A0A077Z242_TRITR Loading...

Cpn60 TCP1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z242, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 552 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	50.2	Low	71.3	Confident	150 Å²	150	102.6 Å²	102.6	74%	0.739	54%	0.536	S	S	*	.				0	-36.4	0	-74.9	-174.9	178.4	0	0	112.6
2	A	60.1	Low	72.3	Confident	53 Å²	53	103.8 Å²	103.8	44%	0.438	54%	0.536	S	S	.	.	H	α-helix	trans	-75.9	-21.5	-176.8	0	0	0	0	0	116.7	R6	A2-R6 VanDerWaalsContact O-CB 3.27Å; A2-R6 WeakPolarHBondContact O-CB 3.25Å; A2-R6 VanDerWaalsContact O-CD 3.25Å; A2-R6 WeakPolarHBondContact O-CD 3.05Å; A2-R6 WeakPolarHBondContact O-CG 3.42Å; A2-R6 PolarHBondContact O-N 3.26Å
3	S	68.1	Low	73.3	Confident	85 Å²	85	101.1 Å²	101.1	59%	0.594	52%	0.516	S	S	*	.	H	α-helix	trans	-73.8	-49.3	-171.5	45.9	0	0	0	0	113.9	R6 L7	S3-R6 PolarHBondContact O-N 3.48Å; S3-L7 WeakPolarHBondContact O-CG 3.27Å; S3-L7 PolarHBondContact O-N 3.16Å
4	L	66.1	Low	74.3	Confident	54 Å²	54	95.5 Å²	95.5	28%	0.283	49%	0.492	S	S	.	.	H	α-helix	trans	-71.4	-42	-179.3	-81.3	160.1	0	0	0	112.9	R6 L7 N8 L544	L4-R6 PolarHBondContact O-N 3.12Å; L4-L7 HydrophobicContact CD2-CD1 4.47Å; L4-L7 WeakPolarHBondContact O-CB 3.48Å; L4-L7 PolarHBondContact O-N 3.2Å; L4-N8 PolarHBondContact O-N 2.99Å; L4-L544 HydrophobicContact CD1-CD2 4.23Å
5	L	69.4	Low	75	Confident	76 Å²	76	95.3 Å²	95.3	40%	0.398	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-25.7	174.9	-78.8	161	0	0	0	112.6	N8 P9 Y13	L5-N8 CarbonylContact O-C 3.59Å; L5-P9 WeakPolarHBondContact O-CA 3.48Å; L5-Y13 HydrophobicContact CD1-CE1 3.99Å; L5-Y13 HydrophobicContact CD2-CE1 4.36Å; L5-Y13 HydrophobicContact CG-CE1 3.91Å
6	R	73.2	Confident	75.5	Confident	213 Å²	213	94.3 Å²	94.3	80%	0.804	49%	0.487	S	S	*	.	H	α-helix	trans	-73.4	-31.8	170.8	-81	173.7	-175	179.7	1.3	112.9	A2 S3 L4	A2-R6 VanDerWaalsContact O-CB 3.27Å; A2-R6 WeakPolarHBondContact O-CB 3.25Å; A2-R6 VanDerWaalsContact O-CD 3.25Å; A2-R6 WeakPolarHBondContact O-CD 3.05Å; A2-R6 WeakPolarHBondContact O-CG 3.42Å; A2-R6 PolarHBondContact O-N 3.26Å; S3-R6 PolarHBondContact O-N 3.48Å; L4-R6 PolarHBondContact O-N 3.12Å
7	L	77.2	Confident	76.1	Confident	142 Å²	142	93.1 Å²	93.1	74%	0.743	50%	0.495	S	S	*	.	H	α-helix	trans	-76.6	-42.5	178.6	-69.2	167.7	0	0	0	111.6	S3 L4	S3-L7 WeakPolarHBondContact O-CG 3.27Å; S3-L7 PolarHBondContact O-N 3.16Å; L4-L7 HydrophobicContact CD2-CD1 4.47Å; L4-L7 WeakPolarHBondContact O-CB 3.48Å; L4-L7 PolarHBondContact O-N 3.2Å
8	N	78.4	Confident	76.7	Confident	49 Å²	49	90.4 Å²	90.4	26%	0.262	49%	0.487	S	S	.	.			trans	-146.3	108.4	173.6	-174.4	-3.7	0	0	0	110	L4 L5 K10 A11 S546	L4-N8 PolarHBondContact O-N 2.99Å; L5-N8 CarbonylContact O-C 3.59Å; N8-K10 PolarHBondContact O-N 3.3Å; N8-K10 VanDerWaalsContact O-N 3.16Å; N8-K10 PolarHBondContact OD1-N 3.27Å; N8-K10 VanDerWaalsContact OD1-N 3.12Å; N8-A11 HydrophobicContact CB-CB 4.05Å; N8-A11 PolarHBondContact O-N 3.33Å; N8-S546 PolarHBondContact ND2-OG 2.99Å
9	P	79.1	Confident	77.4	Confident	103 Å²	103	85.6 Å²	85.6	67%	0.669	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.2	-177.5	26.4	-34	0	0	0	113.3	L5	L5-P9 WeakPolarHBondContact O-CA 3.48Å
10	K	81.4	Confident	78	Confident	185 Å²	185	82 Å²	82	80%	0.804	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	2.1	179.5	-63.9	-175.5	178.4	-179.3	0	113.7	N8 E12	N8-K10 PolarHBondContact O-N 3.3Å; N8-K10 VanDerWaalsContact O-N 3.16Å; N8-K10 PolarHBondContact OD1-N 3.27Å; N8-K10 VanDerWaalsContact OD1-N 3.12Å; K10-E12 PolarHBondContact O-N 3.39Å
11	A	81.4	Confident	78.6	Confident	19 Å²	19	84.1 Å²	84.1	16%	0.157	45%	0.449	C	S	.	.			trans	-74.9	125.9	-179.4	0	0	0	0	0	110.9	N8	N8-A11 HydrophobicContact CB-CB 4.05Å; N8-A11 PolarHBondContact O-N 3.33Å
12	E	83.4	Confident	80.6	Confident	116 Å²	116	79.6 Å²	79.6	54%	0.542	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.9	168.7	-59.8	170.8	165.8	0	0	108.2	K10 R545	K10-E12 PolarHBondContact O-N 3.39Å; E12-R545 HydrophobicContact CB-CB 4.09Å; E12-R545 PolarHBondContact N-O 3.33Å; E12-R545 PolarHBondContact O-N 3.45Å; E12-R545 IonicContact OE1-NH1 3.91Å; E12-R545 WeakPolarHBondContact OE2-CD 3.45Å; E12-R545 IonicContact OE2-CZ 3.79Å; E12-R545 IonicContact OE2-NE 3.87Å; E12-R545 IonicContact OE2-NH1 2.91Å; E12-R545 PolarHBondContact OE2-NH1 3.06Å
13	Y	85.4	Confident	82.2	Confident	69 Å²	69	77.2 Å²	77.2	27%	0.271	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.6	178.9	65.9	-93.2	0	0	0	112.1	L5 R15 I543	L5-Y13 HydrophobicContact CD1-CE1 3.99Å; L5-Y13 HydrophobicContact CD2-CE1 4.36Å; L5-Y13 HydrophobicContact CG-CE1 3.91Å; Y13-R15 HydrophobicContact CD2-CG 3.8Å; Y13-R15 HydrophobicContact CE2-CG 4.21Å; Y13-I543 VanDerWaalsContact CA-O 3.26Å; Y13-I543 WeakPolarHBondContact CA-O 3.47Å
14	A	86.1	Confident	83.3	Confident	23 Å²	23	73.1 Å²	73.1	19%	0.19	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.3	165.1	0	0	0	0	0	108.3	A19 E542 I543	A14-A19 HydrophobicContact CB-CB 4.39Å; A14-E542 WeakPolarHBondContact O-CA 3.36Å; A14-I543 HydrophobicContact CB-CB 4.37Å; A14-I543 PolarHBondContact N-O 3.28Å; A14-I543 PolarHBondContact O-N 2.94Å
15	R	85.2	Confident	84.7	Confident	93 Å²	93	76.3 Å²	76.3	35%	0.351	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.2	-176.1	-66.1	-166.6	-69.6	152.6	10.9	113	Y13 A17 A18 D541 E542	Y13-R15 HydrophobicContact CD2-CG 3.8Å; Y13-R15 HydrophobicContact CE2-CG 4.21Å; R15-A17 PolarHBondContact O-N 3.31Å; R15-A18 WeakPolarHBondContact O-CB 3.46Å; R15-A18 PolarHBondContact O-N 3.32Å; R15-D541 CarbonylContact C-O 3.54Å; R15-E542 HydrophobicContact CB-CG 4.49Å; R15-E542 WeakPolarHBondContact CD-OE1 3.43Å; R15-E542 HydrophobicContact CG-CG 3.99Å; R15-E542 WeakPolarHBondContact CG-OE1 3.18Å
16	S	82.6	Confident	85.8	Confident	79 Å²	79	73.4 Å²	73.4	55%	0.552	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.7	-109.3	175.8	-48.9	0	0	0	0	112.4	A18 A19 L20 D541	S16-A18 VanDerWaalsContact C-N 3.3Å; S16-A18 PolarHBondContact O-N 3.19Å; S16-A19 WeakPolarHBondContact O-CB 3.32Å; S16-A19 PolarHBondContact O-N 2.91Å; S16-A19 VanDerWaalsContact O-N 3.13Å; S16-L20 PolarHBondContact O-N 3.01Å; S16-D541 WeakPolarHBondContact CA-O 3.46Å; S16-D541 PolarHBondContact N-O 2.92Å
17	A	85.6	Confident	86.8	Confident	74 Å²	74	63.3 Å²	63.3	61%	0.612	35%	0.347	S	S	*	.	H	α-helix	trans	-59.8	-38.2	-178	0	0	0	0	0	112.9	R15 A19 L20 E21	R15-A17 PolarHBondContact O-N 3.31Å; A17-A19 VanDerWaalsContact C-N 3.31Å; A17-A19 PolarHBondContact O-N 3.43Å; A17-L20 PolarHBondContact O-N 3.13Å; A17-E21 WeakPolarHBondContact O-CB 3.26Å; A17-E21 PolarHBondContact O-N 3.03Å
18	A	88.4	Confident	87.6	Confident	44 Å²	44	59.9 Å²	59.9	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-67.6	-32.7	179	0	0	0	0	0	112.1	R15 S16 V22	R15-A18 WeakPolarHBondContact O-CB 3.46Å; R15-A18 PolarHBondContact O-N 3.32Å; S16-A18 VanDerWaalsContact C-N 3.3Å; S16-A18 PolarHBondContact O-N 3.19Å; A18-V22 WeakPolarHBondContact O-CB 3.34Å; A18-V22 WeakPolarHBondContact O-CG2 3.37Å; A18-V22 PolarHBondContact O-N 3.42Å; A18-V22 VanDerWaalsContact O-N 3.08Å
19	A	89.9	Confident	88.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-43.7	175.2	0	0	0	0	0	111.2	A14 S16 A17 V22 N23 D541 I543	A14-A19 HydrophobicContact CB-CB 4.39Å; S16-A19 WeakPolarHBondContact O-CB 3.32Å; S16-A19 PolarHBondContact O-N 2.91Å; S16-A19 VanDerWaalsContact O-N 3.13Å; A17-A19 VanDerWaalsContact C-N 3.31Å; A17-A19 PolarHBondContact O-N 3.43Å; A19-V22 PolarHBondContact O-N 3.34Å; A19-N23 VanDerWaalsContact O-CG 3.31Å; A19-N23 PolarHBondContact O-N 3.4Å; A19-N23 PolarHBondContact O-ND2 2.89Å; A19-D541 WeakPolarHBondContact CB-O 3.07Å; A19-I543 HydrophobicContact CB-CD1 4.16Å; A19-I543 HydrophobicContact CB-CG1 4.03Å
20	L	89.6	Confident	88.9	Confident	13 Å²	13	55.3 Å²	55.3	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-44.1	176.1	-176.7	66.8	0	0	0	111.8	S16 A17 V22 N23 A24 V110	S16-L20 PolarHBondContact O-N 3.01Å; A17-L20 PolarHBondContact O-N 3.13Å; L20-V22 PolarHBondContact O-N 3.47Å; L20-N23 PolarHBondContact O-N 3.12Å; L20-A24 WeakPolarHBondContact O-CB 3.22Å; L20-A24 PolarHBondContact O-N 2.97Å; L20-V110 HydrophobicContact CD2-CB 3.92Å; L20-V110 HydrophobicContact CD2-CG1 3.61Å; L20-V110 HydrophobicContact CD2-CG2 3.9Å
21	E	90.8	Very high	89.5	Confident	126 Å²	126	46.7 Å²	46.7	59%	0.589	27%	0.266	S	S	*	.	H	α-helix	trans	-60.4	-44.6	178	-173.3	-179.8	-179	0	0	111.5	A17 N23 A24 L25	A17-E21 WeakPolarHBondContact O-CB 3.26Å; A17-E21 PolarHBondContact O-N 3.03Å; E21-N23 VanDerWaalsContact C-N 3.34Å; E21-N23 PolarHBondContact O-N 3.25Å; E21-A24 PolarHBondContact O-N 2.63Å; E21-L25 WeakPolarHBondContact O-CB 2.98Å; E21-L25 PolarHBondContact O-N 2.81Å
22	V	92.3	Very high	90.1	Very high	55 Å²	55	50.4 Å²	50.4	33%	0.333	28%	0.28	S	S	.	.	H	α-helix	trans	-61.2	-42.9	175.4	169.8	0	0	0	0	111.3	A18 A19 L20 A26 H71 I543	A18-V22 WeakPolarHBondContact O-CB 3.34Å; A18-V22 WeakPolarHBondContact O-CG2 3.37Å; A18-V22 PolarHBondContact O-N 3.42Å; A18-V22 VanDerWaalsContact O-N 3.08Å; A19-V22 PolarHBondContact O-N 3.34Å; L20-V22 PolarHBondContact O-N 3.47Å; V22-A26 WeakPolarHBondContact O-CB 3Å; V22-A26 PolarHBondContact O-N 2.87Å; V22-A26 VanDerWaalsContact O-N 3.11Å; V22-H71 WeakPolarHBondContact CG1-NE2 3.26Å; V22-I543 HydrophobicContact CB-CD1 4.3Å; V22-I543 HydrophobicContact CG1-CD1 4.07Å
