.98Å; R106-I148 HydrophobicContact CB-CB 4.42Å; R106-I148 HydrophobicContact CG-CB 4.1Å; R106-I148 HydrophobicContact CG-CG1 4.08Å
107	S	88.8	Confident	94.9	Very high	64 Å²	64	65.4 Å²	65.4	45%	0.448	32%	0.321	S	S	.	.	S	Bend	trans	-97.2	-22.5	162.7	60.5	0	0	0	0	111.2	I148 R149	S107-I148 PolarHBondContact N-O 2.6Å; S107-I148 PolarHBondContact OG-O 3.45Å; S107-I148 VanDerWaalsContact OG-O 3.11Å; S107-R149 WeakPolarHBondContact OG-CA 3.45Å
108	D	90.1	Very high	95	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.091	28%	0.283	C	S	.	.			trans	-94.9	105.8	167.4	-172	-2	0	0	0	110.1	K77 H110 I148 R150	K77-D108 IonicContact NZ-OD2 3.98Å; K77-D108 PolarHBondContact NZ-OD2 2.88Å; D108-H110 VanDerWaalsContact C-N 3.3Å; D108-H110 WeakPolarHBondContact OD1-CB 3.44Å; D108-H110 IonicContact OD1-CD2 2.74Å; D108-H110 IonicContact OD1-CG 3.16Å; D108-H110 PolarHBondContact OD1-N 2.9Å; D108-I148 HydrophobicContact CB-CG2 4.34Å; D108-I148 PolarHBondContact N-O 2.82Å; D108-R150 HydrophobicContact CB-CG 4.34Å
109	H	89.3	Confident	95	Very high	133 Å²	133	58 Å²	58	62%	0.616	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.2	179.9	-63.9	-67.3	0	0	0	113.6	F111	H109-F111 VanDerWaalsContact C-N 3.33Å
110	H	92	Very high	95	Very high	174 Å²	174	62.1 Å²	62.1	81%	0.806	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.8	175	-62.5	-68.6	0	0	0	113.3	D108	D108-H110 VanDerWaalsContact C-N 3.3Å; D108-H110 WeakPolarHBondContact OD1-CB 3.44Å; D108-H110 IonicContact OD1-CD2 2.74Å; D108-H110 IonicContact OD1-CG 3.16Å; D108-H110 PolarHBondContact OD1-N 2.9Å
111	F	92.6	Very high	95.1	Very high	18 Å²	18	65.3 Å²	65.3	8%	0.079	32%	0.319	C	S	.	.	S	Bend	trans	-61.7	141.1	173.9	-168.4	-105.8	0	0	0	111.1	K77 L79 L82 H109 L113 I118 I148	K77-F111 HydrophobicContact CB-CD2 4.48Å; K77-F111 HydrophobicContact CB-CE2 4.3Å; K77-F111 WeakPolarHBondContact O-CE2 3.39Å; L79-F111 HydrophobicContact CD2-CE1 4.16Å; L79-F111 HydrophobicContact CD2-CZ 4.1Å; L79-F111 HydrophobicContact CG-CZ 4.4Å; L82-F111 HydrophobicContact CD1-CE1 4.32Å; L82-F111 HydrophobicContact CD1-CZ 3.79Å; H109-F111 VanDerWaalsContact C-N 3.33Å; F111-L113 VanDerWaalsContact C-N 3.3Å; F111-L113 HydrophobicContact CD1-CB 4.43Å; F111-L113 HydrophobicContact CE1-CB 4.3Å; F111-L113 PolarHBondContact O-N 3.41Å; F111-I118 HydrophobicContact CD1-CD1 3.85Å; F111-I118 HydrophobicContact CD1-CG1 4.28Å; F111-I118 HydrophobicContact CE1-CD1 3.92Å; F111-I118 HydrophobicContact CE1-CG1 3.97Å; F111-I148 HydrophobicContact CB-CG2 3.86Å; F111-I148 HydrophobicContact CD1-CG1 4.31Å; F111-I148 HydrophobicContact CD1-CG2 4.41Å; F111-I148 HydrophobicContact CD2-CG2 3.9Å; F111-I148 HydrophobicContact CG-CG2 3.79Å
112	E	94.3	Very high	95.1	Very high	134 Å²	134	62.8 Å²	62.8	63%	0.626	31%	0.308	S	S	*	.	S	Bend	trans	-59.1	-34.8	-168.3	63.1	-174.3	134.7	0	0	114.3	L79	L79-E112 HydrophobicContact CD1-CG 4.02Å; L79-E112 VanDerWaalsContact CD1-OE1 3.29Å; L79-E112 WeakPolarHBondContact CD1-OE1 3.36Å; L79-E112 HydrophobicContact CG-CG 4.25Å; L79-E112 WeakPolarHBondContact CG-OE1 3.31Å
113	L	94.9	Very high	95	Very high	48 Å²	48	62.8 Å²	62.8	25%	0.251	31%	0.31	S	S	.	.	S	Bend	trans	-102.8	145.6	174.4	-62.9	-172.3	0	0	0	111.6	L79 R106 F111 I118 Y121	L79-L113 HydrophobicContact CD1-CD1 4.06Å; L79-L113 HydrophobicContact CD1-CG 4.23Å; L79-L113 HydrophobicContact CD2-CD1 3.49Å; L79-L113 VanDerWaalsContact CD2-CD1 3.49Å; L79-L113 HydrophobicContact CD2-CG 4.05Å; L79-L113 HydrophobicContact CG-CD1 4.44Å; R106-L113 WeakPolarHBondContact CD-O 3.24Å; R106-L113 PolarHBondContact NH1-O 3.33Å; F111-L113 VanDerWaalsContact C-N 3.3Å; F111-L113 HydrophobicContact CD1-CB 4.43Å; F111-L113 HydrophobicContact CE1-CB 4.3Å; F111-L113 PolarHBondContact O-N 3.41Å; L113-I118 HydrophobicContact CB-CG1 3.8Å; L113-Y121 HydrophobicContact CD1-CG 4.28Å
114	D	96.1	Very high	95.1	Very high	89 Å²	89	65.9 Å²	65.9	48%	0.476	33%	0.326	S	S	.	.			trans	-75.5	177.8	166.1	80.1	7.2	0	0	0	111.6	H116 G117 I118	D114-H116 PolarHBondContact O-N 3.36Å; D114-H116 WeakPolarHBondContact OD1-CA 3.47Å; D114-H116 WeakPolarHBondContact OD1-CB 3.19Å; D114-H116 PolarHBondContact OD1-N 2.95Å; D114-G117 PolarHBondContact O-N 2.83Å; D114-G117 PolarHBondContact OD1-N 3.26Å; D114-I118 VanDerWaalsContact O-CG1 3.25Å; D114-I118 WeakPolarHBondContact O-CG1 3.41Å; D114-I118 PolarHBondContact O-N 3.15Å
115	S	95.8	Very high	95.1	Very high	37 Å²	37	65.6 Å²	65.6	26%	0.259	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-30.1	-177.7	-54.1	0	0	0	0	112.5	A104 R106 Q119	A104-S115 WeakPolarHBondContact CB-O 3.44Å; R106-S115 PolarHBondContact NE-OG 3Å; S115-Q119 VanDerWaalsContact O-CD 3.23Å; S115-Q119 WeakPolarHBondContact O-CG 3.24Å; S115-Q119 PolarHBondContact O-N 3.41Å
116	H	96.7	Very high	95.3	Very high	103 Å²	103	58.9 Å²	58.9	48%	0.477	29%	0.294	S	S	.	.	H	α-helix	trans	-76.6	-43.3	178.6	-174.8	59.4	0	0	0	110.9	D114 I118 Q119 Q120	D114-H116 PolarHBondContact O-N 3.36Å; D114-H116 WeakPolarHBondContact OD1-CA 3.47Å; D114-H116 WeakPolarHBondContact OD1-CB 3.19Å; D114-H116 PolarHBondContact OD1-N 2.95Å; H116-I118 VanDerWaalsContact C-N 3.33Å; H116-I118 PolarHBondContact O-N 3.17Å; H116-Q119 WeakPolarHBondContact O-CB 3.25Å; H116-Q119 PolarHBondContact O-N 2.88Å; H116-Q119 VanDerWaalsContact O-N 3.07Å; H116-Q120 PolarHBondContact NE2-NE2 2.77Å; H116-Q120 PolarHBondContact O-N 2.84Å
117	G	97.5	Very high	95.4	Very high	13 Å²	13	60.2 Å²	60.2	13%	0.134	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-42.8	173.8	0	0	0	0	0	112.1	D114 Q119 Q120 Y121	D114-G117 PolarHBondContact O-N 2.83Å; D114-G117 PolarHBondContact OD1-N 3.26Å; G117-Q119 VanDerWaalsContact C-N 3.32Å; G117-Q119 PolarHBondContact O-N 2.82Å; G117-Q120 PolarHBondContact O-N 2.89Å; G117-Y121 VanDerWaalsContact O-CB 3.24Å; G117-Y121 WeakPolarHBondContact O-CB 3.37Å; G117-Y121 PolarHBondContact O-N 2.93Å
118	I	97.4	Very high	95.8	Very high	1 Å²	1	62 Å²	62	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-42	173.9	-65.1	166.2	0	0	0	111	A104 R106 F111 L113 D114 H116 L122 V146 I148	A104-I118 HydrophobicContact CB-CB 3.88Å; A104-I118 HydrophobicContact CB-CD1 4.41Å; A104-I118 HydrophobicContact CB-CG2 3.71Å; R106-I118 HydrophobicContact CG-CD1 3.98Å; F111-I118 HydrophobicContact CD1-CD1 3.85Å; F111-I118 HydrophobicContact CD1-CG1 4.28Å; F111-I118 HydrophobicContact CE1-CD1 3.92Å; F111-I118 HydrophobicContact CE1-CG1 3.97Å; L113-I118 HydrophobicContact CB-CG1 3.8Å; D114-I118 VanDerWaalsContact O-CG1 3.25Å; D114-I118 WeakPolarHBondContact O-CG1 3.41Å; D114-I118 PolarHBondContact O-N 3.15Å; H116-I118 VanDerWaalsContact C-N 3.33Å; H116-I118 PolarHBondContact O-N 3.17Å; I118-L122 HydrophobicContact CG2-CD1 3.68Å; I118-L122 HydrophobicContact CG2-CG 4.22Å; I118-L122 WeakPolarHBondContact O-CB 3.5Å; I118-L122 WeakPolarHBondContact O-CG 3.33Å; I118-L122 PolarHBondContact O-N 2.92Å; I118-V146 HydrophobicContact CG2-CG1 4.35Å; I118-I148 HydrophobicContact CD1-CD1 4.31Å; I118-I148 HydrophobicContact CD1-CG1 3.67Å
119	Q	98.1	Very high	96.2	Very high	64 Å²	64	63.1 Å²	63.1	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-42.1	179.7	-72.9	162	-7.5	0	0	112.2	I102 A104 S115 H116 G117 G123	I102-Q119 HydrophobicContact CB-CG 4.46Å; I102-Q119 HydrophobicContact CG2-CG 4.22Å; A104-Q119 HydrophobicContact CB-CG 4.02Å; S115-Q119 VanDerWaalsContact O-CD 3.23Å; S115-Q119 WeakPolarHBondContact O-CG 3.24Å; S115-Q119 PolarHBondContact O-N 3.41Å; H116-Q119 WeakPolarHBondContact O-CB 3.25Å; H116-Q119 PolarHBondContact O-N 2.88Å; H116-Q119 VanDerWaalsContact O-N 3.07Å; G117-Q119 VanDerWaalsContact C-N 3.32Å; G117-Q119 PolarHBondContact O-N 2.82Å; Q119-G123 WeakPolarHBondContact O-CA 3.49Å; Q119-G123 PolarHBondContact O-N 3.5Å
120	Q	97.6	Very high	96.5	Very high	106 Å²	106	57.1 Å²	57.1	50%	0.495	29%	0.288	S	S	.	.	H	α-helix	trans	-67.4	-53.7	177	-70.7	178.4	-46.5	0	0	110.7	H116 G117 L122 G123 D124	H116-Q120 PolarHBondContact NE2-NE2 2.77Å; H116-Q120 PolarHBondContact O-N 2.84Å; G117-Q120 PolarHBondContact O-N 2.89Å; Q120-L122 PolarHBondContact O-N 2.91Å; Q120-G123 WeakPolarHBondContact O-CA 3.28Å; Q120-G123 PolarHBondContact O-N 3.41Å; Q120-D124 PolarHBondContact O-N 2.82Å
121	Y	98	Very high	96.6	Very high	73 Å²	73	53.7 Å²	53.7	29%	0.286	28%	0.282	S	S	.	.	H	α-helix	trans	-56.2	-47.6	-178	177.6	-98.8	0	0	0	112.9	L79 K83 L113 G117 A125	L79-Y121 HydrophobicContact CB-CE1 3.8Å; L79-Y121 HydrophobicContact CD2-CD1 3.72Å; L79-Y121 HydrophobicContact CD2-CE1 3.83Å; L79-Y121 HydrophobicContact CD2-CG 4.23Å; L79-Y121 HydrophobicContact CG-CE1 4.33Å; L79-Y121 WeakPolarHBondContact O-CE1 3.46Å; L79-Y121 PolarHBondContact O-OH 2.89Å; K83-Y121 HydrophobicContact CB-CE1 3.97Å; L113-Y121 HydrophobicContact CD1-CG 4.28Å; G117-Y121 VanDerWaalsContact O-CB 3.24Å; G117-Y121 WeakPolarHBondContact O-CB 3.37Å; G117-Y121 PolarHBondContact O-N 2.93Å; Y121-A125 PolarHBondContact O-N 3.43Å; Y121-A125 VanDerWaalsContact O-N 3.11Å
122	L	98.1	Very high	96.7	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-76.8	-26.2	178.2	-61.7	-178.6	0	0	0	112.5	L82 T86 I102 I118 Q120 A125 V126 V146	L82-L122 HydrophobicContact CB-CD1 4.49Å; L82-L122 HydrophobicContact CB-CD2 3.97Å; T86-L122 HydrophobicContact CG2-CB 4.4Å; I102-L122 HydrophobicContact CD1-CB 4.34Å; I102-L122 HydrophobicContact CG1-CB 4.22Å; I102-L122 HydrophobicContact CG2-CB 4.32Å; I118-L122 HydrophobicContact CG2-CD1 3.68Å; I118-L122 HydrophobicContact CG2-CG 4.22Å; I118-L122 WeakPolarHBondContact O-CB 3.5Å; I118-L122 WeakPolarHBondContact O-CG 3.33Å; I118-L122 PolarHBondContact O-N 2.92Å; Q120-L122 PolarHBondContact O-N 2.91Å; L122-A125 PolarHBondContact O-N 2.83Å; L122-V126 WeakPolarHBondContact O-CG2 3.42Å; L122-V126 PolarHBondContact O-N 2.81Å; L122-V146 HydrophobicContact CD1-CB 4.48Å; L122-V146 HydrophobicContact CD1-CG1 4.35Å; L122-V146 HydrophobicContact CD1-CG2 3.73Å
123	G	97.5	Very high	96.9	Very high	9 Å²	9	53.2 Å²	53.2	9%	0.093	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-46.4	171.4	0	0	0	0	0	111.9	Q119 Q120 V126 M127	Q119-G123 WeakPolarHBondContact O-CA 3.49Å; Q119-G123 PolarHBondContact O-N 3.5Å; Q120-G123 WeakPolarHBondContact O-CA 3.28Å; Q120-G123 PolarHBondContact O-N 3.41Å; G123-V126 WeakPolarHBondContact O-CB 3.11Å; G123-V126 PolarHBondContact O-N 3.29Å; G123-M127 PolarHBondContact O-N 2.93Å
124	D	97.5	Very high	97	Very high	97 Å²	97	58.2 Å²	58.2	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-43.5	175.2	-63.6	-20.1	0	0	0	110.6	Q120 V126 M127 D128	Q120-D124 PolarHBondContact O-N 2.82Å; D124-V126 VanDerWaalsContact C-N 3.26Å; D124-V126 PolarHBondContact O-N 3.18Å; D124-M127 PolarHBondContact O-N 3.49Å; D124-D128 PolarHBondContact O-N 2.84Å
125	A	97.7	Very high	97	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-35.2	175.4	0	0	0	0	0	113.5	K83 Q87 Y121 L122	K83-A125 HydrophobicContact CD-CB 4.16Å; K83-A125 HydrophobicContact CG-CB 3.82Å; Q87-A125 HydrophobicContact CG-CB 4.33Å; Q87-A125 VanDerWaalsContact CG-O 3.31Å; Q87-A125 WeakPolarHBondContact CG-O 3.45Å; Q87-A125 PolarHBondContact NE2-O 3.21Å; Y121-A125 PolarHBondContact O-N 3.43Å; Y121-A125 VanDerWaalsContact O-N 3.11Å; L122-A125 PolarHBondContact O-N 2.83Å
126	V	97.8	Very high	97.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66	-44.9	173.2	177.1	0	0	0	0	110.6	T86 M90 F100 I102 L122 G123 D124 D128 V129 C130 I133	T86-V126 HydrophobicContact CG2-CG2 3.64Å; M90-V126 HydrophobicContact CB-CG1 4.41Å; M90-V126 HydrophobicContact CE-CG1 3.87Å; M90-V126 HydrophobicContact CG-CB 4.42Å; M90-V126 HydrophobicContact CG-CG1 3.97Å; M90-V126 HydrophobicContact CG-CG2 3.78Å; M90-V126 HydrophobicContact SD-CG1 4.45Å; M90-V126 HydrophobicContact SD-CG2 4.46Å; F100-V126 HydrophobicContact CD1-CG1 4.42Å; F100-V126 HydrophobicContact CD2-CB 4.26Å; F100-V126 HydrophobicContact CD2-CG1 3.89Å; F100-V126 HydrophobicContact CD2-CG2 4.08Å; F100-V126 HydrophobicContact CE1-CG1 4.23Å; F100-V126 HydrophobicContact CE2-CB 3.64Å; F100-V126 HydrophobicContact CE2-CG1 3.68Å; F100-V126 HydrophobicContact CE2-CG2 3.67Å; F100-V126 HydrophobicContact CG-CG1 4.25Å; F100-V126 HydrophobicContact CZ-CB 3.91Å; F100-V126 HydrophobicContact CZ-CG1 3.85Å; F100-V126 HydrophobicContact CZ-CG2 4.43Å; I102-V126 HydrophobicContact CD1-CG2 4.06Å; L122-V126 WeakPolarHBondContact O-CG2 3.42Å; L122-V126 PolarHBondContact O-N 2.81Å; G123-V126 WeakPolarHBondContact O-CB 3.11Å; G123-V126 PolarHBondContact O-N 3.29Å; D124-V126 VanDerWaalsContact C-N 3.26Å; D124-V126 PolarHBondContact O-N 3.18Å; V126-D128 VanDerWaalsContact C-N 3.29Å; V126-D128 PolarHBondContact O-N 2.69Å; V126-V129 WeakPolarHBondContact O-CG2 3.42Å; V126-V129 PolarHBondContact O-N 3.09Å; V126-C130 WeakPolarHBondContact O-CB 3.48Å; V126-C130 PolarHBondContact O-N 3.46Å; V126-I133 HydrophobicContact CG1-CD1 4.12Å; V126-I133 HydrophobicContact CG1-CG2 3.85Å
127	M	96.6	Very high	97	Very high	82 Å²	82	59.3 Å²	59.3	40%	0.404	31%	0.314	S	S	.	.	H	α-helix	trans	-66.9	-29.9	-179.3	-65.4	-178	-169.2	0	0	112.7	F100 G123 D124 V129 C130 P131 A135	F100-M127 HydrophobicContact CE1-CE 4.3Å; F100-M127 HydrophobicContact CZ-CE 4.18Å; G123-M127 PolarHBondContact O-N 2.93Å; D124-M127 PolarHBondContact O-N 3.49Å; M127-V129 VanDerWaalsContact C-N 3.26Å; M127-V129 PolarHBondContact O-N 2.85Å; M127-C130 CarbonylContact O-C 3.49Å; M127-P131 WeakPolarHBondContact O-CA 3.29Å; M127-A135 HydrophobicContact CE-CB 4.4Å
128	D	97.1	Very high	96.9	Very high	102 Å²	102	67.3 Å²	67.3	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-57.7	-37.7	174.4	-72.9	-17.2	0	0	0	112.3	K83 D124 V126	K83-D128 IonicContact NZ-OD2 2.74Å; K83-D128 PolarHBondContact NZ-OD2 2.86Å; D124-D128 PolarHBondContact O-N 2.84Å; V126-D128 VanDerWaalsContact C-N 3.29Å; V126-D128 PolarHBondContact O-N 2.69Å
129	V	96.9	Very high	96.7	Very high	40 Å²	40	78.1 Å²	78.1	24%	0.242	39%	0.386	C	S	.	.	H	α-helix	trans	-105.3	-17.6	-176.2	-64.7	0	0	0	0	113.8	Q87 Q91 V126 M127	Q87-V129 HydrophobicContact CB-CG1 4.01Å; Q87-V129 HydrophobicContact CB-CG2 4.03Å; Q87-V129 HydrophobicContact CG-CB 4.48Å; Q87-V129 HydrophobicContact CG-CG1 3.78Å; Q87-V129 HydrophobicContact CG-CG2 3.84Å; Q91-V129 HydrophobicContact CG-CB 4.06Å; Q91-V129 HydrophobicContact CG-CG2 4.17Å; V126-V129 WeakPolarHBondContact O-CG2 3.42Å; V126-V129 PolarHBondContact O-N 3.09Å; M127-V129 VanDerWaalsContact C-N 3.26Å; M127-V129 PolarHBondContact O-N 2.85Å
130	C	96.1	Very high	96.7	Very high	7 Å²	7	76.4 Å²	76.4	5%	0.047	38%	0.38	C	S	.	.			trans	-131.8	71.1	178.8	-59.2	0	0	0	0	109.5	Y94 V126 M127 D132 I133	Y94-C130 HydrophobicContact CD1-CB 3.75Å; Y94-C130 HydrophobicContact CE1-CB 3.93Å; V126-C130 WeakPolarHBondContact O-CB 3.48Å; V126-C130 PolarHBondContact O-N 3.46Å; M127-C130 CarbonylContact O-C 3.49Å; C130-D132 PolarHBondContact O-N 3.05Å; C130-D132 VanDerWaalsContact O-N 3.16Å; C130-I133 HydrophobicContact CB-CB 3.97Å; C130-I133 HydrophobicContact CB-CG2 3.85Å; C130-I133 WeakPolarHBondContact O-CB 3.3Å; C130-I133 WeakPolarHBondContact O-CG2 3.47Å; C130-I133 PolarHBondContact O-N 3.34Å; C130-I133 VanDerWaalsContact O-N 3.11Å
131	P	94.5	Very high	96.6	Very high	102 Å²	102	76.4 Å²	76.4	66%	0.662	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.5	-170.5	23.2	-34.3	0	0	0	114.4	M127	M127-P131 WeakPolarHBondContact O-CA 3.29Å
132	D	95.5	Very high	96.6	Very high	132 Å²	132	73.6 Å²	73.6	71%	0.706	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-6.2	-179.5	-63.8	-48	0	0	0	113.9	C130	C130-D132 PolarHBondContact O-N 3.05Å; C130-D132 VanDerWaalsContact O-N 3.16Å
133	I	97.5	Very high	96.5	Very high	10 Å²	10	75.3 Å²	75.3	5%	0.051	38%	0.382	C	S	.	.			trans	-71.4	139.5	-176.9	-157.9	174.8	0	0	0	111.3	M90 Y94 E98 F100 V126 C130	M90-I133 HydrophobicContact CE-CD1 3.36Å; Y94-I133 HydrophobicContact CD2-CD1 3.74Å; Y94-I133 HydrophobicContact CD2-CG1 3.93Å; Y94-I133 HydrophobicContact CE1-CB 4.16Å; Y94-I133 HydrophobicContact CE2-CB 4Å; Y94-I133 HydrophobicContact CE2-CD1 3.95Å; Y94-I133 HydrophobicContact CE2-CG1 3.58Å; Y94-I133 HydrophobicContact CG-CD1 4.11Å; Y94-I133 WeakPolarHBondContact OH-CA 3.31Å; Y94-I133 PolarHBondContact OH-N 3.11Å; E98-I133 WeakPolarHBondContact O-CG1 3.33Å; F100-I133 HydrophobicContact CB-CD1 3.74Å; F100-I133 HydrophobicContact CB-CG1 4.36Å; F100-I133 HydrophobicContact CD1-CB 4.38Å; F100-I133 HydrophobicContact CD1-CD1 3.76Å; F100-I133 HydrophobicContact CD1-CG1 3.75Å; F100-I133 HydrophobicContact CD1-CG2 3.81Å; F100-I133 HydrophobicContact CE1-CG1 4.48Å; F100-I133 HydrophobicContact CE1-CG2 3.68Å; F100-I133 HydrophobicContact CG-CD1 3.87Å; F100-I133 HydrophobicContact CG-CG1 4.35Å; F100-I133 HydrophobicContact CZ-CG2 4.48Å; V126-I133 HydrophobicContact CG1-CD1 4.12Å; V126-I133 HydrophobicContact CG1-CG2 3.85Å; C130-I133 HydrophobicContact CB-CB 3.97Å; C130-I133 HydrophobicContact CB-CG2 3.85Å; C130-I133 WeakPolarHBondContact O-CB 3.3Å; C130-I133 WeakPolarHBondContact O-CG2 3.47Å; C130-I133 PolarHBondContact O-N 3.34Å; C130-I133 VanDerWaalsContact O-N 3.11Å
134	K	96.4	Very high	96.5	Very high	153 Å²	153	74.9 Å²	74.9	67%	0.665	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.1	-177.2	-65.7	178.7	-176	173.6	0	111.3	T99 F100	T99-K134 CarbonylContact C-O 3.57Å; T99-K134 VanDerWaalsContact CA-O 3.25Å; T99-K134 WeakPolarHBondContact CA-O 3.07Å; T99-K134 WeakPolarHBondContact CB-O 3.2Å; T99-K134 HydrophobicContact CG2-CB 4.28Å; F100-K134 PolarHBondContact N-O 2.91Å
135	A	96.7	Very high	96.5	Very high	60 Å²	60	74.2 Å²	74.2	50%	0.496	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.3	172.5	0	0	0	0	0	111	F100 M127 M137	F100-A135 HydrophobicContact CD1-CB 4.46Å; F100-A135 HydrophobicContact CE1-CB 3.92Å; F100-A135 HydrophobicContact CZ-CB 4.43Å; F100-A135 CarbonylContact O-C 3.53Å; F100-A135 WeakPolarHBondContact O-CA 3.37Å; M127-A135 HydrophobicContact CE-CB 4.4Å; A135-M137 HydrophobicContact CB-CE 4.16Å
136	Q	97.3	Very high	96.4	Very high	78 Å²	78	74.2 Å²	74.2	36%	0.364	37%	0.368	S	S	.	.			trans	-134.7	112.1	179.7	176.7	155.8	-57.2	0	0	111.3	T99 F100 K138 R139 P140	T99-Q136 HydrophobicContact CG2-CB 4.19Å; F100-Q136 PolarHBondContact O-N 3.06Å; Q136-K138 WeakPolarHBondContact CG-O 3.3Å; Q136-K138 PolarHBondContact NE2-O 3.08Å; Q136-K138 PolarHBondContact O-N 3.34Å; Q136-R139 PolarHBondContact NE2-O 3.19Å; Q136-P140 HydrophobicContact CB-CB 4.46Å; Q136-P140 WeakPolarHBondContact O-CB 3.41Å
137	M	95.1	Very high	96.3	Very high	114 Å²	114	76.8 Å²	76.8	56%	0.562	38%	0.38	S	S	*	.	S	Bend	trans	-78.6	-22.8	-172.6	-65.8	-57.3	110.6	0	0	114.6	K101 A135	K101-M137 HydrophobicContact CB-CE 4.44Å; K101-M137 HydrophobicContact CD-SD 4.35Å; K101-M137 HydrophobicContact CG-CE 4.1Å; K101-M137 HydrophobicContact CG-SD 4.15Å; K101-M137 PolarHBondContact NZ-O 3.08Å; A135-M137 HydrophobicContact CB-CE 4.16Å
138	K	95.5	Very high	96.2	Very high	181 Å²	181	72.9 Å²	72.9	79%	0.787	36%	0.361	S	S	*	.	S	Bend	trans	-116.5	122.9	-179.3	-67.5	-177.3	-179.2	177.8	0	109.5	Q136	Q136-K138 WeakPolarHBondContact CG-O 3.3Å; Q136-K138 PolarHBondContact NE2-O 3.08Å; Q136-K138 PolarHBondContact O-N 3.34Å
139	R	94	Very high	95.9	Very high	228 Å²	228	69.4 Å²	69.4	86%	0.86	34%	0.34	S	S	*	.	S	Bend	trans	48.4	56.8	-178.4	-57.5	-176	-65	-163.3	0.7	112.4	Q136	Q136-R139 PolarHBondContact NE2-O 3.19Å
140	P	96.5	Very high	95.4	Very high	28 Å²	28	77.1 Å²	77.1	18%	0.182	37%	0.365	C	S	.	.			trans	-64.5	154.3	170.2	31.9	-37	0	0	0	110.2	K101 Q136 I142 N143	K101-P140 HydrophobicContact CB-CB 3.9Å; K101-P140 HydrophobicContact CB-CG 3.69Å; K101-P140 HydrophobicContact CD-CG 4.31Å; Q136-P140 HydrophobicContact CB-CB 4.46Å; Q136-P140 WeakPolarHBondContact O-CB 3.41Å; P140-I142 WeakPolarHBondContact CB-O 3.18Å; P140-N143 HydrophobicContact CG-CB 4Å
141	D	96.8	Very high	95.1	Very high	107 Å²	107	80.8 Å²	80.8	57%	0.572	38%	0.384	S	S	*	.	S	Bend	trans	-70.1	-43.4	171.7	-54	-62.4	0	0	0	109.9	E98 T99	E98-D141 HydrophobicContact CB-CB 3.91Å; E98-D141 HydrophobicContact CG-CB 4.18Å; T99-D141 WeakPolarHBondContact CB-OD2 3.48Å; T99-D141 PolarHBondContact N-OD2 2.88Å; T99-D141 PolarHBondContact O-N 3.22Å; T99-D141 VanDerWaalsContact O-N 3.15Å; T99-D141 PolarHBondContact OG1-N 3.11Å; T99-D141 PolarHBondContact OG1-OD2 2.9Å
142	I	96.6	Very high	94.9	Very high	14 Å²	14	75.9 Å²	75.9	7%	0.072	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.5	175.5	-60.2	165	0	0	0	109.8	M90 I93 E98 T99 F100 K101 P140	M90-I142 HydrophobicContact CE-CD1 3.96Å; M90-I142 HydrophobicContact CE-CG2 4.28Å; M90-I142 HydrophobicContact SD-CG2 4.05Å; I93-I142 HydrophobicContact CD1-CD1 3.96Å; I93-I142 HydrophobicContact CD1-CG1 4.22Å; I93-I142 HydrophobicContact CD1-CG2 3.67Å; I93-I142 HydrophobicContact CG1-CD1 3.89Å; E98-I142 HydrophobicContact CB-CD1 3.61Å; E98-I142 HydrophobicContact CB-CG1 4.02Å; E98-I142 HydrophobicContact CG-CD1 3.96Å; E98-I142 HydrophobicContact CG-CG1 4.26Å; T99-I142 PolarHBondContact O-N 3.27Å; F100-I142 CarbonylContact C-O 3.59Å; F100-I142 VanDerWaalsContact CA-O 3.24Å; F100-I142 WeakPolarHBondContact CA-O 3.07Å; F100-I142 HydrophobicContact CB-CB 4.23Å; K101-I142 PolarHBondContact N-O 3.41Å; P140-I142 WeakPolarHBondContact CB-O 3.18Å
143	N	97.1	Very high	94.9	Very high	36 Å²	36	69.6 Å²	69.6	19%	0.193	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	89.8	170.1	-176.4	9.8	0	0	0	110.3	K101 T103 P140 R145	K101-N143 CarbonylContact O-C 3.59Å; K101-N143 WeakPolarHBondContact O-CA 2.98Å; K101-N143 PolarHBondContact O-OD1 2.91Å; T103-N143 WeakPolarHBondContact CB-OD1 3.4Å; T103-N143 PolarHBondContact OG1-ND2 3.14Å; T103-N143 PolarHBondContact OG1-OD1 3.3Å; P140-N143 HydrophobicContact CG-CB 4Å; N143-R145 PolarHBondContact O-N 3.13Å; N143-R145 VanDerWaalsContact O-N 3.15Å
144	L	97.7	Very high	94.8	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	107.3	176	-176.4	63.1	0	0	0	109.4	T86 I89 M90 K101 I102 T103 L155	T86-L144 HydrophobicContact CG2-CD2 3.65Å; I89-L144 HydrophobicContact CD1-CD1 4.14Å; I89-L144 HydrophobicContact CG2-CD1 4.21Å; M90-L144 HydrophobicContact SD-CD2 4.46Å; K101-L144 PolarHBondContact O-N 2.93Å; I102-L144 WeakPolarHBondContact CA-O 3.41Å; I102-L144 HydrophobicContact CD1-CB 3.86Å; I102-L144 HydrophobicContact CD1-CD2 3.8Å; I102-L144 HydrophobicContact CD1-CG 4.2Å; T103-L144 PolarHBondContact N-O 3.04Å; L144-L155 HydrophobicContact CD1-CB 4.31Å; L144-L155 HydrophobicContact CD2-CD2 4.45Å
145	R	96.6	Very high	94.8	Very high	83 Å²	83	63.4 Å²	63.4	31%	0.313	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	129	178.6	-58.4	176.8	-177.8	162.8	6.9	109.3	T103 N143 L155 S156 T159	T103-R145 CarbonylContact O-C 3.54Å; T103-R145 VanDerWaalsContact O-CA 3.3Å; T103-R145 WeakPolarHBondContact O-CA 3.47Å; N143-R145 PolarHBondContact O-N 3.13Å; N143-R145 VanDerWaalsContact O-N 3.15Å; R145-L155 CarbonylContact O-C 3.59Å; R145-L155 WeakPolarHBondContact O-CA 3.27Å; R145-S156 WeakPolarHBondContact CA-O 3.46Å; R145-S156 WeakPolarHBondContact CB-O 3.39Å; R145-S156 PolarHBondContact N-O 3.27Å; R145-S156 PolarHBondContact O-N 3.24Å; R145-T159 PolarHBondContact NH1-OG1 3.32Å; R145-T159 PolarHBondContact NH2-OG1 2.79Å
146	V	96.9	Very high	94.7	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.2	176.6	-177.1	0	0	0	0	108	L82 I102 T103 A104 K105 I118 L122 I148 Y154 L155	L82-V146 HydrophobicContact CD2-CG1 3.73Å; I102-V146 HydrophobicContact CG2-CG2 4.37Å; T103-V146 PolarHBondContact O-N 3.25Å; A104-V146 CarbonylContact C-O 3.6Å; A104-V146 VanDerWaalsContact CA-O 3.31Å; A104-V146 WeakPolarHBondContact CA-O 3.41Å; K105-V146 PolarHBondContact N-O 3.02Å; I118-V146 HydrophobicContact CG2-CG1 4.35Å; L122-V146 HydrophobicContact CD1-CB 4.48Å; L122-V146 HydrophobicContact CD1-CG1 4.35Å; L122-V146 HydrophobicContact CD1-CG2 3.73Å; V146-I148 HydrophobicContact CG1-CD1 3.84Å; V146-Y154 CarbonylContact C-O 3.49Å; V146-Y154 WeakPolarHBondContact CA-O 3.37Å; V146-L155 HydrophobicContact CG2-CD2 4.49Å; V146-L155 HydrophobicContact CG2-CG 4.33Å