23	N	92.7	Very high	90.5	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-46.1	177.8	-75	-22.8	0	0	0	112.3	A19 L20 E21 A26 A27 T73 L537	A19-N23 VanDerWaalsContact O-CG 3.31Å; A19-N23 PolarHBondContact O-N 3.4Å; A19-N23 PolarHBondContact O-ND2 2.89Å; L20-N23 PolarHBondContact O-N 3.12Å; E21-N23 VanDerWaalsContact C-N 3.34Å; E21-N23 PolarHBondContact O-N 3.25Å; N23-A26 PolarHBondContact O-N 3.48Å; N23-A27 WeakPolarHBondContact O-CB 3.37Å; N23-A27 PolarHBondContact O-N 3.11Å; N23-T73 HydrophobicContact CB-CG2 4.1Å; N23-T73 PolarHBondContact OD1-OG1 3.29Å; N23-L537 PolarHBondContact ND2-O 3.44Å
24	A	92.2	Very high	90.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.5	-39.4	-178.6	0	0	0	0	0	111.7	L20 E21 A26 A27 R28 E107	L20-A24 WeakPolarHBondContact O-CB 3.22Å; L20-A24 PolarHBondContact O-N 2.97Å; E21-A24 PolarHBondContact O-N 2.63Å; A24-A26 PolarHBondContact O-N 3.45Å; A24-A27 PolarHBondContact O-N 2.91Å; A24-R28 WeakPolarHBondContact O-CB 3.36Å; A24-R28 VanDerWaalsContact O-CG 3.23Å; A24-R28 WeakPolarHBondContact O-CG 3.35Å; A24-R28 PolarHBondContact O-N 3.44Å; A24-E107 WeakPolarHBondContact CB-OE2 3.28Å
25	L	94	Very high	91.2	Very high	121 Å²	121	44.2 Å²	44.2	63%	0.634	25%	0.253	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174.1	-177.7	65.8	0	0	0	111.5	E21 R28 G29	E21-L25 WeakPolarHBondContact O-CB 2.98Å; E21-L25 PolarHBondContact O-N 2.81Å; L25-R28 PolarHBondContact O-N 2.93Å; L25-G29 PolarHBondContact O-N 3.07Å
26	A	93.4	Very high	91.5	Very high	15 Å²	15	42 Å²	42	12%	0.124	25%	0.25	C	C	.	.	H	α-helix	trans	-64.5	-41.4	177.5	0	0	0	0	0	112.5	V22 N23 A24 G29 L30 H71 T73	V22-A26 WeakPolarHBondContact O-CB 3Å; V22-A26 PolarHBondContact O-N 2.87Å; V22-A26 VanDerWaalsContact O-N 3.11Å; N23-A26 PolarHBondContact O-N 3.48Å; A24-A26 PolarHBondContact O-N 3.45Å; A26-G29 PolarHBondContact O-N 3.31Å; A26-L30 PolarHBondContact O-N 3.49Å; A26-L30 VanDerWaalsContact O-N 3.11Å; A26-H71 WeakPolarHBondContact CB-CE1 3.28Å; A26-H71 WeakPolarHBondContact CB-ND1 3.47Å; A26-T73 HydrophobicContact CB-CG2 4.46Å
27	A	94.2	Very high	91.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-40.8	177.3	0	0	0	0	0	112.2	N23 A24 L30 L31 I77 L103	N23-A27 WeakPolarHBondContact O-CB 3.37Å; N23-A27 PolarHBondContact O-N 3.11Å; A24-A27 PolarHBondContact O-N 2.91Å; A27-L30 PolarHBondContact O-N 3.18Å; A27-L31 WeakPolarHBondContact O-CB 3.29Å; A27-L31 PolarHBondContact O-N 3.17Å; A27-I77 HydrophobicContact CB-CD1 3.73Å; A27-L103 HydrophobicContact CB-CD1 3.53Å
28	R	93.7	Very high	92.2	Very high	70 Å²	70	35.7 Å²	35.7	26%	0.264	20%	0.199	S	C	.	.	H	α-helix	trans	-61.6	-42.6	172.9	-74.6	171.6	179.5	172	-1.5	111.6	A24 L25 L30 L31 E32 K104 E107	A24-R28 WeakPolarHBondContact O-CB 3.36Å; A24-R28 VanDerWaalsContact O-CG 3.23Å; A24-R28 WeakPolarHBondContact O-CG 3.35Å; A24-R28 PolarHBondContact O-N 3.44Å; L25-R28 PolarHBondContact O-N 2.93Å; R28-L30 PolarHBondContact O-N 2.84Å; R28-L31 WeakPolarHBondContact O-CB 3.27Å; R28-L31 PolarHBondContact O-N 2.64Å; R28-E32 PolarHBondContact O-N 3.31Å; R28-K104 HydrophobicContact CG-CB 4.28Å; R28-E107 VanDerWaalsContact CZ-CD 3.4Å; R28-E107 IonicContact CZ-OE1 3.27Å; R28-E107 VanDerWaalsContact CZ-OE1 3.27Å; R28-E107 IonicContact CZ-OE2 2.9Å; R28-E107 IonicContact NE-OE2 3.57Å; R28-E107 IonicContact NH1-OE1 2.87Å; R28-E107 PolarHBondContact NH1-OE1 3.48Å; R28-E107 IonicContact NH1-OE2 3.07Å; R28-E107 PolarHBondContact NH1-OE2 3.25Å; R28-E107 VanDerWaalsContact NH1-OE2 3.07Å; R28-E107 IonicContact NH2-OE1 2.93Å; R28-E107 PolarHBondContact NH2-OE1 2.83Å; R28-E107 IonicContact NH2-OE2 2.81Å; R28-E107 PolarHBondContact NH2-OE2 3.48Å
29	G	92.7	Very high	92.2	Very high	39 Å²	39	34 Å²	34	40%	0.402	19%	0.187	S	C	.	.	H	α-helix	trans	-59	-45.5	175.7	0	0	0	0	0	112.4	L25 A26 V33	L25-G29 PolarHBondContact O-N 3.07Å; A26-G29 PolarHBondContact O-N 3.31Å; G29-V33 WeakPolarHBondContact O-CG2 3.42Å; G29-V33 PolarHBondContact O-N 2.93Å
30	L	92.5	Very high	92.2	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-38.3	174.2	-77.1	-178.1	0	0	0	112.8	A26 A27 R28 V33 M34 L64 A74 I77 I96	A26-L30 PolarHBondContact O-N 3.49Å; A26-L30 VanDerWaalsContact O-N 3.11Å; A27-L30 PolarHBondContact O-N 3.18Å; R28-L30 PolarHBondContact O-N 2.84Å; L30-V33 PolarHBondContact O-N 3.42Å; L30-M34 WeakPolarHBondContact O-CB 3.43Å; L30-M34 WeakPolarHBondContact O-CG 3.48Å; L30-M34 PolarHBondContact O-N 3.31Å; L30-L64 HydrophobicContact CD2-CD2 4.36Å; L30-A74 HydrophobicContact CD1-CB 3.57Å; L30-A74 HydrophobicContact CD2-CB 4.38Å; L30-A74 HydrophobicContact CG-CB 4.01Å; L30-I77 HydrophobicContact CD1-CB 4.05Å; L30-I77 HydrophobicContact CD1-CD1 4.33Å; L30-I77 HydrophobicContact CD1-CG2 4.03Å; L30-I96 HydrophobicContact CB-CG2 3.91Å
31	L	93.7	Very high	92.3	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-57.6	-51.6	176.6	177.2	160.2	0	0	0	111	A27 R28 V33 M34 K35 V97 E101	A27-L31 WeakPolarHBondContact O-CB 3.29Å; A27-L31 PolarHBondContact O-N 3.17Å; R28-L31 WeakPolarHBondContact O-CB 3.27Å; R28-L31 PolarHBondContact O-N 2.64Å; L31-V33 VanDerWaalsContact C-N 3.27Å; L31-V33 PolarHBondContact O-N 3.4Å; L31-M34 PolarHBondContact O-N 3.38Å; L31-M34 VanDerWaalsContact O-N 3.12Å; L31-K35 HydrophobicContact CD2-CB 4.35Å; L31-K35 HydrophobicContact CD2-CD 4.19Å; L31-K35 WeakPolarHBondContact O-CB 3.47Å; L31-K35 PolarHBondContact O-N 3.07Å; L31-V97 HydrophobicContact CD1-CG1 4.41Å; L31-V97 VanDerWaalsContact CD1-O 3.32Å; L31-V97 WeakPolarHBondContact CD1-O 3.43Å; L31-V97 HydrophobicContact CG-CG1 4.21Å; L31-E101 HydrophobicContact CD1-CB 4.03Å; L31-E101 VanDerWaalsContact CD1-N 3.3Å
32	E	93.4	Very high	92.2	Very high	98 Å²	98	36.9 Å²	36.9	46%	0.458	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-36.7	-177.8	-67.6	-58.2	152.4	0	0	112	R28	R28-E32 PolarHBondContact O-N 3.31Å
33	V	92.3	Very high	92.2	Very high	53 Å²	53	37.8 Å²	37.8	32%	0.321	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-44.4	174.9	175.3	0	0	0	0	111.1	G29 L30 L31 T36 K45 L63	G29-V33 WeakPolarHBondContact O-CG2 3.42Å; G29-V33 PolarHBondContact O-N 2.93Å; L30-V33 PolarHBondContact O-N 3.42Å; L31-V33 VanDerWaalsContact C-N 3.27Å; L31-V33 PolarHBondContact O-N 3.4Å; V33-T36 PolarHBondContact O-OG1 3.45Å; V33-K45 HydrophobicContact CG1-CD 4.49Å; V33-K45 WeakPolarHBondContact O-CE 3.45Å; V33-K45 PolarHBondContact O-NZ 3.01Å; V33-L63 HydrophobicContact CG1-CD2 3.97Å
34	M	93	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-83.5	-28.4	-174.6	-67.6	-61	-177.7	0	0	114.2	L30 L31 T36 N37 L63 L64 I96 V97	L30-M34 WeakPolarHBondContact O-CB 3.43Å; L30-M34 WeakPolarHBondContact O-CG 3.48Å; L30-M34 PolarHBondContact O-N 3.31Å; L31-M34 PolarHBondContact O-N 3.38Å; L31-M34 VanDerWaalsContact O-N 3.12Å; M34-T36 PolarHBondContact O-N 3.23Å; M34-N37 WeakPolarHBondContact O-CB 3.39Å; M34-N37 PolarHBondContact O-N 3.04Å; M34-L63 HydrophobicContact CE-CB 4.29Å; M34-L63 HydrophobicContact CE-CD2 3.64Å; M34-L63 HydrophobicContact CE-CG 4.37Å; M34-L63 HydrophobicContact SD-CD2 3.76Å; M34-L64 HydrophobicContact CE-CD1 4.17Å; M34-L64 HydrophobicContact CE-CD2 3.39Å; M34-L64 HydrophobicContact CE-CG 3.43Å; M34-L64 VanDerWaalsContact CE-CG 3.43Å; M34-I96 HydrophobicContact CB-CG2 4.3Å; M34-I96 HydrophobicContact CE-CD1 3.79Å; M34-I96 HydrophobicContact CG-CB 4.25Å; M34-I96 HydrophobicContact CG-CD1 3.79Å; M34-I96 HydrophobicContact CG-CG2 3.9Å; M34-I96 HydrophobicContact SD-CD1 4.19Å; M34-V97 HydrophobicContact CB-CG2 4.13Å
35	K	93	Very high	92	Very high	25 Å²	25	43 Å²	43	11%	0.109	24%	0.24	C	C	.	.	H	α-helix	trans	-53.5	-43.2	179.9	176.7	178.9	179.6	-158.6	0	111.7	L31 N37 L38 S472 E475 N476	L31-K35 HydrophobicContact CD2-CB 4.35Å; L31-K35 HydrophobicContact CD2-CD 4.19Å; L31-K35 WeakPolarHBondContact O-CB 3.47Å; L31-K35 PolarHBondContact O-N 3.07Å; K35-N37 PolarHBondContact O-N 3.21Å; K35-L38 WeakPolarHBondContact O-CB 3.49Å; K35-L38 PolarHBondContact O-N 3.08Å; K35-S472 WeakPolarHBondContact CG-OG 3.38Å; K35-E475 WeakPolarHBondContact CE-OE2 3.36Å; K35-E475 IonicContact NZ-OE1 3.08Å; K35-E475 PolarHBondContact NZ-OE1 2.91Å; K35-E475 IonicContact NZ-OE2 3.94Å; K35-E475 PolarHBondContact NZ-OE2 2.86Å; K35-N476 PolarHBondContact O-ND2 3.06Å
36	T	92.8	Very high	91.9	Very high	46 Å²	46	42.9 Å²	42.9	28%	0.282	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.5	178.8	53	0	0	0	0	114.5	V33 M34 G42 T43 K45	V33-T36 PolarHBondContact O-OG1 3.45Å; M34-T36 PolarHBondContact O-N 3.23Å; T36-G42 CarbonylContact O-C 3.48Å; T36-G42 WeakPolarHBondContact O-CA 3.23Å; T36-T43 PolarHBondContact O-N 3.41Å; T36-T43 PolarHBondContact O-OG1 3.21Å; T36-K45 PolarHBondContact OG1-NZ 3.02Å
37	N	90.5	Very high	91.8	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-19.2	176.5	-67.4	-3.4	0	0	0	112.9	M34 K35 K45 K58	M34-N37 WeakPolarHBondContact O-CB 3.39Å; M34-N37 PolarHBondContact O-N 3.04Å; K35-N37 PolarHBondContact O-N 3.21Å; N37-K45 WeakPolarHBondContact OD1-CE 3.41Å; N37-K45 PolarHBondContact OD1-NZ 3.36Å; N37-K58 HydrophobicContact CB-CG 4.39Å; N37-K58 PolarHBondContact ND2-O 3.45Å; N37-K58 WeakPolarHBondContact O-CE 3.46Å
38	L	91.4	Very high	91.7	Very high	16 Å²	16	49.5 Å²	49.5	8%	0.084	27%	0.269	C	S	.	.			trans	-69.9	133.4	-167.1	-168.6	70.4	0	0	0	112.9	K35 I469 L473 N476	K35-L38 WeakPolarHBondContact O-CB 3.49Å; K35-L38 PolarHBondContact O-N 3.08Å; L38-I469 HydrophobicContact CD2-CG2 4.28Å; L38-L473 HydrophobicContact CD2-CD2 4.32Å; L38-L473 HydrophobicContact CD2-CG 4.17Å; L38-L473 HydrophobicContact CG-CD2 4.04Å; L38-L473 HydrophobicContact CG-CG 4.43Å; L38-N476 PolarHBondContact O-ND2 3.22Å
39	G	89	Confident	91.4	Very high	10 Å²	10	48.4 Å²	48.4	10%	0.103	27%	0.272	C	S	.	.	S	Bend	trans	79.9	170.5	174.7	0	0	0	0	0	114.7	K41 G42 K58 L473	G39-K41 VanDerWaalsContact C-N 3.26Å; G39-K41 PolarHBondContact O-N 3.48Å; G39-G42 PolarHBondContact O-N 3.38Å; G39-K58 WeakPolarHBondContact O-CE 3.45Å; G39-K58 PolarHBondContact O-NZ 3.02Å; G39-L473 VanDerWaalsContact CA-CD2 3.48Å
40	P	89.4	Confident	91.3	Very high	60 Å²	60	51.3 Å²	51.3	39%	0.39	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.3	-175.6	27.8	-36.6	0	0	0	113.3	G42 K58 R175 L503	P40-G42 VanDerWaalsContact C-N 3.34Å; P40-K58 PolarHBondContact O-NZ 2.87Å; P40-K58 VanDerWaalsContact O-NZ 3.09Å; P40-R175 WeakPolarHBondContact CA-O 3.39Å; P40-R175 HydrophobicContact CB-CB 4.41Å; P40-R175 VanDerWaalsContact CB-O 3.23Å; P40-R175 WeakPolarHBondContact CB-O 3.47Å; P40-L503 HydrophobicContact CG-CD1 3.27Å
41	K	90.9	Very high	91.3	Very high	129 Å²	129	55.9 Å²	55.9	56%	0.561	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-0	174.5	-63.4	-62.3	-173.8	176.8	0	114.3	G39 L503	G39-K41 VanDerWaalsContact C-N 3.26Å; G39-K41 PolarHBondContact O-N 3.48Å; K41-L503 HydrophobicContact CG-CB 4.43Å
42	G	89.6	Confident	91	Very high	10 Å²	10	58.1 Å²	58.1	10%	0.103	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-62.5	155.2	173	0	0	0	0	0	113.2	T36 G39 P40 K58	T36-G42 CarbonylContact O-C 3.48Å; T36-G42 WeakPolarHBondContact O-CA 3.23Å; G39-G42 PolarHBondContact O-N 3.38Å; P40-G42 VanDerWaalsContact C-N 3.34Å; G42-K58 WeakPolarHBondContact O-CE 3.34Å; G42-K58 PolarHBondContact O-NZ 2.84Å
43	T	91.2	Very high	90.8	Very high	74 Å²	74	55.1 Å²	55.1	45%	0.454	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-79.5	155	-179.9	62.9	0	0	0	0	112.5	T36	T36-T43 PolarHBondContact O-N 3.41Å; T36-T43 PolarHBondContact O-OG1 3.21Å
44	V	90.5	Very high	90.7	Very high	70 Å²	70	55.8 Å²	55.8	42%	0.424	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-97.9	137.6	173.1	-179.5	0	0	0	0	108.4	L56 K58	V44-L56 HydrophobicContact CG1-CB 4.17Å; V44-L56 HydrophobicContact CG1-CD2 4.42Å; V44-K58 HydrophobicContact CG2-CB 4.43Å; V44-K58 HydrophobicContact CG2-CD 4.41Å
45	K	91.2	Very high	90.5	Very high	43 Å²	43	58.3 Å²	58.3	19%	0.187	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.3	175.5	-60.8	-169.3	-166.8	-51.6	0	110.5	V33 T36 N37 T57 L63	V33-K45 HydrophobicContact CG1-CD 4.49Å; V33-K45 WeakPolarHBondContact O-CE 3.45Å; V33-K45 PolarHBondContact O-NZ 3.01Å; T36-K45 PolarHBondContact OG1-NZ 3.02Å; N37-K45 WeakPolarHBondContact OD1-CE 3.41Å; N37-K45 PolarHBondContact OD1-NZ 3.36Å; K45-T57 PolarHBondContact N-O 3.23Å; K45-T57 PolarHBondContact O-N 3.44Å; K45-L63 HydrophobicContact CB-CD1 3.9Å; K45-L63 HydrophobicContact CD-CD1 3.71Å; K45-L63 HydrophobicContact CD-CD2 3.58Å; K45-L63 HydrophobicContact CD-CG 4.33Å; K45-L63 HydrophobicContact CG-CD1 4.4Å
46	M	91.5	Very high	90.4	Very high	118 Å²	118	59.2 Å²	59.2	58%	0.581	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.8	170.4	-174	-178	-74.5	0	0	108.9	I54 L56	M46-I54 HydrophobicContact CE-CG2 4.39Å; M46-I54 HydrophobicContact CG-CG2 3.78Å; M46-I54 HydrophobicContact SD-CG2 4.04Å; M46-L56 HydrophobicContact CB-CD2 3.71Å; M46-L56 HydrophobicContact CE-CD2 3.71Å; M46-L56 HydrophobicContact CG-CD2 3.85Å
47	L	90.9	Very high	90.2	Very high	36 Å²	36	57.2 Å²	57.2	19%	0.188	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.3	172.7	-66.5	172.3	0	0	0	109.2	I54 K55 T57 L63 E66 M67	L47-I54 CarbonylContact O-C 3.54Å; L47-I54 WeakPolarHBondContact O-CA 3.38Å; L47-K55 HydrophobicContact CB-CB 4.41Å; L47-K55 PolarHBondContact N-O 3.19Å; L47-K55 PolarHBondContact O-N 3.47Å; L47-T57 HydrophobicContact CD1-CG2 4.25Å; L47-L63 HydrophobicContact CD1-CD1 3.72Å; L47-L63 HydrophobicContact CD2-CD1 3.76Å; L47-L63 HydrophobicContact CG-CD1 3.86Å; L47-E66 HydrophobicContact CD1-CB 3.5Å; L47-E66 VanDerWaalsContact CD1-CB 3.5Å; L47-E66 HydrophobicContact CD1-CG 4.04Å; L47-M67 HydrophobicContact CD2-CG 4.32Å
48	I	91.7	Very high	90.2	Very high	119 Å²	119	58 Å²	58	61%	0.61	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.3	174.6	-55.9	174	0	0	0	106.6	G53	I48-G53 WeakPolarHBondContact CA-O 3.28Å
49	S	89.1	Confident	90	Very high	47 Å²	47	57.7 Å²	57.7	33%	0.329	36%	0.362	S	S	.	.			trans	-75.4	163.8	176.1	69.8	0	0	0	0	111	S51 G52 G53	S49-S51 PolarHBondContact O-N 2.84Å; S49-S51 VanDerWaalsContact O-N 3.1Å; S49-S51 PolarHBondContact OG-OG 2.85Å; S49-G52 PolarHBondContact O-N 3.36Å; S49-G53 PolarHBondContact N-O 3.02Å; S49-G53 WeakPolarHBondContact OG-CA 3.26Å; S49-G53 PolarHBondContact OG-N 3.42Å; S49-G53 VanDerWaalsContact OG-N 3.08Å; S49-G53 PolarHBondContact OG-O 3.31Å
50	G	90.1	Very high	90	Very high	99 Å²	99	57.2 Å²	57.2	100%	1.021	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.2	177.3	0	0	0	0	0	114.4	G52	G50-G52 VanDerWaalsContact C-N 3.3Å
51	S	92.2	Very high	90	Very high	113 Å²	113	55.1 Å²	55.1	79%	0.79	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	0.2	173.2	57.3	0	0	0	0	113.7	S49 G53	S49-S51 PolarHBondContact O-N 2.84Å; S49-S51 VanDerWaalsContact O-N 3.1Å; S49-S51 PolarHBondContact OG-OG 2.85Å; S51-G53 VanDerWaalsContact C-N 3.33Å
52	G	88.5	Confident	89.9	Confident	50 Å²	50	49.6 Å²	49.6	52%	0.515	32%	0.32	S	S	.	.			trans	81.7	9.1	-174.7	0	0	0	0	0	114.1	S49 G50 I54	S49-G52 PolarHBondContact O-N 3.36Å; G50-G52 VanDerWaalsContact C-N 3.3Å; G52-I54 PolarHBondContact O-N 3.11Å
53	G	87.6	Confident	90	Very high	36 Å²	36	49.2 Å²	49.2	37%	0.371	32%	0.315	S	S	.	.			trans	-69.7	123.6	175	0	0	0	0	0	110.8	I48 S49 S51	I48-G53 WeakPolarHBondContact CA-O 3.28Å; S49-G53 PolarHBondContact N-O 3.02Å; S49-G53 WeakPolarHBondContact OG-CA 3.26Å; S49-G53 PolarHBondContact OG-N 3.42Å; S49-G53 VanDerWaalsContact OG-N 3.08Å; S49-G53 PolarHBondContact OG-O 3.31Å; S51-G53 VanDerWaalsContact C-N 3.33Å
54	I	90.2	Very high	90	Very high	67 Å²	67	46 Å²	46	34%	0.344	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.2	177.8	-56.1	171.2	0	0	0	108.8	M46 L47 G52 H404	M46-I54 HydrophobicContact CE-CG2 4.39Å; M46-I54 HydrophobicContact CG-CG2 3.78Å; M46-I54 HydrophobicContact SD-CG2 4.04Å; L47-I54 CarbonylContact O-C 3.54Å; L47-I54 WeakPolarHBondContact O-CA 3.38Å; G52-I54 PolarHBondContact O-N 3.11Å; I54-H404 PolarHBondContact O-CE1 3.48Å; I54-H404 PolarHBondContact O-ND1 2.83Å
55	K	89.4	Confident	89.9	Confident	52 Å²	52	47.3 Å²	47.3	23%	0.226	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	127.2	171.9	-162.2	178	-163.6	175.8	0	109.5	L47 V62 E66	L47-K55 HydrophobicContact CB-CB 4.41Å; L47-K55 PolarHBondContact N-O 3.19Å; L47-K55 PolarHBondContact O-N 3.47Å; K55-V62 HydrophobicContact CD-CG1 3.88Å; K55-V62 VanDerWaalsContact CE-CG1 3.42Å; K55-V62 VanDerWaalsContact NZ-CG1 3.34Å; K55-E66 HydrophobicContact CD-CG 4.04Å; K55-E66 IonicContact NZ-OE1 2.93Å; K55-E66 PolarHBondContact NZ-OE1 3.41Å
56	L	90.7	Very high	89.8	Confident	45 Å²	45	49.7 Å²	49.7	24%	0.236	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.7	173.1	-67.8	175.4	0	0	0	107.9	V44 M46 H404	V44-L56 HydrophobicContact CG1-CB 4.17Å; V44-L56 HydrophobicContact CG1-CD2 4.42Å; M46-L56 HydrophobicContact CB-CD2 3.71Å; M46-L56 HydrophobicContact CE-CD2 3.71Å; M46-L56 HydrophobicContact CG-CD2 3.85Å; L56-H404 HydrophobicContact CD1-CB 4.48Å
57	T	89.1	Confident	89.7	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.025	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.9	176.7	-169.5	0	0	0	0	112.3	K45 L47 D59 V62 L63	K45-T57 PolarHBondContact N-O 3.23Å; K45-T57 PolarHBondContact O-N 3.44Å; L47-T57 HydrophobicContact CD1-CG2 4.25Å; T57-D59 PolarHBondContact OG1-N 2.94Å; T57-V62 HydrophobicContact CG2-CB 4.21Å; T57-V62 HydrophobicContact CG2-CG1 3.92Å; T57-L63 HydrophobicContact CG2-CB 4.27Å; T57-L63 HydrophobicContact CG2-CD1 4.13Å
58	K	89.6	Confident	89.6	Confident	19 Å²	19	54.9 Å²	54.9	8%	0.083	33%	0.334	C	S	.	.			trans	-108.5	-15.3	167	-172.1	160.7	170.7	-172.3	0	112	N37 G39 P40 G42 V44 T176	N37-K58 HydrophobicContact CB-CG 4.39Å; N37-K58 PolarHBondContact ND2-O 3.45Å; N37-K58 WeakPolarHBondContact O-CE 3.46Å; G39-K58 WeakPolarHBondContact O-CE 3.45Å; G39-K58 PolarHBondContact O-NZ 3.02Å; P40-K58 PolarHBondContact O-NZ 2.87Å; P40-K58 VanDerWaalsContact O-NZ 3.09Å; G42-K58 WeakPolarHBondContact O-CE 3.34Å; G42-K58 PolarHBondContact O-NZ 2.84Å; V44-K58 HydrophobicContact CG2-CB 4.43Å; V44-K58 HydrophobicContact CG2-CD 4.41Å; K58-T176 WeakPolarHBondContact CD-O 3.43Å; K58-T176 WeakPolarHBondContact CE-O 3.44Å; K58-T176 PolarHBondContact NZ-O 3.39Å
59	D	88.2	Confident	89.5	Confident	11 Å²	11	51.2 Å²	51.2	6%	0.059	32%	0.315	C	S	.	.			trans	-75.3	128.4	179.6	-179.9	14.6	0	0	0	110.7	T57 N61 V62 L63 T92 K177	T57-D59 PolarHBondContact OG1-N 2.94Å; D59-N61 VanDerWaalsContact C-N 3.31Å; D59-N61 PolarHBondContact O-N 3.42Å; D59-N61 PolarHBondContact OD1-N 3.08Å; D59-N61 VanDerWaalsContact OD1-N 3.09Å; D59-V62 HydrophobicContact CB-CB 4.36Å; D59-V62 HydrophobicContact CB-CG2 4.14Å; D59-V62 PolarHBondContact O-N 3.04Å; D59-L63 PolarHBondContact O-N 3.45Å; D59-L63 VanDerWaalsContact O-N 3.07Å; D59-T92 PolarHBondContact OD1-OG1 2.93Å; D59-K177 IonicContact OD2-NZ 3.93Å