147	E	94.3	Very high	94.6	Very high	53 Å²	53	61.3 Å²	61.3	25%	0.248	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112.8	176	-165.4	-179.6	162.8	0	0	110.2	K105 R149 Y154	K105-E147 HydrophobicContact CB-CG 4.48Å; K105-E147 CarbonylContact O-C 3.36Å; K105-E147 WeakPolarHBondContact O-CA 3.28Å; E147-R149 HydrophobicContact CG-CG 4.12Å; E147-R149 IonicContact OE1-CZ 3.91Å; E147-R149 IonicContact OE1-NE 2.84Å; E147-R149 PolarHBondContact OE1-NE 3.36Å; E147-R149 IonicContact OE1-NH2 3.01Å; E147-R149 PolarHBondContact OE1-NH2 3.3Å; E147-R149 IonicContact OE2-CZ 3.67Å; E147-R149 IonicContact OE2-NE 2.97Å; E147-R149 IonicContact OE2-NH2 3.44Å; E147-R149 PolarHBondContact OE2-NH2 3.31Å; E147-Y154 PolarHBondContact N-O 2.76Å; E147-Y154 PolarHBondContact O-N 3.49Å
148	I	94.9	Very high	94.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.7	175	-48.3	-57.1	0	0	0	109.2	K77 L82 K105 R106 S107 D108 F111 I118 V146 A153	K77-I148 HydrophobicContact CD-CG2 4.4Å; L82-I148 HydrophobicContact CD1-CD1 3.87Å; L82-I148 HydrophobicContact CD2-CD1 4.38Å; K105-I148 PolarHBondContact O-N 3.3Å; R106-I148 HydrophobicContact CB-CB 4.42Å; R106-I148 HydrophobicContact CG-CB 4.1Å; R106-I148 HydrophobicContact CG-CG1 4.08Å; S107-I148 PolarHBondContact N-O 2.6Å; S107-I148 PolarHBondContact OG-O 3.45Å; S107-I148 VanDerWaalsContact OG-O 3.11Å; D108-I148 HydrophobicContact CB-CG2 4.34Å; D108-I148 PolarHBondContact N-O 2.82Å; F111-I148 HydrophobicContact CB-CG2 3.86Å; F111-I148 HydrophobicContact CD1-CG1 4.31Å; F111-I148 HydrophobicContact CD1-CG2 4.41Å; F111-I148 HydrophobicContact CD2-CG2 3.9Å; F111-I148 HydrophobicContact CG-CG2 3.79Å; I118-I148 HydrophobicContact CD1-CD1 4.31Å; I118-I148 HydrophobicContact CD1-CG1 3.67Å; V146-I148 HydrophobicContact CG1-CD1 3.84Å; I148-A153 HydrophobicContact CD1-CB 3.75Å
149	R	90.4	Very high	94.4	Very high	29 Å²	29	53.7 Å²	53.7	11%	0.109	24%	0.239	C	C	.	.			trans	-120.2	178.3	179.1	-59.5	-168.8	173.9	165.8	3.6	111.3	M1 H45 K77 S107 E147 D151 G152 Y154	M1-R149 PolarHBondContact SD-NH2 3.42Å; H45-R149 PolarHBondContact CE1-NH1 3.28Å; H45-R149 VanDerWaalsContact CE1-NH1 3.34Å; H45-R149 PolarHBondContact NE2-NH1 2.9Å; K77-R149 WeakPolarHBondContact CD-O 3.13Å; K77-R149 PolarHBondContact NZ-O 3.16Å; S107-R149 WeakPolarHBondContact OG-CA 3.45Å; E147-R149 HydrophobicContact CG-CG 4.12Å; E147-R149 IonicContact OE1-CZ 3.91Å; E147-R149 IonicContact OE1-NE 2.84Å; E147-R149 PolarHBondContact OE1-NE 3.36Å; E147-R149 IonicContact OE1-NH2 3.01Å; E147-R149 PolarHBondContact OE1-NH2 3.3Å; E147-R149 IonicContact OE2-CZ 3.67Å; E147-R149 IonicContact OE2-NE 2.97Å; E147-R149 IonicContact OE2-NH2 3.44Å; E147-R149 PolarHBondContact OE2-NH2 3.31Å; R149-D151 VanDerWaalsContact C-N 3.29Å; R149-D151 WeakPolarHBondContact CB-OD1 3.23Å; R149-G152 PolarHBondContact N-O 2.87Å; R149-Y154 HydrophobicContact CB-CD2 4.47Å; R149-Y154 HydrophobicContact CB-CE2 4.23Å; R149-Y154 HydrophobicContact CG-CD2 4.08Å; R149-Y154 HydrophobicContact CG-CE2 4.18Å
150	R	87.3	Confident	94.5	Very high	203 Å²	203	44.3 Å²	44.3	77%	0.766	21%	0.205	S	C	*	.	S	Bend	trans	-70.4	-30.2	177.7	-71.5	-174.7	179	-179.8	-1.4	112.4	K77 D108	K77-R150 WeakPolarHBondContact CE-O 3.49Å; K77-R150 VanDerWaalsContact NZ-C 3.31Å; K77-R150 PolarHBondContact NZ-O 2.79Å; D108-R150 HydrophobicContact CB-CG 4.34Å
151	D	88.9	Confident	94.5	Very high	83 Å²	83	51.2 Å²	51.2	44%	0.444	23%	0.233	S	C	.	.	S	Bend	trans	-99.8	-7.9	-171.9	62.9	-54.6	0	0	0	114.5	R74 R149 Y154	R74-D151 PolarHBondContact NE-O 2.75Å; R74-D151 PolarHBondContact NH2-O 2.76Å; R149-D151 VanDerWaalsContact C-N 3.29Å; R149-D151 WeakPolarHBondContact CB-OD1 3.23Å; D151-Y154 PolarHBondContact OD2-OH 3.06Å
152	G	92	Very high	94.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.214	C	C	.	.			trans	168.9	175.4	-177.2	0	0	0	0	0	112.9	K77 R149	K77-G152 VanDerWaalsContact CG-CA 3.5Å; R149-G152 PolarHBondContact N-O 2.87Å
153	A	94.8	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.8	166.6	0	0	0	0	0	109.5	R74 V75 K77 L82 I148	R74-A153 WeakPolarHBondContact CA-O 3.49Å; V75-A153 HydrophobicContact CG2-CB 3.91Å; V75-A153 PolarHBondContact N-O 2.92Å; V75-A153 PolarHBondContact O-N 3.39Å; K77-A153 HydrophobicContact CG-CB 4.42Å; L82-A153 HydrophobicContact CD2-CB 3.66Å; L82-A153 HydrophobicContact CG-CB 4.21Å; I148-A153 HydrophobicContact CD1-CB 3.75Å
154	Y	94.8	Very high	94.3	Very high	31 Å²	31	46.2 Å²	46.2	12%	0.122	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.2	-174.4	-65.8	-93.2	0	0	0	110.4	I73 R74 V146 E147 R149 D151	I73-Y154 WeakPolarHBondContact O-CA 3.38Å; R74-Y154 HydrophobicContact CB-CD1 4.06Å; R74-Y154 HydrophobicContact CB-CE1 3.8Å; R74-Y154 HydrophobicContact CG-CD1 4.43Å; R74-Y154 HydrophobicContact CG-CE1 3.93Å; V146-Y154 CarbonylContact C-O 3.49Å; V146-Y154 WeakPolarHBondContact CA-O 3.37Å; E147-Y154 PolarHBondContact N-O 2.76Å; E147-Y154 PolarHBondContact O-N 3.49Å; R149-Y154 HydrophobicContact CB-CD2 4.47Å; R149-Y154 HydrophobicContact CB-CE2 4.23Å; R149-Y154 HydrophobicContact CG-CD2 4.08Å; R149-Y154 HydrophobicContact CG-CE2 4.18Å; D151-Y154 PolarHBondContact OD2-OH 3.06Å
155	L	96.8	Very high	94.2	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.2	177.1	-63.1	87.1	0	0	0	110	S72 I73 V75 L82 M85 T86 I89 L144 R145 V146	S72-L155 CarbonylContact C-O 3.57Å; S72-L155 WeakPolarHBondContact CA-O 3.21Å; I73-L155 PolarHBondContact N-O 3.28Å; I73-L155 PolarHBondContact O-N 3.02Å; V75-L155 HydrophobicContact CG1-CD1 4.24Å; V75-L155 HydrophobicContact CG2-CD1 3.58Å; L82-L155 HydrophobicContact CD2-CD1 3.91Å; L82-L155 HydrophobicContact CD2-CG 4.42Å; M85-L155 HydrophobicContact CB-CD1 4.47Å; M85-L155 HydrophobicContact CB-CD2 4.29Å; M85-L155 HydrophobicContact CG-CD1 4.1Å; M85-L155 HydrophobicContact CG-CD2 4.07Å; T86-L155 WeakPolarHBondContact OG1-CD2 3.45Å; I89-L155 HydrophobicContact CD1-CB 3.82Å; I89-L155 HydrophobicContact CD1-CD2 3.97Å; L144-L155 HydrophobicContact CD1-CB 4.31Å; L144-L155 HydrophobicContact CD2-CD2 4.45Å; R145-L155 CarbonylContact O-C 3.59Å; R145-L155 WeakPolarHBondContact O-CA 3.27Å; V146-L155 HydrophobicContact CG2-CD2 4.49Å; V146-L155 HydrophobicContact CG2-CG 4.33Å
156	S	95.6	Very high	94.2	Very high	12 Å²	12	42.8 Å²	42.8	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	133.2	174.8	61.9	0	0	0	0	110.4	P71 R145	P71-S156 WeakPolarHBondContact O-CB 3.38Å; R145-S156 WeakPolarHBondContact CA-O 3.46Å; R145-S156 WeakPolarHBondContact CB-O 3.39Å; R145-S156 PolarHBondContact N-O 3.27Å; R145-S156 PolarHBondContact O-N 3.24Å
157	Y	93.7	Very high	94.2	Very high	82 Å²	82	42.7 Å²	42.7	32%	0.322	21%	0.205	S	C	.	.			trans	-108.6	-17.6	175.7	60.5	-83.5	0	0	0	112.6	I89 I93	I89-Y157 HydrophobicContact CG2-CD1 3.61Å; I89-Y157 HydrophobicContact CG2-CE1 3.96Å; I89-Y157 HydrophobicContact CG2-CG 4.35Å; I93-Y157 HydrophobicContact CD1-CD1 4.4Å; I93-Y157 HydrophobicContact CD1-CD2 3.84Å; I93-Y157 HydrophobicContact CD1-CE2 4.29Å; I93-Y157 HydrophobicContact CD1-CG 3.92Å; I93-Y157 HydrophobicContact CG2-CD2 4.38Å; I93-Y157 HydrophobicContact CG2-CE1 4.31Å; I93-Y157 HydrophobicContact CG2-CE2 3.77Å
158	E	92.6	Very high	94.3	Very high	81 Å²	81	40.5 Å²	40.5	38%	0.379	20%	0.195	S	C	.	.			trans	-103.9	153.3	-178.2	-54.3	-171.8	154.3	0	0	113.7	S70	S70-E158 VanDerWaalsContact CB-O 3.24Å; S70-E158 WeakPolarHBondContact CB-O 3.18Å; S70-E158 PolarHBondContact OG-O 2.98Å
159	T	93.9	Very high	94.3	Very high	55 Å²	55	41.7 Å²	41.7	34%	0.337	21%	0.208	S	C	.	.			trans	-138.7	104.2	166.9	-60.2	0	0	0	0	108.3	T68 F69 S70 R145	T68-T159 HydrophobicContact CG2-CG2 3.88Å; F69-T159 CarbonylContact O-C 3.51Å; F69-T159 WeakPolarHBondContact O-CA 3.41Å; S70-T159 PolarHBondContact OG-OG1 3.18Å; R145-T159 PolarHBondContact NH1-OG1 3.32Å; R145-T159 PolarHBondContact NH2-OG1 2.79Å
160	I	96	Very high	94.6	Very high	30 Å²	30	41.8 Å²	41.8	15%	0.154	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.3	-179.3	-57.6	166.9	0	0	0	108.2	L57 E61 T68 F69 P71	L57-I160 HydrophobicContact CD1-CD1 4.01Å; L57-I160 HydrophobicContact CD2-CD1 4.2Å; L57-I160 HydrophobicContact CG-CD1 4.47Å; E61-I160 HydrophobicContact CG-CG2 3.91Å; E61-I160 VanDerWaalsContact OE1-CG2 3.23Å; E61-I160 WeakPolarHBondContact OE1-CG2 3.47Å; T68-I160 CarbonylContact C-O 3.55Å; T68-I160 WeakPolarHBondContact CA-O 3.23Å; T68-I160 VanDerWaalsContact CB-O 3.28Å; T68-I160 WeakPolarHBondContact CB-O 3.47Å; F69-I160 HydrophobicContact CD2-CB 4.07Å; F69-I160 HydrophobicContact CD2-CD1 4.27Å; F69-I160 HydrophobicContact CE1-CB 4.2Å; F69-I160 HydrophobicContact CE1-CG2 3.89Å; F69-I160 HydrophobicContact CE2-CB 3.64Å; F69-I160 HydrophobicContact CE2-CD1 3.65Å; F69-I160 HydrophobicContact CE2-CG1 4.23Å; F69-I160 HydrophobicContact CE2-CG2 3.76Å; F69-I160 HydrophobicContact CZ-CB 3.73Å; F69-I160 HydrophobicContact CZ-CD1 4.35Å; F69-I160 HydrophobicContact CZ-CG2 3.36Å; F69-I160 PolarHBondContact N-O 3.26Å; F69-I160 PolarHBondContact O-N 2.83Å; P71-I160 HydrophobicContact CG-CD1 4.06Å
161	K	96.5	Very high	94.9	Very high	173 Å²	173	34.6 Å²	34.6	75%	0.752	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.3	176.2	-69.5	-178.3	-178.8	174	0	109.2
162	G	96.1	Very high	95.3	Very high	17 Å²	17	31.9 Å²	31.9	18%	0.175	18%	0.184	C	C	.	.			trans	-89.7	-178.9	166.7	0	0	0	0	0	111.6	E61 I66 Q67 G164	E61-G162 CarbonylContact O-C 3.59Å; I66-G162 CarbonylContact O-C 3.54Å; I66-G162 WeakPolarHBondContact O-CA 3.35Å; Q67-G162 PolarHBondContact O-N 3.26Å; G162-G164 PolarHBondContact O-N 3Å; G162-G164 VanDerWaalsContact O-N 3.14Å
163	A	95.5	Very high	95.6	Very high	19 Å²	19	35.2 Å²	35.2	16%	0.157	20%	0.197	C	C	.	.			trans	-64.2	-15.6	178.7	0	0	0	0	0	114.2	E61 F64	E61-A163 WeakPolarHBondContact O-CB 3.49Å; E61-A163 PolarHBondContact O-N 2.83Å; F64-A163 HydrophobicContact CD1-CB 3.48Å; F64-A163 VanDerWaalsContact CD1-CB 3.48Å; F64-A163 HydrophobicContact CE1-CB 3.76Å; F64-A163 HydrophobicContact CG-CB 4.26Å
164	G	95.4	Very high	95.8	Very high	16 Å²	16	35.2 Å²	35.2	17%	0.165	20%	0.197	C	C	.	.			trans	66.6	-154.9	-178.6	0	0	0	0	0	112.1	F64 G65 I66 G162	F64-G164 CarbonylContact C-O 3.52Å; F64-G164 WeakPolarHBondContact CA-O 3.33Å; G65-G164 PolarHBondContact N-O 2.96Å; I66-G164 VanDerWaalsContact O-CA 3.27Å; I66-G164 WeakPolarHBondContact O-CA 3.36Å; I66-G164 PolarHBondContact O-N 2.93Å; G162-G164 PolarHBondContact O-N 3Å; G162-G164 VanDerWaalsContact O-N 3.14Å
165	G	95.4	Very high	96	Very high	6 Å²	6	33.8 Å²	33.8	6%	0.062	19%	0.191	C	C	.	.	S	Bend	trans	69.1	-154.6	178.8	0	0	0	0	0	114	G65 K193	G65-G165 WeakPolarHBondContact CA-O 3.43Å; G165-K193 CarbonylContact C-O 3.55Å; G165-K193 VanDerWaalsContact CA-O 3.26Å; G165-K193 WeakPolarHBondContact CA-O 3.26Å
166	L	96.1	Very high	96.1	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.031	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-107	149.9	-179.7	-61.4	178	0	0	0	111	E6 F17 F64 V168 K193	E6-L166 HydrophobicContact CB-CD2 3.79Å; F17-L166 HydrophobicContact CD1-CD2 4.45Å; F17-L166 HydrophobicContact CE1-CD1 4.39Å; F17-L166 HydrophobicContact CE1-CD2 4.14Å; F64-L166 WeakPolarHBondContact CB-O 3.28Å; L166-V168 PolarHBondContact O-N 2.97Å; L166-K193 PolarHBondContact N-O 3.25Å
167	P	96.5	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.191	C	C	.	.			trans	-58.3	127.3	174.1	-17.7	30.2	0	0	0	110.9	R20 L21 F64 G169 T170 G195	R20-P167 HydrophobicContact CG-CB 4.29Å; L21-P167 HydrophobicContact CB-CB 4Å; L21-P167 HydrophobicContact CB-CG 3.74Å; L21-P167 HydrophobicContact CD1-CB 4.27Å; L21-P167 HydrophobicContact CD1-CG 4.24Å; L21-P167 HydrophobicContact CG-CG 4.38Å; F64-P167 WeakPolarHBondContact O-CA 3.27Å; P167-G169 PolarHBondContact O-N 2.94Å; P167-T170 HydrophobicContact CB-CG2 3.91Å; P167-T170 HydrophobicContact CG-CG2 4.2Å; P167-T170 WeakPolarHBondContact O-CB 3.13Å; P167-T170 VanDerWaalsContact O-CG2 3.3Å; P167-T170 WeakPolarHBondContact O-CG2 3.14Å; P167-T170 PolarHBondContact O-N 2.64Å; P167-T170 VanDerWaalsContact O-N 3.15Å; P167-T170 PolarHBondContact O-OG1 2.97Å; P167-G195 WeakPolarHBondContact O-CA 3.3Å
168	V	97	Very high	96.4	Very high	6 Å²	6	30.4 Å²	30.4	4%	0.036	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	134.7	177	179.3	0	0	0	0	110.7	R20 N24 F64 L166 M192 E197 V228	R20-V168 WeakPolarHBondContact CG-O 3.18Å; R20-V168 PolarHBondContact NE-O 3.18Å; R20-V168 PolarHBondContact NH2-O 2.9Å; N24-V168 PolarHBondContact ND2-N 2.7Å; N24-V168 PolarHBondContact ND2-O 3.15Å; F64-V168 HydrophobicContact CB-CG2 4.09Å; F64-V168 HydrophobicContact CD2-CG2 3.73Å; F64-V168 HydrophobicContact CG-CG2 4.38Å; L166-V168 PolarHBondContact O-N 2.97Å; V168-M192 HydrophobicContact CG2-CB 4.14Å; V168-M192 WeakPolarHBondContact CG2-O 2.81Å; V168-E197 HydrophobicContact CG1-CB 4.44Å; V168-V228 HydrophobicContact CB-CG1 3.91Å; V168-V228 HydrophobicContact CG1-CB 4.25Å; V168-V228 HydrophobicContact CG1-CG1 3.69Å; V168-V228 HydrophobicContact CG2-CG1 3.45Å; V168-V228 VanDerWaalsContact CG2-CG1 3.45Å
169	G	95.7	Very high	96.5	Very high	25 Å²	25	28.7 Å²	28.7	26%	0.258	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	-4.5	-174.6	0	0	0	0	0	114.9	P167 G195	P167-G169 PolarHBondContact O-N 2.94Å; G169-G195 CarbonylContact C-O 3.59Å; G169-G195 PolarHBondContact N-O 2.81Å
170	T	95.2	Very high	96.4	Very high	31 Å²	31	26.1 Å²	26.1	19%	0.19	16%	0.158	C	C	.	.	S	Bend	trans	-82.6	-15.2	175.5	62.8	0	0	0	0	114.1	F17 R20 P167 G195	F17-T170 HydrophobicContact CB-CG2 4.36Å; F17-T170 HydrophobicContact CD1-CG2 3.68Å; F17-T170 HydrophobicContact CD2-CG2 4.23Å; F17-T170 VanDerWaalsContact CE1-CB 3.49Å; F17-T170 HydrophobicContact CE1-CG2 3.92Å; F17-T170 WeakPolarHBondContact CE1-OG1 3.45Å; F17-T170 HydrophobicContact CE2-CG2 4.45Å; F17-T170 HydrophobicContact CG-CG2 3.84Å; F17-T170 HydrophobicContact CZ-CG2 4.3Å; R20-T170 HydrophobicContact CB-CG2 3.98Å; R20-T170 HydrophobicContact CG-CG2 3.95Å; P167-T170 HydrophobicContact CB-CG2 3.91Å; P167-T170 HydrophobicContact CG-CG2 4.2Å; P167-T170 WeakPolarHBondContact O-CB 3.13Å; P167-T170 VanDerWaalsContact O-CG2 3.3Å; P167-T170 WeakPolarHBondContact O-CG2 3.14Å; P167-T170 PolarHBondContact O-N 2.64Å; P167-T170 VanDerWaalsContact O-N 3.15Å; P167-T170 PolarHBondContact O-OG1 2.97Å; T170-G195 PolarHBondContact N-O 2.92Å
171	S	95.3	Very high	96.2	Very high	53 Å²	53	25.8 Å²	25.8	37%	0.371	16%	0.162	S	C	.	.	S	Bend	trans	-110.1	11	-176.4	-55.8	0	0	0	0	113.1	R194 G195	S171-R194 WeakPolarHBondContact CB-O 3.26Å; S171-R194 PolarHBondContact OG-O 2.86Å; S171-G195 WeakPolarHBondContact CB-O 3.43Å; S171-G195 PolarHBondContact N-O 3.19Å
172	G	96.6	Very high	96.2	Very high	26 Å²	26	18.5 Å²	18.5	27%	0.268	13%	0.132	S	C	.	.			trans	84.1	-170.6	-175.6	0	0	0	0	0	113.2	E197	G172-E197 PolarHBondContact O-N 2.8Å
173	R	98.4	Very high	96.3	Very high	70 Å²	70	18.5 Å²	18.5	26%	0.264	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.6	-175.7	-178	-176.9	-65.6	-167.8	-8.9	111.5	M175 E197 E199 R273 G275 L276	R173-M175 HydrophobicContact CG-CE 3.79Å; R173-E197 CarbonylContact C-O 3.59Å; R173-E197 WeakPolarHBondContact CA-O 3.43Å; R173-E197 IonicContact CZ-OE1 3.06Å; R173-E197 IonicContact NE-OE1 3.96Å; R173-E197 PolarHBondContact NE-OE1 2.72Å; R173-E197 IonicContact NH2-OE1 3.4Å; R173-E197 PolarHBondContact NH2-OE1 2.79Å; R173-E199 IonicContact CZ-OE1 3.51Å; R173-E199 VanDerWaalsContact CZ-OE1 3.31Å; R173-E199 IonicContact NE-OE1 2.86Å; R173-E199 IonicContact NH1-OE1 3.34Å; R173-E199 PolarHBondContact NH1-OE1 2.78Å; R173-E199 IonicContact NH2-OE1 2.76Å; R173-R273 WeakPolarHBondContact CD-O 3.23Å; R173-R273 PolarHBondContact NH1-O 3.39Å; R173-G275 CarbonylContact O-C 3.5Å; R173-G275 WeakPolarHBondContact O-CA 3.27Å; R173-L276 PolarHBondContact O-N 2.75Å
174	G	98.7	Very high	96.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	152.3	174.3	0	0	0	0	0	112.5	E197 I198 E199 V277	G174-E197 PolarHBondContact N-O 3.44Å; G174-I198 WeakPolarHBondContact O-CA 3.41Å; G174-E199 PolarHBondContact O-N 2.89Å; G174-E199 VanDerWaalsContact O-N 3.11Å; G174-V277 CarbonylContact C-O 3.59Å; G174-V277 VanDerWaalsContact CA-O 3.28Å; G174-V277 WeakPolarHBondContact CA-O 3.43Å
175	M	98.9	Very high	96.5	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	113.1	176.7	-60.5	-60.4	99.1	0	0	109.6	R173 E199 V201 T266 I269 R270 R273 V277 I278 I279	R173-M175 HydrophobicContact CG-CE 3.79Å; M175-E199 HydrophobicContact CE-CB 3.71Å; M175-E199 HydrophobicContact CE-CG 3.84Å; M175-E199 HydrophobicContact SD-CB 4.03Å; M175-V201 HydrophobicContact CB-CG2 4.03Å; M175-V201 HydrophobicContact CG-CG2 4.46Å; M175-V201 HydrophobicContact SD-CG2 4.25Å; M175-T266 HydrophobicContact CB-CG2 3.69Å; M175-T266 HydrophobicContact CG-CG2 4.48Å; M175-I269 HydrophobicContact SD-CG2 3.93Å; M175-R270 HydrophobicContact CB-CB 4.49Å; M175-R270 HydrophobicContact CG-CB 3.52Å; M175-R270 HydrophobicContact CG-CG 4.19Å; M175-R273 HydrophobicContact CE-CB 4.05Å; M175-R273 HydrophobicContact SD-CB 4.16Å; M175-R273 HydrophobicContact SD-CG 4.38Å; M175-V277 PolarHBondContact N-O 2.77Å; M175-I278 CarbonylContact O-C 3.56Å; M175-I278 WeakPolarHBondContact O-CA 3.39Å; M175-I279 PolarHBondContact O-N 3.08Å
176	L	98.8	Very high	96.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	113.1	176.1	174.3	65.6	0	0	0	109.8	L178 A187 I198 E199 A200 V201 L224 I279	L176-L178 HydrophobicContact CD2-CD1 3.79Å; L176-L178 HydrophobicContact CG-CB 4.44Å; L176-L178 HydrophobicContact CG-CD1 4.37Å; L176-L178 PolarHBondContact O-N 3.01Å; L176-A187 HydrophobicContact CD1-CB 4.44Å; L176-I198 HydrophobicContact CB-CB 4.38Å; L176-I198 HydrophobicContact CD2-CD1 3.79Å; L176-E199 PolarHBondContact N-O 2.64Å; L176-A200 CarbonylContact O-C 3.57Å; L176-A200 WeakPolarHBondContact O-CA 3.38Å; L176-V201 PolarHBondContact O-N 3.39Å; L176-L224 HydrophobicContact CD2-CD1 4.3Å; L176-I279 CarbonylContact C-O 3.51Å; L176-I279 WeakPolarHBondContact CA-O 3.48Å; L176-I279 HydrophobicContact CD1-CB 4.03Å; L176-I279 HydrophobicContact CD1-CG2 3.67Å
177	M	98.6	Very high	96.8	Very high	20 Å²	20	16.5 Å²	16.5	10%	0.099	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	99.1	168.3	-61.3	179	75.8	0	0	108.9	S184 V201 F203 M262 T266 I278 I279 N280	M177-S184 WeakPolarHBondContact O-CB 3.27Å; M177-V201 WeakPolarHBondContact CA-O 3.38Å; M177-F203 HydrophobicContact CE-CE2 3.88Å; M177-M262 HydrophobicContact CE-CB 3.65Å; M177-T266 HydrophobicContact CG-CG2 3.82Å; M177-T266 HydrophobicContact SD-CG2 4.48Å; M177-I278 HydrophobicContact CG-CG2 4.04Å; M177-I278 HydrophobicContact SD-CG2 3.92Å; M177-I279 PolarHBondContact N-O 2.88Å; M177-N280 HydrophobicContact CB-CB 4.29Å; M177-N280 HydrophobicContact SD-CB 4.32Å
178	L	97.6	Very high	96.9	Very high	5 Å²	5	16.5 Å²	16.5	3%	0.026	11%	0.109	C	C	.	.			trans	-99.8	121.5	-175.3	-166.9	84.2	0	0	0	110.3	L176 P185 A200 V201 H202 A217 T221 F233	L176-L178 HydrophobicContact CD2-CD1 3.79Å; L176-L178 HydrophobicContact CG-CB 4.44Å; L176-L178 HydrophobicContact CG-CD1 4.37Å; L176-L178 PolarHBondContact O-N 3.01Å; L178-P185 HydrophobicContact CD1-CG 4.1Å; L178-A200 HydrophobicContact CB-CB 4.22Å; L178-A200 HydrophobicContact CD2-CB 4.29Å; L178-V201 PolarHBondContact N-O 3.41Å; L178-H202 PolarHBondContact O-ND1 2.74Å; L178-A217 WeakPolarHBondContact CD2-O 2.8Å; L178-T221 WeakPolarHBondContact CD2-OG1 3.29Å; L178-F233 HydrophobicContact CD2-CE2 4.29Å
179	S	93.5	Very high	96.9	Very high	44 Å²	44	16.9 Å²	16.9	31%	0.308	11%	0.11	S	C	.	.			trans	-108.8	165.7	170.3	85	0	0	0	0	109.7	G181 S184 D337	S179-G181 PolarHBondContact O-N 3.27Å; S179-G181 PolarHBondContact OG-N 3.33Å; S179-S184 PolarHBondContact N-OG 3.2Å; S179-S184 PolarHBondContact O-OG 2.86Å; S179-S184 VanDerWaalsContact O-OG 3.07Å; S179-D337 VanDerWaalsContact CB-OD2 3.24Å; S179-D337 WeakPolarHBondContact CB-OD2 3.37Å; S179-D337 PolarHBondContact OG-OD2 3Å
180	G	92.2	Very high	97.1	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.01	11%	0.106	C	C	.	.	S	Bend	trans	-70.1	17.4	171.9	0	0	0	0	0	115.1	K216 D337	G180-K216 VanDerWaalsContact O-CE 3.25Å; G180-K216 WeakPolarHBondContact O-CE 3.33Å; G180-K216 PolarHBondContact O-NZ 3.3Å; G180-D337 WeakPolarHBondContact CA-OD1 3.19Å; G180-D337 WeakPolarHBondContact CA-OD2 3.33Å; G180-D337 PolarHBondContact N-OD1 2.91Å; G180-D337 PolarHBondContact N-OD2 3.49Å
181	G	92.8	Very high	97.2	Very high	23 Å²	23	16.1 Å²	16.1	24%	0.237	10%	0.1	C	C	.	.	S	Bend	trans	-106.1	167.8	-179.3	0	0	0	0	0	112.9	S179 D183 P185	S179-G181 PolarHBondContact O-N 3.27Å; S179-G181 PolarHBondContact OG-N 3.33Å; G181-D183 VanDerWaalsContact C-N 3.33Å; G181-D183 PolarHBondContact O-N 2.87Å; G181-P185 WeakPolarHBondContact O-CD 3.27Å
182	I	96.1	Very high	97.4	Very high	21 Å²	21	13.6 Å²	13.6	11%	0.108	8%	0.082	C	C	.	.	S	Bend	trans	-60.7	-39	-172.2	-57.9	170.4	0	0	0	112.6	P185 V186 I318 I319 A322 F328 A331 I332	I182-P185 WeakPolarHBondContact O-CD 3.43Å; I182-V186 WeakPolarHBondContact O-CG2 3.35Å; I182-I318 HydrophobicContact CG2-CG2 3.96Å; I182-I319 HydrophobicContact CD1-CG1 4.36Å; I182-A322 HydrophobicContact CG2-CB 3.52Å; I182-F328 HydrophobicContact CD1-CD2 4.01Å; I182-F328 HydrophobicContact CD1-CE2 3.83Å; I182-F328 HydrophobicContact CG1-CD2 4.41Å; I182-A331 HydrophobicContact CB-CB 4.32Å; I182-A331 HydrophobicContact CG1-CB 3.74Å; I182-I332 HydrophobicContact CD1-CG2 4.11Å; I182-I332 HydrophobicContact CG1-CG2 4.46Å
183	D	97.6	Very high	97.4	Very high	16 Å²	16	16.1 Å²	16.1	9%	0.086	9%	0.086	C	C	.	.	H	α-helix	trans	-78.3	-31.4	-160.9	-50.1	-4.1	0	0	0	112.7	G181 V186 A187 G281 Q286 K315 I318	G181-D183 VanDerWaalsContact C-N 3.33Å; G181-D183 PolarHBondContact O-N 2.87Å; D183-V186 PolarHBondContact O-N 3.26Å; D183-A187 WeakPolarHBondContact O-CB 3.21Å; D183-A187 PolarHBondContact O-N 2.79Å; D183-G281 VanDerWaalsContact CB-O 3.25Å; D183-G281 WeakPolarHBondContact CB-O 3.35Å; D183-Q286 PolarHBondContact OD2-NE2 3Å; D183-Q286 PolarHBondContact OD2-OE1 3.24Å; D183-K315 IonicContact OD1-NZ 3.86Å; D183-K315 PolarHBondContact OD1-NZ 3.03Å; D183-K315 IonicContact OD2-NZ 3.33Å; D183-I318 HydrophobicContact CB-CG2 4.41Å
184	S	97.4	Very high	97.4	Very high	5 Å²	5	17.9 Å²	17.9	4%	0.035	9%	0.093	C	C	.	.	H	α-helix	trans	-75.9	-39.7	-173.3	72.4	0	0	0	0	114.4	M177 S179 V186 A187 G188	M177-S184 WeakPolarHBondContact O-CB 3.27Å; S179-S184 PolarHBondContact N-OG 3.2Å; S179-S184 PolarHBondContact O-OG 2.86Å; S179-S184 VanDerWaalsContact O-OG 3.07Å; S184-V186 VanDerWaalsContact C-N 3.31Å; S184-V186 PolarHBondContact O-N 3.21Å; S184-A187 PolarHBondContact O-N 2.87Å; S184-G188 PolarHBondContact O-N 3.14Å
185	P	98.1	Very high	97.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.6	-40.7	168.2	-21.5	31	0	0	0	112.5	L178 G181 I182 A187 G188 Y189 L220 T327	L178-P185 HydrophobicContact CD1-CG 4.1Å; G181-P185 WeakPolarHBondContact O-CD 3.27Å; I182-P185 WeakPolarHBondContact O-CD 3.43Å; P185-A187 PolarHBondContact O-N 3.11Å; P185-G188 WeakPolarHBondContact O-CA 3.39Å; P185-G188 PolarHBondContact O-N 3.08Å; P185-Y189 PolarHBondContact O-N 3.2Å; P185-L220 HydrophobicContact CG-CB 4.07Å; P185-L220 HydrophobicContact CG-CD1 4.12Å; P185-L220 HydrophobicContact CG-CD2 3.97Å; P185-L220 HydrophobicContact CG-CG 4.28Å; P185-T327 HydrophobicContact CB-CG2 3.82Å
186	V	98.6	Very high	97.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.1	-43.7	176.4	173.2	0	0	0	0	111.2	I182 D183 S184 G188 Y189 L190 V310 I318 L321 A322 I325	I182-V186 WeakPolarHBondContact O-CG2 3.35Å; D183-V186 PolarHBondContact O-N 3.26Å; S184-V186 VanDerWaalsContact C-N 3.31Å; S184-V186 PolarHBondContact O-N 3.21Å; V186-G188 VanDerWaalsContact C-N 3.33Å; V186-G188 PolarHBondContact O-N 2.83Å; V186-Y189 PolarHBondContact O-N 2.8Å; V186-L190 HydrophobicContact CG1-CD1 4.08Å; V186-L190 HydrophobicContact CG1-CG 4.49Å; V186-L190 WeakPolarHBondContact O-CG 3.46Å; V186-L190 PolarHBondContact O-N 2.93Å; V186-V310 HydrophobicContact CB-CG1 4.5Å; V186-V310 HydrophobicContact CG1-CG1 3.79Å; V186-I318 HydrophobicContact CB-CG2 4.38Å; V186-I318 HydrophobicContact CG1-CG2 4.43Å; V186-I318 HydrophobicContact CG2-CG2 4.23Å; V186-L321 HydrophobicContact CG1-CB 4.16Å; V186-L321 HydrophobicContact CG1-CD2 3.53Å; V186-L321 HydrophobicContact CG1-CG 3.89Å; V186-A322 HydrophobicContact CG2-CB 3.72Å; V186-I325 HydrophobicContact CG2-CD1 4.14Å