60	G	88	Confident	89.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-35.2	178.7	0	0	0	0	0	112.5	L63 L64	G60-L63 PolarHBondContact O-N 3.13Å; G60-L64 WeakPolarHBondContact O-CB 3.37Å; G60-L64 VanDerWaalsContact O-CG 3.29Å; G60-L64 WeakPolarHBondContact O-CG 3.47Å; G60-L64 PolarHBondContact O-N 3.25Å
61	N	89.8	Confident	89.6	Confident	15 Å²	15	53.7 Å²	53.7	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-68.9	-43.6	180	177.7	59.3	0	0	0	111.8	D59 L63 L64 N65 N85 T92	D59-N61 VanDerWaalsContact C-N 3.31Å; D59-N61 PolarHBondContact O-N 3.42Å; D59-N61 PolarHBondContact OD1-N 3.08Å; D59-N61 VanDerWaalsContact OD1-N 3.09Å; N61-L63 VanDerWaalsContact C-N 3.31Å; N61-L63 PolarHBondContact O-N 2.97Å; N61-L64 PolarHBondContact O-N 3.39Å; N61-N65 PolarHBondContact O-N 3.5Å; N61-N65 VanDerWaalsContact O-N 3.13Å; N61-N65 PolarHBondContact O-ND2 3.28Å; N61-N65 PolarHBondContact OD1-ND2 3.5Å; N61-N85 HydrophobicContact CB-CB 4.1Å; N61-N85 PolarHBondContact ND2-ND2 2.89Å; N61-T92 HydrophobicContact CB-CG2 3.84Å
62	V	89.2	Confident	89.5	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-43	173.9	178.6	0	0	0	0	110.6	K55 T57 D59 E66	K55-V62 HydrophobicContact CD-CG1 3.88Å; K55-V62 VanDerWaalsContact CE-CG1 3.42Å; K55-V62 VanDerWaalsContact NZ-CG1 3.34Å; T57-V62 HydrophobicContact CG2-CB 4.21Å; T57-V62 HydrophobicContact CG2-CG1 3.92Å; D59-V62 HydrophobicContact CB-CB 4.36Å; D59-V62 HydrophobicContact CB-CG2 4.14Å; D59-V62 PolarHBondContact O-N 3.04Å; V62-E66 HydrophobicContact CG1-CG 4.43Å; V62-E66 WeakPolarHBondContact O-CG 3.2Å; V62-E66 PolarHBondContact O-N 3.09Å
63	L	91.1	Very high	89.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-47.6	178.2	-167.4	78.6	0	0	0	112	V33 M34 K45 L47 T57 D59 G60 N61 N65 E66 M67	V33-L63 HydrophobicContact CG1-CD2 3.97Å; M34-L63 HydrophobicContact CE-CB 4.29Å; M34-L63 HydrophobicContact CE-CD2 3.64Å; M34-L63 HydrophobicContact CE-CG 4.37Å; M34-L63 HydrophobicContact SD-CD2 3.76Å; K45-L63 HydrophobicContact CB-CD1 3.9Å; K45-L63 HydrophobicContact CD-CD1 3.71Å; K45-L63 HydrophobicContact CD-CD2 3.58Å; K45-L63 HydrophobicContact CD-CG 4.33Å; K45-L63 HydrophobicContact CG-CD1 4.4Å; L47-L63 HydrophobicContact CD1-CD1 3.72Å; L47-L63 HydrophobicContact CD2-CD1 3.76Å; L47-L63 HydrophobicContact CG-CD1 3.86Å; T57-L63 HydrophobicContact CG2-CB 4.27Å; T57-L63 HydrophobicContact CG2-CD1 4.13Å; D59-L63 PolarHBondContact O-N 3.45Å; D59-L63 VanDerWaalsContact O-N 3.07Å; G60-L63 PolarHBondContact O-N 3.13Å; N61-L63 VanDerWaalsContact C-N 3.31Å; N61-L63 PolarHBondContact O-N 2.97Å; L63-N65 PolarHBondContact O-N 3.32Å; L63-E66 PolarHBondContact O-N 2.68Å; L63-M67 HydrophobicContact CD1-SD 4.44Å; L63-M67 HydrophobicContact CD2-SD 4.08Å; L63-M67 HydrophobicContact CG-CG 4.42Å; L63-M67 HydrophobicContact CG-SD 3.82Å; L63-M67 WeakPolarHBondContact O-CB 3.41Å; L63-M67 VanDerWaalsContact O-CG 3.23Å; L63-M67 WeakPolarHBondContact O-CG 3.42Å; L63-M67 PolarHBondContact O-N 2.98Å
64	L	90.8	Very high	89.9	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-36.9	-177.8	-73.2	174.5	0	0	0	113.6	L30 M34 G60 N61 E66 I69 A78 S81 I96	L30-L64 HydrophobicContact CD2-CD2 4.36Å; M34-L64 HydrophobicContact CE-CD1 4.17Å; M34-L64 HydrophobicContact CE-CD2 3.39Å; M34-L64 HydrophobicContact CE-CG 3.43Å; M34-L64 VanDerWaalsContact CE-CG 3.43Å; G60-L64 WeakPolarHBondContact O-CB 3.37Å; G60-L64 VanDerWaalsContact O-CG 3.29Å; G60-L64 WeakPolarHBondContact O-CG 3.47Å; G60-L64 PolarHBondContact O-N 3.25Å; N61-L64 PolarHBondContact O-N 3.39Å; L64-E66 VanDerWaalsContact C-N 3.35Å; L64-I69 HydrophobicContact CD2-CD1 3.71Å; L64-A78 HydrophobicContact CB-CB 4.34Å; L64-A78 HydrophobicContact CD1-CB 3.97Å; L64-A78 HydrophobicContact CD2-CB 4.03Å; L64-A78 HydrophobicContact CG-CB 4.34Å; L64-S81 VanDerWaalsContact CD1-CB 3.48Å; L64-I96 HydrophobicContact CD1-CD1 3.44Å; L64-I96 VanDerWaalsContact CD1-CD1 3.44Å; L64-I96 HydrophobicContact CD1-CG1 4.49Å; L64-I96 HydrophobicContact CD2-CD1 4.4Å; L64-I96 HydrophobicContact CG-CD1 4.19Å
65	N	89.6	Confident	90.1	Very high	97 Å²	97	47.7 Å²	47.7	52%	0.519	25%	0.251	S	S	.	.	H	α-helix	trans	-72.7	-30.2	-179.8	-72	-36.4	0	0	0	112.3	N61 L63	N61-N65 PolarHBondContact O-N 3.5Å; N61-N65 VanDerWaalsContact O-N 3.13Å; N61-N65 PolarHBondContact O-ND2 3.28Å; N61-N65 PolarHBondContact OD1-ND2 3.5Å; L63-N65 PolarHBondContact O-N 3.32Å
66	E	88.5	Confident	90.2	Very high	93 Å²	93	49.4 Å²	49.4	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-85	-26.2	178.3	-64	-73.2	177.2	0	0	112.3	L47 K55 V62 L63 L64	L47-E66 HydrophobicContact CD1-CB 3.5Å; L47-E66 VanDerWaalsContact CD1-CB 3.5Å; L47-E66 HydrophobicContact CD1-CG 4.04Å; K55-E66 HydrophobicContact CD-CG 4.04Å; K55-E66 IonicContact NZ-OE1 2.93Å; K55-E66 PolarHBondContact NZ-OE1 3.41Å; V62-E66 HydrophobicContact CG1-CG 4.43Å; V62-E66 WeakPolarHBondContact O-CG 3.2Å; V62-E66 PolarHBondContact O-N 3.09Å; L63-E66 PolarHBondContact O-N 2.68Å; L64-E66 VanDerWaalsContact C-N 3.35Å
67	M	88.6	Confident	90.4	Very high	71 Å²	71	47.3 Å²	47.3	35%	0.35	25%	0.252	S	S	.	.	S	Bend	trans	-75.5	130.7	176	-75.5	-178.3	71.7	0	0	111.8	L47 L63 I69	L47-M67 HydrophobicContact CD2-CG 4.32Å; L63-M67 HydrophobicContact CD1-SD 4.44Å; L63-M67 HydrophobicContact CD2-SD 4.08Å; L63-M67 HydrophobicContact CG-CG 4.42Å; L63-M67 HydrophobicContact CG-SD 3.82Å; L63-M67 WeakPolarHBondContact O-CB 3.41Å; L63-M67 VanDerWaalsContact O-CG 3.23Å; L63-M67 WeakPolarHBondContact O-CG 3.42Å; L63-M67 PolarHBondContact O-N 2.98Å; M67-I69 HydrophobicContact CB-CG1 4.22Å; M67-I69 PolarHBondContact O-N 3.22Å
68	Q	89.4	Confident	90.6	Very high	193 Å²	193	47.6 Å²	47.6	90%	0.902	25%	0.254	S	S	*	.			trans	-80.4	86.2	172.9	-64.5	-178.9	7.7	0	0	110.5	T70	Q68-T70 PolarHBondContact O-N 3.22Å
69	I	89.5	Confident	90.7	Very high	42 Å²	42	53.8 Å²	53.8	22%	0.215	28%	0.281	C	S	.	.			trans	-80.7	113.9	-177.8	-57.1	172.2	0	0	0	110.3	L64 M67 A74 A78	L64-I69 HydrophobicContact CD2-CD1 3.71Å; M67-I69 HydrophobicContact CB-CG1 4.22Å; M67-I69 PolarHBondContact O-N 3.22Å; I69-A74 HydrophobicContact CG2-CB 3.38Å; I69-A78 HydrophobicContact CD1-CB 3.73Å
70	T	90	Very high	90.9	Very high	138 Å²	138	53.9 Å²	53.9	85%	0.847	28%	0.283	S	S	*	.			trans	-90	-27.3	179.3	55.7	0	0	0	0	113.6	Q68	Q68-T70 PolarHBondContact O-N 3.22Å
71	H	90.7	Very high	91.1	Very high	60 Å²	60	53.9 Å²	53.9	28%	0.278	28%	0.283	S	S	.	.	S	Bend	trans	-77.6	126.8	-175.3	-167.2	-71.6	0	0	0	111.3	V22 A26 T73 A74 T75	V22-H71 WeakPolarHBondContact CG1-NE2 3.26Å; A26-H71 WeakPolarHBondContact CB-CE1 3.28Å; A26-H71 WeakPolarHBondContact CB-ND1 3.47Å; H71-T73 PolarHBondContact CE1-OG1 2.99Å; H71-T73 VanDerWaalsContact CE1-OG1 3.23Å; H71-T73 WeakPolarHBondContact ND1-CB 3.15Å; H71-T73 PolarHBondContact ND1-N 3.15Å; H71-T73 PolarHBondContact ND1-OG1 2.95Å; H71-T73 PolarHBondContact O-N 3.39Å; H71-A74 HydrophobicContact CB-CB 3.99Å; H71-A74 WeakPolarHBondContact O-CB 3.12Å; H71-A74 PolarHBondContact O-N 3.12Å; H71-A74 VanDerWaalsContact O-N 3.08Å; H71-T75 PolarHBondContact O-N 3.4Å; H71-T75 PolarHBondContact O-OG1 3.05Å; H71-T75 VanDerWaalsContact O-OG1 3.13Å
72	P	91.6	Very high	91.3	Very high	80 Å²	80	54.8 Å²	54.8	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-42	-171.7	23.4	-34.2	0	0	0	113.2	A74 T75 L76	P72-A74 VanDerWaalsContact C-N 3.32Å; P72-A74 PolarHBondContact O-N 3Å; P72-T75 WeakPolarHBondContact O-CB 3.49Å; P72-T75 PolarHBondContact O-N 3.3Å; P72-L76 PolarHBondContact O-N 3.14Å
73	T	92.3	Very high	91.5	Very high	7 Å²	7	56.6 Å²	56.6	4%	0.043	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-40.8	176.3	-44.5	0	0	0	0	111.8	N23 A26 H71 L76 I77 L537	N23-T73 HydrophobicContact CB-CG2 4.1Å; N23-T73 PolarHBondContact OD1-OG1 3.29Å; A26-T73 HydrophobicContact CB-CG2 4.46Å; H71-T73 PolarHBondContact CE1-OG1 2.99Å; H71-T73 VanDerWaalsContact CE1-OG1 3.23Å; H71-T73 WeakPolarHBondContact ND1-CB 3.15Å; H71-T73 PolarHBondContact ND1-N 3.15Å; H71-T73 PolarHBondContact ND1-OG1 2.95Å; H71-T73 PolarHBondContact O-N 3.39Å; T73-L76 PolarHBondContact O-N 3.33Å; T73-I77 HydrophobicContact CG2-CD1 4.28Å; T73-I77 WeakPolarHBondContact O-CG1 3.3Å; T73-I77 PolarHBondContact O-N 3.35Å; T73-L537 HydrophobicContact CG2-CD1 3.87Å; T73-L537 HydrophobicContact CG2-CD2 3.75Å; T73-L537 HydrophobicContact CG2-CG 4.45Å
74	A	92.7	Very high	91.5	Very high	6 Å²	6	56.6 Å²	56.6	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-68.3	-37.6	178.1	0	0	0	0	0	111	L30 I69 H71 P72 L76 I77 A78	L30-A74 HydrophobicContact CD1-CB 3.57Å; L30-A74 HydrophobicContact CD2-CB 4.38Å; L30-A74 HydrophobicContact CG-CB 4.01Å; I69-A74 HydrophobicContact CG2-CB 3.38Å; H71-A74 HydrophobicContact CB-CB 3.99Å; H71-A74 WeakPolarHBondContact O-CB 3.12Å; H71-A74 PolarHBondContact O-N 3.12Å; H71-A74 VanDerWaalsContact O-N 3.08Å; P72-A74 VanDerWaalsContact C-N 3.32Å; P72-A74 PolarHBondContact O-N 3Å; A74-L76 VanDerWaalsContact C-N 3.35Å; A74-L76 PolarHBondContact O-N 3.4Å; A74-I77 PolarHBondContact O-N 2.82Å; A74-A78 VanDerWaalsContact O-CB 3.28Å; A74-A78 WeakPolarHBondContact O-CB 3.33Å; A74-A78 PolarHBondContact O-N 2.62Å