187	A	98.7	Very high	97.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.2	0	0	0	0	0	112.2	L176 D183 S184 P185 L190 A191 I279 N280 P309	L176-A187 HydrophobicContact CD1-CB 4.44Å; D183-A187 WeakPolarHBondContact O-CB 3.21Å; D183-A187 PolarHBondContact O-N 2.79Å; S184-A187 PolarHBondContact O-N 2.87Å; P185-A187 PolarHBondContact O-N 3.11Å; A187-L190 PolarHBondContact O-N 3.3Å; A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.11Å; A187-I279 HydrophobicContact CB-CG2 4.38Å; A187-N280 WeakPolarHBondContact CB-O 3.48Å; A187-P309 HydrophobicContact CB-CB 4.45Å; A187-P309 HydrophobicContact CB-CG 4.05Å
188	G	98.6	Very high	97.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-55.6	-52.4	172.7	0	0	0	0	0	112.3	S184 P185 V186 L190 A191 M192	S184-G188 PolarHBondContact O-N 3.14Å; P185-G188 WeakPolarHBondContact O-CA 3.39Å; P185-G188 PolarHBondContact O-N 3.08Å; V186-G188 VanDerWaalsContact C-N 3.33Å; V186-G188 PolarHBondContact O-N 2.83Å; G188-L190 PolarHBondContact O-N 2.83Å; G188-A191 PolarHBondContact O-N 2.96Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.31Å; G188-M192 PolarHBondContact O-N 3.47Å
189	Y	98.6	Very high	97.3	Very high	14 Å²	14	21 Å²	21	6%	0.055	11%	0.108	C	C	.	.	H	α-helix	trans	-55.1	-46.3	176.4	171.6	-92.9	0	0	0	112.9	F64 P185 V186 M192 K193 Y227 L321 I325	F64-Y189 HydrophobicContact CE1-CE2 4.04Å; F64-Y189 HydrophobicContact CE2-CD2 4.38Å; F64-Y189 HydrophobicContact CE2-CE2 4.36Å; F64-Y189 AromaticContact CZ-CD2 3.71Å; F64-Y189 HydrophobicContact CZ-CD2 3.71Å; F64-Y189 HydrophobicContact CZ-CE1 4.46Å; F64-Y189 AromaticContact CZ-CE2 3.4Å; F64-Y189 HydrophobicContact CZ-CE2 3.4Å; F64-Y189 HydrophobicContact CZ-CG 4.37Å; F64-Y189 AromaticContact CZ-CZ 3.83Å; P185-Y189 PolarHBondContact O-N 3.2Å; V186-Y189 PolarHBondContact O-N 2.8Å; Y189-M192 PolarHBondContact O-N 3.36Å; Y189-K193 PolarHBondContact O-N 2.97Å; Y189-Y227 HydrophobicContact CD2-CD1 4.26Å; Y189-Y227 HydrophobicContact CD2-CD2 4.44Å; Y189-Y227 HydrophobicContact CD2-CE1 4.15Å; Y189-Y227 HydrophobicContact CD2-CE2 4.31Å; Y189-Y227 HydrophobicContact CD2-CG 4.43Å; Y189-Y227 AromaticContact CE2-CD1 3.9Å; Y189-Y227 HydrophobicContact CE2-CD1 3.9Å; Y189-Y227 AromaticContact CE2-CE1 3.58Å; Y189-Y227 HydrophobicContact CE2-CE1 3.58Å; Y189-Y227 HydrophobicContact CE2-CE2 4.48Å; Y189-Y227 AromaticContact CE2-CZ 3.9Å; Y189-L321 HydrophobicContact CD1-CD1 4.11Å; Y189-L321 HydrophobicContact CD1-CD2 4.14Å; Y189-L321 HydrophobicContact CD1-CG 4.31Å; Y189-L321 HydrophobicContact CE1-CD1 3.73Å; Y189-L321 HydrophobicContact CE1-CD2 4.31Å; Y189-L321 HydrophobicContact CE1-CG 4.41Å; Y189-I325 HydrophobicContact CD1-CG2 4.25Å; Y189-I325 HydrophobicContact CD2-CG2 3.64Å; Y189-I325 HydrophobicContact CE1-CG2 4.3Å; Y189-I325 HydrophobicContact CE2-CG2 3.68Å; Y189-I325 HydrophobicContact CG-CD1 4.14Å; Y189-I325 HydrophobicContact CG-CG2 3.93Å
190	L	98.6	Very high	97.5	Very high	34 Å²	34	19 Å²	19	18%	0.178	9%	0.094	C	C	.	.	H	α-helix	trans	-67.7	-35.5	179.5	-70.5	173	0	0	0	112.8	V186 A187 G188 K193 R194 P309 V310 M313 L321	V186-L190 HydrophobicContact CG1-CD1 4.08Å; V186-L190 HydrophobicContact CG1-CG 4.49Å; V186-L190 WeakPolarHBondContact O-CG 3.46Å; V186-L190 PolarHBondContact O-N 2.93Å; A187-L190 PolarHBondContact O-N 3.3Å; G188-L190 PolarHBondContact O-N 2.83Å; L190-K193 WeakPolarHBondContact O-CB 3.44Å; L190-R194 PolarHBondContact O-N 3.48Å; L190-P309 HydrophobicContact CB-CB 3.6Å; L190-P309 HydrophobicContact CB-CG 4.34Å; L190-P309 HydrophobicContact CD1-CB 3.78Å; L190-P309 HydrophobicContact CG-CB 4.36Å; L190-V310 HydrophobicContact CD1-CG1 3.85Å; L190-M313 HydrophobicContact CD1-SD 3.98Å; L190-L321 HydrophobicContact CD1-CD2 4.08Å; L190-L321 HydrophobicContact CD2-CD2 3.76Å; L190-L321 HydrophobicContact CG-CD2 3.91Å
191	A	98.6	Very high	97.8	Very high	6 Å²	6	18.9 Å²	18.9	5%	0.05	9%	0.093	C	C	.	.	H	α-helix	trans	-67.1	-45.9	174.2	0	0	0	0	0	111.6	A187 G188 K193 R194 V196 I198 I279	A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.11Å; G188-A191 PolarHBondContact O-N 2.96Å; A191-K193 VanDerWaalsContact C-N 3.29Å; A191-K193 PolarHBondContact O-N 2.85Å; A191-R194 CarbonylContact O-C 3.56Å; A191-R194 WeakPolarHBondContact O-CA 3.32Å; A191-R194 PolarHBondContact O-N 2.94Å; A191-V196 HydrophobicContact CB-CB 4.37Å; A191-V196 WeakPolarHBondContact O-CB 3.1Å; A191-V196 PolarHBondContact O-N 3.35Å; A191-I198 HydrophobicContact CB-CG2 4.5Å; A191-I279 HydrophobicContact CB-CD1 3.7Å; A191-I279 HydrophobicContact CB-CG1 4.27Å; A191-I279 HydrophobicContact CB-CG2 4.08Å
192	M	98.3	Very high	98.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-58.6	-40.2	175.3	-69.5	-174.6	-55.8	0	0	111.7	F64 V168 G188 Y189 R194 G195 I198 L224 V228	F64-M192 HydrophobicContact CD2-CB 4.03Å; F64-M192 HydrophobicContact CE2-CB 3.62Å; V168-M192 HydrophobicContact CG2-CB 4.14Å; V168-M192 WeakPolarHBondContact CG2-O 2.81Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.31Å; G188-M192 PolarHBondContact O-N 3.47Å; Y189-M192 PolarHBondContact O-N 3.36Å; M192-R194 PolarHBondContact O-N 2.97Å; M192-R194 VanDerWaalsContact O-N 3.11Å; M192-G195 WeakPolarHBondContact O-CA 3.11Å; M192-G195 PolarHBondContact O-N 3.16Å; M192-I198 HydrophobicContact CE-CD1 4.3Å; M192-I198 HydrophobicContact CG-CD1 3.97Å; M192-I198 HydrophobicContact CG-CG1 3.99Å; M192-I198 HydrophobicContact CG-CG2 4.06Å; M192-I198 HydrophobicContact SD-CD1 3.57Å; M192-I198 VanDerWaalsContact SD-CD1 3.57Å; M192-I198 HydrophobicContact SD-CG1 3.83Å; M192-L224 HydrophobicContact CE-CB 3.85Å; M192-L224 HydrophobicContact CE-CD1 4.32Å; M192-L224 HydrophobicContact CE-CD2 3.9Å; M192-L224 HydrophobicContact CE-CG 4.24Å; M192-V228 HydrophobicContact CB-CG1 4.15Å; M192-V228 HydrophobicContact CE-CG1 4.43Å; M192-V228 HydrophobicContact CG-CG1 3.94Å; M192-V228 HydrophobicContact SD-CB 4.12Å; M192-V228 HydrophobicContact SD-CG1 3.27Å; M192-V228 WeakPolarHBondContact SD-CG1 3.49Å; M192-V228 HydrophobicContact SD-CG2 3.7Å
193	K	97.6	Very high	98.1	Very high	79 Å²	79	17.7 Å²	17.7	34%	0.343	8%	0.081	S	C	.	.	H	α-helix	trans	-56.6	-28.4	173.6	-173.3	177.5	-179.7	-175.8	0	113.5	F64 G165 L166 Y189 L190 A191 G195	F64-K193 HydrophobicContact CD1-CB 3.86Å; F64-K193 HydrophobicContact CD1-CG 3.84Å; F64-K193 HydrophobicContact CE1-CB 3.4Å; F64-K193 HydrophobicContact CE1-CD 4.19Å; F64-K193 HydrophobicContact CE1-CG 3.57Å; F64-K193 HydrophobicContact CE2-CB 4.37Å; F64-K193 HydrophobicContact CZ-CB 3.67Å; F64-K193 HydrophobicContact CZ-CG 4.34Å; G165-K193 CarbonylContact C-O 3.55Å; G165-K193 VanDerWaalsContact CA-O 3.26Å; G165-K193 WeakPolarHBondContact CA-O 3.26Å; L166-K193 PolarHBondContact N-O 3.25Å; Y189-K193 PolarHBondContact O-N 2.97Å; L190-K193 WeakPolarHBondContact O-CB 3.44Å; A191-K193 VanDerWaalsContact C-N 3.29Å; A191-K193 PolarHBondContact O-N 2.85Å; K193-G195 VanDerWaalsContact C-N 3.31Å
194	R	97.4	Very high	98	Very high	107 Å²	107	17 Å²	17	40%	0.404	8%	0.078	S	C	.	.	B	Isolated β-bridge	trans	-92.1	14.5	175.1	-63.8	-49.7	-54.7	160.3	-6.6	113.5	E6 S171 L190 A191 M192	E6-R194 IonicContact OE1-CZ 3.66Å; E6-R194 IonicContact OE1-NH1 3.21Å; E6-R194 PolarHBondContact OE1-NH1 3.28Å; E6-R194 IonicContact OE2-CZ 2.79Å; E6-R194 IonicContact OE2-NH1 3.82Å; E6-R194 PolarHBondContact OE2-NH1 2.69Å; E6-R194 IonicContact OE2-NH2 2.74Å; E6-R194 PolarHBondContact OE2-NH2 2.87Å; S171-R194 WeakPolarHBondContact CB-O 3.26Å; S171-R194 PolarHBondContact OG-O 2.86Å; L190-R194 PolarHBondContact O-N 3.48Å; A191-R194 CarbonylContact O-C 3.56Å; A191-R194 WeakPolarHBondContact O-CA 3.32Å; A191-R194 PolarHBondContact O-N 2.94Å; M192-R194 PolarHBondContact O-N 2.97Å; M192-R194 VanDerWaalsContact O-N 3.11Å
195	G	96.7	Very high	97.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	12.6	172.8	0	0	0	0	0	114.2	P167 G169 T170 S171 M192 K193	P167-G195 WeakPolarHBondContact O-CA 3.3Å; G169-G195 CarbonylContact C-O 3.59Å; G169-G195 PolarHBondContact N-O 2.81Å; T170-G195 PolarHBondContact N-O 2.92Å; S171-G195 WeakPolarHBondContact CB-O 3.43Å; S171-G195 PolarHBondContact N-O 3.19Å; M192-G195 WeakPolarHBondContact O-CA 3.11Å; M192-G195 PolarHBondContact O-N 3.16Å; K193-G195 VanDerWaalsContact C-N 3.31Å
196	V	98.2	Very high	97.3	Very high	22 Å²	22	20.1 Å²	20.1	13%	0.133	10%	0.098	C	C	.	.			trans	-83.5	125.1	179.7	-173.9	0	0	0	0	109.9	A191 I198 I279	A191-V196 HydrophobicContact CB-CB 4.37Å; A191-V196 WeakPolarHBondContact O-CB 3.1Å; A191-V196 PolarHBondContact O-N 3.35Å; V196-I198 HydrophobicContact CG1-CG2 4.37Å; V196-I279 HydrophobicContact CG1-CD1 3.97Å
197	E	98.2	Very high	96.8	Very high	55 Å²	55	25.6 Å²	25.6	26%	0.257	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.8	167	-176.7	177.9	121.1	0	0	108.6	R20 V168 G172 R173 G174	R20-E197 IonicContact NH2-OE2 3Å; R20-E197 PolarHBondContact NH2-OE2 2.85Å; V168-E197 HydrophobicContact CG1-CB 4.44Å; G172-E197 PolarHBondContact O-N 2.8Å; R173-E197 CarbonylContact C-O 3.59Å; R173-E197 WeakPolarHBondContact CA-O 3.43Å; R173-E197 IonicContact CZ-OE1 3.06Å; R173-E197 IonicContact NE-OE1 3.96Å; R173-E197 PolarHBondContact NE-OE1 2.72Å; R173-E197 IonicContact NH2-OE1 3.4Å; R173-E197 PolarHBondContact NH2-OE1 2.79Å; G174-E197 PolarHBondContact N-O 3.44Å
198	I	98.5	Very high	96.2	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.046	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.1	-176.1	62.9	168.3	0	0	0	111.4	G174 L176 A191 M192 V196 L224 I231 I279	G174-I198 WeakPolarHBondContact O-CA 3.41Å; L176-I198 HydrophobicContact CB-CB 4.38Å; L176-I198 HydrophobicContact CD2-CD1 3.79Å; A191-I198 HydrophobicContact CB-CG2 4.5Å; M192-I198 HydrophobicContact CE-CD1 4.3Å; M192-I198 HydrophobicContact CG-CD1 3.97Å; M192-I198 HydrophobicContact CG-CG1 3.99Å; M192-I198 HydrophobicContact CG-CG2 4.06Å; M192-I198 HydrophobicContact SD-CD1 3.57Å; M192-I198 VanDerWaalsContact SD-CD1 3.57Å; M192-I198 HydrophobicContact SD-CG1 3.83Å; V196-I198 HydrophobicContact CG1-CG2 4.37Å; I198-L224 HydrophobicContact CD1-CD1 4.1Å; I198-I231 HydrophobicContact CD1-CD1 4.14Å; I198-I231 HydrophobicContact CG1-CD1 4.38Å; I198-I231 HydrophobicContact CG1-CG2 4.46Å; I198-I279 HydrophobicContact CG2-CD1 3.79Å
199	E	98.7	Very high	95.6	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.019	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.8	156.8	-55.9	-171.2	172.3	0	0	107.2	R173 G174 M175 L176 Q232 I234 R273	R173-E199 IonicContact CZ-OE1 3.51Å; R173-E199 VanDerWaalsContact CZ-OE1 3.31Å; R173-E199 IonicContact NE-OE1 2.86Å; R173-E199 IonicContact NH1-OE1 3.34Å; R173-E199 PolarHBondContact NH1-OE1 2.78Å; R173-E199 IonicContact NH2-OE1 2.76Å; G174-E199 PolarHBondContact O-N 2.89Å; G174-E199 VanDerWaalsContact O-N 3.11Å; M175-E199 HydrophobicContact CE-CB 3.71Å; M175-E199 HydrophobicContact CE-CG 3.84Å; M175-E199 HydrophobicContact SD-CB 4.03Å; L176-E199 PolarHBondContact N-O 2.64Å; E199-Q232 CarbonylContact C-O 3.55Å; E199-Q232 WeakPolarHBondContact CA-O 3.37Å; E199-Q232 HydrophobicContact CB-CB 4.11Å; E199-Q232 HydrophobicContact CG-CB 3.87Å; E199-Q232 HydrophobicContact CG-CG 4.3Å; E199-I234 HydrophobicContact CB-CD1 4.34Å; E199-R273 IonicContact OE1-CZ 2.83Å; E199-R273 IonicContact OE1-NE 3.19Å; E199-R273 PolarHBondContact OE1-NE 2.81Å; E199-R273 IonicContact OE1-NH2 3.09Å; E199-R273 PolarHBondContact OE1-NH2 3.41Å; E199-R273 WeakPolarHBondContact OE2-CG 3.45Å; E199-R273 IonicContact OE2-CZ 2.97Å; E199-R273 IonicContact OE2-NE 2.86Å; E199-R273 PolarHBondContact OE2-NE 2.95Å; E199-R273 IonicContact OE2-NH2 2.93Å; E199-R273 PolarHBondContact OE2-NH2 3.39Å
200	A	98.7	Very high	95.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.5	-178.6	0	0	0	0	0	109.8	L176 L178 T221 I231 Q232 F233 I234	L176-A200 CarbonylContact O-C 3.57Å; L176-A200 WeakPolarHBondContact O-CA 3.38Å; L178-A200 HydrophobicContact CB-CB 4.22Å; L178-A200 HydrophobicContact CD2-CB 4.29Å; A200-T221 HydrophobicContact CB-CG2 4.3Å; A200-I231 HydrophobicContact CB-CG2 4.3Å; A200-Q232 PolarHBondContact N-O 3.03Å; A200-F233 HydrophobicContact CB-CD2 4.02Å; A200-I234 WeakPolarHBondContact O-CB 3.22Å; A200-I234 PolarHBondContact O-N 3.2Å
201	V	98.8	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.1	175.3	-179	0	0	0	0	107.7	M175 L176 M177 L178 F203 I234 V236 T266 I269	M175-V201 HydrophobicContact CB-CG2 4.03Å; M175-V201 HydrophobicContact CG-CG2 4.46Å; M175-V201 HydrophobicContact SD-CG2 4.25Å; L176-V201 PolarHBondContact O-N 3.39Å; M177-V201 WeakPolarHBondContact CA-O 3.38Å; L178-V201 PolarHBondContact N-O 3.41Å; V201-F203 HydrophobicContact CG1-CE2 3.92Å; V201-F203 HydrophobicContact CG1-CZ 4Å; V201-I234 WeakPolarHBondContact CA-O 3.25Å; V201-I234 HydrophobicContact CG2-CB 4.46Å; V201-I234 HydrophobicContact CG2-CD1 4.44Å; V201-V236 HydrophobicContact CG1-CG2 3.59Å; V201-T266 HydrophobicContact CB-CG2 4.49Å; V201-T266 HydrophobicContact CG2-CG2 4.33Å; V201-I269 HydrophobicContact CG1-CD1 3.88Å; V201-I269 HydrophobicContact CG2-CG2 4.19Å
202	H	98.1	Very high	94.5	Very high	7 Å²	7	43.4 Å²	43.4	3%	0.032	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.2	-178.2	-178.3	70.3	0	0	0	110.7	L178 A217 F233 I234 V236 D337	L178-H202 PolarHBondContact O-ND1 2.74Å; H202-A217 VanDerWaalsContact CE1-CB 3.48Å; H202-A217 WeakPolarHBondContact CE1-CB 3.44Å; H202-F233 HydrophobicContact CB-CE1 4.07Å; H202-F233 HydrophobicContact CB-CE2 3.81Å; H202-F233 HydrophobicContact CB-CZ 3.38Å; H202-F233 AromaticContact CD2-CZ 3.94Å; H202-F233 AromaticContact CG-CZ 3.75Å; H202-I234 PolarHBondContact N-O 3.03Å; H202-V236 PolarHBondContact O-N 3.38Å; H202-D337 IonicContact CE1-OD1 2.87Å
203	F	97.1	Very high	94.1	Very high	11 Å²	11	43.4 Å²	43.4	5%	0.048	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.9	-179	-65.5	-90.6	0	0	0	110.3	M177 V201 V236 F238 M262 L265 T266 C338	M177-F203 HydrophobicContact CE-CE2 3.88Å; V201-F203 HydrophobicContact CG1-CE2 3.92Å; V201-F203 HydrophobicContact CG1-CZ 4Å; F203-V236 HydrophobicContact CD1-CB 3.76Å; F203-V236 HydrophobicContact CD1-CG1 3.72Å; F203-V236 HydrophobicContact CD1-CG2 4.39Å; F203-V236 HydrophobicContact CE1-CB 3.96Å; F203-V236 HydrophobicContact CE1-CG1 3.66Å; F203-V236 HydrophobicContact CE1-CG2 4.21Å; F203-V236 HydrophobicContact CG-CB 4.39Å; F203-F238 HydrophobicContact CB-CB 4.19Å; F203-F238 HydrophobicContact CB-CD1 4.43Å; F203-F238 HydrophobicContact CB-CG 4.27Å; F203-F238 HydrophobicContact CD1-CB 4.13Å; F203-F238 HydrophobicContact CD1-CD1 4.4Å; F203-F238 AromaticContact CD1-CD2 3.62Å; F203-F238 HydrophobicContact CD1-CD2 3.62Å; F203-F238 HydrophobicContact CD1-CE2 4.13Å; F203-F238 AromaticContact CD1-CG 3.79Å; F203-F238 HydrophobicContact CD1-CG 3.79Å; F203-F238 HydrophobicContact CE1-CD2 4.13Å; F203-F238 HydrophobicContact CE1-CE2 4.34Å; F203-F238 HydrophobicContact CG-CG 4.46Å; F203-M262 HydrophobicContact CB-CE 3.93Å; F203-M262 HydrophobicContact CD1-CG 3.93Å; F203-M262 HydrophobicContact CD2-CB 4.34Å; F203-M262 HydrophobicContact CD2-CE 4.38Å; F203-M262 HydrophobicContact CD2-CG 4Å; F203-M262 HydrophobicContact CD2-SD 4.24Å; F203-M262 HydrophobicContact CE1-CB 4.04Å; F203-M262 HydrophobicContact CE1-CG 3.95Å; F203-M262 HydrophobicContact CE2-CB 3.87Å; F203-M262 HydrophobicContact CE2-CG 4.03Å; F203-M262 HydrophobicContact CG-CE 4.07Å; F203-M262 HydrophobicContact CG-CG 3.96Å; F203-M262 HydrophobicContact CG-SD 4.42Å; F203-M262 HydrophobicContact CZ-CB 3.71Å; F203-M262 HydrophobicContact CZ-CG 4.01Å; F203-M262 VanDerWaalsContact CZ-O 3.29Å; F203-M262 WeakPolarHBondContact CZ-O 3.18Å; F203-L265 HydrophobicContact CE1-CB 3.98Å; F203-L265 HydrophobicContact CE1-CD1 3.8Å; F203-L265 HydrophobicContact CZ-CB 4.28Å; F203-T266 WeakPolarHBondContact CZ-OG1 3.26Å; F203-C338 PolarHBondContact O-SG 3.09Å
204	A	94.8	Very high	94	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.017	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	141	179.6	0	0	0	0	0	110.7	E235 V236 F238	A204-E235 HydrophobicContact CB-CG 4.02Å; A204-V236 PolarHBondContact N-O 3.25Å; A204-F238 PolarHBondContact O-N 2.88Å
205	S	92.7	Very high	93.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.			trans	-130.8	63.3	-177.4	-58	0	0	0	0	112	Y208 T209 T239 Q242	S205-Y208 WeakPolarHBondContact O-CA 3.4Å; S205-Y208 WeakPolarHBondContact O-CB 3.28Å; S205-Y208 PolarHBondContact O-N 2.82Å; S205-T209 PolarHBondContact N-OG1 2.85Å; S205-T209 PolarHBondContact O-N 3.47Å; S205-T209 PolarHBondContact O-OG1 3.18Å; S205-T239 WeakPolarHBondContact CA-OG1 3.42Å; S205-Q242 PolarHBondContact OG-OE1 2.83Å
206	P	88.2	Confident	93.8	Very high	70 Å²	70	40.7 Å²	40.7	46%	0.455	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	147	174.8	28.1	-34.6	0	0	0	111.2	Y208 T239	P206-Y208 VanDerWaalsContact C-N 3.31Å; P206-T239 WeakPolarHBondContact O-CG2 3.4Å; P206-T239 PolarHBondContact O-OG1 3.11Å
207	P	87	Confident	93.7	Very high	116 Å²	116	39.7 Å²	39.7	75%	0.753	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	cis	-83.5	4.1	2.5	35.8	-36.6	0	0	0	114
208	Y	86.8	Confident	93.6	Very high	102 Å²	102	38.8 Å²	38.8	40%	0.4	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-43.3	-176.1	-55.3	-78	0	0	0	112.7	S205 P206 T239 E243 I341 F342	S205-Y208 WeakPolarHBondContact O-CA 3.4Å; S205-Y208 WeakPolarHBondContact O-CB 3.28Å; S205-Y208 PolarHBondContact O-N 2.82Å; P206-Y208 VanDerWaalsContact C-N 3.31Å; Y208-T239 HydrophobicContact CD2-CG2 3.94Å; Y208-T239 HydrophobicContact CE2-CG2 3.75Å; Y208-E243 HydrophobicContact CE2-CG 4.44Å; Y208-E243 PolarHBondContact OH-OE1 3.29Å; Y208-I341 VanDerWaalsContact O-CD1 3.28Å; Y208-I341 WeakPolarHBondContact O-CD1 3.29Å; Y208-F342 HydrophobicContact CD1-CE2 4.42Å; Y208-F342 HydrophobicContact CD1-CZ 4.16Å; Y208-F342 AromaticContact CD2-CE2 3.87Å; Y208-F342 HydrophobicContact CD2-CE2 3.87Å; Y208-F342 AromaticContact CD2-CZ 3.49Å; Y208-F342 HydrophobicContact CD2-CZ 3.49Å; Y208-F342 VanDerWaalsContact CD2-CZ 3.49Å; Y208-F342 HydrophobicContact CE1-CZ 4.36Å; Y208-F342 AromaticContact CE2-CZ 3.71Å; Y208-F342 HydrophobicContact CE2-CZ 3.71Å; Y208-F342 AromaticContact CG-CE2 3.79Å; Y208-F342 HydrophobicContact CG-CE2 3.79Å; Y208-F342 AromaticContact CG-CZ 3.71Å; Y208-F342 HydrophobicContact CG-CZ 3.71Å
209	T	85.6	Confident	93.6	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.08	21%	0.209	C	C	.	.	S	Bend	trans	-83.2	127.4	170.6	53.6	0	0	0	0	109.9	S205 C338 I341	S205-T209 PolarHBondContact N-OG1 2.85Å; S205-T209 PolarHBondContact O-N 3.47Å; S205-T209 PolarHBondContact O-OG1 3.18Å; T209-C338 HydrophobicContact CG2-CB 3.85Å; T209-I341 HydrophobicContact CG2-CD1 3.88Å
210	S	88.2	Confident	93.5	Very high	44 Å²	44	40.1 Å²	40.1	31%	0.308	21%	0.208	S	C	.	.			trans	-75.6	161.5	178.1	79	0	0	0	0	112.3	Q212 A213 L214	S210-Q212 PolarHBondContact O-N 2.98Å; S210-Q212 PolarHBondContact OG-N 3.47Å; S210-Q212 PolarHBondContact OG-OE1 3.36Å; S210-A213 WeakPolarHBondContact O-CB 3.34Å; S210-A213 PolarHBondContact O-N 2.81Å; S210-A213 VanDerWaalsContact O-N 3.09Å; S210-A213 PolarHBondContact OG-N 2.95Å; S210-L214 PolarHBondContact O-N 2.99Å
211	E	91.5	Very high	93.5	Very high	164 Å²	164	40.1 Å²	40.1	77%	0.766	21%	0.208	S	C	*	.	H	α-helix	trans	-60.1	-33.4	173	-170.8	172.5	-162.3	0	0	111.5	A213 L214 Q215	E211-A213 VanDerWaalsContact C-N 3.34Å; E211-A213 PolarHBondContact O-N 3.27Å; E211-L214 PolarHBondContact O-N 3.12Å; E211-Q215 WeakPolarHBondContact O-CB 3.32Å; E211-Q215 PolarHBondContact O-N 3.21Å
212	Q	92.4	Very high	93.4	Very high	105 Å²	105	43.3 Å²	43.3	49%	0.491	22%	0.222	S	C	.	.	H	α-helix	trans	-65.4	-34.4	174.3	-57.6	89.7	-11.7	0	0	112.9	S210 Q215 K216 F335	S210-Q212 PolarHBondContact O-N 2.98Å; S210-Q212 PolarHBondContact OG-N 3.47Å; S210-Q212 PolarHBondContact OG-OE1 3.36Å; Q212-Q215 PolarHBondContact O-N 2.94Å; Q212-K216 WeakPolarHBondContact O-CB 3.28Å; Q212-K216 PolarHBondContact O-N 2.96Å; Q212-F335 HydrophobicContact CB-CD1 3.59Å; Q212-F335 HydrophobicContact CB-CD2 4.02Å; Q212-F335 HydrophobicContact CB-CE1 3.62Å; Q212-F335 HydrophobicContact CB-CE2 4.05Å; Q212-F335 HydrophobicContact CB-CG 3.8Å; Q212-F335 HydrophobicContact CB-CZ 3.86Å; Q212-F335 HydrophobicContact CG-CD1 4.37Å; Q212-F335 HydrophobicContact CG-CE1 3.95Å; Q212-F335 HydrophobicContact CG-CZ 4.13Å
213	A	91.8	Very high	93.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-67.4	-41.5	175.9	0	0	0	0	0	111.3	S210 E211 K216 A217 F335	S210-A213 WeakPolarHBondContact O-CB 3.34Å; S210-A213 PolarHBondContact O-N 2.81Å; S210-A213 VanDerWaalsContact O-N 3.09Å; S210-A213 PolarHBondContact OG-N 2.95Å; E211-A213 VanDerWaalsContact C-N 3.34Å; E211-A213 PolarHBondContact O-N 3.27Å; A213-K216 PolarHBondContact O-N 3.31Å; A213-A217 PolarHBondContact O-N 3.05Å; A213-F335 HydrophobicContact CB-CB 4.05Å
214	L	94.1	Very high	93.4	Very high	30 Å²	30	45.4 Å²	45.4	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-46.7	173	177.8	61.8	0	0	0	111	S210 E211 K216 A217 K218 F233 E235	S210-L214 PolarHBondContact O-N 2.99Å; E211-L214 PolarHBondContact O-N 3.12Å; L214-K216 VanDerWaalsContact C-N 3.33Å; L214-K216 PolarHBondContact O-N 3.16Å; L214-A217 WeakPolarHBondContact O-CB 3.28Å; L214-A217 PolarHBondContact O-N 3.42Å; L214-A217 VanDerWaalsContact O-N 3.13Å; L214-K218 WeakPolarHBondContact O-CG 3.23Å; L214-K218 PolarHBondContact O-N 2.92Å; L214-K218 VanDerWaalsContact O-N 3.08Å; L214-F233 HydrophobicContact CD1-CE1 3.95Å; L214-F233 HydrophobicContact CD1-CZ 4.09Å; L214-E235 HydrophobicContact CD1-CG 4.18Å; L214-E235 WeakPolarHBondContact CD2-OE2 3.44Å
215	Q	95.2	Very high	93.5	Very high	90 Å²	90	45.3 Å²	45.3	42%	0.421	23%	0.231	S	C	.	.	H	α-helix	trans	-60.6	-42.6	177.7	-170.8	59.3	46.2	0	0	111.4	E211 Q212 A217 K218 D219	E211-Q215 WeakPolarHBondContact O-CB 3.32Å; E211-Q215 PolarHBondContact O-N 3.21Å; Q212-Q215 PolarHBondContact O-N 2.94Å; Q215-A217 VanDerWaalsContact C-N 3.28Å; Q215-A217 PolarHBondContact O-N 3.38Å; Q215-K218 CarbonylContact O-C 3.57Å; Q215-K218 WeakPolarHBondContact O-CA 3.37Å; Q215-K218 WeakPolarHBondContact O-CB 3.17Å; Q215-K218 PolarHBondContact O-N 3.34Å; Q215-D219 PolarHBondContact NE2-OD1 2.99Å; Q215-D219 PolarHBondContact O-N 2.96Å
216	K	95.5	Very high	93.6	Very high	9 Å²	9	47.5 Å²	47.5	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-55	-43.4	174	179.9	177.5	65.9	159.5	0	112	G180 Q212 A213 L214 K218 D219 L220 L330 Q333 F335	G180-K216 VanDerWaalsContact O-CE 3.25Å; G180-K216 WeakPolarHBondContact O-CE 3.33Å; G180-K216 PolarHBondContact O-NZ 3.3Å; Q212-K216 WeakPolarHBondContact O-CB 3.28Å; Q212-K216 PolarHBondContact O-N 2.96Å; A213-K216 PolarHBondContact O-N 3.31Å; L214-K216 VanDerWaalsContact C-N 3.33Å; L214-K216 PolarHBondContact O-N 3.16Å; K216-K218 VanDerWaalsContact C-N 3.34Å; K216-D219 PolarHBondContact O-N 2.91Å; K216-L220 HydrophobicContact CG-CD1 4.22Å; K216-L220 WeakPolarHBondContact O-CB 3.39Å; K216-L220 VanDerWaalsContact O-CG 3.26Å; K216-L220 WeakPolarHBondContact O-CG 3.32Å; K216-L220 PolarHBondContact O-N 2.69Å; K216-L330 VanDerWaalsContact CD-O 3.24Å; K216-L330 WeakPolarHBondContact CD-O 3.4Å; K216-Q333 HydrophobicContact CD-CB 4.15Å; K216-Q333 PolarHBondContact NZ-O 2.64Å; K216-F335 VanDerWaalsContact CE-O 3.23Å; K216-F335 WeakPolarHBondContact CE-O 3.44Å; K216-F335 PolarHBondContact NZ-O 2.8Å
217	A	95.7	Very high	93.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-36.6	177.1	0	0	0	0	0	112.5	L178 H202 A213 L214 Q215 T221 F233	L178-A217 WeakPolarHBondContact CD2-O 2.8Å; H202-A217 VanDerWaalsContact CE1-CB 3.48Å; H202-A217 WeakPolarHBondContact CE1-CB 3.44Å; A213-A217 PolarHBondContact O-N 3.05Å; L214-A217 WeakPolarHBondContact O-CB 3.28Å; L214-A217 PolarHBondContact O-N 3.42Å; L214-A217 VanDerWaalsContact O-N 3.13Å; Q215-A217 VanDerWaalsContact C-N 3.28Å; Q215-A217 PolarHBondContact O-N 3.38Å; A217-T221 PolarHBondContact O-N 3.43Å; A217-T221 PolarHBondContact O-OG1 2.98Å; A217-F233 HydrophobicContact CB-CE2 4.13Å; A217-F233 HydrophobicContact CB-CZ 4.06Å