75	T	93.1	Very high	91.6	Very high	47 Å²	47	56.9 Å²	56.9	29%	0.288	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-39.7	172.8	-51	0	0	0	0	112	H71 P72 A78 K79	H71-T75 PolarHBondContact O-N 3.4Å; H71-T75 PolarHBondContact O-OG1 3.05Å; H71-T75 VanDerWaalsContact O-OG1 3.13Å; P72-T75 WeakPolarHBondContact O-CB 3.49Å; P72-T75 PolarHBondContact O-N 3.3Å; T75-A78 PolarHBondContact O-N 2.94Å; T75-K79 WeakPolarHBondContact O-CG 3.34Å; T75-K79 PolarHBondContact O-N 2.75Å
76	L	92.6	Very high	91.7	Very high	87 Å²	87	57.3 Å²	57.3	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-66.2	-43.5	177.9	-172.2	130.1	0	0	0	111.7	P72 T73 A74 A78 K79 A80 I533 L537	P72-L76 PolarHBondContact O-N 3.14Å; T73-L76 PolarHBondContact O-N 3.33Å; A74-L76 VanDerWaalsContact C-N 3.35Å; A74-L76 PolarHBondContact O-N 3.4Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-K79 PolarHBondContact O-N 2.85Å; L76-A80 PolarHBondContact O-N 2.82Å; L76-I533 HydrophobicContact CD2-CG2 3.81Å; L76-L537 HydrophobicContact CD2-CD1 4.41Å; L76-L537 HydrophobicContact CD2-CD2 4.1Å; L76-L537 HydrophobicContact CD2-CG 4.28Å
77	I	93.5	Very high	91.8	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-40.9	173.8	-64.8	169.9	0	0	0	110.7	A27 L30 T73 A74 K79 A80 S81 I96 I99 I533 L537	A27-I77 HydrophobicContact CB-CD1 3.73Å; L30-I77 HydrophobicContact CD1-CB 4.05Å; L30-I77 HydrophobicContact CD1-CD1 4.33Å; L30-I77 HydrophobicContact CD1-CG2 4.03Å; T73-I77 HydrophobicContact CG2-CD1 4.28Å; T73-I77 WeakPolarHBondContact O-CG1 3.3Å; T73-I77 PolarHBondContact O-N 3.35Å; A74-I77 PolarHBondContact O-N 2.82Å; I77-K79 PolarHBondContact O-N 2.91Å; I77-A80 WeakPolarHBondContact O-CB 3.15Å; I77-A80 PolarHBondContact O-N 2.94Å; I77-S81 PolarHBondContact O-N 3.01Å; I77-S81 VanDerWaalsContact O-N 3.1Å; I77-I96 HydrophobicContact CG2-CB 4.44Å; I77-I96 HydrophobicContact CG2-CG1 4.11Å; I77-I96 HydrophobicContact CG2-CG2 4.12Å; I77-I99 HydrophobicContact CD1-CG2 3.96Å; I77-I99 HydrophobicContact CG1-CG2 4.12Å; I77-I99 HydrophobicContact CG2-CD1 4.37Å; I77-I533 HydrophobicContact CG1-CG2 4.49Å; I77-L537 HydrophobicContact CD1-CD1 4.11Å; I77-L537 HydrophobicContact CG1-CD1 4.05Å
78	A	93	Very high	91.8	Very high	10 Å²	10	55.2 Å²	55.2	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-45	177.9	0	0	0	0	0	112.2	L64 I69 A74 T75 L76 A80 S81 T82	L64-A78 HydrophobicContact CB-CB 4.34Å; L64-A78 HydrophobicContact CD1-CB 3.97Å; L64-A78 HydrophobicContact CD2-CB 4.03Å; L64-A78 HydrophobicContact CG-CB 4.34Å; I69-A78 HydrophobicContact CD1-CB 3.73Å; A74-A78 VanDerWaalsContact O-CB 3.28Å; A74-A78 WeakPolarHBondContact O-CB 3.33Å; A74-A78 PolarHBondContact O-N 2.62Å; T75-A78 PolarHBondContact O-N 2.94Å; L76-A78 VanDerWaalsContact C-N 3.34Å; A78-A80 PolarHBondContact O-N 3.24Å; A78-S81 WeakPolarHBondContact O-CB 3.49Å; A78-S81 PolarHBondContact O-N 3.37Å; A78-S81 VanDerWaalsContact O-N 3.08Å; A78-T82 PolarHBondContact O-N 3.45Å; A78-T82 PolarHBondContact O-OG1 3.4Å
79	K	92.4	Very high	91.6	Very high	148 Å²	148	46 Å²	46	64%	0.643	26%	0.259	S	S	*	.	H	α-helix	trans	-59.4	-35.2	176	-76	179.3	178	-176.2	0	112.8	T75 L76 I77 T82 A83	T75-K79 WeakPolarHBondContact O-CG 3.34Å; T75-K79 PolarHBondContact O-N 2.75Å; L76-K79 PolarHBondContact O-N 2.85Å; I77-K79 PolarHBondContact O-N 2.91Å; K79-T82 PolarHBondContact O-N 2.76Å; K79-A83 PolarHBondContact O-N 3.13Å
80	A	92	Very high	91.5	Very high	13 Å²	13	45.8 Å²	45.8	11%	0.107	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-40.2	174.9	0	0	0	0	0	113	L76 I77 A78 T82 A83 Q84 I95 I533	L76-A80 PolarHBondContact O-N 2.82Å; I77-A80 WeakPolarHBondContact O-CB 3.15Å; I77-A80 PolarHBondContact O-N 2.94Å; A78-A80 PolarHBondContact O-N 3.24Å; A80-T82 VanDerWaalsContact C-N 3.3Å; A80-T82 PolarHBondContact O-N 2.91Å; A80-A83 PolarHBondContact O-N 3.12Å; A80-Q84 PolarHBondContact O-N 3.03Å; A80-I95 HydrophobicContact CB-CD1 4.35Å; A80-I533 HydrophobicContact CB-CD1 3.03Å; A80-I533 HydrophobicContact CB-CG1 4.32Å
81	S	92.6	Very high	91.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-40.1	172.6	-179.3	0	0	0	0	111.5	L64 I77 A78 Q84 N85 T92	L64-S81 VanDerWaalsContact CD1-CB 3.48Å; I77-S81 PolarHBondContact O-N 3.01Å; I77-S81 VanDerWaalsContact O-N 3.1Å; A78-S81 WeakPolarHBondContact O-CB 3.49Å; A78-S81 PolarHBondContact O-N 3.37Å; A78-S81 VanDerWaalsContact O-N 3.08Å; S81-Q84 PolarHBondContact O-N 3.32Å; S81-N85 PolarHBondContact O-N 3.37Å; S81-T92 PolarHBondContact OG-O 3.38Å
82	T	93.4	Very high	91.4	Very high	35 Å²	35	36.8 Å²	36.8	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-45.3	174.7	-48.8	0	0	0	0	111.1	A78 K79 A80 Q84 N85 D86	A78-T82 PolarHBondContact O-N 3.45Å; A78-T82 PolarHBondContact O-OG1 3.4Å; K79-T82 PolarHBondContact O-N 2.76Å; A80-T82 VanDerWaalsContact C-N 3.3Å; A80-T82 PolarHBondContact O-N 2.91Å; T82-Q84 VanDerWaalsContact C-N 3.32Å; T82-Q84 PolarHBondContact O-N 3.03Å; T82-N85 WeakPolarHBondContact O-CB 3.44Å; T82-N85 PolarHBondContact O-N 3.3Å; T82-N85 VanDerWaalsContact O-N 3.12Å; T82-D86 VanDerWaalsContact O-CG 3.32Å; T82-D86 PolarHBondContact O-N 3.37Å
83	A	93.6	Very high	91.5	Very high	51 Å²	51	33.6 Å²	33.6	42%	0.421	19%	0.187	S	C	.	.	H	α-helix	trans	-61.1	-39.1	176.9	0	0	0	0	0	112.7	K79 A80 D86 I87	K79-A83 PolarHBondContact O-N 3.13Å; A80-A83 PolarHBondContact O-N 3.12Å; A83-D86 PolarHBondContact O-N 3.28Å; A83-I87 WeakPolarHBondContact O-CG1 3.41Å; A83-I87 PolarHBondContact O-N 2.89Å
84	Q	92.4	Very high	91.5	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-44.5	173.5	-179.5	68.3	20.4	0	0	111.3	A80 S81 T82 D86 I87 T88 I95 V522	A80-Q84 PolarHBondContact O-N 3.03Å; S81-Q84 PolarHBondContact O-N 3.32Å; T82-Q84 VanDerWaalsContact C-N 3.32Å; T82-Q84 PolarHBondContact O-N 3.03Å; Q84-D86 VanDerWaalsContact C-N 3.34Å; Q84-D86 PolarHBondContact O-N 3.43Å; Q84-I87 PolarHBondContact O-N 2.89Å; Q84-T88 PolarHBondContact NE2-OG1 3.38Å; Q84-T88 VanDerWaalsContact NE2-OG1 3.08Å; Q84-T88 PolarHBondContact O-N 3.09Å; Q84-T88 PolarHBondContact O-OG1 3.26Å; Q84-I95 HydrophobicContact CB-CD1 4.15Å; Q84-V522 PolarHBondContact NE2-O 3.28Å
85	N	92.7	Very high	91.5	Very high	13 Å²	13	33.9 Å²	33.9	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-41.2	177.9	-169.7	66	0	0	0	112.1	N61 S81 T82 I87 G89 T92 R418	N61-N85 HydrophobicContact CB-CB 4.1Å; N61-N85 PolarHBondContact ND2-ND2 2.89Å; S81-N85 PolarHBondContact O-N 3.37Å; T82-N85 WeakPolarHBondContact O-CB 3.44Å; T82-N85 PolarHBondContact O-N 3.3Å; T82-N85 VanDerWaalsContact O-N 3.12Å; N85-I87 VanDerWaalsContact C-N 3.34Å; N85-I87 PolarHBondContact O-N 3.5Å; N85-G89 WeakPolarHBondContact O-CA 3.35Å; N85-G89 PolarHBondContact O-N 2.95Å; N85-T92 HydrophobicContact CB-CG2 3.64Å; N85-R418 PolarHBondContact O-NH1 2.69Å
86	D	91.4	Very high	91.6	Very high	106 Å²	106	31.7 Å²	31.7	57%	0.567	18%	0.176	S	C	*	.	H	α-helix	trans	-66.3	-37	-177.3	-69.7	-19.3	0	0	0	112.3	T82 A83 Q84	T82-D86 VanDerWaalsContact O-CG 3.32Å; T82-D86 PolarHBondContact O-N 3.37Å; A83-D86 PolarHBondContact O-N 3.28Å; Q84-D86 VanDerWaalsContact C-N 3.34Å; Q84-D86 PolarHBondContact O-N 3.43Å
87	I	90	Very high	91.7	Very high	118 Å²	118	27.5 Å²	27.5	61%	0.605	15%	0.154	S	C	*	.	H	α-helix	trans	-81.2	-47.7	-179.9	-62.6	171.8	0	0	0	111.5	A83 Q84 N85	A83-I87 WeakPolarHBondContact O-CG1 3.41Å; A83-I87 PolarHBondContact O-N 2.89Å; Q84-I87 PolarHBondContact O-N 2.89Å; N85-I87 VanDerWaalsContact C-N 3.34Å; N85-I87 PolarHBondContact O-N 3.5Å
88	T	88.1	Confident	91.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-109.1	-31.2	-168	64.8	0	0	0	0	113.1	Q84 D90 N422 V522 N525	Q84-T88 PolarHBondContact NE2-OG1 3.38Å; Q84-T88 VanDerWaalsContact NE2-OG1 3.08Å; Q84-T88 PolarHBondContact O-N 3.09Å; Q84-T88 PolarHBondContact O-OG1 3.26Å; T88-D90 PolarHBondContact O-N 3.43Å; T88-D90 PolarHBondContact OG1-O 3.08Å; T88-N422 PolarHBondContact O-ND2 2.73Å; T88-V522 HydrophobicContact CG2-CG2 4.35Å; T88-N525 HydrophobicContact CG2-CB 4.21Å; T88-N525 WeakPolarHBondContact CG2-ND2 2.92Å
89	G	85.5	Confident	91.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	73.4	8.4	-175.4	0	0	0	0	0	115.3	N85	N85-G89 WeakPolarHBondContact O-CA 3.35Å; N85-G89 PolarHBondContact O-N 2.95Å
90	D	87.9	Confident	91.9	Very high	38 Å²	38	20 Å²	20	20%	0.203	12%	0.12	C	C	.	.	S	Bend	trans	-150.8	168.7	176.3	-158.5	-7.7	0	0	0	110	T88 V522	T88-D90 PolarHBondContact O-N 3.43Å; T88-D90 PolarHBondContact OG1-O 3.08Å; D90-V522 HydrophobicContact CB-CG2 4.16Å
91	G	88	Confident	92.1	Very high	5 Å²	5	20.1 Å²	20.1	5%	0.052	12%	0.118	C	C	.	.			trans	80	15	178.9	0	0	0	0	0	114.7	S94 I95	G91-S94 PolarHBondContact O-N 3.41Å; G91-I95 PolarHBondContact O-N 2.89Å; G91-I95 VanDerWaalsContact O-N 3.07Å
92	T	91.4	Very high	92.2	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-65.5	-37.2	-178.8	60.8	0	0	0	0	112.9	D59 N61 S81 N85 I95 I96	D59-T92 PolarHBondContact OD1-OG1 2.93Å; N61-T92 HydrophobicContact CB-CG2 3.84Å; S81-T92 PolarHBondContact OG-O 3.38Å; N85-T92 HydrophobicContact CB-CG2 3.64Å; T92-I95 VanDerWaalsContact O-CG2 3.26Å; T92-I95 WeakPolarHBondContact O-CG2 3.49Å; T92-I96 WeakPolarHBondContact O-CD1 3.42Å; T92-I96 WeakPolarHBondContact O-CG1 3.33Å
93	S	92.5	Very high	92.2	Very high	13 Å²	13	18.8 Å²	18.8	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-76.6	-40.2	175	-59.4	0	0	0	0	110.9	I95 I96 V97	S93-I95 PolarHBondContact O-N 2.98Å; S93-I96 PolarHBondContact O-N 3.1Å; S93-V97 WeakPolarHBondContact O-CG2 3.45Å; S93-V97 PolarHBondContact O-N 2.96Å; S93-V97 VanDerWaalsContact O-N 3.14Å