218	K	96.9	Very high	94.2	Very high	36 Å²	36	42 Å²	42	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-44.8	173.3	-63.6	-177.4	-173	-153.3	0	111.7	L214 Q215 K216 L220 T221 E222 F233 E379 I381	L214-K218 WeakPolarHBondContact O-CG 3.23Å; L214-K218 PolarHBondContact O-N 2.92Å; L214-K218 VanDerWaalsContact O-N 3.08Å; Q215-K218 CarbonylContact O-C 3.57Å; Q215-K218 WeakPolarHBondContact O-CA 3.37Å; Q215-K218 WeakPolarHBondContact O-CB 3.17Å; Q215-K218 PolarHBondContact O-N 3.34Å; K216-K218 VanDerWaalsContact C-N 3.34Å; K218-L220 VanDerWaalsContact C-N 3.33Å; K218-L220 PolarHBondContact O-N 3.33Å; K218-T221 CarbonylContact O-C 3.46Å; K218-T221 WeakPolarHBondContact O-CA 3.47Å; K218-T221 VanDerWaalsContact O-CB 3.23Å; K218-T221 WeakPolarHBondContact O-CB 3.39Å; K218-T221 PolarHBondContact O-N 3.41Å; K218-E222 PolarHBondContact O-N 3.18Å; K218-F233 HydrophobicContact CG-CD1 4.33Å; K218-F233 HydrophobicContact CG-CE1 4.02Å; K218-F233 HydrophobicContact CG-CE2 4.27Å; K218-F233 HydrophobicContact CG-CZ 3.97Å; K218-E379 WeakPolarHBondContact CD-OE1 3.36Å; K218-E379 WeakPolarHBondContact CE-OE1 3.15Å; K218-E379 IonicContact NZ-OE1 3.16Å; K218-E379 PolarHBondContact NZ-OE1 3.22Å; K218-E379 IonicContact NZ-OE2 3.99Å; K218-E379 PolarHBondContact NZ-OE2 3.33Å; K218-I381 HydrophobicContact CB-CD1 4.41Å
219	D	97	Very high	94.4	Very high	42 Å²	42	38.4 Å²	38.4	23%	0.225	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-40.4	178.3	-61	-15.8	0	0	0	111.1	Q215 K216 T221 E222 K223 L330	Q215-D219 PolarHBondContact NE2-OD1 2.99Å; Q215-D219 PolarHBondContact O-N 2.96Å; K216-D219 PolarHBondContact O-N 2.91Å; D219-T221 VanDerWaalsContact C-N 3.29Å; D219-T221 PolarHBondContact O-N 2.83Å; D219-E222 WeakPolarHBondContact O-CB 3.49Å; D219-E222 PolarHBondContact O-N 2.67Å; D219-K223 WeakPolarHBondContact O-CG 3.38Å; D219-K223 PolarHBondContact O-N 2.84Å; D219-L330 HydrophobicContact CB-CD1 4Å; D219-L330 HydrophobicContact CB-CD2 4.42Å
220	L	97.7	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-35.5	172.3	-73.2	172.2	0	0	0	112.4	P185 K216 K218 T327 L330 A331	P185-L220 HydrophobicContact CG-CB 4.07Å; P185-L220 HydrophobicContact CG-CD1 4.12Å; P185-L220 HydrophobicContact CG-CD2 3.97Å; P185-L220 HydrophobicContact CG-CG 4.28Å; K216-L220 HydrophobicContact CG-CD1 4.22Å; K216-L220 WeakPolarHBondContact O-CB 3.39Å; K216-L220 VanDerWaalsContact O-CG 3.26Å; K216-L220 WeakPolarHBondContact O-CG 3.32Å; K216-L220 PolarHBondContact O-N 2.69Å; K218-L220 VanDerWaalsContact C-N 3.33Å; K218-L220 PolarHBondContact O-N 3.33Å; L220-T327 HydrophobicContact CD2-CG2 4.18Å; L220-T327 WeakPolarHBondContact CD2-O 3.23Å; L220-L330 HydrophobicContact CD2-CB 3.74Å; L220-L330 HydrophobicContact CD2-CD1 4.43Å; L220-L330 HydrophobicContact CG-CB 4.32Å; L220-A331 HydrophobicContact CD1-CB 4.46Å; L220-A331 HydrophobicContact CD2-CB 4.19Å
221	T	98.1	Very high	95.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-65.6	-44.2	172.1	-54.6	0	0	0	0	110.5	L178 A200 A217 K218 D219 K223 L224 T225 I231 F233 I381	L178-T221 WeakPolarHBondContact CD2-OG1 3.29Å; A200-T221 HydrophobicContact CB-CG2 4.3Å; A217-T221 PolarHBondContact O-N 3.43Å; A217-T221 PolarHBondContact O-OG1 2.98Å; K218-T221 CarbonylContact O-C 3.46Å; K218-T221 WeakPolarHBondContact O-CA 3.47Å; K218-T221 VanDerWaalsContact O-CB 3.23Å; K218-T221 WeakPolarHBondContact O-CB 3.39Å; K218-T221 PolarHBondContact O-N 3.41Å; D219-T221 VanDerWaalsContact C-N 3.29Å; D219-T221 PolarHBondContact O-N 2.83Å; T221-K223 VanDerWaalsContact C-N 3.29Å; T221-K223 PolarHBondContact O-N 3.02Å; T221-L224 WeakPolarHBondContact O-CB 3.48Å; T221-L224 PolarHBondContact O-N 3.08Å; T221-T225 PolarHBondContact O-N 2.75Å; T221-I231 HydrophobicContact CG2-CB 3.86Å; T221-I231 HydrophobicContact CG2-CD1 4.26Å; T221-I231 HydrophobicContact CG2-CG2 3.64Å; T221-F233 HydrophobicContact CG2-CD2 4.32Å; T221-F233 VanDerWaalsContact OG1-CD2 3.3Å; T221-F233 WeakPolarHBondContact OG1-CD2 3.33Å; T221-I381 HydrophobicContact CG2-CB 4.09Å; T221-I381 HydrophobicContact CG2-CG1 4.08Å; T221-I381 HydrophobicContact CG2-CG2 4.37Å
222	E	97.5	Very high	95.6	Very high	66 Å²	66	31.8 Å²	31.8	31%	0.308	17%	0.17	S	C	.	.	H	α-helix	trans	-56.9	-42.2	178.1	-170.3	-173.4	-144.8	0	0	111.2	K218 D219 L224 T225 P226 I381	K218-E222 PolarHBondContact O-N 3.18Å; D219-E222 WeakPolarHBondContact O-CB 3.49Å; D219-E222 PolarHBondContact O-N 2.67Å; E222-L224 PolarHBondContact O-N 3.49Å; E222-L224 VanDerWaalsContact O-N 3.08Å; E222-T225 WeakPolarHBondContact O-CB 3.35Å; E222-T225 PolarHBondContact O-N 3.07Å; E222-T225 PolarHBondContact O-OG1 3.18Å; E222-P226 VanDerWaalsContact O-CD 3.29Å; E222-P226 WeakPolarHBondContact O-CD 3.24Å; E222-I381 HydrophobicContact CB-CG2 3.83Å; E222-I381 HydrophobicContact CG-CG2 4.31Å
223	K	97.1	Very high	95.9	Very high	61 Å²	61	26.8 Å²	26.8	27%	0.265	15%	0.147	S	C	.	.	H	α-helix	trans	-58.7	-22.6	176	-67.3	-63.6	-174	-179.7	0	114.5	D219 T221 P226 D326 T327 L330	D219-K223 WeakPolarHBondContact O-CG 3.38Å; D219-K223 PolarHBondContact O-N 2.84Å; T221-K223 VanDerWaalsContact C-N 3.29Å; T221-K223 PolarHBondContact O-N 3.02Å; K223-P226 WeakPolarHBondContact O-CD 3.38Å; K223-D326 HydrophobicContact CD-CB 4.41Å; K223-D326 VanDerWaalsContact CD-O 3.23Å; K223-D326 WeakPolarHBondContact CD-O 3.3Å; K223-D326 VanDerWaalsContact CE-O 3.24Å; K223-D326 WeakPolarHBondContact CE-O 3Å; K223-D326 WeakPolarHBondContact CE-OD2 3.37Å; K223-D326 WeakPolarHBondContact CG-O 3.44Å; K223-D326 IonicContact NZ-OD2 2.7Å; K223-D326 PolarHBondContact NZ-OD2 3.43Å; K223-T327 HydrophobicContact CB-CG2 3.64Å; K223-T327 HydrophobicContact CG-CG2 4.2Å; K223-L330 HydrophobicContact CD-CD1 4.33Å; K223-L330 HydrophobicContact CG-CD1 3.78Å
224	L	97.6	Very high	96.3	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-85.9	-23.3	176	-63	-177.4	0	0	0	113.3	L176 M192 I198 T221 E222 P226 Y227 I231 I325	L176-L224 HydrophobicContact CD2-CD1 4.3Å; M192-L224 HydrophobicContact CE-CB 3.85Å; M192-L224 HydrophobicContact CE-CD1 4.32Å; M192-L224 HydrophobicContact CE-CD2 3.9Å; M192-L224 HydrophobicContact CE-CG 4.24Å; I198-L224 HydrophobicContact CD1-CD1 4.1Å; T221-L224 WeakPolarHBondContact O-CB 3.48Å; T221-L224 PolarHBondContact O-N 3.08Å; E222-L224 PolarHBondContact O-N 3.49Å; E222-L224 VanDerWaalsContact O-N 3.08Å; L224-P226 VanDerWaalsContact C-CD 3.4Å; L224-Y227 WeakPolarHBondContact O-CD2 3.49Å; L224-Y227 PolarHBondContact O-N 2.86Å; L224-I231 HydrophobicContact CB-CD1 3.6Å; L224-I325 HydrophobicContact CD2-CD1 4.26Å
225	T	96.7	Very high	96.5	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-62.2	-31.2	-176.2	65.9	0	0	0	0	114.9	T221 E222 Y227 V228 G229 I231 I381 P383	T221-T225 PolarHBondContact O-N 2.75Å; E222-T225 WeakPolarHBondContact O-CB 3.35Å; E222-T225 PolarHBondContact O-N 3.07Å; E222-T225 PolarHBondContact O-OG1 3.18Å; T225-Y227 PolarHBondContact O-N 2.99Å; T225-V228 PolarHBondContact O-N 3.34Å; T225-V228 VanDerWaalsContact O-N 3.08Å; T225-G229 VanDerWaalsContact CA-O 3.23Å; T225-G229 WeakPolarHBondContact CA-O 3.49Å; T225-G229 WeakPolarHBondContact CB-O 3.3Å; T225-G229 WeakPolarHBondContact O-CA 3.46Å; T225-G229 PolarHBondContact O-N 3.06Å; T225-I231 HydrophobicContact CG2-CB 4.32Å; T225-I231 HydrophobicContact CG2-CD1 3.98Å; T225-I231 HydrophobicContact CG2-CG1 4.06Å; T225-I381 HydrophobicContact CG2-CB 4.46Å; T225-I381 HydrophobicContact CG2-CG2 4.09Å; T225-I381 VanDerWaalsContact CG2-O 3.3Å; T225-I381 WeakPolarHBondContact CG2-O 3.42Å; T225-P383 WeakPolarHBondContact OG1-CA 3.32Å
226	P	94.6	Very high	96.6	Very high	45 Å²	45	21.9 Å²	21.9	29%	0.292	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-61.1	-17	176.1	-26.2	37.2	0	0	0	114.5	K62 E222 K223 L224	K62-P226 HydrophobicContact CD-CB 3.7Å; E222-P226 VanDerWaalsContact O-CD 3.29Å; E222-P226 WeakPolarHBondContact O-CD 3.24Å; K223-P226 WeakPolarHBondContact O-CD 3.38Å; L224-P226 VanDerWaalsContact C-CD 3.4Å
227	Y	95.4	Very high	96.7	Very high	30 Å²	30	23.7 Å²	23.7	12%	0.118	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-88.4	-20	179.3	-60.8	-86.1	0	0	0	113.1	K62 F64 Y189 L224 T225	K62-Y227 HydrophobicContact CB-CD1 3.84Å; K62-Y227 HydrophobicContact CB-CE1 3.93Å; K62-Y227 HydrophobicContact CD-CE1 4.37Å; K62-Y227 HydrophobicContact CG-CD1 4.41Å; K62-Y227 HydrophobicContact CG-CE1 4Å; K62-Y227 VanDerWaalsContact O-CD1 3.27Å; K62-Y227 WeakPolarHBondContact O-CD1 3.27Å; F64-Y227 HydrophobicContact CE2-CD1 4.13Å; F64-Y227 HydrophobicContact CE2-CG 4.26Å; F64-Y227 HydrophobicContact CZ-CD1 4.2Å; Y189-Y227 HydrophobicContact CD2-CD1 4.26Å; Y189-Y227 HydrophobicContact CD2-CD2 4.44Å; Y189-Y227 HydrophobicContact CD2-CE1 4.15Å; Y189-Y227 HydrophobicContact CD2-CE2 4.31Å; Y189-Y227 HydrophobicContact CD2-CG 4.43Å; Y189-Y227 AromaticContact CE2-CD1 3.9Å; Y189-Y227 HydrophobicContact CE2-CD1 3.9Å; Y189-Y227 AromaticContact CE2-CE1 3.58Å; Y189-Y227 HydrophobicContact CE2-CE1 3.58Å; Y189-Y227 HydrophobicContact CE2-CE2 4.48Å; Y189-Y227 AromaticContact CE2-CZ 3.9Å; L224-Y227 WeakPolarHBondContact O-CD2 3.49Å; L224-Y227 PolarHBondContact O-N 2.86Å; T225-Y227 PolarHBondContact O-N 2.99Å
228	V	92.7	Very high	96.7	Very high	41 Å²	41	23.8 Å²	23.8	25%	0.248	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.1	-12.7	-166.3	-61.9	0	0	0	0	115.8	V168 M192 T225 I231	V168-V228 HydrophobicContact CB-CG1 3.91Å; V168-V228 HydrophobicContact CG1-CB 4.25Å; V168-V228 HydrophobicContact CG1-CG1 3.69Å; V168-V228 HydrophobicContact CG2-CG1 3.45Å; V168-V228 VanDerWaalsContact CG2-CG1 3.45Å; M192-V228 HydrophobicContact CB-CG1 4.15Å; M192-V228 HydrophobicContact CE-CG1 4.43Å; M192-V228 HydrophobicContact CG-CG1 3.94Å; M192-V228 HydrophobicContact SD-CB 4.12Å; M192-V228 HydrophobicContact SD-CG1 3.27Å; M192-V228 WeakPolarHBondContact SD-CG1 3.49Å; M192-V228 HydrophobicContact SD-CG2 3.7Å; T225-V228 PolarHBondContact O-N 3.34Å; T225-V228 VanDerWaalsContact O-N 3.08Å; V228-I231 HydrophobicContact CG2-CD1 3.84Å; V228-I231 HydrophobicContact CG2-CG1 3.72Å
229	G	91.3	Very high	96.6	Very high	27 Å²	27	23.2 Å²	23.2	28%	0.278	14%	0.136	S	C	.	.	S	Bend	trans	87.7	-148.6	-167	0	0	0	0	0	111.5	T225	T225-G229 VanDerWaalsContact CA-O 3.23Å; T225-G229 WeakPolarHBondContact CA-O 3.49Å; T225-G229 WeakPolarHBondContact CB-O 3.3Å; T225-G229 WeakPolarHBondContact O-CA 3.46Å; T225-G229 PolarHBondContact O-N 3.06Å
230	G	94.2	Very high	96.6	Very high	31 Å²	31	25 Å²	25	32%	0.32	14%	0.143	S	C	.	.			trans	-60.6	140.6	-179.4	0	0	0	0	0	113.1	I381 M382	G230-I381 CarbonylContact C-O 3.56Å; G230-I381 VanDerWaalsContact CA-O 3.26Å; G230-I381 WeakPolarHBondContact CA-O 3.36Å; G230-M382 VanDerWaalsContact CA-SD 3.6Å
231	I	98.3	Very high	96.6	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.6	172.6	-63.8	171.8	0	0	0	108.2	I198 A200 T221 L224 T225 V228 F233 I381	I198-I231 HydrophobicContact CD1-CD1 4.14Å; I198-I231 HydrophobicContact CG1-CD1 4.38Å; I198-I231 HydrophobicContact CG1-CG2 4.46Å; A200-I231 HydrophobicContact CB-CG2 4.3Å; T221-I231 HydrophobicContact CG2-CB 3.86Å; T221-I231 HydrophobicContact CG2-CD1 4.26Å; T221-I231 HydrophobicContact CG2-CG2 3.64Å; L224-I231 HydrophobicContact CB-CD1 3.6Å; T225-I231 HydrophobicContact CG2-CB 4.32Å; T225-I231 HydrophobicContact CG2-CD1 3.98Å; T225-I231 HydrophobicContact CG2-CG1 4.06Å; V228-I231 HydrophobicContact CG2-CD1 3.84Å; V228-I231 HydrophobicContact CG2-CG1 3.72Å; I231-F233 PolarHBondContact O-N 3.43Å; I231-I381 PolarHBondContact N-O 3.08Å; I231-I381 PolarHBondContact O-N 2.91Å
232	Q	98.6	Very high	96.4	Very high	48 Å²	48	25.2 Å²	25.2	22%	0.224	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	122.7	172.1	-59.1	-67.9	-56.2	0	0	108.9	E199 A200	E199-Q232 CarbonylContact C-O 3.55Å; E199-Q232 WeakPolarHBondContact CA-O 3.37Å; E199-Q232 HydrophobicContact CB-CB 4.11Å; E199-Q232 HydrophobicContact CG-CB 3.87Å; E199-Q232 HydrophobicContact CG-CG 4.3Å; A200-Q232 PolarHBondContact N-O 3.03Å
233	F	98.7	Very high	96.3	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.3	175	-174.4	-87.9	0	0	0	109.2	L178 A200 H202 L214 A217 K218 T221 I231 E235 I378 E379 I381	L178-F233 HydrophobicContact CD2-CE2 4.29Å; A200-F233 HydrophobicContact CB-CD2 4.02Å; H202-F233 HydrophobicContact CB-CE1 4.07Å; H202-F233 HydrophobicContact CB-CE2 3.81Å; H202-F233 HydrophobicContact CB-CZ 3.38Å; H202-F233 AromaticContact CD2-CZ 3.94Å; H202-F233 AromaticContact CG-CZ 3.75Å; L214-F233 HydrophobicContact CD1-CE1 3.95Å; L214-F233 HydrophobicContact CD1-CZ 4.09Å; A217-F233 HydrophobicContact CB-CE2 4.13Å; A217-F233 HydrophobicContact CB-CZ 4.06Å; K218-F233 HydrophobicContact CG-CD1 4.33Å; K218-F233 HydrophobicContact CG-CE1 4.02Å; K218-F233 HydrophobicContact CG-CE2 4.27Å; K218-F233 HydrophobicContact CG-CZ 3.97Å; T221-F233 HydrophobicContact CG2-CD2 4.32Å; T221-F233 VanDerWaalsContact OG1-CD2 3.3Å; T221-F233 WeakPolarHBondContact OG1-CD2 3.33Å; I231-F233 PolarHBondContact O-N 3.43Å; F233-E235 HydrophobicContact CE1-CB 4.24Å; F233-I378 WeakPolarHBondContact O-CA 3.48Å; F233-E379 HydrophobicContact CB-CG 4Å; F233-E379 HydrophobicContact CD1-CG 4.36Å; F233-E379 WeakPolarHBondContact CD1-OE1 3.35Å; F233-E379 PolarHBondContact N-O 2.99Å; F233-E379 PolarHBondContact O-N 3.32Å; F233-I381 HydrophobicContact CB-CD1 4.38Å; F233-I381 HydrophobicContact CB-CG1 3.74Å; F233-I381 HydrophobicContact CG-CG1 4.45Å
234	I	98.7	Very high	96.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	103.9	-175.9	-54.5	177.1	0	0	0	107.6	E199 A200 V201 H202 V236 I269 R273 L376 K377 I378	E199-I234 HydrophobicContact CB-CD1 4.34Å; A200-I234 WeakPolarHBondContact O-CB 3.22Å; A200-I234 PolarHBondContact O-N 3.2Å; V201-I234 WeakPolarHBondContact CA-O 3.25Å; V201-I234 HydrophobicContact CG2-CB 4.46Å; V201-I234 HydrophobicContact CG2-CD1 4.44Å; H202-I234 PolarHBondContact N-O 3.03Å; I234-V236 HydrophobicContact CG2-CG2 4.36Å; I234-I269 HydrophobicContact CD1-CG2 3.66Å; I234-I269 HydrophobicContact CG2-CD1 4.3Å; I234-R273 HydrophobicContact CD1-CG 4.18Å; I234-L376 HydrophobicContact CG2-CD2 4.12Å; I234-K377 CarbonylContact C-O 3.59Å; I234-K377 WeakPolarHBondContact CA-O 3.5Å; I234-I378 HydrophobicContact CG1-CG1 4.19Å; I234-I378 HydrophobicContact CG1-CG2 4.31Å; I234-I378 HydrophobicContact CG2-CG1 4.31Å
235	E	98.2	Very high	96.2	Very high	17 Å²	17	26.5 Å²	26.5	8%	0.079	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.3	171.9	-174.6	-167.7	135.3	0	0	109.4	A204 L214 F233 K377	A204-E235 HydrophobicContact CB-CG 4.02Å; L214-E235 HydrophobicContact CD1-CG 4.18Å; L214-E235 WeakPolarHBondContact CD2-OE2 3.44Å; F233-E235 HydrophobicContact CE1-CB 4.24Å; E235-K377 HydrophobicContact CB-CB 4.2Å; E235-K377 PolarHBondContact N-O 3.08Å; E235-K377 PolarHBondContact O-N 3.21Å; E235-K377 VanDerWaalsContact O-N 3.07Å; E235-K377 IonicContact OE1-NZ 3.39Å; E235-K377 PolarHBondContact OE1-NZ 3.29Å; E235-K377 IonicContact OE2-NZ 2.72Å
236	V	98.3	Very high	96	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.2	-178.6	-174	0	0	0	0	109.1	V201 H202 F203 A204 I234 F238 L265 I269 C372 L376	V201-V236 HydrophobicContact CG1-CG2 3.59Å; H202-V236 PolarHBondContact O-N 3.38Å; F203-V236 HydrophobicContact CD1-CB 3.76Å; F203-V236 HydrophobicContact CD1-CG1 3.72Å; F203-V236 HydrophobicContact CD1-CG2 4.39Å; F203-V236 HydrophobicContact CE1-CB 3.96Å; F203-V236 HydrophobicContact CE1-CG1 3.66Å; F203-V236 HydrophobicContact CE1-CG2 4.21Å; F203-V236 HydrophobicContact CG-CB 4.39Å; A204-V236 PolarHBondContact N-O 3.25Å; I234-V236 HydrophobicContact CG2-CG2 4.36Å; V236-F238 PolarHBondContact O-N 2.75Å; V236-L265 HydrophobicContact CG1-CD1 4.17Å; V236-I269 HydrophobicContact CG2-CD1 3.66Å; V236-C372 WeakPolarHBondContact CG1-SG 3.49Å; V236-L376 HydrophobicContact CB-CD2 4.18Å; V236-L376 HydrophobicContact CG1-CD2 4.09Å; V236-L376 HydrophobicContact CG2-CD2 3.76Å
237	P	96.7	Very high	96	Very high	48 Å²	48	32.9 Å²	32.9	31%	0.312	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	118.3	177.5	28.6	-33.5	0	0	0	110.1	C372 G375	P237-C372 PolarHBondContact O-SG 2.61Å; P237-G375 WeakPolarHBondContact CD-O 3.29Å; P237-G375 WeakPolarHBondContact CG-O 3.23Å
238	F	96.8	Very high	96	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	20%	0.201	C	C	.	.			trans	-125.8	1	-165.2	-160.2	-112.5	0	0	0	114.5	F203 A204 V236 E240 I241 Q242 T258 M261 M262 L265	F203-F238 HydrophobicContact CB-CB 4.19Å; F203-F238 HydrophobicContact CB-CD1 4.43Å; F203-F238 HydrophobicContact CB-CG 4.27Å; F203-F238 HydrophobicContact CD1-CB 4.13Å; F203-F238 HydrophobicContact CD1-CD1 4.4Å; F203-F238 AromaticContact CD1-CD2 3.62Å; F203-F238 HydrophobicContact CD1-CD2 3.62Å; F203-F238 HydrophobicContact CD1-CE2 4.13Å; F203-F238 AromaticContact CD1-CG 3.79Å; F203-F238 HydrophobicContact CD1-CG 3.79Å; F203-F238 HydrophobicContact CE1-CD2 4.13Å; F203-F238 HydrophobicContact CE1-CE2 4.34Å; F203-F238 HydrophobicContact CG-CG 4.46Å; A204-F238 PolarHBondContact O-N 2.88Å; V236-F238 PolarHBondContact O-N 2.75Å; F238-E240 PolarHBondContact O-N 3.07Å; F238-I241 HydrophobicContact CD2-CB 4.21Å; F238-I241 HydrophobicContact CD2-CD1 3.9Å; F238-I241 HydrophobicContact CD2-CG2 4.41Å; F238-I241 HydrophobicContact CE1-CG2 4.35Å; F238-I241 HydrophobicContact CE2-CB 3.94Å; F238-I241 HydrophobicContact CE2-CD1 3.73Å; F238-I241 HydrophobicContact CE2-CG1 4.43Å; F238-I241 HydrophobicContact CE2-CG2 3.65Å; F238-I241 HydrophobicContact CZ-CB 4.24Å; F238-I241 HydrophobicContact CZ-CG2 3.62Å; F238-I241 PolarHBondContact O-N 2.91Å; F238-Q242 HydrophobicContact CD1-CG 3.52Å; F238-Q242 HydrophobicContact CE1-CG 3.53Å; F238-Q242 PolarHBondContact O-N 3.29Å; F238-T258 HydrophobicContact CE1-CG2 3.77Å; F238-T258 HydrophobicContact CZ-CG2 4.26Å; F238-M261 HydrophobicContact CE2-CB 4.03Å; F238-M261 HydrophobicContact CZ-CB 3.95Å; F238-M262 HydrophobicContact CD1-CE 3.89Å; F238-M262 HydrophobicContact CE1-CE 3.6Å; F238-M262 HydrophobicContact CE1-CG 3.93Å; F238-M262 HydrophobicContact CE2-CG 4.13Å; F238-M262 HydrophobicContact CZ-CE 4.28Å; F238-M262 HydrophobicContact CZ-CG 3.64Å; F238-L265 HydrophobicContact CD2-CD1 3.68Å; F238-L265 HydrophobicContact CE2-CD1 3.55Å
239	T	95.4	Very high	96.1	Very high	24 Å²	24	34.3 Å²	34.3	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-53.3	-178.7	-50.8	0	0	0	0	113.2	S205 P206 Y208 I241 Q242 E243	S205-T239 WeakPolarHBondContact CA-OG1 3.42Å; P206-T239 WeakPolarHBondContact O-CG2 3.4Å; P206-T239 PolarHBondContact O-OG1 3.11Å; Y208-T239 HydrophobicContact CD2-CG2 3.94Å; Y208-T239 HydrophobicContact CE2-CG2 3.75Å; T239-I241 VanDerWaalsContact C-N 3.31Å; T239-I241 PolarHBondContact O-N 3.17Å; T239-Q242 PolarHBondContact O-N 3.49Å; T239-E243 HydrophobicContact CG2-CG 4.27Å; T239-E243 PolarHBondContact O-N 2.88Å
240	E	96.4	Very high	96.2	Very high	80 Å²	80	35.9 Å²	35.9	37%	0.374	20%	0.199	S	C	.	.	H	α-helix	trans	-56.9	-45.3	-174.9	-174	-173.3	171.8	0	0	111.5	F238 Q242 E243 E244 L368 R371	F238-E240 PolarHBondContact O-N 3.07Å; E240-Q242 VanDerWaalsContact C-N 3.33Å; E240-Q242 PolarHBondContact O-N 3.35Å; E240-E243 PolarHBondContact O-N 3.08Å; E240-E244 WeakPolarHBondContact O-CB 3.49Å; E240-E244 WeakPolarHBondContact O-CG 3.35Å; E240-E244 PolarHBondContact O-N 2.89Å; E240-L368 HydrophobicContact CG-CD2 3.88Å; E240-R371 IonicContact OE1-CZ 3.92Å; E240-R371 IonicContact OE1-NE 3.48Å; E240-R371 PolarHBondContact OE1-NE 3.05Å; E240-R371 IonicContact OE1-NH2 2.86Å; E240-R371 PolarHBondContact OE1-NH2 2.93Å; E240-R371 IonicContact OE2-NE 3.78Å; E240-R371 PolarHBondContact OE2-NE 3.49Å
241	I	96.8	Very high	96.2	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-41.3	178.3	-70.9	168.6	0	0	0	111.1	F238 T239 I245 M261 L265 L368 C372	F238-I241 HydrophobicContact CD2-CB 4.21Å; F238-I241 HydrophobicContact CD2-CD1 3.9Å; F238-I241 HydrophobicContact CD2-CG2 4.41Å; F238-I241 HydrophobicContact CE1-CG2 4.35Å; F238-I241 HydrophobicContact CE2-CB 3.94Å; F238-I241 HydrophobicContact CE2-CD1 3.73Å; F238-I241 HydrophobicContact CE2-CG1 4.43Å; F238-I241 HydrophobicContact CE2-CG2 3.65Å; F238-I241 HydrophobicContact CZ-CB 4.24Å; F238-I241 HydrophobicContact CZ-CG2 3.62Å; F238-I241 PolarHBondContact O-N 2.91Å; T239-I241 VanDerWaalsContact C-N 3.31Å; T239-I241 PolarHBondContact O-N 3.17Å; I241-I245 HydrophobicContact CG2-CD1 3.78Å; I241-I245 WeakPolarHBondContact O-CB 3.27Å; I241-I245 WeakPolarHBondContact O-CD1 3.46Å; I241-I245 VanDerWaalsContact O-CG1 3.24Å; I241-I245 WeakPolarHBondContact O-CG1 3.37Å; I241-I245 PolarHBondContact O-N 3.4Å; I241-M261 HydrophobicContact CD1-CE 3.81Å; I241-M261 HydrophobicContact CG1-CE 4.23Å; I241-M261 HydrophobicContact CG2-CB 3.76Å; I241-M261 HydrophobicContact CG2-CE 4.28Å; I241-M261 HydrophobicContact CG2-CG 3.75Å; I241-L265 HydrophobicContact CD1-CD1 3.81Å; I241-L368 HydrophobicContact CD1-CB 4.41Å; I241-L368 HydrophobicContact CG1-CB 3.99Å; I241-L368 HydrophobicContact CG1-CD1 4.49Å; I241-L368 HydrophobicContact CG1-CD2 4.04Å; I241-L368 HydrophobicContact CG1-CG 4.41Å; I241-C372 HydrophobicContact CD1-CB 4.17Å
242	Q	94.7	Very high	96	Very high	2 Å²	2	39 Å²	39	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-40.1	178.9	-69.7	-169.6	-55.3	0	0	112.4	S205 F238 T239 E240 K246 C338 F342	S205-Q242 PolarHBondContact OG-OE1 2.83Å; F238-Q242 HydrophobicContact CD1-CG 3.52Å; F238-Q242 HydrophobicContact CE1-CG 3.53Å; F238-Q242 PolarHBondContact O-N 3.29Å; T239-Q242 PolarHBondContact O-N 3.49Å; E240-Q242 VanDerWaalsContact C-N 3.33Å; E240-Q242 PolarHBondContact O-N 3.35Å; Q242-K246 WeakPolarHBondContact O-CB 3.35Å; Q242-K246 PolarHBondContact O-N 3.38Å; Q242-C338 PolarHBondContact NE2-O 2.7Å; Q242-F342 HydrophobicContact CB-CD1 3.91Å; Q242-F342 HydrophobicContact CB-CD2 4.48Å; Q242-F342 HydrophobicContact CB-CE1 3.79Å; Q242-F342 HydrophobicContact CB-CE2 4.37Å; Q242-F342 HydrophobicContact CB-CG 4.25Å; Q242-F342 HydrophobicContact CB-CZ 4.02Å; Q242-F342 VanDerWaalsContact CD-CD2 3.48Å; Q242-F342 HydrophobicContact CG-CG 4.49Å
243	E	95	Very high	95.8	Very high	86 Å²	86	37.6 Å²	37.6	40%	0.402	20%	0.202	S	C	.	.	H	α-helix	trans	-63.3	-45.5	175.7	-71.4	-179.6	161.6	0	0	111.3	Y208 T239 E240 I245 K246 A247	Y208-E243 HydrophobicContact CE2-CG 4.44Å; Y208-E243 PolarHBondContact OH-OE1 3.29Å; T239-E243 HydrophobicContact CG2-CG 4.27Å; T239-E243 PolarHBondContact O-N 2.88Å; E240-E243 PolarHBondContact O-N 3.08Å; E243-I245 PolarHBondContact O-N 3.02Å; E243-K246 PolarHBondContact O-N 2.77Å; E243-A247 WeakPolarHBondContact O-CB 3.49Å; E243-A247 PolarHBondContact O-N 2.95Å
244	E	96.4	Very high	95.7	Very high	64 Å²	64	39.4 Å²	39.4	30%	0.299	21%	0.209	S	C	.	.	H	α-helix	trans	-58	-50.2	175.6	-79.7	-60	136.7	0	0	111.7	E240 K246 A247 H248 F363 L368	E240-E244 WeakPolarHBondContact O-CB 3.49Å; E240-E244 WeakPolarHBondContact O-CG 3.35Å; E240-E244 PolarHBondContact O-N 2.89Å; E244-K246 VanDerWaalsContact C-N 3.28Å; E244-K246 PolarHBondContact O-N 3.44Å; E244-A247 PolarHBondContact O-N 3.21Å; E244-H248 PolarHBondContact O-N 3.24Å; E244-H248 PolarHBondContact O-ND1 3Å; E244-H248 IonicContact OE1-CE1 3.99Å; E244-H248 IonicContact OE2-CE1 3.11Å; E244-H248 PolarHBondContact OE2-CE1 2.94Å; E244-H248 IonicContact OE2-ND1 2.84Å; E244-H248 PolarHBondContact OE2-ND1 3.47Å; E244-F363 HydrophobicContact CB-CD1 4.27Å; E244-F363 HydrophobicContact CB-CE1 4.33Å; E244-F363 WeakPolarHBondContact O-CE1 3.24Å; E244-L368 HydrophobicContact CB-CD1 4.48Å; E244-L368 HydrophobicContact CG-CD1 4.43Å; E244-L368 HydrophobicContact CG-CD2 4.08Å