94	S	92.5	Very high	92.2	Very high	18 Å²	18	19.8 Å²	19.8	13%	0.126	10%	0.104	C	C	.	.	H	α-helix	trans	-62.9	-40.9	-176.8	-52.9	0	0	0	0	112.7	G91 I96 V97 L98 M526	G91-S94 PolarHBondContact O-N 3.41Å; S94-I96 VanDerWaalsContact C-N 3.32Å; S94-I96 PolarHBondContact O-N 3.07Å; S94-V97 PolarHBondContact O-N 3.47Å; S94-L98 WeakPolarHBondContact O-CB 3.32Å; S94-L98 WeakPolarHBondContact O-CG 3.4Å; S94-L98 PolarHBondContact O-N 2.86Å; S94-M526 VanDerWaalsContact CB-SD 3.53Å
95	I	93.9	Very high	92.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-60.9	-40.1	178	-164.8	-175.8	0	0	0	111.8	A80 Q84 G91 T92 S93 I99 M526 C530	A80-I95 HydrophobicContact CB-CD1 4.35Å; Q84-I95 HydrophobicContact CB-CD1 4.15Å; G91-I95 PolarHBondContact O-N 2.89Å; G91-I95 VanDerWaalsContact O-N 3.07Å; T92-I95 VanDerWaalsContact O-CG2 3.26Å; T92-I95 WeakPolarHBondContact O-CG2 3.49Å; S93-I95 PolarHBondContact O-N 2.98Å; I95-I99 HydrophobicContact CG1-CD1 4Å; I95-I99 WeakPolarHBondContact O-CD1 3.3Å; I95-I99 VanDerWaalsContact O-CG1 3.23Å; I95-I99 WeakPolarHBondContact O-CG1 3.44Å; I95-I99 PolarHBondContact O-N 3.03Å; I95-M526 HydrophobicContact CB-CG 4.45Å; I95-C530 WeakPolarHBondContact CG1-SG 3.45Å
96	I	93.9	Very high	92.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-70.3	-45.4	-178.8	-59	165.6	0	0	0	110.4	L30 M34 L64 I77 T92 S93 S94 L98 I99 G100	L30-I96 HydrophobicContact CB-CG2 3.91Å; M34-I96 HydrophobicContact CB-CG2 4.3Å; M34-I96 HydrophobicContact CE-CD1 3.79Å; M34-I96 HydrophobicContact CG-CB 4.25Å; M34-I96 HydrophobicContact CG-CD1 3.79Å; M34-I96 HydrophobicContact CG-CG2 3.9Å; M34-I96 HydrophobicContact SD-CD1 4.19Å; L64-I96 HydrophobicContact CD1-CD1 3.44Å; L64-I96 VanDerWaalsContact CD1-CD1 3.44Å; L64-I96 HydrophobicContact CD1-CG1 4.49Å; L64-I96 HydrophobicContact CD2-CD1 4.4Å; L64-I96 HydrophobicContact CG-CD1 4.19Å; I77-I96 HydrophobicContact CG2-CB 4.44Å; I77-I96 HydrophobicContact CG2-CG1 4.11Å; I77-I96 HydrophobicContact CG2-CG2 4.12Å; T92-I96 WeakPolarHBondContact O-CD1 3.42Å; T92-I96 WeakPolarHBondContact O-CG1 3.33Å; S93-I96 PolarHBondContact O-N 3.1Å; S94-I96 VanDerWaalsContact C-N 3.32Å; S94-I96 PolarHBondContact O-N 3.07Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.38Å; I96-I99 PolarHBondContact O-N 3.38Å; I96-G100 PolarHBondContact O-N 3.05Å
97	V	94.9	Very high	92.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.9	-41.1	178.6	178.3	0	0	0	0	110.4	L31 M34 S93 S94 E101 V468	L31-V97 HydrophobicContact CD1-CG1 4.41Å; L31-V97 VanDerWaalsContact CD1-O 3.32Å; L31-V97 WeakPolarHBondContact CD1-O 3.43Å; L31-V97 HydrophobicContact CG-CG1 4.21Å; M34-V97 HydrophobicContact CB-CG2 4.13Å; S93-V97 WeakPolarHBondContact O-CG2 3.45Å; S93-V97 PolarHBondContact O-N 2.96Å; S93-V97 VanDerWaalsContact O-N 3.14Å; S94-V97 PolarHBondContact O-N 3.47Å; V97-E101 PolarHBondContact O-N 3.12Å; V97-V468 HydrophobicContact CG1-CB 4.32Å; V97-V468 HydrophobicContact CG1-CG1 3.71Å; V97-V468 HydrophobicContact CG1-CG2 3.64Å
98	L	94.6	Very high	92.4	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-64.7	-47.5	175.6	-76.8	173	0	0	0	112.5	S94 I96 G100 E101 M102 L466 V468 I469 M526 C530	S94-L98 WeakPolarHBondContact O-CB 3.32Å; S94-L98 WeakPolarHBondContact O-CG 3.4Å; S94-L98 PolarHBondContact O-N 2.86Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.38Å; L98-G100 VanDerWaalsContact C-N 3.32Å; L98-G100 PolarHBondContact O-N 3.17Å; L98-E101 PolarHBondContact O-N 3.23Å; L98-M102 WeakPolarHBondContact O-CB 3.21Å; L98-M102 WeakPolarHBondContact O-CG 3.23Å; L98-M102 PolarHBondContact O-N 3.5Å; L98-L466 HydrophobicContact CD2-CD2 4.11Å; L98-V468 HydrophobicContact CD2-CG1 3.93Å; L98-I469 HydrophobicContact CD1-CD1 3.83Å; L98-I469 HydrophobicContact CD2-CD1 3.95Å; L98-I469 HydrophobicContact CD2-CG1 4.18Å; L98-I469 HydrophobicContact CG-CD1 3.87Å; L98-I469 HydrophobicContact CG-CG1 4.28Å; L98-M526 HydrophobicContact CD1-CE 3.68Å; L98-M526 HydrophobicContact CD1-CG 3.77Å; L98-M526 HydrophobicContact CD1-SD 3.62Å; L98-C530 HydrophobicContact CB-CB 4.42Å; L98-C530 VanDerWaalsContact CB-SG 3.57Å
99	I	94.8	Very high	92.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-44.1	178.5	-69	163.8	0	0	0	110.8	I77 I95 I96 M102 L103 C530 I533 L537	I77-I99 HydrophobicContact CD1-CG2 3.96Å; I77-I99 HydrophobicContact CG1-CG2 4.12Å; I77-I99 HydrophobicContact CG2-CD1 4.37Å; I95-I99 HydrophobicContact CG1-CD1 4Å; I95-I99 WeakPolarHBondContact O-CD1 3.3Å; I95-I99 VanDerWaalsContact O-CG1 3.23Å; I95-I99 WeakPolarHBondContact O-CG1 3.44Å; I95-I99 PolarHBondContact O-N 3.03Å; I96-I99 PolarHBondContact O-N 3.38Å; I99-M102 PolarHBondContact O-N 3.4Å; I99-L103 HydrophobicContact CG2-CD1 4.16Å; I99-L103 WeakPolarHBondContact O-CG 3.44Å; I99-L103 PolarHBondContact O-N 3.18Å; I99-C530 HydrophobicContact CG1-CB 4.13Å; I99-I533 HydrophobicContact CD1-CB 4.07Å; I99-I533 HydrophobicContact CD1-CD1 3.99Å; I99-I533 HydrophobicContact CD1-CG2 3.94Å; I99-I533 HydrophobicContact CG2-CG2 4.3Å; I99-L537 HydrophobicContact CG2-CD1 4.48Å
100	G	94.5	Very high	92.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.7	-41.7	178.6	0	0	0	0	0	112.9	I96 L98 K104	I96-G100 PolarHBondContact O-N 3.05Å; L98-G100 VanDerWaalsContact C-N 3.32Å; L98-G100 PolarHBondContact O-N 3.17Å; G100-K104 WeakPolarHBondContact O-CB 3.39Å; G100-K104 PolarHBondContact O-N 3.37Å
101	E	95	Very high	92.9	Very high	15 Å²	15	21.9 Å²	21.9	7%	0.07	12%	0.12	C	C	.	.	H	α-helix	trans	-73.3	-39.7	178.8	-167.9	69.5	-160.2	0	0	111.3	L31 V97 L98 L103 K104 Q105 A465 V468	L31-E101 HydrophobicContact CD1-CB 4.03Å; L31-E101 VanDerWaalsContact CD1-N 3.3Å; V97-E101 PolarHBondContact O-N 3.12Å; L98-E101 PolarHBondContact O-N 3.23Å; E101-L103 VanDerWaalsContact C-N 3.3Å; E101-L103 PolarHBondContact O-N 3.4Å; E101-K104 WeakPolarHBondContact O-CB 3.41Å; E101-K104 PolarHBondContact O-N 3.25Å; E101-K104 VanDerWaalsContact O-N 3.13Å; E101-K104 IonicContact OE1-NZ 3.83Å; E101-K104 WeakPolarHBondContact OE2-CD 3.34Å; E101-K104 IonicContact OE2-NZ 3.61Å; E101-Q105 HydrophobicContact CG-CG 4.22Å; E101-Q105 WeakPolarHBondContact O-CG 3.38Å; E101-Q105 PolarHBondContact O-N 3.28Å; E101-Q105 PolarHBondContact OE1-NE2 3Å; E101-A465 HydrophobicContact CB-CB 4.32Å; E101-A465 HydrophobicContact CG-CB 4.08Å; E101-V468 HydrophobicContact CB-CB 3.92Å; E101-V468 HydrophobicContact CB-CG1 4.01Å; E101-V468 HydrophobicContact CB-CG2 3.96Å; E101-V468 HydrophobicContact CG-CB 3.85Å; E101-V468 HydrophobicContact CG-CG1 4.41Å; E101-V468 HydrophobicContact CG-CG2 4.03Å
102	M	94.7	Very high	93.1	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-57.3	-44.4	175.3	-75	-179.5	69.8	0	0	111.7	L98 I99 A106 F123 Y462 A465 C530 A534	L98-M102 WeakPolarHBondContact O-CB 3.21Å; L98-M102 WeakPolarHBondContact O-CG 3.23Å; L98-M102 PolarHBondContact O-N 3.5Å; I99-M102 PolarHBondContact O-N 3.4Å; M102-A106 VanDerWaalsContact O-CB 3.28Å; M102-A106 WeakPolarHBondContact O-CB 3.47Å; M102-A106 PolarHBondContact O-N 3.43Å; M102-F123 HydrophobicContact CB-CE2 4.35Å; M102-F123 HydrophobicContact CB-CZ 4.32Å; M102-F123 HydrophobicContact CE-CD1 4.42Å; M102-F123 HydrophobicContact CE-CD2 3.59Å; M102-F123 HydrophobicContact CE-CE1 4.4Å; M102-F123 HydrophobicContact CE-CE2 3.6Å; M102-F123 HydrophobicContact CE-CG 4.02Å; M102-F123 HydrophobicContact CE-CZ 4.02Å; M102-Y462 HydrophobicContact CE-CD2 3.44Å; M102-Y462 VanDerWaalsContact CE-CD2 3.44Å; M102-Y462 HydrophobicContact CE-CE2 3.34Å; M102-Y462 HydrophobicContact SD-CD2 4.42Å; M102-Y462 HydrophobicContact SD-CE2 4.07Å; M102-A465 HydrophobicContact CB-CB 4.35Å; M102-A465 HydrophobicContact CG-CB 3.66Å; M102-C530 HydrophobicContact SD-CB 4.13Å; M102-A534 HydrophobicContact CB-CB 4.04Å; M102-A534 HydrophobicContact CE-CB 3.72Å; M102-A534 HydrophobicContact SD-CB 4.05Å
103	L	93.8	Very high	93	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-68	-38.1	176.1	-71.3	174.8	0	0	0	111.9	A27 I99 E101 A106 E107 L537 L538	A27-L103 HydrophobicContact CB-CD1 3.53Å; I99-L103 HydrophobicContact CG2-CD1 4.16Å; I99-L103 WeakPolarHBondContact O-CG 3.44Å; I99-L103 PolarHBondContact O-N 3.18Å; E101-L103 VanDerWaalsContact C-N 3.3Å; E101-L103 PolarHBondContact O-N 3.4Å; L103-A106 PolarHBondContact O-N 2.85Å; L103-E107 WeakPolarHBondContact O-CB 3.13Å; L103-E107 PolarHBondContact O-N 3.44Å; L103-L537 HydrophobicContact CD1-CB 4.24Å; L103-L537 HydrophobicContact CD1-CD1 3.84Å; L103-L537 HydrophobicContact CD2-CB 4.16Å; L103-L538 HydrophobicContact CD2-CB 4.38Å
104	K	93.9	Very high	92.9	Very high	72 Å²	72	31.2 Å²	31.2	31%	0.313	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-45.8	175.1	176.7	-178.1	175.1	-167.1	0	112.1	R28 G100 E101 E107 M108	R28-K104 HydrophobicContact CG-CB 4.28Å; G100-K104 WeakPolarHBondContact O-CB 3.39Å; G100-K104 PolarHBondContact O-N 3.37Å; E101-K104 WeakPolarHBondContact O-CB 3.41Å; E101-K104 PolarHBondContact O-N 3.25Å; E101-K104 VanDerWaalsContact O-N 3.13Å; E101-K104 IonicContact OE1-NZ 3.83Å; E101-K104 WeakPolarHBondContact OE2-CD 3.34Å; E101-K104 IonicContact OE2-NZ 3.61Å; K104-E107 PolarHBondContact O-N 3.03Å; K104-M108 PolarHBondContact O-N 3.43Å
105	Q	93.5	Very high	92.9	Very high	25 Å²	25	36.1 Å²	36.1	12%	0.117	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-40.1	177.2	-66.2	-59.6	-29.7	0	0	111.2	E101 M108 Y109 A461 A465	E101-Q105 HydrophobicContact CG-CG 4.22Å; E101-Q105 WeakPolarHBondContact O-CG 3.38Å; E101-Q105 PolarHBondContact O-N 3.28Å; E101-Q105 PolarHBondContact OE1-NE2 3Å; Q105-M108 PolarHBondContact O-N 3Å; Q105-Y109 VanDerWaalsContact O-CD2 3.26Å; Q105-Y109 WeakPolarHBondContact O-CD2 2.63Å; Q105-A461 HydrophobicContact CB-CB 4.04Å; Q105-A465 HydrophobicContact CG-CB 4.2Å
106	A	92.6	Very high	92.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-41.8	175.5	0	0	0	0	0	112.7	M102 L103 M108 Y109 V110 I119 F123 L538	M102-A106 VanDerWaalsContact O-CB 3.28Å; M102-A106 WeakPolarHBondContact O-CB 3.47Å; M102-A106 PolarHBondContact O-N 3.43Å; L103-A106 PolarHBondContact O-N 2.85Å; A106-M108 VanDerWaalsContact C-N 3.25Å; A106-M108 PolarHBondContact O-N 2.89Å; A106-Y109 PolarHBondContact O-N 3.1Å; A106-V110 WeakPolarHBondContact O-CG2 3.37Å; A106-V110 PolarHBondContact O-N 2.84Å; A106-I119 HydrophobicContact CB-CD1 4.3Å; A106-I119 HydrophobicContact CB-CG2 3.96Å; A106-F123 HydrophobicContact CB-CE2 4.5Å; A106-F123 HydrophobicContact CB-CZ 4.15Å; A106-L538 HydrophobicContact CB-CD1 3.45Å; A106-L538 VanDerWaalsContact CB-CD1 3.45Å
107	E	91.8	Very high	92.7	Very high	44 Å²	44	45 Å²	45	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-37.7	178.7	-172.4	-170.5	125.4	0	0	111.8	A24 R28 L103 K104 Y109 V110 S111	A24-E107 WeakPolarHBondContact CB-OE2 3.28Å; R28-E107 VanDerWaalsContact CZ-CD 3.4Å; R28-E107 IonicContact CZ-OE1 3.27Å; R28-E107 VanDerWaalsContact CZ-OE1 3.27Å; R28-E107 IonicContact CZ-OE2 2.9Å; R28-E107 IonicContact NE-OE2 3.57Å; R28-E107 IonicContact NH1-OE1 2.87Å; R28-E107 PolarHBondContact NH1-OE1 3.48Å; R28-E107 IonicContact NH1-OE2 3.07Å; R28-E107 PolarHBondContact NH1-OE2 3.25Å; R28-E107 VanDerWaalsContact NH1-OE2 3.07Å; R28-E107 IonicContact NH2-OE1 2.93Å; R28-E107 PolarHBondContact NH2-OE1 2.83Å; R28-E107 IonicContact NH2-OE2 2.81Å; R28-E107 PolarHBondContact NH2-OE2 3.48Å; L103-E107 WeakPolarHBondContact O-CB 3.13Å; L103-E107 PolarHBondContact O-N 3.44Å; K104-E107 PolarHBondContact O-N 3.03Å; E107-Y109 PolarHBondContact O-N 3.33Å; E107-V110 PolarHBondContact O-N 3.43Å; E107-S111 WeakPolarHBondContact O-CB 3.45Å; E107-S111 PolarHBondContact O-N 3.45Å; E107-S111 PolarHBondContact O-OG 2.92Å
108	M	92	Very high	92.5	Very high	95 Å²	95	46.8 Å²	46.8	47%	0.468	25%	0.246	S	C	.	.	H	α-helix	trans	-57.9	-51	175.8	-66.5	177.7	64.5	0	0	111.2	K104 Q105 A106 V110 S111 E112	K104-M108 PolarHBondContact O-N 3.43Å; Q105-M108 PolarHBondContact O-N 3Å; A106-M108 VanDerWaalsContact C-N 3.25Å; A106-M108 PolarHBondContact O-N 2.89Å; M108-V110 PolarHBondContact O-N 2.92Å; M108-S111 PolarHBondContact O-N 2.98Å; M108-S111 PolarHBondContact O-OG 3.25Å; M108-E112 PolarHBondContact O-N 3.07Å
109	Y	92.3	Very high	92.4	Very high	26 Å²	26	46.7 Å²	46.7	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-69	-33.6	178.5	-66.6	-64.9	0	0	0	113.4	Q105 A106 E107 S111 E112 G113 V114 L457 Q460 A461	Q105-Y109 VanDerWaalsContact O-CD2 3.26Å; Q105-Y109 WeakPolarHBondContact O-CD2 2.63Å; A106-Y109 PolarHBondContact O-N 3.1Å; E107-Y109 PolarHBondContact O-N 3.33Å; Y109-S111 VanDerWaalsContact C-N 3.32Å; Y109-E112 PolarHBondContact O-N 2.99Å; Y109-G113 PolarHBondContact O-N 2.69Å; Y109-V114 VanDerWaalsContact O-CB 3.27Å; Y109-V114 WeakPolarHBondContact O-CB 3.36Å; Y109-V114 WeakPolarHBondContact O-CG2 3.22Å; Y109-V114 PolarHBondContact O-N 2.98Å; Y109-L457 HydrophobicContact CD1-CB 4.17Å; Y109-L457 HydrophobicContact CD1-CD1 4.37Å; Y109-L457 HydrophobicContact CD1-CD2 4.31Å; Y109-L457 HydrophobicContact CE1-CB 4.24Å; Y109-L457 HydrophobicContact CE1-CD2 3.9Å; Y109-L457 HydrophobicContact CG-CB 4.45Å; Y109-Q460 VanDerWaalsContact OH-CD 3.28Å; Y109-A461 HydrophobicContact CD2-CB 3.83Å; Y109-A461 HydrophobicContact CE2-CB 3.58Å
110	V	91.3	Very high	92.3	Very high	31 Å²	31	49.4 Å²	49.4	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-37.7	174.1	177.5	0	0	0	0	110.7	L20 A106 E107 M108 E112 G113 P116 I119	L20-V110 HydrophobicContact CD2-CB 3.92Å; L20-V110 HydrophobicContact CD2-CG1 3.61Å; L20-V110 HydrophobicContact CD2-CG2 3.9Å; A106-V110 WeakPolarHBondContact O-CG2 3.37Å; A106-V110 PolarHBondContact O-N 2.84Å; E107-V110 PolarHBondContact O-N 3.43Å; M108-V110 PolarHBondContact O-N 2.92Å; V110-E112 VanDerWaalsContact C-N 3.25Å; V110-E112 PolarHBondContact O-N 3.06Å; V110-G113 WeakPolarHBondContact O-CA 3.48Å; V110-G113 PolarHBondContact O-N 3.31Å; V110-P116 HydrophobicContact CG1-CG 4.3Å; V110-P116 HydrophobicContact CG2-CG 4.06Å; V110-I119 HydrophobicContact CG2-CD1 3.5Å; V110-I119 VanDerWaalsContact CG2-CD1 3.5Å
111	S	89.9	Confident	92.2	Very high	99 Å²	99	52.2 Å²	52.2	69%	0.692	27%	0.27	S	S	*	.	H	α-helix	trans	-64.8	-29.7	175.8	78	0	0	0	0	112.7	E107 M108 Y109 G113	E107-S111 WeakPolarHBondContact O-CB 3.45Å; E107-S111 PolarHBondContact O-N 3.45Å; E107-S111 PolarHBondContact O-OG 2.92Å; M108-S111 PolarHBondContact O-N 2.98Å; M108-S111 PolarHBondContact O-OG 3.25Å; Y109-S111 VanDerWaalsContact C-N 3.32Å; S111-G113 PolarHBondContact O-N 3.23Å
112	E	91.1	Very high	92	Very high	141 Å²	141	51.5 Å²	51.5	66%	0.659	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.1	170.8	-66.9	177	175.7	0	0	113.5	M108 Y109 V110	M108-E112 PolarHBondContact O-N 3.07Å; Y109-E112 PolarHBondContact O-N 2.99Å; V110-E112 VanDerWaalsContact C-N 3.25Å; V110-E112 PolarHBondContact O-N 3.06Å
113	G	89.2	Confident	92	Very high	62 Å²	62	51.3 Å²	51.3	64%	0.639	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	13.9	177.6	0	0	0	0	0	114.9	Y109 V110 S111	Y109-G113 PolarHBondContact O-N 2.69Å; V110-G113 WeakPolarHBondContact O-CA 3.48Å; V110-G113 PolarHBondContact O-N 3.31Å; S111-G113 PolarHBondContact O-N 3.23Å
114	V	91.1	Very high	91.9	Very high	15 Å²	15	53.8 Å²	53.8	9%	0.091	28%	0.277	C	S	.	.			trans	-75.3	128.3	172.3	-175.8	0	0	0	0	109.7	Y109 I118 I119 L457	Y109-V114 VanDerWaalsContact O-CB 3.27Å; Y109-V114 WeakPolarHBondContact O-CB 3.36Å; Y109-V114 WeakPolarHBondContact O-CG2 3.22Å; Y109-V114 PolarHBondContact O-N 2.98Å; V114-I118 HydrophobicContact CG1-CB 4.05Å; V114-I118 HydrophobicContact CG1-CD1 4.35Å; V114-I118 HydrophobicContact CG1-CG2 4.21Å; V114-I119 HydrophobicContact CG1-CG1 4.12Å; V114-L457 HydrophobicContact CG2-CD1 3.71Å
115	H	91.2	Very high	91.8	Very high	120 Å²	120	52.9 Å²	52.9	56%	0.556	28%	0.275	S	S	*	.			trans	-64	130.7	177.9	-170.5	-76.4	0	0	0	110.7	R117 I118	H115-R117 VanDerWaalsContact C-N 3.25Å; H115-R117 VanDerWaalsContact ND1-CB 3.28Å; H115-R117 WeakPolarHBondContact ND1-CB 3.35Å; H115-R117 PolarHBondContact ND1-N 2.78Å; H115-R117 VanDerWaalsContact ND1-N 3.15Å; H115-R117 PolarHBondContact O-N 3.26Å; H115-R117 VanDerWaalsContact O-N 3.09Å; H115-I118 HydrophobicContact CB-CD1 4.25Å; H115-I118 HydrophobicContact CB-CG1 4.41Å; H115-I118 WeakPolarHBondContact O-CB 3.38Å; H115-I118 PolarHBondContact O-N 3.38Å
116	P	91.7	Very high	91.6	Very high	32 Å²	32	51.7 Å²	51.7	21%	0.208	27%	0.27	C	S	.	.	H	α-helix	trans	-49.8	-42	-176.4	-29.8	34.2	0	0	0	113.8	V110 I118 I119 F120 L538	V110-P116 HydrophobicContact CG1-CG 4.3Å; V110-P116 HydrophobicContact CG2-CG 4.06Å; P116-I118 PolarHBondContact O-N 3.17Å; P116-I119 WeakPolarHBondContact O-CA 3.43Å; P116-I119 WeakPolarHBondContact O-CB 3.43Å; P116-I119 PolarHBondContact O-N 3.13Å; P116-F120 PolarHBondContact O-N 3.1Å; P116-L538 VanDerWaalsContact C-CD2 3.46Å; P116-L538 HydrophobicContact CB-CD2 3.38Å; P116-L538 HydrophobicContact CB-CG 4.04Å; P116-L538 WeakPolarHBondContact O-CD2 3.3Å
117	R	92.2	Very high	91.6	Very high	156 Å²	156	52.8 Å²	52.8	59%	0.589	27%	0.274	S	S	*	.	H	α-helix	trans	-51	-33	175.4	-169.2	172.5	179.6	162.4	3.9	115.1	H115 F120 E121	H115-R117 VanDerWaalsContact C-N 3.25Å; H115-R117 VanDerWaalsContact ND1-CB 3.28Å; H115-R117 WeakPolarHBondContact ND1-CB 3.35Å; H115-R117 PolarHBondContact ND1-N 2.78Å; H115-R117 VanDerWaalsContact ND1-N 3.15Å; H115-R117 PolarHBondContact O-N 3.26Å; H115-R117 VanDerWaalsContact O-N 3.09Å; R117-F120 WeakPolarHBondContact O-CB 3.38Å; R117-E121 IonicContact NE-OE1 2.82Å; R117-E121 WeakPolarHBondContact O-CG 2.92Å; R117-E121 PolarHBondContact O-N 3.44Å
118	I	92.4	Very high	91.5	Very high	39 Å²	39	54.5 Å²	54.5	20%	0.2	29%	0.285	C	S	.	.	H	α-helix	trans	-70.8	-38.2	178.1	-61.3	174.1	0	0	0	110.7	V114 H115 P116 E121 G122 R454	V114-I118 HydrophobicContact CG1-CB 4.05Å; V114-I118 HydrophobicContact CG1-CD1 4.35Å; V114-I118 HydrophobicContact CG1-CG2 4.21Å; H115-I118 HydrophobicContact CB-CD1 4.25Å; H115-I118 HydrophobicContact CB-CG1 4.41Å; H115-I118 WeakPolarHBondContact O-CB 3.38Å; H115-I118 PolarHBondContact O-N 3.38Å; P116-I118 PolarHBondContact O-N 3.17Å; I118-E121 PolarHBondContact O-N 3.16Å; I118-G122 PolarHBondContact O-N 2.97Å; I118-G122 VanDerWaalsContact O-N 3.1Å; I118-R454 HydrophobicContact CD1-CB 4.32Å; I118-R454 HydrophobicContact CG2-CB 3.7Å