245	I	95.9	Very high	95.5	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-58.3	-43.1	177.7	-71.1	166.8	0	0	0	110.9	I241 E243 S249 W254 L257 M261 F363	I241-I245 HydrophobicContact CG2-CD1 3.78Å; I241-I245 WeakPolarHBondContact O-CB 3.27Å; I241-I245 WeakPolarHBondContact O-CD1 3.46Å; I241-I245 VanDerWaalsContact O-CG1 3.24Å; I241-I245 WeakPolarHBondContact O-CG1 3.37Å; I241-I245 PolarHBondContact O-N 3.4Å; E243-I245 PolarHBondContact O-N 3.02Å; I245-S249 VanDerWaalsContact O-CB 3.29Å; I245-S249 WeakPolarHBondContact O-CB 3.39Å; I245-S249 PolarHBondContact O-N 3.48Å; I245-S249 VanDerWaalsContact O-N 3.08Å; I245-W254 HydrophobicContact CG2-CB 4.24Å; I245-W254 HydrophobicContact CG2-CG 4.35Å; I245-L257 HydrophobicContact CD1-CB 3.99Å; I245-L257 HydrophobicContact CG1-CB 4.18Å; I245-L257 HydrophobicContact CG2-CB 3.99Å; I245-L257 HydrophobicContact CG2-CD1 4.2Å; I245-M261 HydrophobicContact CD1-CG 4.26Å; I245-F363 HydrophobicContact CG1-CE1 4.36Å; I245-F363 HydrophobicContact CG1-CZ 4.21Å
246	K	93.1	Very high	95.3	Very high	108 Å²	108	40 Å²	40	47%	0.47	21%	0.212	S	C	.	.	H	α-helix	trans	-66.3	-39.1	-179.8	-172.4	177.7	179.2	179.6	0	112.1	Q242 E243 E244 W254	Q242-K246 WeakPolarHBondContact O-CB 3.35Å; Q242-K246 PolarHBondContact O-N 3.38Å; E243-K246 PolarHBondContact O-N 2.77Å; E244-K246 VanDerWaalsContact C-N 3.28Å; E244-K246 PolarHBondContact O-N 3.44Å; K246-W254 HydrophobicContact CB-CZ2 4.49Å; K246-W254 HydrophobicContact CD-CH2 4.43Å; K246-W254 HydrophobicContact CG-CH2 3.83Å; K246-W254 HydrophobicContact CG-CZ2 3.67Å; K246-W254 HydrophobicContact CG-CZ3 4.33Å
247	A	94.5	Very high	95.3	Very high	71 Å²	71	40.1 Å²	40.1	59%	0.587	21%	0.213	S	C	*	.	H	α-helix	trans	-71.9	-38	-179	0	0	0	0	0	112.9	E243 E244	E243-A247 WeakPolarHBondContact O-CB 3.49Å; E243-A247 PolarHBondContact O-N 2.95Å; E244-A247 PolarHBondContact O-N 3.21Å
248	H	95.4	Very high	95.3	Very high	90 Å²	90	38.1 Å²	38.1	42%	0.417	20%	0.2	S	C	.	.	H	α-helix	trans	-114.1	-1.6	-165.7	-57.9	116.9	0	0	0	115.2	E244 R362 F363	E244-H248 PolarHBondContact O-N 3.24Å; E244-H248 PolarHBondContact O-ND1 3Å; E244-H248 IonicContact OE1-CE1 3.99Å; E244-H248 IonicContact OE2-CE1 3.11Å; E244-H248 PolarHBondContact OE2-CE1 2.94Å; E244-H248 IonicContact OE2-ND1 2.84Å; E244-H248 PolarHBondContact OE2-ND1 3.47Å; H248-R362 PolarHBondContact O-NH1 3.37Å; H248-F363 HydrophobicContact CB-CE1 3.8Å; H248-F363 HydrophobicContact CB-CZ 4.23Å
249	S	94.6	Very high	95.2	Very high	11 Å²	11	40 Å²	40	8%	0.077	21%	0.207	C	C	.	.	S	Bend	trans	-124.9	149.6	-179.8	-78.6	0	0	0	0	115.4	I245 Q251 W254 L257 F363	I245-S249 VanDerWaalsContact O-CB 3.29Å; I245-S249 WeakPolarHBondContact O-CB 3.39Å; I245-S249 PolarHBondContact O-N 3.48Å; I245-S249 VanDerWaalsContact O-N 3.08Å; S249-Q251 PolarHBondContact O-N 3.34Å; S249-W254 PolarHBondContact O-NE1 3.15Å; S249-L257 VanDerWaalsContact CB-CD1 3.45Å; S249-L257 WeakPolarHBondContact OG-CD1 3.44Å; S249-F363 VanDerWaalsContact OG-CZ 3.26Å; S249-F363 WeakPolarHBondContact OG-CZ 3.47Å
250	P	94.5	Very high	95.4	Very high	60 Å²	60	38.8 Å²	38.8	39%	0.39	20%	0.2	S	C	.	.			trans	-60.5	138	173.7	-17.9	29.3	0	0	0	111.6	G252 Y253 L359	P250-G252 VanDerWaalsContact C-N 3.26Å; P250-G252 PolarHBondContact O-N 2.93Å; P250-G252 VanDerWaalsContact O-N 3.07Å; P250-Y253 HydrophobicContact CB-CD2 4.27Å; P250-Y253 HydrophobicContact CG-CD2 4.45Å; P250-Y253 PolarHBondContact O-N 3.14Å; P250-L359 VanDerWaalsContact CD-CD2 3.49Å; P250-L359 HydrophobicContact CG-CD1 4.44Å; P250-L359 HydrophobicContact CG-CD2 4.15Å
251	Q	93.4	Very high	95.4	Very high	83 Å²	83	35.5 Å²	35.5	39%	0.388	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-49.3	-41	-174.2	-176.1	174.4	59.1	0	0	114.9	S249 Y253 W254 P344 P345	S249-Q251 PolarHBondContact O-N 3.34Å; Q251-Y253 PolarHBondContact O-N 2.56Å; Q251-Y253 VanDerWaalsContact O-N 3.09Å; Q251-W254 VanDerWaalsContact CA-CE2 3.47Å; Q251-W254 HydrophobicContact CB-CD2 4.32Å; Q251-W254 HydrophobicContact CB-CH2 4.28Å; Q251-W254 HydrophobicContact CB-CZ2 3.96Å; Q251-W254 HydrophobicContact CG-CD2 4.1Å; Q251-W254 HydrophobicContact CG-CE3 3.94Å; Q251-W254 HydrophobicContact CG-CH2 3.87Å; Q251-W254 HydrophobicContact CG-CZ2 4.04Å; Q251-W254 HydrophobicContact CG-CZ3 3.83Å; Q251-W254 PolarHBondContact O-N 3.12Å; Q251-P344 HydrophobicContact CG-CB 3.53Å; Q251-P344 WeakPolarHBondContact O-CB 3.4Å; Q251-P344 WeakPolarHBondContact O-CG 3.49Å; Q251-P345 HydrophobicContact CG-CG 4.49Å
252	G	94.3	Very high	95.5	Very high	16 Å²	16	35.4 Å²	35.4	17%	0.165	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-63.6	-15.9	179.5	0	0	0	0	0	115.2	P250 Q346 K348	P250-G252 VanDerWaalsContact C-N 3.26Å; P250-G252 PolarHBondContact O-N 2.93Å; P250-G252 VanDerWaalsContact O-N 3.07Å; G252-Q346 WeakPolarHBondContact CA-O 3.39Å; G252-K348 WeakPolarHBondContact O-CB 3.35Å; G252-K348 PolarHBondContact O-N 3.05Å
253	Y	95.1	Very high	95.7	Very high	19 Å²	19	35.5 Å²	35.5	8%	0.075	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-102.5	-7.2	179.4	-73.6	-85.2	0	0	0	114.1	P250 Q251 M255 T256 L257 K348 P351 K355 V356 L359	P250-Y253 HydrophobicContact CB-CD2 4.27Å; P250-Y253 HydrophobicContact CG-CD2 4.45Å; P250-Y253 PolarHBondContact O-N 3.14Å; Q251-Y253 PolarHBondContact O-N 2.56Å; Q251-Y253 VanDerWaalsContact O-N 3.09Å; Y253-M255 VanDerWaalsContact C-N 3.27Å; Y253-M255 PolarHBondContact O-N 3.14Å; Y253-T256 PolarHBondContact O-N 3.43Å; Y253-T256 VanDerWaalsContact O-N 3.09Å; Y253-L257 WeakPolarHBondContact O-CG 3.39Å; Y253-L257 PolarHBondContact O-N 3.43Å; Y253-K348 HydrophobicContact CD1-CD 4.4Å; Y253-K348 HydrophobicContact CD2-CD 4.03Å; Y253-K348 HydrophobicContact CE1-CD 3.95Å; Y253-K348 HydrophobicContact CE2-CD 3.52Å; Y253-K348 HydrophobicContact CG-CD 4.44Å; Y253-K348 VanDerWaalsContact CZ-CD 3.47Å; Y253-P351 HydrophobicContact CD1-CB 4.34Å; Y253-P351 HydrophobicContact CE1-CB 4.01Å; Y253-K355 HydrophobicContact CE1-CB 4.35Å; Y253-K355 HydrophobicContact CE1-CG 4.19Å; Y253-K355 HydrophobicContact CE2-CG 3.99Å; Y253-K355 WeakPolarHBondContact OH-CG 3.29Å; Y253-V356 HydrophobicContact CD1-CG2 3.8Å; Y253-V356 HydrophobicContact CE1-CG2 3.79Å; Y253-L359 HydrophobicContact CD1-CD1 4.03Å; Y253-L359 HydrophobicContact CD2-CD1 3.72Å; Y253-L359 HydrophobicContact CE2-CD1 4.26Å; Y253-L359 HydrophobicContact CG-CD1 3.59Å
254	W	95	Very high	95.9	Very high	38 Å²	38	34.2 Å²	34.2	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	-52.3	-46.3	-177.1	-68	-9.6	0	0	0	112.5	I245 K246 S249 Q251 T258 P344	I245-W254 HydrophobicContact CG2-CB 4.24Å; I245-W254 HydrophobicContact CG2-CG 4.35Å; K246-W254 HydrophobicContact CB-CZ2 4.49Å; K246-W254 HydrophobicContact CD-CH2 4.43Å; K246-W254 HydrophobicContact CG-CH2 3.83Å; K246-W254 HydrophobicContact CG-CZ2 3.67Å; K246-W254 HydrophobicContact CG-CZ3 4.33Å; S249-W254 PolarHBondContact O-NE1 3.15Å; Q251-W254 VanDerWaalsContact CA-CE2 3.47Å; Q251-W254 HydrophobicContact CB-CD2 4.32Å; Q251-W254 HydrophobicContact CB-CH2 4.28Å; Q251-W254 HydrophobicContact CB-CZ2 3.96Å; Q251-W254 HydrophobicContact CG-CD2 4.1Å; Q251-W254 HydrophobicContact CG-CE3 3.94Å; Q251-W254 HydrophobicContact CG-CH2 3.87Å; Q251-W254 HydrophobicContact CG-CZ2 4.04Å; Q251-W254 HydrophobicContact CG-CZ3 3.83Å; Q251-W254 PolarHBondContact O-N 3.12Å; W254-T258 WeakPolarHBondContact O-CB 3.49Å; W254-T258 PolarHBondContact O-N 2.75Å; W254-T258 PolarHBondContact O-OG1 3.02Å; W254-P344 HydrophobicContact CB-CG 4.38Å; W254-P344 HydrophobicContact CD2-CB 4.48Å; W254-P344 HydrophobicContact CE3-CB 3.93Å
255	M	94	Very high	96	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.133	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-44.3	179.7	-176.2	61.5	68.2	0	0	112.3	Y253 T258 R259 A343 P344	Y253-M255 VanDerWaalsContact C-N 3.27Å; Y253-M255 PolarHBondContact O-N 3.14Å; M255-T258 PolarHBondContact O-N 2.81Å; M255-R259 WeakPolarHBondContact O-CB 3.41Å; M255-R259 WeakPolarHBondContact O-CG 3.47Å; M255-R259 PolarHBondContact O-N 3.29Å; M255-R259 HydrophobicContact SD-CG 4.14Å; M255-A343 HydrophobicContact CE-CB 4.21Å; M255-P344 HydrophobicContact CB-CG 4.39Å
256	T	95.9	Very high	96.1	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-46.6	180	-54.7	0	0	0	0	111.4	Y253 R259 R260 A297 I298 P351 V356	Y253-T256 PolarHBondContact O-N 3.43Å; Y253-T256 VanDerWaalsContact O-N 3.09Å; T256-R259 PolarHBondContact O-N 3.1Å; T256-R260 WeakPolarHBondContact O-CB 3.46Å; T256-R260 WeakPolarHBondContact O-CG 3.48Å; T256-R260 PolarHBondContact O-N 3.43Å; T256-A297 HydrophobicContact CG2-CB 4.11Å; T256-I298 HydrophobicContact CG2-CG1 4.16Å; T256-P351 HydrophobicContact CG2-CB 4.13Å; T256-P351 HydrophobicContact CG2-CG 4.13Å; T256-V356 HydrophobicContact CG2-CG1 4.29Å; T256-V356 HydrophobicContact CG2-CG2 3.82Å
257	L	97	Very high	96.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-41.6	178.8	-66.7	165.7	0	0	0	111.4	I245 S249 Y253 R259 R260 M261 V356 L359 E360 F363	I245-L257 HydrophobicContact CD1-CB 3.99Å; I245-L257 HydrophobicContact CG1-CB 4.18Å; I245-L257 HydrophobicContact CG2-CB 3.99Å; I245-L257 HydrophobicContact CG2-CD1 4.2Å; S249-L257 VanDerWaalsContact CB-CD1 3.45Å; S249-L257 WeakPolarHBondContact OG-CD1 3.44Å; Y253-L257 WeakPolarHBondContact O-CG 3.39Å; Y253-L257 PolarHBondContact O-N 3.43Å; L257-R259 PolarHBondContact O-N 3.05Å; L257-R260 WeakPolarHBondContact O-CB 3.25Å; L257-R260 PolarHBondContact O-N 2.81Å; L257-M261 PolarHBondContact O-N 2.95Å; L257-V356 HydrophobicContact CD2-CG1 3.93Å; L257-L359 HydrophobicContact CD1-CB 4.38Å; L257-L359 HydrophobicContact CD1-CD1 4.37Å; L257-L359 HydrophobicContact CD2-CB 4.39Å; L257-E360 HydrophobicContact CD2-CG 3.7Å; L257-F363 HydrophobicContact CD1-CE2 4.31Å
258	T	96.1	Very high	96.6	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.043	13%	0.125	C	C	.	.	H	α-helix	trans	-58.1	-50.4	176.1	-69.1	0	0	0	0	111.1	F238 W254 M255 R260 M261 M262	F238-T258 HydrophobicContact CE1-CG2 3.77Å; F238-T258 HydrophobicContact CZ-CG2 4.26Å; W254-T258 WeakPolarHBondContact O-CB 3.49Å; W254-T258 PolarHBondContact O-N 2.75Å; W254-T258 PolarHBondContact O-OG1 3.02Å; M255-T258 PolarHBondContact O-N 2.81Å; T258-R260 VanDerWaalsContact C-N 3.31Å; T258-R260 PolarHBondContact O-N 3.4Å; T258-M261 PolarHBondContact O-N 3.17Å; T258-M262 HydrophobicContact CG2-CE 3.78Å; T258-M262 HydrophobicContact CG2-SD 4.16Å; T258-M262 WeakPolarHBondContact O-CG 3.44Å; T258-M262 PolarHBondContact O-N 2.86Å
259	R	96.3	Very high	96.7	Very high	39 Å²	39	20.5 Å²	20.5	15%	0.147	11%	0.106	C	C	.	.	H	α-helix	trans	-66.8	-33.3	-179.2	-64.9	-72.5	-84.8	-166.8	-2.7	112.2	M255 T256 L257 L263 E282 I298	M255-R259 WeakPolarHBondContact O-CB 3.41Å; M255-R259 WeakPolarHBondContact O-CG 3.47Å; M255-R259 PolarHBondContact O-N 3.29Å; M255-R259 HydrophobicContact SD-CG 4.14Å; T256-R259 PolarHBondContact O-N 3.1Å; L257-R259 PolarHBondContact O-N 3.05Å; R259-L263 WeakPolarHBondContact O-CB 3.34Å; R259-L263 PolarHBondContact O-N 3Å; R259-E282 IonicContact CZ-OE1 3.46Å; R259-E282 IonicContact NE-OE1 3.21Å; R259-E282 IonicContact NH2-OE1 2.87Å; R259-E282 PolarHBondContact NH2-OE1 3.37Å; R259-I298 HydrophobicContact CB-CD1 3.63Å; R259-I298 HydrophobicContact CB-CG1 3.92Å; R259-I298 HydrophobicContact CB-CG2 3.92Å; R259-I298 HydrophobicContact CG-CD1 4.13Å
260	R	97.9	Very high	96.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.5	-45.8	172	-78.5	177.9	66.9	90.2	-6	111.7	T256 L257 T258 L263 R264 A297 I298 E300 V301 E360	T256-R260 WeakPolarHBondContact O-CB 3.46Å; T256-R260 WeakPolarHBondContact O-CG 3.48Å; T256-R260 PolarHBondContact O-N 3.43Å; L257-R260 WeakPolarHBondContact O-CB 3.25Å; L257-R260 PolarHBondContact O-N 2.81Å; T258-R260 VanDerWaalsContact C-N 3.31Å; T258-R260 PolarHBondContact O-N 3.4Å; R260-L263 PolarHBondContact O-N 3.08Å; R260-R264 WeakPolarHBondContact O-CG 3.48Å; R260-R264 PolarHBondContact O-N 3.49Å; R260-A297 WeakPolarHBondContact CD-O 3.48Å; R260-A297 PolarHBondContact NH1-O 3.13Å; R260-I298 HydrophobicContact CG-CB 4.38Å; R260-I298 HydrophobicContact CG-CG1 4.38Å; R260-I298 HydrophobicContact CG-CG2 4.46Å; R260-E300 IonicContact CZ-OE2 2.81Å; R260-E300 IonicContact NH1-OE2 3.77Å; R260-E300 PolarHBondContact NH1-OE2 3.3Å; R260-E300 IonicContact NH2-OE2 2.65Å; R260-E300 PolarHBondContact NH2-OE2 3.28Å; R260-V301 HydrophobicContact CB-CG1 3.77Å; R260-V301 HydrophobicContact CG-CG1 3.79Å; R260-E360 WeakPolarHBondContact CD-OE1 3.17Å; R260-E360 IonicContact CZ-OE1 3.55Å; R260-E360 IonicContact CZ-OE2 3.53Å; R260-E360 VanDerWaalsContact NE-CD 3.34Å; R260-E360 IonicContact NE-OE1 2.71Å; R260-E360 PolarHBondContact NE-OE1 3.3Å; R260-E360 IonicContact NE-OE2 3.45Å; R260-E360 PolarHBondContact NE-OE2 3.35Å; R260-E360 IonicContact NH2-OE1 3.57Å; R260-E360 IonicContact NH2-OE2 2.78Å; R260-E360 PolarHBondContact NH2-OE2 3.11Å
261	M	98.3	Very high	97.1	Very high	10 Å²	10	25.5 Å²	25.5	5%	0.049	12%	0.121	C	C	.	.	H	α-helix	trans	-65	-42.8	175.9	-70	-58	-65.6	0	0	112.8	F238 I241 I245 L257 T258 L263 R264 L265 I365 L368 M369	F238-M261 HydrophobicContact CE2-CB 4.03Å; F238-M261 HydrophobicContact CZ-CB 3.95Å; I241-M261 HydrophobicContact CD1-CE 3.81Å; I241-M261 HydrophobicContact CG1-CE 4.23Å; I241-M261 HydrophobicContact CG2-CB 3.76Å; I241-M261 HydrophobicContact CG2-CE 4.28Å; I241-M261 HydrophobicContact CG2-CG 3.75Å; I245-M261 HydrophobicContact CD1-CG 4.26Å; L257-M261 PolarHBondContact O-N 2.95Å; T258-M261 PolarHBondContact O-N 3.17Å; M261-L263 VanDerWaalsContact C-N 3.26Å; M261-L263 PolarHBondContact O-N 3.03Å; M261-R264 PolarHBondContact O-N 3.41Å; M261-L265 WeakPolarHBondContact O-CB 3.26Å; M261-L265 WeakPolarHBondContact O-CG 3.46Å; M261-L265 PolarHBondContact O-N 2.86Å; M261-I365 HydrophobicContact CE-CG2 4.23Å; M261-I365 HydrophobicContact SD-CG1 4.33Å; M261-I365 HydrophobicContact SD-CG2 4.06Å; M261-L368 HydrophobicContact CE-CB 4.34Å; M261-M369 HydrophobicContact CE-CG 3.89Å
262	M	98.1	Very high	97.4	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-57.5	-41.3	173.8	-70.5	176.7	169.7	0	0	111.7	M177 F203 F238 T258 T266 C338	M177-M262 HydrophobicContact CE-CB 3.65Å; F203-M262 HydrophobicContact CB-CE 3.93Å; F203-M262 HydrophobicContact CD1-CG 3.93Å; F203-M262 HydrophobicContact CD2-CB 4.34Å; F203-M262 HydrophobicContact CD2-CE 4.38Å; F203-M262 HydrophobicContact CD2-CG 4Å; F203-M262 HydrophobicContact CD2-SD 4.24Å; F203-M262 HydrophobicContact CE1-CB 4.04Å; F203-M262 HydrophobicContact CE1-CG 3.95Å; F203-M262 HydrophobicContact CE2-CB 3.87Å; F203-M262 HydrophobicContact CE2-CG 4.03Å; F203-M262 HydrophobicContact CG-CE 4.07Å; F203-M262 HydrophobicContact CG-CG 3.96Å; F203-M262 HydrophobicContact CG-SD 4.42Å; F203-M262 HydrophobicContact CZ-CB 3.71Å; F203-M262 HydrophobicContact CZ-CG 4.01Å; F203-M262 VanDerWaalsContact CZ-O 3.29Å; F203-M262 WeakPolarHBondContact CZ-O 3.18Å; F238-M262 HydrophobicContact CD1-CE 3.89Å; F238-M262 HydrophobicContact CE1-CE 3.6Å; F238-M262 HydrophobicContact CE1-CG 3.93Å; F238-M262 HydrophobicContact CE2-CG 4.13Å; F238-M262 HydrophobicContact CZ-CE 4.28Å; F238-M262 HydrophobicContact CZ-CG 3.64Å; T258-M262 HydrophobicContact CG2-CE 3.78Å; T258-M262 HydrophobicContact CG2-SD 4.16Å; T258-M262 WeakPolarHBondContact O-CG 3.44Å; T258-M262 PolarHBondContact O-N 2.86Å; M262-T266 WeakPolarHBondContact O-CB 3.3Å; M262-T266 PolarHBondContact O-N 3.04Å; M262-T266 PolarHBondContact O-OG1 2.89Å; M262-C338 VanDerWaalsContact CE-SG 3.54Å
263	L	98.4	Very high	97.5	Very high	4 Å²	4	29 Å²	29	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-70.6	-40.7	-180	-174.6	58.5	0	0	0	112.3	R259 R260 M261 T266 D267 I278 I298 V301 T302 I306	R259-L263 WeakPolarHBondContact O-CB 3.34Å; R259-L263 PolarHBondContact O-N 3Å; R260-L263 PolarHBondContact O-N 3.08Å; M261-L263 VanDerWaalsContact C-N 3.26Å; M261-L263 PolarHBondContact O-N 3.03Å; L263-T266 PolarHBondContact O-N 2.8Å; L263-D267 WeakPolarHBondContact O-CB 3.47Å; L263-D267 PolarHBondContact O-N 2.93Å; L263-I278 HydrophobicContact CD1-CD1 3.55Å; L263-I278 HydrophobicContact CD1-CG2 4.13Å; L263-I298 HydrophobicContact CD2-CG2 4.05Å; L263-V301 HydrophobicContact CB-CG2 3.88Å; L263-V301 HydrophobicContact CD2-CG2 3.62Å; L263-V301 HydrophobicContact CG-CG2 3.7Å; L263-T302 HydrophobicContact CD1-CG2 4.1Å; L263-T302 HydrophobicContact CD2-CG2 3.83Å; L263-T302 HydrophobicContact CG-CG2 3.75Å; L263-I306 HydrophobicContact CD1-CD1 3.53Å; L263-I306 HydrophobicContact CD1-CG1 4.34Å; L263-I306 HydrophobicContact CD2-CD1 3.52Å; L263-I306 HydrophobicContact CG-CD1 4.15Å
264	R	98.7	Very high	97.7	Very high	58 Å²	58	35.8 Å²	35.8	22%	0.219	16%	0.163	C	C	.	.	H	α-helix	trans	-58.5	-47	172.2	-70.9	179.8	-172.7	-78.3	6.6	111.9	R260 M261 D267 A268 V301 E360 M369	R260-R264 WeakPolarHBondContact O-CG 3.48Å; R260-R264 PolarHBondContact O-N 3.49Å; M261-R264 PolarHBondContact O-N 3.41Å; R264-D267 PolarHBondContact O-N 2.99Å; R264-A268 PolarHBondContact O-N 2.89Å; R264-V301 HydrophobicContact CG-CB 3.69Å; R264-V301 HydrophobicContact CG-CG1 4.05Å; R264-V301 HydrophobicContact CG-CG2 3.94Å; R264-E360 IonicContact NH2-OE2 2.79Å; R264-E360 PolarHBondContact NH2-OE2 3.41Å; R264-M369 HydrophobicContact CB-CE 3.89Å; R264-M369 HydrophobicContact CB-SD 3.76Å; R264-M369 HydrophobicContact CG-SD 4.43Å
265	L	98.8	Very high	97.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-44.7	178.3	-73.6	165.8	0	0	0	111.8	F203 V236 F238 I241 M261 D267 A268 I269 M369 C372 L373	F203-L265 HydrophobicContact CE1-CB 3.98Å; F203-L265 HydrophobicContact CE1-CD1 3.8Å; F203-L265 HydrophobicContact CZ-CB 4.28Å; V236-L265 HydrophobicContact CG1-CD1 4.17Å; F238-L265 HydrophobicContact CD2-CD1 3.68Å; F238-L265 HydrophobicContact CE2-CD1 3.55Å; I241-L265 HydrophobicContact CD1-CD1 3.81Å; M261-L265 WeakPolarHBondContact O-CB 3.26Å; M261-L265 WeakPolarHBondContact O-CG 3.46Å; M261-L265 PolarHBondContact O-N 2.86Å; L265-D267 VanDerWaalsContact C-N 3.27Å; L265-D267 PolarHBondContact O-N 3.08Å; L265-A268 PolarHBondContact O-N 3.27Å; L265-I269 VanDerWaalsContact O-CG1 3.25Å; L265-I269 WeakPolarHBondContact O-CG1 3.38Å; L265-I269 PolarHBondContact O-N 3.32Å; L265-M369 HydrophobicContact CD2-CB 4.3Å; L265-M369 HydrophobicContact CD2-CG 4.14Å; L265-C372 HydrophobicContact CD1-CB 4.4Å; L265-C372 VanDerWaalsContact CD1-SG 3.51Å; L265-C372 HydrophobicContact CD2-CB 3.8Å; L265-L373 HydrophobicContact CD2-CD2 4.09Å; L265-L373 HydrophobicContact CD2-CG 4.01Å
266	T	98.8	Very high	98.1	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-36	177.8	-52.2	0	0	0	0	111.3	M175 M177 V201 F203 M262 L263 I269 R270 I278	M175-T266 HydrophobicContact CB-CG2 3.69Å; M175-T266 HydrophobicContact CG-CG2 4.48Å; M177-T266 HydrophobicContact CG-CG2 3.82Å; M177-T266 HydrophobicContact SD-CG2 4.48Å; V201-T266 HydrophobicContact CB-CG2 4.49Å; V201-T266 HydrophobicContact CG2-CG2 4.33Å; F203-T266 WeakPolarHBondContact CZ-OG1 3.26Å; M262-T266 WeakPolarHBondContact O-CB 3.3Å; M262-T266 PolarHBondContact O-N 3.04Å; M262-T266 PolarHBondContact O-OG1 2.89Å; L263-T266 PolarHBondContact O-N 2.8Å; T266-I269 PolarHBondContact O-N 3.23Å; T266-R270 VanDerWaalsContact O-CB 3.27Å; T266-R270 WeakPolarHBondContact O-CB 3.39Å; T266-R270 PolarHBondContact O-N 3.06Å; T266-I278 HydrophobicContact CG2-CD1 4.16Å; T266-I278 HydrophobicContact CG2-CG1 4.03Å; T266-I278 HydrophobicContact CG2-CG2 3.81Å
267	D	98.8	Very high	98.2	Very high	29 Å²	29	39 Å²	39	16%	0.155	18%	0.184	C	C	.	.	H	α-helix	trans	-70.5	-38.2	177.3	-162.8	27.6	0	0	0	112.9	L263 R264 L265 R270 E271 I278 T302 T304	L263-D267 WeakPolarHBondContact O-CB 3.47Å; L263-D267 PolarHBondContact O-N 2.93Å; R264-D267 PolarHBondContact O-N 2.99Å; L265-D267 VanDerWaalsContact C-N 3.27Å; L265-D267 PolarHBondContact O-N 3.08Å; D267-R270 WeakPolarHBondContact O-CB 3.09Å; D267-R270 PolarHBondContact O-N 2.89Å; D267-R270 PolarHBondContact O-NE 2.85Å; D267-R270 IonicContact OD1-NE 2.8Å; D267-R270 PolarHBondContact OD1-NE 3.01Å; D267-R270 VanDerWaalsContact OD1-NE 3.16Å; D267-E271 PolarHBondContact O-N 3.35Å; D267-I278 HydrophobicContact CB-CD1 3.82Å; D267-T302 VanDerWaalsContact CG-OG1 3.28Å; D267-T302 VanDerWaalsContact OD2-CB 3.29Å; D267-T302 WeakPolarHBondContact OD2-CB 3.37Å; D267-T302 PolarHBondContact OD2-OG1 2.81Å; D267-T304 VanDerWaalsContact OD1-CB 3.32Å; D267-T304 WeakPolarHBondContact OD1-CB 3.45Å; D267-T304 PolarHBondContact OD1-OG1 3.07Å; D267-T304 PolarHBondContact OD2-OG1 2.99Å
268	A	98.8	Very high	98.3	Very high	20 Å²	20	38.9 Å²	38.9	17%	0.165	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-44.9	171.9	0	0	0	0	0	111.5	R264 L265 R270 E271 M272 M369 L373	R264-A268 PolarHBondContact O-N 2.89Å; L265-A268 PolarHBondContact O-N 3.27Å; A268-R270 VanDerWaalsContact C-N 3.33Å; A268-R270 PolarHBondContact O-N 2.99Å; A268-E271 WeakPolarHBondContact O-CB 3.43Å; A268-E271 PolarHBondContact O-N 2.87Å; A268-E271 VanDerWaalsContact O-N 3.12Å; A268-M272 WeakPolarHBondContact O-CG 3.43Å; A268-M272 PolarHBondContact O-N 2.96Å; A268-M369 HydrophobicContact CB-CE 4.1Å; A268-L373 HydrophobicContact CB-CD1 3.9Å; A268-L373 HydrophobicContact CB-CD2 4.17Å
269	I	98.8	Very high	98.4	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-44.4	174	-66.9	163.7	0	0	0	110.1	M175 V201 I234 V236 L265 T266 E271 M272 R273 L373 L376	M175-I269 HydrophobicContact SD-CG2 3.93Å; V201-I269 HydrophobicContact CG1-CD1 3.88Å; V201-I269 HydrophobicContact CG2-CG2 4.19Å; I234-I269 HydrophobicContact CD1-CG2 3.66Å; I234-I269 HydrophobicContact CG2-CD1 4.3Å; V236-I269 HydrophobicContact CG2-CD1 3.66Å; L265-I269 VanDerWaalsContact O-CG1 3.25Å; L265-I269 WeakPolarHBondContact O-CG1 3.38Å; L265-I269 PolarHBondContact O-N 3.32Å; T266-I269 PolarHBondContact O-N 3.23Å; I269-E271 PolarHBondContact O-N 2.89Å; I269-M272 PolarHBondContact O-N 3.13Å; I269-R273 HydrophobicContact CG2-CG 3.88Å; I269-R273 VanDerWaalsContact O-CB 3.28Å; I269-R273 WeakPolarHBondContact O-CB 3.47Å; I269-R273 WeakPolarHBondContact O-CG 3.36Å; I269-R273 PolarHBondContact O-N 2.88Å; I269-L373 HydrophobicContact CG1-CD2 3.86Å; I269-L376 HydrophobicContact CD1-CD1 4.4Å; I269-L376 HydrophobicContact CD1-CD2 3.96Å; I269-L376 HydrophobicContact CG1-CD1 4.01Å; I269-L376 HydrophobicContact CG1-CD2 4.44Å
270	R	98.7	Very high	98.5	Very high	47 Å²	47	37 Å²	37	18%	0.177	18%	0.177	C	C	.	.	H	α-helix	trans	-54	-42.3	174.4	175	-121.3	49.2	102	-12.4	110.9	M175 T266 D267 A268 R273 H274 G275	M175-R270 HydrophobicContact CB-CB 4.49Å; M175-R270 HydrophobicContact CG-CB 3.52Å; M175-R270 HydrophobicContact CG-CG 4.19Å; T266-R270 VanDerWaalsContact O-CB 3.27Å; T266-R270 WeakPolarHBondContact O-CB 3.39Å; T266-R270 PolarHBondContact O-N 3.06Å; D267-R270 WeakPolarHBondContact O-CB 3.09Å; D267-R270 PolarHBondContact O-N 2.89Å; D267-R270 PolarHBondContact O-NE 2.85Å; D267-R270 IonicContact OD1-NE 2.8Å; D267-R270 PolarHBondContact OD1-NE 3.01Å; D267-R270 VanDerWaalsContact OD1-NE 3.16Å; A268-R270 VanDerWaalsContact C-N 3.33Å; A268-R270 PolarHBondContact O-N 2.99Å; R270-R273 PolarHBondContact O-N 3.33Å; R270-H274 PolarHBondContact O-N 2.96Å; R270-H274 VanDerWaalsContact O-N 3.08Å; R270-G275 WeakPolarHBondContact CD-O 3.38Å; R270-G275 VanDerWaalsContact CG-C 3.48Å; R270-G275 VanDerWaalsContact CG-O 3.31Å; R270-G275 WeakPolarHBondContact CG-O 3.35Å; R270-G275 PolarHBondContact NH1-O 3.44Å; R270-G275 PolarHBondContact O-N 2.95Å
271	E	98.6	Very high	98.4	Very high	128 Å²	128	37.5 Å²	37.5	60%	0.598	18%	0.181	S	C	*	.	H	α-helix	trans	-62.2	-53.3	175.7	-160.9	164.5	-178.3	0	0	112.3	D267 A268 I269 R273 H274	D267-E271 PolarHBondContact O-N 3.35Å; A268-E271 WeakPolarHBondContact O-CB 3.43Å; A268-E271 PolarHBondContact O-N 2.87Å; A268-E271 VanDerWaalsContact O-N 3.12Å; I269-E271 PolarHBondContact O-N 2.89Å; E271-R273 PolarHBondContact O-N 3.36Å; E271-H274 PolarHBondContact O-N 3.3Å; E271-H274 VanDerWaalsContact O-N 3.11Å
272	M	98.4	Very high	98.3	Very high	107 Å²	107	37.2 Å²	37.2	53%	0.527	18%	0.18	S	C	.	.	H	α-helix	trans	-57.8	-32.2	179.4	-66.9	169.2	61.8	0	0	112.5	A268 I269 L373 L376	A268-M272 WeakPolarHBondContact O-CG 3.43Å; A268-M272 PolarHBondContact O-N 2.96Å; I269-M272 PolarHBondContact O-N 3.13Å; M272-L373 HydrophobicContact SD-CD2 4.18Å; M272-L376 HydrophobicContact CE-CD1 4.21Å
273	R	98.1	Very high	98.2	Very high	65 Å²	65	37.4 Å²	37.4	25%	0.245	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	7.3	-176.6	-57.9	-61.2	-63.6	177.4	-3.1	113.5	R173 M175 E199 I234 I269 R270 E271 G275	R173-R273 WeakPolarHBondContact CD-O 3.23Å; R173-R273 PolarHBondContact NH1-O 3.39Å; M175-R273 HydrophobicContact CE-CB 4.05Å; M175-R273 HydrophobicContact SD-CB 4.16Å; M175-R273 HydrophobicContact SD-CG 4.38Å; E199-R273 IonicContact OE1-CZ 2.83Å; E199-R273 IonicContact OE1-NE 3.19Å; E199-R273 PolarHBondContact OE1-NE 2.81Å; E199-R273 IonicContact OE1-NH2 3.09Å; E199-R273 PolarHBondContact OE1-NH2 3.41Å; E199-R273 WeakPolarHBondContact OE2-CG 3.45Å; E199-R273 IonicContact OE2-CZ 2.97Å; E199-R273 IonicContact OE2-NE 2.86Å; E199-R273 PolarHBondContact OE2-NE 2.95Å; E199-R273 IonicContact OE2-NH2 2.93Å; E199-R273 PolarHBondContact OE2-NH2 3.39Å; I234-R273 HydrophobicContact CD1-CG 4.18Å; I269-R273 HydrophobicContact CG2-CG 3.88Å; I269-R273 VanDerWaalsContact O-CB 3.28Å; I269-R273 WeakPolarHBondContact O-CB 3.47Å; I269-R273 WeakPolarHBondContact O-CG 3.36Å; I269-R273 PolarHBondContact O-N 2.88Å; R270-R273 PolarHBondContact O-N 3.33Å; E271-R273 PolarHBondContact O-N 3.36Å; R273-G275 PolarHBondContact O-N 3.34Å
274	H	98.1	Very high	98.1	Very high	162 Å²	162	41.3 Å²	41.3	75%	0.75	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	34.5	-178	-52.7	-59.8	0	0	0	114.1	R270 E271	R270-H274 PolarHBondContact O-N 2.96Å; R270-H274 VanDerWaalsContact O-N 3.08Å; E271-H274 PolarHBondContact O-N 3.3Å; E271-H274 VanDerWaalsContact O-N 3.11Å
275	G	98.5	Very high	97.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.01	22%	0.219	C	C	.	.			trans	-75.6	157.3	171.8	0	0	0	0	0	112.5	R173 R270 R273	R173-G275 CarbonylContact O-C 3.5Å; R173-G275 WeakPolarHBondContact O-CA 3.27Å; R270-G275 WeakPolarHBondContact CD-O 3.38Å; R270-G275 VanDerWaalsContact CG-C 3.48Å; R270-G275 VanDerWaalsContact CG-O 3.31Å; R270-G275 WeakPolarHBondContact CG-O 3.35Å; R270-G275 PolarHBondContact NH1-O 3.44Å; R270-G275 PolarHBondContact O-N 2.95Å; R273-G275 PolarHBondContact O-N 3.34Å
276	L	98.6	Very high	97.3	Very high	110 Å²	110	44.5 Å²	44.5	58%	0.576	24%	0.235	S	C	*	.	S	Bend	trans	-102.3	-26.4	179.6	-63.2	177.6	0	0	0	113.3	R173	R173-L276 PolarHBondContact O-N 2.75Å
277	V	98.7	Very high	96.9	Very high	25 Å²	25	47.9 Å²	47.9	15%	0.152	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.5	-171.2	-58.5	0	0	0	0	111.6	G174 M175 I279 P305 I307	G174-V277 CarbonylContact C-O 3.59Å; G174-V277 VanDerWaalsContact CA-O 3.28Å; G174-V277 WeakPolarHBondContact CA-O 3.43Å; M175-V277 PolarHBondContact N-O 2.77Å; V277-I279 HydrophobicContact CG2-CD1 4.43Å; V277-I279 HydrophobicContact CG2-CG1 4.14Å; V277-P305 WeakPolarHBondContact CA-O 3.49Å; V277-P305 WeakPolarHBondContact CB-O 3.29Å; V277-P305 HydrophobicContact CG1-CB 4.05Å; V277-P305 HydrophobicContact CG1-CG 4.48Å; V277-I307 HydrophobicContact CB-CG1 4.06Å; V277-I307 HydrophobicContact CG1-CG1 4.23Å; V277-I307 HydrophobicContact CG2-CG1 4.15Å
278	I	98.9	Very high	96.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.5	166	-61	172.7	0	0	0	107.7	M175 M177 L263 T266 D267 T304 P305 I306 I307	M175-I278 CarbonylContact O-C 3.56Å; M175-I278 WeakPolarHBondContact O-CA 3.39Å; M177-I278 HydrophobicContact CG-CG2 4.04Å; M177-I278 HydrophobicContact SD-CG2 3.92Å; L263-I278 HydrophobicContact CD1-CD1 3.55Å; L263-I278 HydrophobicContact CD1-CG2 4.13Å; T266-I278 HydrophobicContact CG2-CD1 4.16Å; T266-I278 HydrophobicContact CG2-CG1 4.03Å; T266-I278 HydrophobicContact CG2-CG2 3.81Å; D267-I278 HydrophobicContact CB-CD1 3.82Å; I278-T304 HydrophobicContact CD1-CG2 4.21Å; I278-T304 HydrophobicContact CG1-CG2 4.01Å; I278-P305 PolarHBondContact N-O 3.27Å; I278-I306 HydrophobicContact CB-CG1 4.43Å; I278-I306 CarbonylContact O-C 3.48Å; I278-I306 WeakPolarHBondContact O-CA 3.49Å; I278-I307 PolarHBondContact O-N 2.98Å
279	I	98.8	Very high	95.7	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.9	179.4	-56.2	152.9	0	0	0	107.5	M175 L176 M177 A187 A191 V196 I198 V277 I307 P309	M175-I279 PolarHBondContact O-N 3.08Å; L176-I279 CarbonylContact C-O 3.51Å; L176-I279 WeakPolarHBondContact CA-O 3.48Å; L176-I279 HydrophobicContact CD1-CB 4.03Å; L176-I279 HydrophobicContact CD1-CG2 3.67Å; M177-I279 PolarHBondContact N-O 2.88Å; A187-I279 HydrophobicContact CB-CG2 4.38Å; A191-I279 HydrophobicContact CB-CD1 3.7Å; A191-I279 HydrophobicContact CB-CG1 4.27Å; A191-I279 HydrophobicContact CB-CG2 4.08Å; V196-I279 HydrophobicContact CG1-CD1 3.97Å; I198-I279 HydrophobicContact CG2-CD1 3.79Å; V277-I279 HydrophobicContact CG2-CD1 4.43Å; V277-I279 HydrophobicContact CG2-CG1 4.14Å; I279-I307 WeakPolarHBondContact CA-O 3.25Å; I279-I307 HydrophobicContact CG1-CB 4.31Å; I279-P309 HydrophobicContact CG2-CG 4.13Å
280	N	97.5	Very high	95.5	Very high	6 Å²	6	48 Å²	48	3%	0.032	26%	0.257	C	S	.	.			trans	-139.4	165.4	173.2	73.3	28	0	0	0	111.8	M177 A187 E282 I307 R308 P309	M177-N280 HydrophobicContact CB-CB 4.29Å; M177-N280 HydrophobicContact SD-CB 4.32Å; A187-N280 WeakPolarHBondContact CB-O 3.48Å; N280-E282 HydrophobicContact CB-CG 4.5Å; N280-E282 PolarHBondContact ND2-OE2 3.14Å; N280-E282 WeakPolarHBondContact OD1-CB 3.41Å; N280-E282 WeakPolarHBondContact OD1-CG 3.4Å; N280-E282 PolarHBondContact OD1-N 3.23Å; N280-E282 VanDerWaalsContact OD1-N 3.14Å; N280-I307 PolarHBondContact N-O 3.47Å; N280-I307 VanDerWaalsContact N-O 3.14Å; N280-R308 WeakPolarHBondContact OD1-CG 3.25Å; N280-P309 WeakPolarHBondContact O-CD 3.35Å
281	G	96.8	Very high	95.3	Very high	9 Å²	9	47.2 Å²	47.2	9%	0.093	26%	0.257	C	S	.	.			trans	-93.8	33.5	176.8	0	0	0	0	0	114.2	D183	D183-G281 VanDerWaalsContact CB-O 3.25Å; D183-G281 WeakPolarHBondContact CB-O 3.35Å
282	E	96.4	Very high	95.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.019	26%	0.256	C	S	.	.			trans	-73	128.4	179.4	-67.8	179.3	148.2	0	0	111.8	R259 N280 Q290 M295 R308 V311	R259-E282 IonicContact CZ-OE1 3.46Å; R259-E282 IonicContact NE-OE1 3.21Å; R259-E282 IonicContact NH2-OE1 2.87Å; R259-E282 PolarHBondContact NH2-OE1 3.37Å; N280-E282 HydrophobicContact CB-CG 4.5Å; N280-E282 PolarHBondContact ND2-OE2 3.14Å; N280-E282 WeakPolarHBondContact OD1-CB 3.41Å; N280-E282 WeakPolarHBondContact OD1-CG 3.4Å; N280-E282 PolarHBondContact OD1-N 3.23Å; N280-E282 VanDerWaalsContact OD1-N 3.14Å; E282-Q290 HydrophobicContact CB-CG 4.23Å; E282-Q290 HydrophobicContact CG-CG 4.16Å; E282-M295 HydrophobicContact CB-CE 4.06Å; E282-R308 IonicContact OE2-CZ 2.75Å; E282-R308 IonicContact OE2-NE 3.93Å; E282-R308 PolarHBondContact OE2-NE 3.42Å; E282-R308 IonicContact OE2-NH2 3.31Å; E282-V311 VanDerWaalsContact O-CA 3.25Å; E282-V311 WeakPolarHBondContact O-CA 3.25Å; E282-V311 PolarHBondContact O-N 2.81Å
283	S	96	Very high	95.2	Very high	8 Å²	8	45 Å²	45	6%	0.056	25%	0.248	C	C	.	.			trans	-112.5	129.2	172	178.7	0	0	0	0	110.8	G285 Q286 Q290 M313	S283-G285 PolarHBondContact O-N 3.4Å; S283-G285 VanDerWaalsContact O-N 3.15Å; S283-Q286 PolarHBondContact O-N 2.85Å; S283-Q290 VanDerWaalsContact N-OE1 3.16Å; S283-Q290 WeakPolarHBondContact O-CB 3.39Å; S283-Q290 PolarHBondContact O-OE1 3.05Å; S283-M313 PolarHBondContact OG-O 3.33Å; S283-M313 VanDerWaalsContact OG-O 3.06Å
284	L	96.1	Very high	95.1	Very high	86 Å²	86	41.9 Å²	41.9	45%	0.45	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	119.9	-170.6	179.3	62.9	0	0	0	111.8	Q286 L292 M295 V311	L284-Q286 VanDerWaalsContact C-N 3.33Å; L284-L292 HydrophobicContact CD1-CD2 3.63Å; L284-L292 HydrophobicContact CD1-CG 3.86Å; L284-L292 HydrophobicContact CD2-CD2 4.38Å; L284-M295 HydrophobicContact CD1-CE 4.34Å; L284-M295 HydrophobicContact CD1-SD 4.23Å; L284-V311 HydrophobicContact CB-CG2 4.2Å; L284-V311 WeakPolarHBondContact CB-O 3.39Å; L284-V311 PolarHBondContact N-O 3.48Å
285	G	91.6	Very high	95	Very high	57 Å²	57	35.1 Å²	35.1	59%	0.588	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	3.3	175.4	0	0	0	0	0	115.5	S283 Q290	S283-G285 PolarHBondContact O-N 3.4Å; S283-G285 VanDerWaalsContact O-N 3.15Å; G285-Q290 PolarHBondContact N-O 2.86Å
286	Q	88.6	Confident	95	Very high	68 Å²	68	39.7 Å²	39.7	32%	0.318	23%	0.233	S	C	.	.	S	Bend	trans	-70.9	-40.3	-179.4	-173.2	176.4	-52	0	0	113	D183 S283 L284	D183-Q286 PolarHBondContact OD2-NE2 3Å; D183-Q286 PolarHBondContact OD2-OE1 3.24Å; S283-Q286 PolarHBondContact O-N 2.85Å; L284-Q286 VanDerWaalsContact C-N 3.33Å
287	V	89.3	Confident	94.9	Very high	71 Å²	71	34.5 Å²	34.5	43%	0.43	21%	0.206	S	C	.	.	S	Bend	trans	-135.7	166.2	176.1	-62.5	0	0	0	0	111.7	S289 Q290	V287-S289 WeakPolarHBondContact CG2-OG 3.37Å; V287-S289 PolarHBondContact O-N 2.76Å; V287-S289 VanDerWaalsContact O-N 3.13Å; V287-Q290 HydrophobicContact CG2-CB 4.1Å; V287-Q290 VanDerWaalsContact CG2-CD 3.47Å; V287-Q290 HydrophobicContact CG2-CG 3.61Å; V287-Q290 PolarHBondContact O-N 3.11Å
288	A	85.8	Confident	94.8	Very high	26 Å²	26	33.6 Å²	33.6	22%	0.215	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-58.4	-29.3	-174.7	0	0	0	0	0	114.8	Q290 S294 P347 T349	A288-Q290 VanDerWaalsContact C-N 3.28Å; A288-Q290 PolarHBondContact O-N 2.99Å; A288-S294 PolarHBondContact O-OG 3.15Å; A288-S294 VanDerWaalsContact O-OG 3.04Å; A288-P347 HydrophobicContact CB-CB 3.77Å; A288-P347 HydrophobicContact CB-CG 3.45Å; A288-P347 VanDerWaalsContact CB-CG 3.45Å; A288-T349 HydrophobicContact CB-CG2 3.87Å
289	S	87.8	Confident	94.8	Very high	11 Å²	11	35.8 Å²	35.8	8%	0.077	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-77	-11	175.2	53.2	0	0	0	0	114	V287 S294	V287-S289 WeakPolarHBondContact CG2-OG 3.37Å; V287-S289 PolarHBondContact O-N 2.76Å; V287-S289 VanDerWaalsContact O-N 3.13Å; S289-S294 WeakPolarHBondContact O-CB 3.34Å
290	Q	93.4	Very high	94.7	Very high	15 Å²	15	40.1 Å²	40.1	7%	0.07	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-111.1	24.6	-173.1	-63.1	176.4	-1.3	0	0	112.7	E282 S283 G285 V287 A288 M295	E282-Q290 HydrophobicContact CB-CG 4.23Å; E282-Q290 HydrophobicContact CG-CG 4.16Å; S283-Q290 VanDerWaalsContact N-OE1 3.16Å; S283-Q290 WeakPolarHBondContact O-CB 3.39Å; S283-Q290 PolarHBondContact O-OE1 3.05Å; G285-Q290 PolarHBondContact N-O 2.86Å; V287-Q290 HydrophobicContact CG2-CB 4.1Å; V287-Q290 VanDerWaalsContact CG2-CD 3.47Å; V287-Q290 HydrophobicContact CG2-CG 3.61Å; V287-Q290 PolarHBondContact O-N 3.11Å; A288-Q290 VanDerWaalsContact C-N 3.28Å; A288-Q290 PolarHBondContact O-N 2.99Å; Q290-M295 HydrophobicContact CB-CE 4.18Å
291	T	96	Very high	94.7	Very high	31 Å²	31	40.9 Å²	40.9	19%	0.19	24%	0.237	C	C	.	.	S	Bend	trans	-79.8	158.3	165.6	74.2	0	0	0	0	110.2	H293 S294 M295 T349	T291-H293 PolarHBondContact O-N 3.06Å; T291-H293 PolarHBondContact OG1-N 2.85Å; T291-S294 PolarHBondContact O-N 3.38Å; T291-S294 VanDerWaalsContact O-N 3.12Å; T291-S294 PolarHBondContact OG1-N 3.48Å; T291-S294 VanDerWaalsContact OG1-N 3.12Å; T291-S294 PolarHBondContact OG1-OG 2.96Å; T291-M295 WeakPolarHBondContact O-CG 3.26Å; T291-M295 PolarHBondContact O-N 3.29Å; T291-T349 WeakPolarHBondContact CB-O 3.5Å; T291-T349 WeakPolarHBondContact CG2-O 3.46Å; T291-T349 PolarHBondContact OG1-O 3.47Å
292	L	96.7	Very high	94.8	Very high	110 Å²	110	41 Å²	41	58%	0.576	24%	0.236	S	C	*	.	H	α-helix	trans	-56.6	-34.5	175.4	-66.7	179.2	0	0	0	113.1	L284 M295 V296	L284-L292 HydrophobicContact CD1-CD2 3.63Å; L284-L292 HydrophobicContact CD1-CG 3.86Å; L284-L292 HydrophobicContact CD2-CD2 4.38Å; L292-M295 HydrophobicContact CD2-SD 4.47Å; L292-M295 PolarHBondContact O-N 2.85Å; L292-V296 WeakPolarHBondContact O-CB 3.36Å; L292-V296 VanDerWaalsContact O-CG2 3.27Å; L292-V296 WeakPolarHBondContact O-CG2 3.37Å; L292-V296 PolarHBondContact O-N 3.46Å
293	H	97.4	Very high	94.9	Very high	78 Å²	78	47.8 Å²	47.8	36%	0.361	28%	0.278	S	S	.	.	H	α-helix	trans	-69.5	-42.8	178.9	-67.5	71.6	0	0	0	111.1	T291 A297 R350	T291-H293 PolarHBondContact O-N 3.06Å; T291-H293 PolarHBondContact OG1-N 2.85Å; H293-A297 WeakPolarHBondContact O-CB 3.36Å; H293-A297 PolarHBondContact O-N 3.43Å; H293-R350 HydrophobicContact CB-CB 4.21Å; H293-R350 HydrophobicContact CB-CG 4.29Å; H293-R350 PolarHBondContact CE1-NH1 2.86Å; H293-R350 PolarHBondContact CE1-NH2 2.83Å; H293-R350 PolarHBondContact NE2-NH1 3.43Å; H293-R350 PolarHBondContact NE2-NH2 2.86Å
294	S	96.3	Very high	95	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-43.8	174.2	-63.8	0	0	0	0	111.3	A288 S289 T291 V296 A297 I298 P351	A288-S294 PolarHBondContact O-OG 3.15Å; A288-S294 VanDerWaalsContact O-OG 3.04Å; S289-S294 WeakPolarHBondContact O-CB 3.34Å; T291-S294 PolarHBondContact O-N 3.38Å; T291-S294 VanDerWaalsContact O-N 3.12Å; T291-S294 PolarHBondContact OG1-N 3.48Å; T291-S294 VanDerWaalsContact OG1-N 3.12Å; T291-S294 PolarHBondContact OG1-OG 2.96Å; S294-V296 PolarHBondContact O-N 3.33Å; S294-A297 CarbonylContact O-C 3.6Å; S294-A297 PolarHBondContact O-N 3.43Å; S294-I298 WeakPolarHBondContact O-CB 3.48Å; S294-I298 WeakPolarHBondContact O-CD1 3.25Å; S294-I298 WeakPolarHBondContact O-CG1 3.19Å; S294-I298 PolarHBondContact O-N 2.73Å; S294-P351 WeakPolarHBondContact OG-CD 3.39Å
295	M	96.6	Very high	95.1	Very high	20 Å²	20	47.8 Å²	47.8	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-46	177.2	-72.5	178.2	172.6	0	0	112.1	E282 L284 Q290 T291 L292 I298 N299 V311	E282-M295 HydrophobicContact CB-CE 4.06Å; L284-M295 HydrophobicContact CD1-CE 4.34Å; L284-M295 HydrophobicContact CD1-SD 4.23Å; Q290-M295 HydrophobicContact CB-CE 4.18Å; T291-M295 WeakPolarHBondContact O-CG 3.26Å; T291-M295 PolarHBondContact O-N 3.29Å; L292-M295 HydrophobicContact CD2-SD 4.47Å; L292-M295 PolarHBondContact O-N 2.85Å; M295-I298 PolarHBondContact O-N 3.45Å; M295-N299 WeakPolarHBondContact O-CB 3.24Å; M295-N299 PolarHBondContact O-N 3.27Å; M295-V311 HydrophobicContact CE-CG2 4.22Å
296	V	96.8	Very high	95.4	Very high	97 Å²	97	46 Å²	46	59%	0.588	26%	0.26	S	S	*	.	H	α-helix	trans	-60	-48	175.3	168.2	0	0	0	0	110.7	L292 S294 I298 E300	L292-V296 WeakPolarHBondContact O-CB 3.36Å; L292-V296 VanDerWaalsContact O-CG2 3.27Å; L292-V296 WeakPolarHBondContact O-CG2 3.37Å; L292-V296 PolarHBondContact O-N 3.46Å; S294-V296 PolarHBondContact O-N 3.33Å; V296-I298 VanDerWaalsContact C-N 3.3Å; V296-I298 PolarHBondContact O-N 2.86Å; V296-E300 PolarHBondContact O-N 3.22Å
297	A	97.6	Very high	95.9	Very high	2 Å²	2	46.5 Å²	46.5	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-32.3	179.4	0	0	0	0	0	112.6	T256 R260 H293 S294 P351	T256-A297 HydrophobicContact CG2-CB 4.11Å; R260-A297 WeakPolarHBondContact CD-O 3.48Å; R260-A297 PolarHBondContact NH1-O 3.13Å; H293-A297 WeakPolarHBondContact O-CB 3.36Å; H293-A297 PolarHBondContact O-N 3.43Å; S294-A297 CarbonylContact O-C 3.6Å; S294-A297 PolarHBondContact O-N 3.43Å; A297-P351 HydrophobicContact CB-CB 4.34Å; A297-P351 HydrophobicContact CB-CG 3.82Å
298	I	97.4	Very high	96.3	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-80	-45.9	-179.8	-68.3	161.7	0	0	0	111.2	T256 R259 R260 L263 S294 M295 V296 E300 V301	T256-I298 HydrophobicContact CG2-CG1 4.16Å; R259-I298 HydrophobicContact CB-CD1 3.63Å; R259-I298 HydrophobicContact CB-CG1 3.92Å; R259-I298 HydrophobicContact CB-CG2 3.92Å; R259-I298 HydrophobicContact CG-CD1 4.13Å; R260-I298 HydrophobicContact CG-CB 4.38Å; R260-I298 HydrophobicContact CG-CG1 4.38Å; R260-I298 HydrophobicContact CG-CG2 4.46Å; L263-I298 HydrophobicContact CD2-CG2 4.05Å; S294-I298 WeakPolarHBondContact O-CB 3.48Å; S294-I298 WeakPolarHBondContact O-CD1 3.25Å; S294-I298 WeakPolarHBondContact O-CG1 3.19Å; S294-I298 PolarHBondContact O-N 2.73Å; M295-I298 PolarHBondContact O-N 3.45Å; V296-I298 VanDerWaalsContact C-N 3.3Å; V296-I298 PolarHBondContact O-N 2.86Å; I298-E300 PolarHBondContact O-N 2.82Å; I298-V301 WeakPolarHBondContact O-CG2 3.2Å
299	N	96.9	Very high	96.9	Very high	47 Å²	47	45.7 Å²	45.7	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-66.2	-23.6	-173.2	-161.2	117	0	0	0	113	M295 V301 T302 I306 R308	M295-N299 WeakPolarHBondContact O-CB 3.24Å; M295-N299 PolarHBondContact O-N 3.27Å; N299-V301 PolarHBondContact O-N 3.04Å; N299-T302 PolarHBondContact ND2-O 3.29Å; N299-T302 PolarHBondContact O-N 3.11Å; N299-T302 VanDerWaalsContact O-N 3.15Å; N299-I306 VanDerWaalsContact OD1-CD1 3.25Å; N299-I306 WeakPolarHBondContact OD1-CD1 3.45Å; N299-R308 PolarHBondContact OD1-NH2 3.29Å; N299-R308 VanDerWaalsContact OD1-NH2 3.15Å
300	E	97.7	Very high	97.4	Very high	92 Å²	92	45.2 Å²	45.2	43%	0.43	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22	-174.6	-177.1	-82.2	164.7	0	0	114	R260 V296 I298 T302 L353	R260-E300 IonicContact CZ-OE2 2.81Å; R260-E300 IonicContact NH1-OE2 3.77Å; R260-E300 PolarHBondContact NH1-OE2 3.3Å; R260-E300 IonicContact NH2-OE2 2.65Å; R260-E300 PolarHBondContact NH2-OE2 3.28Å; V296-E300 PolarHBondContact O-N 3.22Å; I298-E300 PolarHBondContact O-N 2.82Å; E300-T302 PolarHBondContact O-N 3.19Å; E300-T302 VanDerWaalsContact O-N 3.12Å; E300-L353 HydrophobicContact CB-CD1 4.03Å; E300-L353 HydrophobicContact CB-CD2 4.39Å; E300-L353 HydrophobicContact CG-CD1 4.04Å; E300-L353 HydrophobicContact CG-CD2 3.95Å
301	V	98.1	Very high	97.6	Very high	21 Å²	21	46.5 Å²	46.5	13%	0.127	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.9	176.9	-57.6	0	0	0	0	115.1	R260 L263 R264 I298 N299	R260-V301 HydrophobicContact CB-CG1 3.77Å; R260-V301 HydrophobicContact CG-CG1 3.79Å; L263-V301 HydrophobicContact CB-CG2 3.88Å; L263-V301 HydrophobicContact CD2-CG2 3.62Å; L263-V301 HydrophobicContact CG-CG2 3.7Å; R264-V301 HydrophobicContact CG-CB 3.69Å; R264-V301 HydrophobicContact CG-CG1 4.05Å; R264-V301 HydrophobicContact CG-CG2 3.94Å; I298-V301 WeakPolarHBondContact O-CG2 3.2Å; N299-V301 PolarHBondContact O-N 3.04Å
302	T	98	Very high	97.7	Very high	12 Å²	12	51 Å²	51	7%	0.074	29%	0.285	C	S	.	.			trans	-150.2	146.3	-177.5	-179.7	0	0	0	0	112.4	L263 D267 N299 E300 T304 I306	L263-T302 HydrophobicContact CD1-CG2 4.1Å; L263-T302 HydrophobicContact CD2-CG2 3.83Å; L263-T302 HydrophobicContact CG-CG2 3.75Å; D267-T302 VanDerWaalsContact CG-OG1 3.28Å; D267-T302 VanDerWaalsContact OD2-CB 3.29Å; D267-T302 WeakPolarHBondContact OD2-CB 3.37Å; D267-T302 PolarHBondContact OD2-OG1 2.81Å; N299-T302 PolarHBondContact ND2-O 3.29Å; N299-T302 PolarHBondContact O-N 3.11Å; N299-T302 VanDerWaalsContact O-N 3.15Å; E300-T302 PolarHBondContact O-N 3.19Å; E300-T302 VanDerWaalsContact O-N 3.12Å; T302-T304 VanDerWaalsContact OG1-CB 3.28Å; T302-T304 WeakPolarHBondContact OG1-CB 3.48Å; T302-T304 PolarHBondContact OG1-N 2.99Å; T302-T304 PolarHBondContact OG1-OG1 2.74Å; T302-I306 HydrophobicContact CG2-CD1 4.41Å
303	T	98	Very high	97.7	Very high	147 Å²	147	47.8 Å²	47.8	90%	0.902	27%	0.267	S	S	*	.			trans	-92.8	-2.9	169.3	56.7	0	0	0	0	113
304	T	98.5	Very high	97.7	Very high	19 Å²	19	48.2 Å²	48.2	12%	0.117	27%	0.272	C	S	.	.	S	Bend	trans	-60.2	135.4	177.2	-70.2	0	0	0	0	110.3	D267 I278 T302 I306	D267-T304 VanDerWaalsContact OD1-CB 3.32Å; D267-T304 WeakPolarHBondContact OD1-CB 3.45Å; D267-T304 PolarHBondContact OD1-OG1 3.07Å; D267-T304 PolarHBondContact OD2-OG1 2.99Å; I278-T304 HydrophobicContact CD1-CG2 4.21Å; I278-T304 HydrophobicContact CG1-CG2 4.01Å; T302-T304 VanDerWaalsContact OG1-CB 3.28Å; T302-T304 WeakPolarHBondContact OG1-CB 3.48Å; T302-T304 PolarHBondContact OG1-N 2.99Å; T302-T304 PolarHBondContact OG1-OG1 2.74Å; T304-I306 PolarHBondContact O-N 3.24Å
305	P	98.4	Very high	97.6	Very high	75 Å²	75	51.7 Å²	51.7	49%	0.487	29%	0.287	S	S	.	.			trans	-60.3	122.9	177	-21.3	31.6	0	0	0	111.6	V277 I278	V277-P305 WeakPolarHBondContact CA-O 3.49Å; V277-P305 WeakPolarHBondContact CB-O 3.29Å; V277-P305 HydrophobicContact CG1-CB 4.05Å; V277-P305 HydrophobicContact CG1-CG 4.48Å; I278-P305 PolarHBondContact N-O 3.27Å
306	I	98.4	Very high	97.6	Very high	20 Å²	20	54.8 Å²	54.8	10%	0.103	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	110.7	173.8	-51.6	-175.4	0	0	0	109.1	L263 I278 N299 T302 T304 R308	L263-I306 HydrophobicContact CD1-CD1 3.53Å; L263-I306 HydrophobicContact CD1-CG1 4.34Å; L263-I306 HydrophobicContact CD2-CD1 3.52Å; L263-I306 HydrophobicContact CG-CD1 4.15Å; I278-I306 HydrophobicContact CB-CG1 4.43Å; I278-I306 CarbonylContact O-C 3.48Å; I278-I306 WeakPolarHBondContact O-CA 3.49Å; N299-I306 VanDerWaalsContact OD1-CD1 3.25Å; N299-I306 WeakPolarHBondContact OD1-CD1 3.45Å; T302-I306 HydrophobicContact CG2-CD1 4.41Å; T304-I306 PolarHBondContact O-N 3.24Å; I306-R308 HydrophobicContact CG2-CG 4.08Å
307	I	98.4	Very high	97.7	Very high	78 Å²	78	54.2 Å²	54.2	40%	0.4	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.6	176.5	-49.2	-56.6	0	0	0	108.4	V277 I278 I279 N280 P309	V277-I307 HydrophobicContact CB-CG1 4.06Å; V277-I307 HydrophobicContact CG1-CG1 4.23Å; V277-I307 HydrophobicContact CG2-CG1 4.15Å; I278-I307 PolarHBondContact O-N 2.98Å; I279-I307 WeakPolarHBondContact CA-O 3.25Å; I279-I307 HydrophobicContact CG1-CB 4.31Å; N280-I307 PolarHBondContact N-O 3.47Å; N280-I307 VanDerWaalsContact N-O 3.14Å; I307-P309 HydrophobicContact CG2-CG 4.11Å; I307-P309 WeakPolarHBondContact O-CD 3.23Å
308	R	97.9	Very high	97.7	Very high	45 Å²	45	54.1 Å²	54.1	17%	0.17	30%	0.298	C	S	.	.			trans	-119.6	77.9	-179	-52.8	-173.8	168	76.3	-2.2	109.6	N280 E282 N299 I306 V310 V311	N280-R308 WeakPolarHBondContact OD1-CG 3.25Å; E282-R308 IonicContact OE2-CZ 2.75Å; E282-R308 IonicContact OE2-NE 3.93Å; E282-R308 PolarHBondContact OE2-NE 3.42Å; E282-R308 IonicContact OE2-NH2 3.31Å; N299-R308 PolarHBondContact OD1-NH2 3.29Å; N299-R308 VanDerWaalsContact OD1-NH2 3.15Å; I306-R308 HydrophobicContact CG2-CG 4.08Å; R308-V310 PolarHBondContact O-N 2.7Å; R308-V311 HydrophobicContact CB-CB 3.76Å; R308-V311 HydrophobicContact CB-CG1 4.31Å; R308-V311 HydrophobicContact CB-CG2 4.34Å; R308-V311 WeakPolarHBondContact O-CB 3.24Å; R308-V311 WeakPolarHBondContact O-CG1 3.4Å; R308-V311 PolarHBondContact O-N 2.92Å; R308-V311 VanDerWaalsContact O-N 3.14Å
309	P	98.4	Very high	97.7	Very high	35 Å²	35	55.9 Å²	55.9	23%	0.227	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.3	-167.7	-25.6	36	0	0	0	114.9	A187 L190 I279 N280 I307	A187-P309 HydrophobicContact CB-CB 4.45Å; A187-P309 HydrophobicContact CB-CG 4.05Å; L190-P309 HydrophobicContact CB-CB 3.6Å; L190-P309 HydrophobicContact CB-CG 4.34Å; L190-P309 HydrophobicContact CD1-CB 3.78Å; L190-P309 HydrophobicContact CG-CB 4.36Å; I279-P309 HydrophobicContact CG2-CG 4.13Å; N280-P309 WeakPolarHBondContact O-CD 3.35Å; I307-P309 HydrophobicContact CG2-CG 4.11Å; I307-P309 WeakPolarHBondContact O-CD 3.23Å
310	V	98.2	Very high	97.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	9.8	-176.4	-57.6	0	0	0	0	113.5	V186 L190 R308 T312 M313 I318	V186-V310 HydrophobicContact CB-CG1 4.5Å; V186-V310 HydrophobicContact CG1-CG1 3.79Å; L190-V310 HydrophobicContact CD1-CG1 3.85Å; R308-V310 PolarHBondContact O-N 2.7Å; V310-T312 PolarHBondContact O-N 2.65Å; V310-T312 VanDerWaalsContact O-N 3.11Å; V310-M313 HydrophobicContact CB-CB 4.47Å; V310-M313 HydrophobicContact CB-SD 4.13Å; V310-M313 HydrophobicContact CG1-SD 3.89Å; V310-M313 PolarHBondContact O-N 3.18Å; V310-I318 HydrophobicContact CB-CD1 3.91Å; V310-I318 HydrophobicContact CB-CG1 4.1Å; V310-I318 HydrophobicContact CG1-CG1 4.24Å; V310-I318 HydrophobicContact CG2-CD1 4.25Å
311	V	98.1	Very high	97.8	Very high	42 Å²	42	56.2 Å²	56.2	26%	0.255	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.7	-169.7	71.1	0	0	0	0	114.8	E282 L284 M295 R308	E282-V311 VanDerWaalsContact O-CA 3.25Å; E282-V311 WeakPolarHBondContact O-CA 3.25Å; E282-V311 PolarHBondContact O-N 2.81Å; L284-V311 HydrophobicContact CB-CG2 4.2Å; L284-V311 WeakPolarHBondContact CB-O 3.39Å; L284-V311 PolarHBondContact N-O 3.48Å; M295-V311 HydrophobicContact CE-CG2 4.22Å; R308-V311 HydrophobicContact CB-CB 3.76Å; R308-V311 HydrophobicContact CB-CG1 4.31Å; R308-V311 HydrophobicContact CB-CG2 4.34Å; R308-V311 WeakPolarHBondContact O-CB 3.24Å; R308-V311 WeakPolarHBondContact O-CG1 3.4Å; R308-V311 PolarHBondContact O-N 2.92Å; R308-V311 VanDerWaalsContact O-N 3.14Å
312	T	97.7	Very high	97.8	Very high	127 Å²	127	55.2 Å²	55.2	78%	0.779	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	3.5	179.1	62	0	0	0	0	113.4	V310	V310-T312 PolarHBondContact O-N 2.65Å; V310-T312 VanDerWaalsContact O-N 3.11Å
313	M	97.7	Very high	97.9	Very high	42 Å²	42	59.9 Å²	59.9	21%	0.207	32%	0.322	C	S	.	.			trans	-85.7	139.1	-179.6	-60.5	179.6	100.2	0	0	109.1	L190 S283 V310 E317 I318	L190-M313 HydrophobicContact CD1-SD 3.98Å; S283-M313 PolarHBondContact OG-O 3.33Å; S283-M313 VanDerWaalsContact OG-O 3.06Å; V310-M313 HydrophobicContact CB-CB 4.47Å; V310-M313 HydrophobicContact CB-SD 4.13Å; V310-M313 HydrophobicContact CG1-SD 3.89Å; V310-M313 PolarHBondContact O-N 3.18Å; M313-E317 VanDerWaalsContact CA-OE2 3.24Å; M313-E317 WeakPolarHBondContact CA-OE2 3.29Å; M313-E317 HydrophobicContact CB-CB 4.25Å; M313-E317 HydrophobicContact CE-CB 4.23Å; M313-I318 HydrophobicContact CB-CD1 4.25Å; M313-I318 HydrophobicContact CB-CG1 3.85Å
314	D	95.6	Very high	97.8	Very high	86 Å²	86	60 Å²	60	46%	0.46	31%	0.311	S	S	.	.			trans	-73	168.3	168.6	75	41.2	0	0	0	111.2	T316 E317 I318	D314-T316 VanDerWaalsContact C-N 3.25Å; D314-T316 PolarHBondContact O-N 2.98Å; D314-T316 WeakPolarHBondContact OD1-CA 3.44Å; D314-T316 VanDerWaalsContact OD1-CB 3.26Å; D314-T316 WeakPolarHBondContact OD1-CB 3.4Å; D314-T316 PolarHBondContact OD1-N 3.28Å; D314-E317 PolarHBondContact N-OE2 2.94Å; D314-E317 PolarHBondContact O-N 3.23Å; D314-E317 PolarHBondContact OD1-N 2.94Å; D314-I318 WeakPolarHBondContact O-CG1 3.24Å; D314-I318 PolarHBondContact O-N 3.02Å
315	K	94.6	Very high	97.7	Very high	73 Å²	73	59.3 Å²	59.3	32%	0.317	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-31.9	-176	-172	59.5	177	-168.5	0	112.5	D183 I318 I319	D183-K315 IonicContact OD1-NZ 3.86Å; D183-K315 PolarHBondContact OD1-NZ 3.03Å; D183-K315 IonicContact OD2-NZ 3.33Å; K315-I318 PolarHBondContact O-N 3.44Å; K315-I319 HydrophobicContact CD-CD1 4.47Å; K315-I319 HydrophobicContact CG-CD1 3.91Å; K315-I319 HydrophobicContact CG-CG1 4.41Å; K315-I319 VanDerWaalsContact O-CG1 3.24Å; K315-I319 WeakPolarHBondContact O-CG1 3.35Å; K315-I319 PolarHBondContact O-N 3.42Å
316	T	97.4	Very high	97.6	Very high	85 Å²	85	60.2 Å²	60.2	52%	0.521	31%	0.306	S	S	.	.	H	α-helix	trans	-68.8	-45.1	-179.6	-52.1	0	0	0	0	110.1	D314 I318 I319 E320	D314-T316 VanDerWaalsContact C-N 3.25Å; D314-T316 PolarHBondContact O-N 2.98Å; D314-T316 WeakPolarHBondContact OD1-CA 3.44Å; D314-T316 VanDerWaalsContact OD1-CB 3.26Å; D314-T316 WeakPolarHBondContact OD1-CB 3.4Å; D314-T316 PolarHBondContact OD1-N 3.28Å; T316-I318 VanDerWaalsContact C-N 3.27Å; T316-I318 PolarHBondContact O-N 3.47Å; T316-I319 PolarHBondContact O-N 2.87Å; T316-I319 VanDerWaalsContact O-N 3.13Å; T316-E320 WeakPolarHBondContact O-CG 3.36Å; T316-E320 PolarHBondContact O-N 2.74Å
317	E	98	Very high	97.6	Very high	85 Å²	85	59.2 Å²	59.2	40%	0.397	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-39.1	175.4	-66.8	178.2	109.7	0	0	112	M313 D314 L321	M313-E317 VanDerWaalsContact CA-OE2 3.24Å; M313-E317 WeakPolarHBondContact CA-OE2 3.29Å; M313-E317 HydrophobicContact CB-CB 4.25Å; M313-E317 HydrophobicContact CE-CB 4.23Å; D314-E317 PolarHBondContact N-OE2 2.94Å; D314-E317 PolarHBondContact O-N 3.23Å; D314-E317 PolarHBondContact OD1-N 2.94Å; E317-L321 PolarHBondContact O-N 3.43Å
318	I	98.3	Very high	97.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-43	176.4	-63.2	168.7	0	0	0	110.6	I182 D183 V186 V310 M313 D314 K315 T316 L321 A322	I182-I318 HydrophobicContact CG2-CG2 3.96Å; D183-I318 HydrophobicContact CB-CG2 4.41Å; V186-I318 HydrophobicContact CB-CG2 4.38Å; V186-I318 HydrophobicContact CG1-CG2 4.43Å; V186-I318 HydrophobicContact CG2-CG2 4.23Å; V310-I318 HydrophobicContact CB-CD1 3.91Å; V310-I318 HydrophobicContact CB-CG1 4.1Å; V310-I318 HydrophobicContact CG1-CG1 4.24Å; V310-I318 HydrophobicContact CG2-CD1 4.25Å; M313-I318 HydrophobicContact CB-CD1 4.25Å; M313-I318 HydrophobicContact CB-CG1 3.85Å; D314-I318 WeakPolarHBondContact O-CG1 3.24Å; D314-I318 PolarHBondContact O-N 3.02Å; K315-I318 PolarHBondContact O-N 3.44Å; T316-I318 VanDerWaalsContact C-N 3.27Å; T316-I318 PolarHBondContact O-N 3.47Å; I318-L321 PolarHBondContact O-N 2.74Å; I318-A322 WeakPolarHBondContact O-CB 3.3Å; I318-A322 PolarHBondContact O-N 3.45Å
319	I	98.2	Very high	97.5	Very high	42 Å²	42	61 Å²	61	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-48.7	178.6	-72.9	168.3	0	0	0	111	I182 K315 T316 L321 A322 E323 F328	I182-I319 HydrophobicContact CD1-CG1 4.36Å; K315-I319 HydrophobicContact CD-CD1 4.47Å; K315-I319 HydrophobicContact CG-CD1 3.91Å; K315-I319 HydrophobicContact CG-CG1 4.41Å; K315-I319 VanDerWaalsContact O-CG1 3.24Å; K315-I319 WeakPolarHBondContact O-CG1 3.35Å; K315-I319 PolarHBondContact O-N 3.42Å; T316-I319 PolarHBondContact O-N 2.87Å; T316-I319 VanDerWaalsContact O-N 3.13Å; I319-L321 PolarHBondContact O-N 3.09Å; I319-A322 CarbonylContact O-C 3.58Å; I319-A322 WeakPolarHBondContact O-CA 3.23Å; I319-A322 WeakPolarHBondContact O-CB 3.38Å; I319-A322 PolarHBondContact O-N 2.78Å; I319-E323 HydrophobicContact CG2-CG 4.3Å; I319-E323 WeakPolarHBondContact O-CG 3.24Å; I319-E323 PolarHBondContact O-N 2.71Å; I319-F328 HydrophobicContact CB-CE2 4.49Å; I319-F328 HydrophobicContact CD1-CE2 4.37Å; I319-F328 HydrophobicContact CG1-CD2 4.38Å; I319-F328 HydrophobicContact CG1-CE2 4.03Å; I319-F328 HydrophobicContact CG2-CD2 3.97Å; I319-F328 HydrophobicContact CG2-CE2 3.79Å; I319-F328 HydrophobicContact CG2-CZ 4.4Å
320	E	98.4	Very high	97.4	Very high	123 Å²	123	60.8 Å²	60.8	58%	0.575	31%	0.306	S	S	*	.	H	α-helix	trans	-55.7	-39.5	177.7	-73.4	178.8	-175.4	0	0	111.5	T316 K324	T316-E320 WeakPolarHBondContact O-CG 3.36Å; T316-E320 PolarHBondContact O-N 2.74Å; E320-K324 WeakPolarHBondContact O-CB 3.49Å; E320-K324 PolarHBondContact O-N 3.5Å; E320-K324 VanDerWaalsContact O-N 3.08Å
321	L	98.1	Very high	97.2	Very high	23 Å²	23	61.2 Å²	61.2	12%	0.12	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-38.1	177	-170.5	51.8	0	0	0	112.1	V186 Y189 L190 E317 I318 I319 K324 I325	V186-L321 HydrophobicContact CG1-CB 4.16Å; V186-L321 HydrophobicContact CG1-CD2 3.53Å; V186-L321 HydrophobicContact CG1-CG 3.89Å; Y189-L321 HydrophobicContact CD1-CD1 4.11Å; Y189-L321 HydrophobicContact CD1-CD2 4.14Å; Y189-L321 HydrophobicContact CD1-CG 4.31Å; Y189-L321 HydrophobicContact CE1-CD1 3.73Å; Y189-L321 HydrophobicContact CE1-CD2 4.31Å; Y189-L321 HydrophobicContact CE1-CG 4.41Å; L190-L321 HydrophobicContact CD1-CD2 4.08Å; L190-L321 HydrophobicContact CD2-CD2 3.76Å; L190-L321 HydrophobicContact CG-CD2 3.91Å; E317-L321 PolarHBondContact O-N 3.43Å; I318-L321 PolarHBondContact O-N 2.74Å; I319-L321 PolarHBondContact O-N 3.09Å; L321-K324 HydrophobicContact CD1-CD 4.25Å; L321-K324 PolarHBondContact O-N 3.04Å; L321-I325 HydrophobicContact CD1-CG2 4.29Å; L321-I325 WeakPolarHBondContact O-CG1 3.48Å; L321-I325 PolarHBondContact O-N 2.87Å; L321-I325 VanDerWaalsContact O-N 3.07Å
322	A	98.4	Very high	97	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-37.4	176.1	0	0	0	0	0	112.8	I182 V186 I318 I319 D326 T327 F328	I182-A322 HydrophobicContact CG2-CB 3.52Å; V186-A322 HydrophobicContact CG2-CB 3.72Å; I318-A322 WeakPolarHBondContact O-CB 3.3Å; I318-A322 PolarHBondContact O-N 3.45Å; I319-A322 CarbonylContact O-C 3.58Å; I319-A322 WeakPolarHBondContact O-CA 3.23Å; I319-A322 WeakPolarHBondContact O-CB 3.38Å; I319-A322 PolarHBondContact O-N 2.78Å; A322-D326 PolarHBondContact O-N 3.15Å; A322-T327 WeakPolarHBondContact CA-OG1 3.46Å; A322-T327 PolarHBondContact O-N 2.93Å; A322-T327 PolarHBondContact O-OG1 2.8Å; A322-T327 VanDerWaalsContact O-OG1 3.06Å; A322-F328 HydrophobicContact CB-CB 4.08Å; A322-F328 PolarHBondContact O-N 3.25Å
323	E	98.4	Very high	96.7	Very high	110 Å²	110	60.6 Å²	60.6	51%	0.514	30%	0.297	S	S	.	.	H	α-helix	trans	-66.2	-46.1	172.7	-71.2	175.5	162.6	0	0	110.4	I319 I325 D326 F328	I319-E323 HydrophobicContact CG2-CG 4.3Å; I319-E323 WeakPolarHBondContact O-CG 3.24Å; I319-E323 PolarHBondContact O-N 2.71Å; E323-I325 VanDerWaalsContact C-N 3.26Å; E323-I325 PolarHBondContact O-N 3.02Å; E323-D326 PolarHBondContact O-N 2.92Å; E323-F328 HydrophobicContact CG-CB 3.84Å; E323-F328 HydrophobicContact CG-CD1 4.13Å; E323-F328 HydrophobicContact CG-CG 3.93Å
324	K	96.9	Very high	96.2	Very high	151 Å²	151	64.3 Å²	64.3	66%	0.657	32%	0.324	S	S	*	.	H	α-helix	trans	-59	-35.2	178.7	179.1	179.2	178	177.3	0	113.5	E320 L321	E320-K324 WeakPolarHBondContact O-CB 3.49Å; E320-K324 PolarHBondContact O-N 3.5Å; E320-K324 VanDerWaalsContact O-N 3.08Å; L321-K324 HydrophobicContact CD1-CD 4.25Å; L321-K324 PolarHBondContact O-N 3.04Å
325	I	96.6	Very high	95.6	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.021	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	10.5	178.9	72.7	-179.8	0	0	0	112.8	V186 Y189 L224 L321 E323 T327	V186-I325 HydrophobicContact CG2-CD1 4.14Å; Y189-I325 HydrophobicContact CD1-CG2 4.25Å; Y189-I325 HydrophobicContact CD2-CG2 3.64Å; Y189-I325 HydrophobicContact CE1-CG2 4.3Å; Y189-I325 HydrophobicContact CE2-CG2 3.68Å; Y189-I325 HydrophobicContact CG-CD1 4.14Å; Y189-I325 HydrophobicContact CG-CG2 3.93Å; L224-I325 HydrophobicContact CD2-CD1 4.26Å; L321-I325 HydrophobicContact CD1-CG2 4.29Å; L321-I325 WeakPolarHBondContact O-CG1 3.48Å; L321-I325 PolarHBondContact O-N 2.87Å; L321-I325 VanDerWaalsContact O-N 3.07Å; E323-I325 VanDerWaalsContact C-N 3.26Å; E323-I325 PolarHBondContact O-N 3.02Å; I325-T327 VanDerWaalsContact C-N 3.33Å; I325-T327 HydrophobicContact CD1-CG2 4.09Å; I325-T327 HydrophobicContact CG1-CG2 3.85Å; I325-T327 WeakPolarHBondContact CG1-OG1 3.21Å; I325-T327 PolarHBondContact O-N 3.28Å
326	D	96.8	Very high	94.7	Very high	93 Å²	93	65.3 Å²	65.3	50%	0.497	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	38.4	174	-168.9	30.9	0	0	0	113.9	K223 A322 E323	K223-D326 HydrophobicContact CD-CB 4.41Å; K223-D326 VanDerWaalsContact CD-O 3.23Å; K223-D326 WeakPolarHBondContact CD-O 3.3Å; K223-D326 VanDerWaalsContact CE-O 3.24Å; K223-D326 WeakPolarHBondContact CE-O 3Å; K223-D326 WeakPolarHBondContact CE-OD2 3.37Å; K223-D326 WeakPolarHBondContact CG-O 3.44Å; K223-D326 IonicContact NZ-OD2 2.7Å; K223-D326 PolarHBondContact NZ-OD2 3.43Å; A322-D326 PolarHBondContact O-N 3.15Å; E323-D326 PolarHBondContact O-N 2.92Å
327	T	97.9	Very high	93.6	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.			trans	-110.3	-16.2	177.1	54.7	0	0	0	0	113.8	P185 L220 K223 A322 I325 A331	P185-T327 HydrophobicContact CB-CG2 3.82Å; L220-T327 HydrophobicContact CD2-CG2 4.18Å; L220-T327 WeakPolarHBondContact CD2-O 3.23Å; K223-T327 HydrophobicContact CB-CG2 3.64Å; K223-T327 HydrophobicContact CG-CG2 4.2Å; A322-T327 WeakPolarHBondContact CA-OG1 3.46Å; A322-T327 PolarHBondContact O-N 2.93Å; A322-T327 PolarHBondContact O-OG1 2.8Å; A322-T327 VanDerWaalsContact O-OG1 3.06Å; I325-T327 VanDerWaalsContact C-N 3.33Å; I325-T327 HydrophobicContact CD1-CG2 4.09Å; I325-T327 HydrophobicContact CG1-CG2 3.85Å; I325-T327 WeakPolarHBondContact CG1-OG1 3.21Å; I325-T327 PolarHBondContact O-N 3.28Å; T327-A331 VanDerWaalsContact O-CB 3.3Å; T327-A331 WeakPolarHBondContact O-CB 3.47Å; T327-A331 PolarHBondContact O-N 2.68Å
328	F	97.8	Very high	92.4	Very high	37 Å²	37	58.2 Å²	58.2	16%	0.162	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-54.6	-171.8	177.9	-103.2	0	0	0	112.8	I182 I319 A322 E323 L330 A331 I332	I182-F328 HydrophobicContact CD1-CD2 4.01Å; I182-F328 HydrophobicContact CD1-CE2 3.83Å; I182-F328 HydrophobicContact CG1-CD2 4.41Å; I319-F328 HydrophobicContact CB-CE2 4.49Å; I319-F328 HydrophobicContact CD1-CE2 4.37Å; I319-F328 HydrophobicContact CG1-CD2 4.38Å; I319-F328 HydrophobicContact CG1-CE2 4.03Å; I319-F328 HydrophobicContact CG2-CD2 3.97Å; I319-F328 HydrophobicContact CG2-CE2 3.79Å; I319-F328 HydrophobicContact CG2-CZ 4.4Å; A322-F328 HydrophobicContact CB-CB 4.08Å; A322-F328 PolarHBondContact O-N 3.25Å; E323-F328 HydrophobicContact CG-CB 3.84Å; E323-F328 HydrophobicContact CG-CD1 4.13Å; E323-F328 HydrophobicContact CG-CG 3.93Å; F328-L330 VanDerWaalsContact C-N 3.28Å; F328-L330 PolarHBondContact O-N 3.49Å; F328-A331 PolarHBondContact O-N 3.12Å; F328-I332 HydrophobicContact CD2-CG2 4.22Å; F328-I332 HydrophobicContact CE1-CD1 4Å; F328-I332 HydrophobicContact CE1-CG2 4.31Å; F328-I332 HydrophobicContact CE2-CG2 3.8Å; F328-I332 HydrophobicContact CZ-CD1 4.4Å; F328-I332 HydrophobicContact CZ-CG2 3.85Å; F328-I332 PolarHBondContact O-N 3.04Å; F328-I332 VanDerWaalsContact O-N 3.11Å
329	E	96.9	Very high	91	Very high	123 Å²	123	59.5 Å²	59.5	58%	0.575	30%	0.297	S	S	*	.	H	α-helix	trans	-59.1	-37.5	-177.3	-66.2	-57.7	137.5	0	0	112.9	I332	E329-I332 VanDerWaalsContact O-CG1 3.29Å; E329-I332 WeakPolarHBondContact O-CG1 3.5Å
330	L	95.2	Very high	89.8	Confident	30 Å²	30	61.1 Å²	61.1	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-45.8	174.1	-71.7	173.7	0	0	0	111.2	K216 D219 L220 K223 F328 I332 Q333	K216-L330 VanDerWaalsContact CD-O 3.24Å; K216-L330 WeakPolarHBondContact CD-O 3.4Å; D219-L330 HydrophobicContact CB-CD1 4Å; D219-L330 HydrophobicContact CB-CD2 4.42Å; L220-L330 HydrophobicContact CD2-CB 3.74Å; L220-L330 HydrophobicContact CD2-CD1 4.43Å; L220-L330 HydrophobicContact CG-CB 4.32Å; K223-L330 HydrophobicContact CD-CD1 4.33Å; K223-L330 HydrophobicContact CG-CD1 3.78Å; F328-L330 VanDerWaalsContact C-N 3.28Å; F328-L330 PolarHBondContact O-N 3.49Å; L330-I332 VanDerWaalsContact C-N 3.28Å; L330-I332 PolarHBondContact O-N 2.82Å; L330-Q333 WeakPolarHBondContact O-CB 3.34Å; L330-Q333 WeakPolarHBondContact O-CG 3.5Å; L330-Q333 PolarHBondContact O-N 3.12Å
331	A	94.1	Very high	88.8	Confident	9 Å²	9	58 Å²	58	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-26.6	-175.1	0	0	0	0	0	113.9	I182 L220 T327 F328	I182-A331 HydrophobicContact CB-CB 4.32Å; I182-A331 HydrophobicContact CG1-CB 3.74Å; L220-A331 HydrophobicContact CD1-CB 4.46Å; L220-A331 HydrophobicContact CD2-CB 4.19Å; T327-A331 VanDerWaalsContact O-CB 3.3Å; T327-A331 WeakPolarHBondContact O-CB 3.47Å; T327-A331 PolarHBondContact O-N 2.68Å; F328-A331 PolarHBondContact O-N 3.12Å
332	I	93.6	Very high	87.9	Confident	86 Å²	86	57.9 Å²	57.9	44%	0.441	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.7	178.6	63.6	168.6	0	0	0	114	I182 F328 E329 L330	I182-I332 HydrophobicContact CD1-CG2 4.11Å; I182-I332 HydrophobicContact CG1-CG2 4.46Å; F328-I332 HydrophobicContact CD2-CG2 4.22Å; F328-I332 HydrophobicContact CE1-CD1 4Å; F328-I332 HydrophobicContact CE1-CG2 4.31Å; F328-I332 HydrophobicContact CE2-CG2 3.8Å; F328-I332 HydrophobicContact CZ-CD1 4.4Å; F328-I332 HydrophobicContact CZ-CG2 3.85Å; F328-I332 PolarHBondContact O-N 3.04Å; F328-I332 VanDerWaalsContact O-N 3.11Å; E329-I332 VanDerWaalsContact O-CG1 3.29Å; E329-I332 WeakPolarHBondContact O-CG1 3.5Å; L330-I332 VanDerWaalsContact C-N 3.28Å; L330-I332 PolarHBondContact O-N 2.82Å
333	Q	92.7	Very high	87.2	Confident	70 Å²	70	60.1 Å²	60.1	33%	0.327	31%	0.313	S	S	.	.	S	Bend	trans	-59.9	141.5	176.7	-67.7	179	-1	0	0	111.2	K216 L330 F335	K216-Q333 HydrophobicContact CD-CB 4.15Å; K216-Q333 PolarHBondContact NZ-O 2.64Å; L330-Q333 WeakPolarHBondContact O-CB 3.34Å; L330-Q333 WeakPolarHBondContact O-CG 3.5Å; L330-Q333 PolarHBondContact O-N 3.12Å; Q333-F335 HydrophobicContact CB-CD2 3.84Å; Q333-F335 HydrophobicContact CB-CE2 4.07Å; Q333-F335 PolarHBondContact O-N 3.18Å
334	P	86.7	Confident	86.5	Confident	120 Å²	120	55.3 Å²	55.3	78%	0.779	29%	0.291	S	S	*	.	S	Bend	trans	-78.9	40.4	-169.9	35.8	-39	0	0	0	113.3
335	F	83.6	Confident	85.9	Confident	68 Å²	68	52.7 Å²	52.7	30%	0.298	29%	0.29	S	S	.	.			trans	-101.8	105.4	173.1	-54.3	-56.7	0	0	0	108.7	Q212 A213 K216 Q333	Q212-F335 HydrophobicContact CB-CD1 3.59Å; Q212-F335 HydrophobicContact CB-CD2 4.02Å; Q212-F335 HydrophobicContact CB-CE1 3.62Å; Q212-F335 HydrophobicContact CB-CE2 4.05Å; Q212-F335 HydrophobicContact CB-CG 3.8Å; Q212-F335 HydrophobicContact CB-CZ 3.86Å; Q212-F335 HydrophobicContact CG-CD1 4.37Å; Q212-F335 HydrophobicContact CG-CE1 3.95Å; Q212-F335 HydrophobicContact CG-CZ 4.13Å; A213-F335 HydrophobicContact CB-CB 4.05Å; K216-F335 VanDerWaalsContact CE-O 3.23Å; K216-F335 WeakPolarHBondContact CE-O 3.44Å; K216-F335 PolarHBondContact NZ-O 2.8Å; Q333-F335 HydrophobicContact CB-CD2 3.84Å; Q333-F335 HydrophobicContact CB-CE2 4.07Å; Q333-F335 PolarHBondContact O-N 3.18Å
336	E	75.4	Confident	85.5	Confident	112 Å²	112	60 Å²	60	52%	0.523	32%	0.323	S	S	.	.			trans	-75.8	139.1	-171.9	-67	-171.3	168.5	0	0	112.9	T340 I341	E336-T340 HydrophobicContact CB-CG2 4.39Å; E336-T340 HydrophobicContact CG-CG2 4.1Å; E336-I341 HydrophobicContact CB-CD1 4.37Å; E336-I341 HydrophobicContact CB-CG1 3.92Å
337	D	73.2	Confident	85.1	Confident	16 Å²	16	57.6 Å²	57.6	9%	0.086	31%	0.313	C	S	.	.			trans	-77.6	162.5	171.4	-68.6	-36.8	0	0	0	111.6	S179 G180 H202 C339 T340 I341	S179-D337 VanDerWaalsContact CB-OD2 3.24Å; S179-D337 WeakPolarHBondContact CB-OD2 3.37Å; S179-D337 PolarHBondContact OG-OD2 3Å; G180-D337 WeakPolarHBondContact CA-OD1 3.19Å; G180-D337 WeakPolarHBondContact CA-OD2 3.33Å; G180-D337 PolarHBondContact N-OD1 2.91Å; G180-D337 PolarHBondContact N-OD2 3.49Å; H202-D337 IonicContact CE1-OD1 2.87Å; D337-C339 PolarHBondContact O-N 3.36Å; D337-T340 PolarHBondContact O-N 3.2Å; D337-I341 PolarHBondContact O-N 3.32Å
338	C	73.8	Confident	84.8	Confident	5 Å²	5	62 Å²	62	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-54.4	-27.8	176.4	65.5	0	0	0	0	114.1	F203 T209 Q242 M262 F342	F203-C338 PolarHBondContact O-SG 3.09Å; T209-C338 HydrophobicContact CG2-CB 3.85Å; Q242-C338 PolarHBondContact NE2-O 2.7Å; M262-C338 VanDerWaalsContact CE-SG 3.54Å; C338-F342 WeakPolarHBondContact O-CD2 3.41Å; C338-F342 PolarHBondContact O-N 3.24Å
339	C	67.3	Low	84.5	Confident	28 Å²	28	63.7 Å²	63.7	19%	0.189	35%	0.346	C	S	.	.	H	α-helix	trans	-69.9	-34.8	177.1	-68	0	0	0	0	112.7	D337 A343	D337-C339 PolarHBondContact O-N 3.36Å; C339-A343 PolarHBondContact O-N 2.88Å
340	T	74.1	Confident	84.5	Confident	75 Å²	75	65.5 Å²	65.5	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-79.5	-43.7	-178.8	-52.7	0	0	0	0	110.2	E336 D337 F342 A343	E336-T340 HydrophobicContact CB-CG2 4.39Å; E336-T340 HydrophobicContact CG-CG2 4.1Å; D337-T340 PolarHBondContact O-N 3.2Å; T340-F342 VanDerWaalsContact C-N 3.28Å; T340-F342 PolarHBondContact O-N 3.4Å; T340-A343 VanDerWaalsContact O-CB 3.23Å; T340-A343 WeakPolarHBondContact O-CB 3.11Å; T340-A343 PolarHBondContact O-N 3.33Å; T340-A343 VanDerWaalsContact O-N 3.08Å
341	I	76.4	Confident	84.5	Confident	58 Å²	58	64.4 Å²	64.4	30%	0.297	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-36.7	-178.6	-61.9	158.9	0	0	0	112	Y208 T209 E336 D337	Y208-I341 VanDerWaalsContact O-CD1 3.28Å; Y208-I341 WeakPolarHBondContact O-CD1 3.29Å; T209-I341 HydrophobicContact CG2-CD1 3.88Å; E336-I341 HydrophobicContact CB-CD1 4.37Å; E336-I341 HydrophobicContact CB-CG1 3.92Å; D337-I341 PolarHBondContact O-N 3.32Å
342	F	80.7	Confident	84.6	Confident	21 Å²	21	70.8 Å²	70.8	9%	0.092	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	11.8	179.1	-71	-98.3	0	0	0	113.2	Y208 Q242 C338 T340 P344	Y208-F342 HydrophobicContact CD1-CE2 4.42Å; Y208-F342 HydrophobicContact CD1-CZ 4.16Å; Y208-F342 AromaticContact CD2-CE2 3.87Å; Y208-F342 HydrophobicContact CD2-CE2 3.87Å; Y208-F342 AromaticContact CD2-CZ 3.49Å; Y208-F342 HydrophobicContact CD2-CZ 3.49Å; Y208-F342 VanDerWaalsContact CD2-CZ 3.49Å; Y208-F342 HydrophobicContact CE1-CZ 4.36Å; Y208-F342 AromaticContact CE2-CZ 3.71Å; Y208-F342 HydrophobicContact CE2-CZ 3.71Å; Y208-F342 AromaticContact CG-CE2 3.79Å; Y208-F342 HydrophobicContact CG-CE2 3.79Å; Y208-F342 AromaticContact CG-CZ 3.71Å; Y208-F342 HydrophobicContact CG-CZ 3.71Å; Q242-F342 HydrophobicContact CB-CD1 3.91Å; Q242-F342 HydrophobicContact CB-CD2 4.48Å; Q242-F342 HydrophobicContact CB-CE1 3.79Å; Q242-F342 HydrophobicContact CB-CE2 4.37Å; Q242-F342 HydrophobicContact CB-CG 4.25Å; Q242-F342 HydrophobicContact CB-CZ 4.02Å; Q242-F342 VanDerWaalsContact CD-CD2 3.48Å; Q242-F342 HydrophobicContact CG-CG 4.49Å; C338-F342 WeakPolarHBondContact O-CD2 3.41Å; C338-F342 PolarHBondContact O-N 3.24Å; T340-F342 VanDerWaalsContact C-N 3.28Å; T340-F342 PolarHBondContact O-N 3.4Å; F342-P344 WeakPolarHBondContact O-CD 3.34Å
343	A	82.9	Confident	84.8	Confident	47 Å²	47	69.3 Å²	69.3	39%	0.388	36%	0.361	S	S	.	.			trans	-62.8	125.9	178.9	0	0	0	0	0	110.2	M255 C339 T340	M255-A343 HydrophobicContact CE-CB 4.21Å; C339-A343 PolarHBondContact O-N 2.88Å; T340-A343 VanDerWaalsContact O-CB 3.23Å; T340-A343 WeakPolarHBondContact O-CB 3.11Å; T340-A343 PolarHBondContact O-N 3.33Å; T340-A343 VanDerWaalsContact O-N 3.08Å
344	P	84.4	Confident	85	Confident	8 Å²	8	73.5 Å²	73.5	5%	0.052	38%	0.38	C	S	.	.			trans	-69.2	148.8	172.8	29.6	-34	0	0	0	110	Q251 W254 M255 F342 Q346 P347	Q251-P344 HydrophobicContact CG-CB 3.53Å; Q251-P344 WeakPolarHBondContact O-CB 3.4Å; Q251-P344 WeakPolarHBondContact O-CG 3.49Å; W254-P344 HydrophobicContact CB-CG 4.38Å; W254-P344 HydrophobicContact CD2-CB 4.48Å; W254-P344 HydrophobicContact CE3-CB 3.93Å; M255-P344 HydrophobicContact CB-CG 4.39Å; F342-P344 WeakPolarHBondContact O-CD 3.34Å; P344-Q346 PolarHBondContact O-N 3.26Å; P344-P347 HydrophobicContact CG-CB 3.85Å; P344-P347 WeakPolarHBondContact O-CD 3.27Å
345	P	83.2	Confident	85.5	Confident	97 Å²	97	70.7 Å²	70.7	63%	0.63	36%	0.356	S	S	*	.	S	Bend	trans	-63.1	-27.7	174.8	25.3	-34.5	0	0	0	112.9	Q251	Q251-P345 HydrophobicContact CG-CG 4.49Å
346	Q	88.1	Confident	86.2	Confident	156 Å²	156	67.4 Å²	67.4	73%	0.729	34%	0.342	S	S	*	.	S	Bend	trans	-130.2	73.9	178.2	-66.2	-174	-6.9	0	0	110.6	G252 P344	G252-Q346 WeakPolarHBondContact CA-O 3.39Å; P344-Q346 PolarHBondContact O-N 3.26Å
347	P	89.8	Confident	87.3	Confident	44 Å²	44	65.1 Å²	65.1	29%	0.286	33%	0.333	S	S	.	.			trans	-65.8	138.4	176.5	26.6	-29.8	0	0	0	110.2	A288 P344 T349	A288-P347 HydrophobicContact CB-CB 3.77Å; A288-P347 HydrophobicContact CB-CG 3.45Å; A288-P347 VanDerWaalsContact CB-CG 3.45Å; P344-P347 HydrophobicContact CG-CB 3.85Å; P344-P347 WeakPolarHBondContact O-CD 3.27Å; P347-T349 PolarHBondContact O-N 2.7Å
348	K	91.7	Very high	88.4	Confident	93 Å²	93	68.4 Å²	68.4	40%	0.404	35%	0.347	S	S	.	.			trans	-70.2	120	171.1	-78.5	-174.6	177.8	-70.8	0	110	G252 Y253 R350	G252-K348 WeakPolarHBondContact O-CB 3.35Å; G252-K348 PolarHBondContact O-N 3.05Å; Y253-K348 HydrophobicContact CD1-CD 4.4Å; Y253-K348 HydrophobicContact CD2-CD 4.03Å; Y253-K348 HydrophobicContact CE1-CD 3.95Å; Y253-K348 HydrophobicContact CE2-CD 3.52Å; Y253-K348 HydrophobicContact CG-CD 4.44Å; Y253-K348 VanDerWaalsContact CZ-CD 3.47Å; K348-R350 VanDerWaalsContact C-N 3.31Å
349	T	91.5	Very high	89.6	Confident	72 Å²	72	68.1 Å²	68.1	44%	0.442	35%	0.346	S	S	.	.	S	Bend	trans	-81	-12.2	172	55	0	0	0	0	113.1	A288 T291 P347	A288-T349 HydrophobicContact CB-CG2 3.87Å; T291-T349 WeakPolarHBondContact CB-O 3.5Å; T291-T349 WeakPolarHBondContact CG2-O 3.46Å; T291-T349 PolarHBondContact OG1-O 3.47Å; P347-T349 PolarHBondContact O-N 2.7Å
350	R	96.3	Very high	91	Very high	160 Å²	160	67.4 Å²	67.4	60%	0.604	34%	0.339	S	S	*	.	S	Bend	trans	-136.5	62.8	179.3	-61.3	174.7	65.4	90.7	4.7	110.8	H293 K348 K352	H293-R350 HydrophobicContact CB-CB 4.21Å; H293-R350 HydrophobicContact CB-CG 4.29Å; H293-R350 PolarHBondContact CE1-NH1 2.86Å; H293-R350 PolarHBondContact CE1-NH2 2.83Å; H293-R350 PolarHBondContact NE2-NH1 3.43Å; H293-R350 PolarHBondContact NE2-NH2 2.86Å; K348-R350 VanDerWaalsContact C-N 3.31Å; R350-K352 PolarHBondContact O-N 2.89Å
351	P	95.4	Very high	92.1	Very high	7 Å²	7	71.6 Å²	71.6	5%	0.045	35%	0.354	C	S	.	.			trans	-62.7	135.9	176.7	28.7	-34.6	0	0	0	110	Y253 T256 S294 A297 V356	Y253-P351 HydrophobicContact CD1-CB 4.34Å; Y253-P351 HydrophobicContact CE1-CB 4.01Å; T256-P351 HydrophobicContact CG2-CB 4.13Å; T256-P351 HydrophobicContact CG2-CG 4.13Å; S294-P351 WeakPolarHBondContact OG-CD 3.39Å; A297-P351 HydrophobicContact CB-CB 4.34Å; A297-P351 HydrophobicContact CB-CG 3.82Å; P351-V356 HydrophobicContact CB-CG2 4.22Å
352	K	96.6	Very high	92.9	Very high	144 Å²	144	75.1 Å²	75.1	63%	0.626	36%	0.363	S	S	*	.			trans	-83.6	122.4	171.3	-65.9	-173.1	176.6	-172	0	108.8	R350 E354 K355 V356	R350-K352 PolarHBondContact O-N 2.89Å; K352-E354 VanDerWaalsContact C-N 3.32Å; K352-E354 PolarHBondContact O-N 2.88Å; K352-K355 HydrophobicContact CB-CB 4.32Å; K352-K355 PolarHBondContact O-N 2.81Å; K352-K355 VanDerWaalsContact O-N 3.09Å; K352-V356 WeakPolarHBondContact O-CG2 3.4Å; K352-V356 PolarHBondContact O-N 3.49Å; K352-V356 VanDerWaalsContact O-N 3.12Å
353	L	97	Very high	93.7	Very high	55 Å²	55	75.3 Å²	75.3	29%	0.288	36%	0.364	S	S	.	.	H	α-helix	trans	-54.2	-46.2	-179.4	175.5	62.1	0	0	0	112.2	E300 K355 V356 L357	E300-L353 HydrophobicContact CB-CD1 4.03Å; E300-L353 HydrophobicContact CB-CD2 4.39Å; E300-L353 HydrophobicContact CG-CD1 4.04Å; E300-L353 HydrophobicContact CG-CD2 3.95Å; L353-K355 PolarHBondContact O-N 3.02Å; L353-V356 WeakPolarHBondContact O-CA 3.21Å; L353-V356 WeakPolarHBondContact O-CB 3.1Å; L353-V356 PolarHBondContact O-N 2.95Å; L353-L357 HydrophobicContact CD1-CD1 4.33Å; L353-L357 HydrophobicContact CD1-CD2 4.46Å; L353-L357 HydrophobicContact CD1-CG 4.14Å; L353-L357 HydrophobicContact CG-CD1 4.15Å; L353-L357 HydrophobicContact CG-CG 4.39Å; L353-L357 WeakPolarHBondContact O-CG 3.44Å; L353-L357 PolarHBondContact O-N 3.04Å
354	E	97.5	Very high	94.3	Very high	157 Å²	157	77.6 Å²	77.6	73%	0.734	37%	0.37	S	S	*	.	H	α-helix	trans	-51	-44.5	176.6	-65.7	163.7	-176.4	0	0	112.4	K352 L357 E358	K352-E354 VanDerWaalsContact C-N 3.32Å; K352-E354 PolarHBondContact O-N 2.88Å; E354-L357 PolarHBondContact O-N 3.31Å; E354-E358 PolarHBondContact O-N 2.57Å
355	K	97.4	Very high	95	Very high	61 Å²	61	78.5 Å²	78.5	27%	0.265	37%	0.374	S	S	.	.	H	α-helix	trans	-71.7	-32.4	178.6	-173.8	52.9	168.8	-176.8	0	112.3	Y253 K352 L353 E358 L359	Y253-K355 HydrophobicContact CE1-CB 4.35Å; Y253-K355 HydrophobicContact CE1-CG 4.19Å; Y253-K355 HydrophobicContact CE2-CG 3.99Å; Y253-K355 WeakPolarHBondContact OH-CG 3.29Å; K352-K355 HydrophobicContact CB-CB 4.32Å; K352-K355 PolarHBondContact O-N 2.81Å; K352-K355 VanDerWaalsContact O-N 3.09Å; L353-K355 PolarHBondContact O-N 3.02Å; K355-E358 HydrophobicContact CD-CB 4.44Å; K355-E358 WeakPolarHBondContact CD-OE2 3.46Å; K355-E358 IonicContact NZ-OE1 2.65Å; K355-E358 PolarHBondContact NZ-OE1 3.18Å; K355-E358 IonicContact NZ-OE2 2.73Å; K355-E358 PolarHBondContact NZ-OE2 2.95Å; K355-L359 HydrophobicContact CD-CG 4.45Å; K355-L359 HydrophobicContact CG-CD1 4.37Å; K355-L359 WeakPolarHBondContact O-CB 3.24Å; K355-L359 WeakPolarHBondContact O-CG 3.36Å; K355-L359 PolarHBondContact O-N 3.04Å
356	V	97.7	Very high	95.6	Very high	0 Å²	0	81.8 Å²	81.8	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-44.4	175.5	176.3	0	0	0	0	109.9	Y253 T256 L257 P351 K352 L353 L359 E360	Y253-V356 HydrophobicContact CD1-CG2 3.8Å; Y253-V356 HydrophobicContact CE1-CG2 3.79Å; T256-V356 HydrophobicContact CG2-CG1 4.29Å; T256-V356 HydrophobicContact CG2-CG2 3.82Å; L257-V356 HydrophobicContact CD2-CG1 3.93Å; P351-V356 HydrophobicContact CB-CG2 4.22Å; K352-V356 WeakPolarHBondContact O-CG2 3.4Å; K352-V356 PolarHBondContact O-N 3.49Å; K352-V356 VanDerWaalsContact O-N 3.12Å; L353-V356 WeakPolarHBondContact O-CA 3.21Å; L353-V356 WeakPolarHBondContact O-CB 3.1Å; L353-V356 PolarHBondContact O-N 2.95Å; V356-L359 PolarHBondContact O-N 3.49Å; V356-E360 WeakPolarHBondContact O-CG 3.42Å; V356-E360 PolarHBondContact O-N 3.41Å
357	L	97.8	Very high	96.1	Very high	64 Å²	64	75.1 Å²	75.1	34%	0.335	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-45.6	176	-64.3	173.7	0	0	0	111.8	L353 E354 L359 E360 E361	L353-L357 HydrophobicContact CD1-CD1 4.33Å; L353-L357 HydrophobicContact CD1-CD2 4.46Å; L353-L357 HydrophobicContact CD1-CG 4.14Å; L353-L357 HydrophobicContact CG-CD1 4.15Å; L353-L357 HydrophobicContact CG-CG 4.39Å; L353-L357 WeakPolarHBondContact O-CG 3.44Å; L353-L357 PolarHBondContact O-N 3.04Å; E354-L357 PolarHBondContact O-N 3.31Å; L357-L359 VanDerWaalsContact C-N 3.26Å; L357-L359 PolarHBondContact O-N 2.94Å; L357-E360 WeakPolarHBondContact O-CB 3.43Å; L357-E360 PolarHBondContact O-N 3.26Å; L357-E361 PolarHBondContact O-N 2.84Å
358	E	97.7	Very high	96.5	Very high	84 Å²	84	73.3 Å²	73.3	39%	0.393	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-35.4	175.1	-169.8	-148.5	128.9	0	0	112.6	E354 K355	E354-E358 PolarHBondContact O-N 2.57Å; K355-E358 HydrophobicContact CD-CB 4.44Å; K355-E358 WeakPolarHBondContact CD-OE2 3.46Å; K355-E358 IonicContact NZ-OE1 2.65Å; K355-E358 PolarHBondContact NZ-OE1 3.18Å; K355-E358 IonicContact NZ-OE2 2.73Å; K355-E358 PolarHBondContact NZ-OE2 2.95Å
359	L	97.5	Very high	96.8	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-73.1	-35.3	174.9	-70.7	171.8	0	0	0	111.6	P250 Y253 L257 K355 V356 L357 E361 R362 F363	P250-L359 VanDerWaalsContact CD-CD2 3.49Å; P250-L359 HydrophobicContact CG-CD1 4.44Å; P250-L359 HydrophobicContact CG-CD2 4.15Å; Y253-L359 HydrophobicContact CD1-CD1 4.03Å; Y253-L359 HydrophobicContact CD2-CD1 3.72Å; Y253-L359 HydrophobicContact CE2-CD1 4.26Å; Y253-L359 HydrophobicContact CG-CD1 3.59Å; L257-L359 HydrophobicContact CD1-CB 4.38Å; L257-L359 HydrophobicContact CD1-CD1 4.37Å; L257-L359 HydrophobicContact CD2-CB 4.39Å; K355-L359 HydrophobicContact CD-CG 4.45Å; K355-L359 HydrophobicContact CG-CD1 4.37Å; K355-L359 WeakPolarHBondContact O-CB 3.24Å; K355-L359 WeakPolarHBondContact O-CG 3.36Å; K355-L359 PolarHBondContact O-N 3.04Å; V356-L359 PolarHBondContact O-N 3.49Å; L357-L359 VanDerWaalsContact C-N 3.26Å; L357-L359 PolarHBondContact O-N 2.94Å; L359-E361 VanDerWaalsContact C-N 3.26Å; L359-E361 PolarHBondContact O-N 3.32Å; L359-R362 WeakPolarHBondContact O-CB 3.39Å; L359-R362 WeakPolarHBondContact O-CG 3.49Å; L359-R362 PolarHBondContact O-N 2.78Å; L359-F363 WeakPolarHBondContact O-CD2 3.26Å; L359-F363 VanDerWaalsContact O-CE2 3.24Å; L359-F363 WeakPolarHBondContact O-CE2 3.39Å
360	E	97.5	Very high	97.2	Very high	12 Å²	12	69.9 Å²	69.9	6%	0.056	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-30.4	179	-82.5	-169.9	168.9	0	0	113	L257 R260 R264 V356 L357 R362 F363 I365	L257-E360 HydrophobicContact CD2-CG 3.7Å; R260-E360 WeakPolarHBondContact CD-OE1 3.17Å; R260-E360 IonicContact CZ-OE1 3.55Å; R260-E360 IonicContact CZ-OE2 3.53Å; R260-E360 VanDerWaalsContact NE-CD 3.34Å; R260-E360 IonicContact NE-OE1 2.71Å; R260-E360 PolarHBondContact NE-OE1 3.3Å; R260-E360 IonicContact NE-OE2 3.45Å; R260-E360 PolarHBondContact NE-OE2 3.35Å; R260-E360 IonicContact NH2-OE1 3.57Å; R260-E360 IonicContact NH2-OE2 2.78Å; R260-E360 PolarHBondContact NH2-OE2 3.11Å; R264-E360 IonicContact NH2-OE2 2.79Å; R264-E360 PolarHBondContact NH2-OE2 3.41Å; V356-E360 WeakPolarHBondContact O-CG 3.42Å; V356-E360 PolarHBondContact O-N 3.41Å; L357-E360 WeakPolarHBondContact O-CB 3.43Å; L357-E360 PolarHBondContact O-N 3.26Å; E360-R362 PolarHBondContact O-N 3.03Å; E360-F363 PolarHBondContact O-N 3.05Å; E360-F363 VanDerWaalsContact O-N 3.09Å; E360-I365 HydrophobicContact CB-CD1 3.88Å; E360-I365 HydrophobicContact CG-CD1 4.03Å
361	E	96.5	Very high	97.3	Very high	164 Å²	164	67.7 Å²	67.7	77%	0.766	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.7	175.1	-68.7	175.4	-174.5	0	0	114.2	L357 L359 F363	L357-E361 PolarHBondContact O-N 2.84Å; L359-E361 VanDerWaalsContact C-N 3.26Å; L359-E361 PolarHBondContact O-N 3.32Å; E361-F363 VanDerWaalsContact C-N 3.33Å
362	R	94.4	Very high	97.4	Very high	131 Å²	131	67.7 Å²	67.7	49%	0.494	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-11.1	179.9	-56.9	175.5	-175	-162.2	-5.6	113.4	H248 L359 E360	H248-R362 PolarHBondContact O-NH1 3.37Å; L359-R362 WeakPolarHBondContact O-CB 3.39Å; L359-R362 WeakPolarHBondContact O-CG 3.49Å; L359-R362 PolarHBondContact O-N 2.78Å; E360-R362 PolarHBondContact O-N 3.03Å
363	F	96	Very high	97.5	Very high	25 Å²	25	62.7 Å²	62.7	11%	0.11	30%	0.304	C	S	.	.	S	Bend	trans	-111	141.4	-174	-54.2	-75.7	0	0	0	111.1	E244 I245 H248 S249 L257 L359 E360 E361 I365 L368	E244-F363 HydrophobicContact CB-CD1 4.27Å; E244-F363 HydrophobicContact CB-CE1 4.33Å; E244-F363 WeakPolarHBondContact O-CE1 3.24Å; I245-F363 HydrophobicContact CG1-CE1 4.36Å; I245-F363 HydrophobicContact CG1-CZ 4.21Å; H248-F363 HydrophobicContact CB-CE1 3.8Å; H248-F363 HydrophobicContact CB-CZ 4.23Å; S249-F363 VanDerWaalsContact OG-CZ 3.26Å; S249-F363 WeakPolarHBondContact OG-CZ 3.47Å; L257-F363 HydrophobicContact CD1-CE2 4.31Å; L359-F363 WeakPolarHBondContact O-CD2 3.26Å; L359-F363 VanDerWaalsContact O-CE2 3.24Å; L359-F363 WeakPolarHBondContact O-CE2 3.39Å; E360-F363 PolarHBondContact O-N 3.05Å; E360-F363 VanDerWaalsContact O-N 3.09Å; E361-F363 VanDerWaalsContact C-N 3.33Å; F363-I365 HydrophobicContact CB-CG1 4.05Å; F363-I365 PolarHBondContact O-N 3.49Å; F363-L368 HydrophobicContact CB-CD1 4.29Å
364	D	96.8	Very high	97.5	Very high	95 Å²	95	64.4 Å²	64.4	51%	0.508	33%	0.327	S	S	.	.			trans	-75.5	74.9	162.6	175.2	22.3	0	0	0	109.5	E366 G367 L368 R371	D364-E366 VanDerWaalsContact C-N 3.3Å; D364-E366 PolarHBondContact O-N 2.91Å; D364-G367 PolarHBondContact O-N 3.22Å; D364-G367 PolarHBondContact OD1-N 3.22Å; D364-G367 WeakPolarHBondContact OD2-CA 3.13Å; D364-L368 VanDerWaalsContact O-CB 3.3Å; D364-L368 WeakPolarHBondContact O-CB 3.47Å; D364-L368 VanDerWaalsContact O-CG 3.23Å; D364-L368 WeakPolarHBondContact O-CG 3.5Å; D364-L368 PolarHBondContact O-N 3.38Å; D364-R371 IonicContact OD2-NH1 3.75Å
365	I	97.6	Very high	97.6	Very high	28 Å²	28	58.5 Å²	58.5	14%	0.144	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-44.3	-176.6	-67.9	179.9	0	0	0	110.8	M261 E360 F363 L368 M369	M261-I365 HydrophobicContact CE-CG2 4.23Å; M261-I365 HydrophobicContact SD-CG1 4.33Å; M261-I365 HydrophobicContact SD-CG2 4.06Å; E360-I365 HydrophobicContact CB-CD1 3.88Å; E360-I365 HydrophobicContact CG-CD1 4.03Å; F363-I365 HydrophobicContact CB-CG1 4.05Å; F363-I365 PolarHBondContact O-N 3.49Å; I365-L368 PolarHBondContact O-N 2.98Å; I365-M369 HydrophobicContact CG2-CG 4.32Å; I365-M369 HydrophobicContact CG2-SD 3.91Å; I365-M369 WeakPolarHBondContact O-CB 3.35Å; I365-M369 VanDerWaalsContact O-CG 3.25Å; I365-M369 WeakPolarHBondContact O-CG 3.43Å; I365-M369 PolarHBondContact O-N 3.09Å
366	E	97.7	Very high	97.6	Very high	166 Å²	166	57.3 Å²	57.3	78%	0.776	30%	0.304	S	S	*	.	H	α-helix	trans	-64.4	-47.6	-178.2	-67.2	-174.9	177.9	0	0	111.4	D364 M369 A370	D364-E366 VanDerWaalsContact C-N 3.3Å; D364-E366 PolarHBondContact O-N 2.91Å; E366-M369 PolarHBondContact O-N 3.13Å; E366-A370 WeakPolarHBondContact O-CB 3.21Å; E366-A370 PolarHBondContact O-N 3.04Å
367	G	98.3	Very high	97.6	Very high	15 Å²	15	63.1 Å²	63.1	16%	0.155	33%	0.33	C	S	.	.	H	α-helix	trans	-65.7	-40.4	177.7	0	0	0	0	0	112.9	D364 A370 R371	D364-G367 PolarHBondContact O-N 3.22Å; D364-G367 PolarHBondContact OD1-N 3.22Å; D364-G367 WeakPolarHBondContact OD2-CA 3.13Å; G367-A370 PolarHBondContact O-N 3.22Å; G367-R371 VanDerWaalsContact C-NH1 3.28Å; G367-R371 WeakPolarHBondContact O-CG 3.47Å; G367-R371 PolarHBondContact O-N 3.3Å; G367-R371 PolarHBondContact O-NH1 3.04Å
368	L	98.2	Very high	97.7	Very high	7 Å²	7	64 Å²	64	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-45	174.3	-76.6	169	0	0	0	111.6	E240 I241 E244 M261 F363 D364 I365 C372	E240-L368 HydrophobicContact CG-CD2 3.88Å; I241-L368 HydrophobicContact CD1-CB 4.41Å; I241-L368 HydrophobicContact CG1-CB 3.99Å; I241-L368 HydrophobicContact CG1-CD1 4.49Å; I241-L368 HydrophobicContact CG1-CD2 4.04Å; I241-L368 HydrophobicContact CG1-CG 4.41Å; E244-L368 HydrophobicContact CB-CD1 4.48Å; E244-L368 HydrophobicContact CG-CD1 4.43Å; E244-L368 HydrophobicContact CG-CD2 4.08Å; M261-L368 HydrophobicContact CE-CB 4.34Å; F363-L368 HydrophobicContact CB-CD1 4.29Å; D364-L368 VanDerWaalsContact O-CB 3.3Å; D364-L368 WeakPolarHBondContact O-CB 3.47Å; D364-L368 VanDerWaalsContact O-CG 3.23Å; D364-L368 WeakPolarHBondContact O-CG 3.5Å; D364-L368 PolarHBondContact O-N 3.38Å; I365-L368 PolarHBondContact O-N 2.98Å; L368-C372 VanDerWaalsContact O-CB 3.27Å; L368-C372 WeakPolarHBondContact O-CB 3.39Å; L368-C372 PolarHBondContact O-N 3.12Å; L368-C372 VanDerWaalsContact O-N 3.08Å
369	M	98.4	Very high	97.7	Very high	34 Å²	34	63.2 Å²	63.2	17%	0.167	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-46.3	175.4	-75.8	-177.8	64.2	0	0	111.4	M261 R264 L265 A268 I365 E366 R371 C372 L373	M261-M369 HydrophobicContact CE-CG 3.89Å; R264-M369 HydrophobicContact CB-CE 3.89Å; R264-M369 HydrophobicContact CB-SD 3.76Å; R264-M369 HydrophobicContact CG-SD 4.43Å; L265-M369 HydrophobicContact CD2-CB 4.3Å; L265-M369 HydrophobicContact CD2-CG 4.14Å; A268-M369 HydrophobicContact CB-CE 4.1Å; I365-M369 HydrophobicContact CG2-CG 4.32Å; I365-M369 HydrophobicContact CG2-SD 3.91Å; I365-M369 WeakPolarHBondContact O-CB 3.35Å; I365-M369 VanDerWaalsContact O-CG 3.25Å; I365-M369 WeakPolarHBondContact O-CG 3.43Å; I365-M369 PolarHBondContact O-N 3.09Å; E366-M369 PolarHBondContact O-N 3.13Å; M369-R371 PolarHBondContact O-N 3.23Å; M369-C372 PolarHBondContact O-N 3.2Å; M369-L373 WeakPolarHBondContact O-CB 3.45Å; M369-L373 VanDerWaalsContact O-CG 3.22Å; M369-L373 WeakPolarHBondContact O-CG 3.37Å; M369-L373 PolarHBondContact O-N 3.48Å
370	A	98.5	Very high	97.7	Very high	59 Å²	59	68.6 Å²	68.6	49%	0.488	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-44.6	-179.2	0	0	0	0	0	112.3	E366 G367 L373 A374	E366-A370 WeakPolarHBondContact O-CB 3.21Å; E366-A370 PolarHBondContact O-N 3.04Å; G367-A370 PolarHBondContact O-N 3.22Å; A370-L373 PolarHBondContact O-N 3.04Å; A370-A374 WeakPolarHBondContact O-CB 3.34Å; A370-A374 PolarHBondContact O-N 2.92Å
371	R	98.3	Very high	97.7	Very high	114 Å²	114	69.1 Å²	69.1	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.5	-71.7	-171.5	-64.8	-81.9	9.5	112.1	E240 D364 G367 M369 A374 G375	E240-R371 IonicContact OE1-CZ 3.92Å; E240-R371 IonicContact OE1-NE 3.48Å; E240-R371 PolarHBondContact OE1-NE 3.05Å; E240-R371 IonicContact OE1-NH2 2.86Å; E240-R371 PolarHBondContact OE1-NH2 2.93Å; E240-R371 IonicContact OE2-NE 3.78Å; E240-R371 PolarHBondContact OE2-NE 3.49Å; D364-R371 IonicContact OD2-NH1 3.75Å; G367-R371 VanDerWaalsContact C-NH1 3.28Å; G367-R371 WeakPolarHBondContact O-CG 3.47Å; G367-R371 PolarHBondContact O-N 3.3Å; G367-R371 PolarHBondContact O-NH1 3.04Å; M369-R371 PolarHBondContact O-N 3.23Å; R371-A374 PolarHBondContact O-N 3.09Å; R371-G375 PolarHBondContact O-N 3.19Å
372	C	97.7	Very high	97.6	Very high	7 Å²	7	66.5 Å²	66.5	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-47.4	177.1	-176.1	0	0	0	0	112.1	V236 P237 I241 L265 L368 M369 A374 G375	V236-C372 WeakPolarHBondContact CG1-SG 3.49Å; P237-C372 PolarHBondContact O-SG 2.61Å; I241-C372 HydrophobicContact CD1-CB 4.17Å; L265-C372 HydrophobicContact CD1-CB 4.4Å; L265-C372 VanDerWaalsContact CD1-SG 3.51Å; L265-C372 HydrophobicContact CD2-CB 3.8Å; L368-C372 VanDerWaalsContact O-CB 3.27Å; L368-C372 WeakPolarHBondContact O-CB 3.39Å; L368-C372 PolarHBondContact O-N 3.12Å; L368-C372 VanDerWaalsContact O-N 3.08Å; M369-C372 PolarHBondContact O-N 3.2Å; C372-A374 VanDerWaalsContact C-N 3.31Å; C372-A374 PolarHBondContact O-N 3.49Å; C372-G375 PolarHBondContact O-N 2.89Å; C372-G375 VanDerWaalsContact O-N 3.1Å
373	L	98.4	Very high	97.4	Very high	38 Å²	38	62.4 Å²	62.4	20%	0.199	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-30	178.6	-68.1	171	0	0	0	112.9	L265 A268 I269 M272 M369 A370 G375 L376	L265-L373 HydrophobicContact CD2-CD2 4.09Å; L265-L373 HydrophobicContact CD2-CG 4.01Å; A268-L373 HydrophobicContact CB-CD1 3.9Å; A268-L373 HydrophobicContact CB-CD2 4.17Å; I269-L373 HydrophobicContact CG1-CD2 3.86Å; M272-L373 HydrophobicContact SD-CD2 4.18Å; M369-L373 WeakPolarHBondContact O-CB 3.45Å; M369-L373 VanDerWaalsContact O-CG 3.22Å; M369-L373 WeakPolarHBondContact O-CG 3.37Å; M369-L373 PolarHBondContact O-N 3.48Å; A370-L373 PolarHBondContact O-N 3.04Å; L373-G375 PolarHBondContact O-N 3.49Å; L373-L376 HydrophobicContact CD2-CD1 4.13Å; L373-L376 VanDerWaalsContact O-CG 3.3Å; L373-L376 WeakPolarHBondContact O-CG 3.28Å
374	A	98.2	Very high	96.7	Very high	92 Å²	92	64.1 Å²	64.1	76%	0.76	36%	0.357	S	S	*	.	H	α-helix	trans	-69.8	-21.7	173.9	0	0	0	0	0	113	A370 R371 C372	A370-A374 WeakPolarHBondContact O-CB 3.34Å; A370-A374 PolarHBondContact O-N 2.92Å; R371-A374 PolarHBondContact O-N 3.09Å; C372-A374 VanDerWaalsContact C-N 3.31Å; C372-A374 PolarHBondContact O-N 3.49Å
375	G	97.9	Very high	95.4	Very high	33 Å²	33	70.8 Å²	70.8	34%	0.34	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	10.1	-177.3	0	0	0	0	0	115.3	P237 R371 C372 L373 K377	P237-G375 WeakPolarHBondContact CD-O 3.29Å; P237-G375 WeakPolarHBondContact CG-O 3.23Å; R371-G375 PolarHBondContact O-N 3.19Å; C372-G375 PolarHBondContact O-N 2.89Å; C372-G375 VanDerWaalsContact O-N 3.1Å; L373-G375 PolarHBondContact O-N 3.49Å; G375-K377 PolarHBondContact O-N 2.99Å
376	L	98.4	Very high	93.4	Very high	35 Å²	35	74 Å²	74	18%	0.183	40%	0.395	C	S	.	.			trans	-59.7	135.9	179.7	-62.8	175.8	0	0	0	111.4	I234 V236 I269 M272 L373	I234-L376 HydrophobicContact CG2-CD2 4.12Å; V236-L376 HydrophobicContact CB-CD2 4.18Å; V236-L376 HydrophobicContact CG1-CD2 4.09Å; V236-L376 HydrophobicContact CG2-CD2 3.76Å; I269-L376 HydrophobicContact CD1-CD1 4.4Å; I269-L376 HydrophobicContact CD1-CD2 3.96Å; I269-L376 HydrophobicContact CG1-CD1 4.01Å; I269-L376 HydrophobicContact CG1-CD2 4.44Å; M272-L376 HydrophobicContact CE-CD1 4.21Å; L373-L376 HydrophobicContact CD2-CD1 4.13Å; L373-L376 VanDerWaalsContact O-CG 3.3Å; L373-L376 WeakPolarHBondContact O-CG 3.28Å
377	K	98.2	Very high	90.6	Very high	123 Å²	123	73.8 Å²	73.8	54%	0.535	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.7	168.3	-51.9	178.2	-164.5	146.7	0	108.9	I234 E235 G375	I234-K377 CarbonylContact C-O 3.59Å; I234-K377 WeakPolarHBondContact CA-O 3.5Å; E235-K377 HydrophobicContact CB-CB 4.2Å; E235-K377 PolarHBondContact N-O 3.08Å; E235-K377 PolarHBondContact O-N 3.21Å; E235-K377 VanDerWaalsContact O-N 3.07Å; E235-K377 IonicContact OE1-NZ 3.39Å; E235-K377 PolarHBondContact OE1-NZ 3.29Å; E235-K377 IonicContact OE2-NZ 2.72Å; G375-K377 PolarHBondContact O-N 2.99Å
378	I	98.4	Very high	87.8	Confident	81 Å²	81	82 Å²	82	42%	0.415	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.1	-177.5	-52.4	179.1	0	0	0	108.4	F233 I234	F233-I378 WeakPolarHBondContact O-CA 3.48Å; I234-I378 HydrophobicContact CG1-CG1 4.19Å; I234-I378 HydrophobicContact CG1-CG2 4.31Å; I234-I378 HydrophobicContact CG2-CG1 4.31Å
379	E	98	Very high	84.8	Confident	69 Å²	69	87.5 Å²	87.5	32%	0.322	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.4	173.3	69.6	-170.5	162.3	0	0	110.4	K218 F233 I381	K218-E379 WeakPolarHBondContact CD-OE1 3.36Å; K218-E379 WeakPolarHBondContact CE-OE1 3.15Å; K218-E379 IonicContact NZ-OE1 3.16Å; K218-E379 PolarHBondContact NZ-OE1 3.22Å; K218-E379 IonicContact NZ-OE2 3.99Å; K218-E379 PolarHBondContact NZ-OE2 3.33Å; F233-E379 HydrophobicContact CB-CG 4Å; F233-E379 HydrophobicContact CD1-CG 4.36Å; F233-E379 WeakPolarHBondContact CD1-OE1 3.35Å; F233-E379 PolarHBondContact N-O 2.99Å; F233-E379 PolarHBondContact O-N 3.32Å; E379-I381 HydrophobicContact CG-CD1 3.94Å
380	E	98.1	Very high	81.8	Confident	113 Å²	113	93.5 Å²	93.5	53%	0.528	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.3	174.1	-173.8	167.8	-159.5	0	0	109.8	M382	E380-M382 HydrophobicContact CG-CG 4.39Å; E380-M382 HydrophobicContact CG-SD 3.98Å
381	I	97.7	Very high	78.9	Confident	22 Å²	22	98.3 Å²	98.3	11%	0.113	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	120.9	173.9	-53.3	-60.5	0	0	0	108.1	K218 T221 E222 T225 G230 I231 F233 E379	K218-I381 HydrophobicContact CB-CD1 4.41Å; T221-I381 HydrophobicContact CG2-CB 4.09Å; T221-I381 HydrophobicContact CG2-CG1 4.08Å; T221-I381 HydrophobicContact CG2-CG2 4.37Å; E222-I381 HydrophobicContact CB-CG2 3.83Å; E222-I381 HydrophobicContact CG-CG2 4.31Å; T225-I381 HydrophobicContact CG2-CB 4.46Å; T225-I381 HydrophobicContact CG2-CG2 4.09Å; T225-I381 VanDerWaalsContact CG2-O 3.3Å; T225-I381 WeakPolarHBondContact CG2-O 3.42Å; G230-I381 CarbonylContact C-O 3.56Å; G230-I381 VanDerWaalsContact CA-O 3.26Å; G230-I381 WeakPolarHBondContact CA-O 3.36Å; I231-I381 PolarHBondContact N-O 3.08Å; I231-I381 PolarHBondContact O-N 2.91Å; F233-I381 HydrophobicContact CB-CD1 4.38Å; F233-I381 HydrophobicContact CB-CG1 3.74Å; F233-I381 HydrophobicContact CG-CG1 4.45Å; E379-I381 HydrophobicContact CG-CD1 3.94Å
382	M	94.6	Very high	76.2	Confident	109 Å²	109	100.7 Å²	100.7	54%	0.537	51%	0.509	S	S	.	.			trans	-104.3	157.3	-178.5	-67.4	-65.2	-73.5	0	0	110.8	G230 E380 A384	G230-M382 VanDerWaalsContact CA-SD 3.6Å; E380-M382 HydrophobicContact CG-CG 4.39Å; E380-M382 HydrophobicContact CG-SD 3.98Å; M382-A384 PolarHBondContact O-N 3.26Å
383	P	89.2	Confident	73.5	Confident	45 Å²	45	103.5 Å²	103.5	29%	0.292	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-57.3	136.7	170.9	-18.6	28.5	0	0	0	111.9	T225 R385	T225-P383 WeakPolarHBondContact OG1-CA 3.32Å; P383-R385 PolarHBondContact O-N 3.3Å
384	A	81.1	Confident	70.9	Confident	62 Å²	62	108.7 Å²	108.7	51%	0.512	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-48	125	167.1	0	0	0	0	0	109.3	M382 T386	M382-A384 PolarHBondContact O-N 3.26Å; A384-T386 PolarHBondContact O-N 3.07Å
385	R	69.6	Low	68.3	Low	235 Å²	235	112.8 Å²	112.8	89%	0.887	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-68.1	127.1	171.1	-70.1	-176.8	179	-179.4	0.5	106.6	P383 E387	P383-R385 PolarHBondContact O-N 3.3Å; R385-E387 VanDerWaalsContact C-N 3.33Å; R385-E387 PolarHBondContact O-N 2.89Å
386	T	56.1	Low	65.9	Low	94 Å²	94	122 Å²	122	58%	0.577	60%	0.603	S	S	*	*			trans	-61	105.5	162.9	-28	0	0	0	0	105.1	A384 K388	A384-T386 PolarHBondContact O-N 3.07Å; T386-K388 PolarHBondContact O-N 3.49Å; T386-K388 VanDerWaalsContact O-N 3.16Å
387	E	39.8	Very low	64.2	Low	163 Å²	163	126.4 Å²	126.4	76%	0.762	62%	0.623	S	S	*	*			trans	-54.1	125.7	161.2	-72	-174.9	165.6	0	0	105.2	R385 N389	R385-E387 VanDerWaalsContact C-N 3.33Å; R385-E387 PolarHBondContact O-N 2.89Å; E387-N389 VanDerWaalsContact C-N 3.29Å; E387-N389 PolarHBondContact O-N 3.21Å
388	K	39.2	Very low	62.5	Low	188 Å²	188	126.6 Å²	126.6	82%	0.817	63%	0.628	S	S	*	*			trans	-56.1	109.4	163.5	-79	-178	176.8	-179	0	103.4	T386 E390	T386-K388 PolarHBondContact O-N 3.49Å; T386-K388 VanDerWaalsContact O-N 3.16Å; K388-E390 PolarHBondContact O-N 3.09Å
389	N	36.1	Very low	60.5	Low	122 Å²	122	129.1 Å²	129.1	65%	0.652	64%	0.64	S	S	*	*			trans	-57.2	92.7	170.4	-82.4	-4.3	0	0	0	106.6	E387 E391	E387-N389 VanDerWaalsContact C-N 3.29Å; E387-N389 PolarHBondContact O-N 3.21Å; N389-E391 PolarHBondContact O-N 2.97Å
390	E	33.7	Very low	58.3	Low	159 Å²	159	132.6 Å²	132.6	74%	0.743	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-71.4	0.8	167.4	-75.4	-172.5	163	0	0	110.6	K388 F392 A393	K388-E390 PolarHBondContact O-N 3.09Å; E390-F392 PolarHBondContact O-N 3.28Å; E390-A393 WeakPolarHBondContact O-CB 3.12Å; E390-A393 PolarHBondContact O-N 2.73Å
391	E	38.5	Very low	55.8	Low	160 Å²	160	133.9 Å²	133.9	75%	0.748	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-65.9	2.7	174.8	-79.9	-165.4	153.9	0	0	115.5	N389	N389-E391 PolarHBondContact O-N 2.97Å
392	F	40.5	Very low	53	Low	164 Å²	164	141.3 Å²	141.3	72%	0.719	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-115.5	11.9	165.8	-73.3	-76.3	0	0	0	114.3	E390 D394	E390-F392 PolarHBondContact O-N 3.28Å; F392-D394 VanDerWaalsContact C-N 3.32Å
393	A	41.4	Very low	50	Low	67 Å²	67	143.6 Å²	143.6	55%	0.554	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-76	-19.5	169.4	0	0	0	0	0	113	E390 F395	E390-A393 WeakPolarHBondContact O-CB 3.12Å; E390-A393 PolarHBondContact O-N 2.73Å; A393-F395 PolarHBondContact O-N 2.65Å
394	D	44	Very low	47	Very low	147 Å²	147	151.2 Å²	151.2	79%	0.786	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-91.3	12.5	-178.4	-78.3	-9.1	0	0	0	114.6	F392	F392-D394 VanDerWaalsContact C-N 3.32Å
395	F	43.1	Very low	44.1	Very low	177 Å²	177	158.7 Å²	158.7	78%	0.776	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-125.6	29.3	173.4	-71.8	-69.9	0	0	0	114.8	A393	A393-F395 PolarHBondContact O-N 2.65Å
396	L	47.7	Very low	41.8	Very low	228 Å²	228	151.7 Å²	151.7	100%	1.194	76%	0.757	S	S	*	*			trans	-124.2	0	158.8	-72.5	174.7	0	0	0	109.3

Retrieved 396 of 396 residues in 1320 ms (Link to these results)

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