119	I	92.4	Very high	91.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-67.6	-43.4	176.2	-58.1	173.4	0	0	0	109.8	A106 V110 V114 P116 E121 G122 F123 L538	A106-I119 HydrophobicContact CB-CD1 4.3Å; A106-I119 HydrophobicContact CB-CG2 3.96Å; V110-I119 HydrophobicContact CG2-CD1 3.5Å; V110-I119 VanDerWaalsContact CG2-CD1 3.5Å; V114-I119 HydrophobicContact CG1-CG1 4.12Å; P116-I119 WeakPolarHBondContact O-CA 3.43Å; P116-I119 WeakPolarHBondContact O-CB 3.43Å; P116-I119 PolarHBondContact O-N 3.13Å; I119-E121 PolarHBondContact O-N 2.96Å; I119-G122 CarbonylContact O-C 3.42Å; I119-G122 WeakPolarHBondContact O-CA 3.39Å; I119-G122 PolarHBondContact O-N 3.28Å; I119-G122 VanDerWaalsContact O-N 3.07Å; I119-F123 HydrophobicContact CG2-CD1 4.14Å; I119-F123 HydrophobicContact CG2-CD2 4.45Å; I119-F123 HydrophobicContact CG2-CE1 3.79Å; I119-F123 HydrophobicContact CG2-CE2 4.09Å; I119-F123 HydrophobicContact CG2-CG 4.49Å; I119-F123 HydrophobicContact CG2-CZ 3.76Å; I119-F123 PolarHBondContact O-N 3.15Å; I119-L538 HydrophobicContact CB-CD1 4.14Å; I119-L538 HydrophobicContact CG2-CD1 3.81Å
120	F	92.3	Very high	90.8	Very high	56 Å²	56	49.9 Å²	49.9	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-52.8	-50.2	172.2	166.4	-97.6	0	0	0	112.1	P116 R117 G122 F123 E124 S535 L538 L539	P116-F120 PolarHBondContact O-N 3.1Å; R117-F120 WeakPolarHBondContact O-CB 3.38Å; F120-G122 VanDerWaalsContact C-N 3.26Å; F120-G122 PolarHBondContact O-N 3.23Å; F120-F123 PolarHBondContact O-N 2.92Å; F120-F123 VanDerWaalsContact O-N 3.13Å; F120-E124 HydrophobicContact CE1-CG 4.31Å; F120-E124 HydrophobicContact CE2-CG 4.02Å; F120-E124 HydrophobicContact CZ-CG 3.86Å; F120-E124 PolarHBondContact O-N 2.99Å; F120-S535 VanDerWaalsContact CD2-CB 3.42Å; F120-S535 WeakPolarHBondContact CD2-OG 3.34Å; F120-L538 HydrophobicContact CB-CD2 4.24Å; F120-L539 HydrophobicContact CB-CD2 4.38Å; F120-L539 HydrophobicContact CD2-CD1 3.93Å; F120-L539 HydrophobicContact CD2-CG 4.47Å; F120-L539 HydrophobicContact CE2-CD1 4.16Å; F120-L539 HydrophobicContact CG-CD1 4.18Å
121	E	91.8	Very high	90.6	Very high	60 Å²	60	49.7 Å²	49.7	28%	0.28	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-35.1	177.7	-72.4	177.8	-160.7	0	0	112.1	R117 I118 I119 I125 K455	R117-E121 IonicContact NE-OE1 2.82Å; R117-E121 WeakPolarHBondContact O-CG 2.92Å; R117-E121 PolarHBondContact O-N 3.44Å; I118-E121 PolarHBondContact O-N 3.16Å; I119-E121 PolarHBondContact O-N 2.96Å; E121-I125 WeakPolarHBondContact O-CD1 3.43Å; E121-I125 VanDerWaalsContact O-CG1 3.28Å; E121-I125 WeakPolarHBondContact O-CG1 3.45Å; E121-I125 PolarHBondContact O-N 2.82Å; E121-K455 HydrophobicContact CB-CD 4.35Å; E121-K455 WeakPolarHBondContact OE2-CE 3.16Å; E121-K455 IonicContact OE2-NZ 3.67Å; E121-K455 PolarHBondContact OE2-NZ 3.47Å
122	G	91.8	Very high	90.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-37.8	173.2	0	0	0	0	0	113.4	I118 I119 F120 I125 A126	I118-G122 PolarHBondContact O-N 2.97Å; I118-G122 VanDerWaalsContact O-N 3.1Å; I119-G122 CarbonylContact O-C 3.42Å; I119-G122 WeakPolarHBondContact O-CA 3.39Å; I119-G122 PolarHBondContact O-N 3.28Å; I119-G122 VanDerWaalsContact O-N 3.07Å; F120-G122 VanDerWaalsContact C-N 3.26Å; F120-G122 PolarHBondContact O-N 3.23Å; G122-I125 PolarHBondContact O-N 2.82Å; G122-A126 WeakPolarHBondContact O-CB 3.46Å; G122-A126 PolarHBondContact O-N 2.98Å
123	F	93.5	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-40.7	176.1	-76.2	0.1	0	0	0	112.3	M102 A106 I119 F120 A126 K127 G458 A461 Y462 A534 L538	M102-F123 HydrophobicContact CB-CE2 4.35Å; M102-F123 HydrophobicContact CB-CZ 4.32Å; M102-F123 HydrophobicContact CE-CD1 4.42Å; M102-F123 HydrophobicContact CE-CD2 3.59Å; M102-F123 HydrophobicContact CE-CE1 4.4Å; M102-F123 HydrophobicContact CE-CE2 3.6Å; M102-F123 HydrophobicContact CE-CG 4.02Å; M102-F123 HydrophobicContact CE-CZ 4.02Å; A106-F123 HydrophobicContact CB-CE2 4.5Å; A106-F123 HydrophobicContact CB-CZ 4.15Å; I119-F123 HydrophobicContact CG2-CD1 4.14Å; I119-F123 HydrophobicContact CG2-CD2 4.45Å; I119-F123 HydrophobicContact CG2-CE1 3.79Å; I119-F123 HydrophobicContact CG2-CE2 4.09Å; I119-F123 HydrophobicContact CG2-CG 4.49Å; I119-F123 HydrophobicContact CG2-CZ 3.76Å; I119-F123 PolarHBondContact O-N 3.15Å; F120-F123 PolarHBondContact O-N 2.92Å; F120-F123 VanDerWaalsContact O-N 3.13Å; F123-A126 PolarHBondContact O-N 3.4Å; F123-K127 WeakPolarHBondContact O-CB 3.29Å; F123-K127 PolarHBondContact O-N 2.77Å; F123-G458 WeakPolarHBondContact CD1-O 3.4Å; F123-G458 WeakPolarHBondContact CE1-O 3.44Å; F123-A461 HydrophobicContact CE1-CB 3.85Å; F123-A461 HydrophobicContact CZ-CB 4.4Å; F123-Y462 HydrophobicContact CB-CD2 4.18Å; F123-Y462 AromaticContact CD1-CD2 3.75Å; F123-Y462 HydrophobicContact CD1-CD2 3.75Å; F123-Y462 HydrophobicContact CD1-CG 4.34Å; F123-Y462 HydrophobicContact CE1-CD2 4.25Å; F123-Y462 HydrophobicContact CG-CD2 4Å; F123-A534 HydrophobicContact CE2-CB 4.47Å; F123-L538 HydrophobicContact CE2-CD1 4.36Å
124	E	91.8	Very high	88.6	Confident	55 Å²	55	42.8 Å²	42.8	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-43.8	175.7	-76.1	-66.7	116.5	0	0	111.7	F120 A126 K127 D128	F120-E124 HydrophobicContact CE1-CG 4.31Å; F120-E124 HydrophobicContact CE2-CG 4.02Å; F120-E124 HydrophobicContact CZ-CG 3.86Å; F120-E124 PolarHBondContact O-N 2.99Å; E124-A126 PolarHBondContact O-N 3.48Å; E124-K127 PolarHBondContact O-N 3.36Å; E124-K127 IonicContact OE1-NZ 3.36Å; E124-K127 PolarHBondContact OE1-NZ 3.35Å; E124-K127 IonicContact OE2-NZ 2.62Å; E124-K127 PolarHBondContact OE2-NZ 2.95Å; E124-D128 PolarHBondContact O-N 3.31Å; E124-D128 VanDerWaalsContact O-N 3.11Å
125	I	91.2	Very high	87.3	Confident	53 Å²	53	44.9 Å²	44.9	27%	0.272	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-45.9	174.5	-66.3	165.4	0	0	0	110.5	E121 G122 D128 I129 V451 K455 V459	E121-I125 WeakPolarHBondContact O-CD1 3.43Å; E121-I125 VanDerWaalsContact O-CG1 3.28Å; E121-I125 WeakPolarHBondContact O-CG1 3.45Å; E121-I125 PolarHBondContact O-N 2.82Å; G122-I125 PolarHBondContact O-N 2.82Å; I125-D128 PolarHBondContact O-N 2.93Å; I125-I129 HydrophobicContact CG2-CD1 3.75Å; I125-I129 VanDerWaalsContact O-CD1 3.3Å; I125-I129 WeakPolarHBondContact O-CD1 3.31Å; I125-I129 VanDerWaalsContact O-CG1 3.25Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; I125-I129 PolarHBondContact O-N 3.43Å; I125-I129 VanDerWaalsContact O-N 3.13Å; I125-V451 HydrophobicContact CD1-CG1 4.45Å; I125-V451 HydrophobicContact CG2-CG2 4.24Å; I125-K455 HydrophobicContact CD1-CD 4.01Å; I125-V459 HydrophobicContact CB-CG2 4.45Å; I125-V459 HydrophobicContact CG2-CG2 4.25Å
126	A	90.9	Very high	85.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-40.7	179.8	0	0	0	0	0	112.5	G122 F123 E124 I129 C130 L444 Y462	G122-A126 WeakPolarHBondContact O-CB 3.46Å; G122-A126 PolarHBondContact O-N 2.98Å; F123-A126 PolarHBondContact O-N 3.4Å; E124-A126 PolarHBondContact O-N 3.48Å; A126-I129 PolarHBondContact O-N 3.36Å; A126-C130 PolarHBondContact O-N 2.94Å; A126-C130 PolarHBondContact O-SG 2.89Å; A126-L444 HydrophobicContact CB-CD2 3.8Å; A126-Y462 HydrophobicContact CB-CD1 3.69Å; A126-Y462 HydrophobicContact CB-CD2 3.9Å; A126-Y462 HydrophobicContact CB-CE1 4.32Å; A126-Y462 HydrophobicContact CB-CE2 4.49Å; A126-Y462 HydrophobicContact CB-CG 3.45Å; A126-Y462 VanDerWaalsContact CB-CG 3.45Å
127	K	91.5	Very high	83.1	Confident	24 Å²	24	45.2 Å²	45.2	10%	0.104	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-50.6	174.7	-180	-167.9	72.4	-165.4	0	111.1	F123 E124 I129 C130 L131 I527	F123-K127 WeakPolarHBondContact O-CB 3.29Å; F123-K127 PolarHBondContact O-N 2.77Å; E124-K127 PolarHBondContact O-N 3.36Å; E124-K127 IonicContact OE1-NZ 3.36Å; E124-K127 PolarHBondContact OE1-NZ 3.35Å; E124-K127 IonicContact OE2-NZ 2.62Å; E124-K127 PolarHBondContact OE2-NZ 2.95Å; K127-I129 VanDerWaalsContact C-N 3.27Å; K127-I129 PolarHBondContact O-N 2.81Å; K127-C130 PolarHBondContact O-N 3Å; K127-C130 VanDerWaalsContact O-N 3.14Å; K127-L131 HydrophobicContact CG-CD1 4.16Å; K127-L131 WeakPolarHBondContact O-CG 3.48Å; K127-L131 PolarHBondContact O-N 2.95Å; K127-I527 HydrophobicContact CG-CG2 4.12Å
128	D	90.2	Very high	80.2	Confident	79 Å²	79	44.6 Å²	44.6	42%	0.422	22%	0.224	S	C	.	.	H	α-helix	trans	-62.2	-36.7	-179.5	-74.9	-10.6	0	0	0	111.9	E124 I125 K132	E124-D128 PolarHBondContact O-N 3.31Å; E124-D128 VanDerWaalsContact O-N 3.11Å; I125-D128 PolarHBondContact O-N 2.93Å; D128-K132 WeakPolarHBondContact O-CB 3.44Å; D128-K132 WeakPolarHBondContact O-CG 3.34Å; D128-K132 PolarHBondContact O-N 2.66Å
129	I	85.5	Confident	77.2	Confident	25 Å²	25	48.4 Å²	48.4	13%	0.128	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-46.4	174.4	-64.4	157.9	0	0	0	110.4	I125 A126 K127 L131 K132 V133 L444 V447	I125-I129 HydrophobicContact CG2-CD1 3.75Å; I125-I129 VanDerWaalsContact O-CD1 3.3Å; I125-I129 WeakPolarHBondContact O-CD1 3.31Å; I125-I129 VanDerWaalsContact O-CG1 3.25Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; I125-I129 PolarHBondContact O-N 3.43Å; I125-I129 VanDerWaalsContact O-N 3.13Å; A126-I129 PolarHBondContact O-N 3.36Å; K127-I129 VanDerWaalsContact C-N 3.27Å; K127-I129 PolarHBondContact O-N 2.81Å; I129-L131 VanDerWaalsContact C-N 3.31Å; I129-L131 PolarHBondContact O-N 3.18Å; I129-K132 WeakPolarHBondContact O-CB 3.45Å; I129-K132 PolarHBondContact O-N 3.34Å; I129-K132 VanDerWaalsContact O-N 3.1Å; I129-V133 HydrophobicContact CG2-CG2 4.44Å; I129-V133 WeakPolarHBondContact O-CG2 3.39Å; I129-V133 PolarHBondContact O-N 3.32Å; I129-L444 HydrophobicContact CB-CD2 3.93Å; I129-L444 HydrophobicContact CD1-CD2 4.07Å; I129-L444 HydrophobicContact CG2-CD2 3.85Å; I129-V447 HydrophobicContact CD1-CB 4.01Å; I129-V447 HydrophobicContact CD1-CG1 3.41Å; I129-V447 VanDerWaalsContact CD1-CG1 3.41Å; I129-V447 HydrophobicContact CD1-CG2 4.31Å; I129-V447 HydrophobicContact CG1-CG1 4.4Å; I129-V447 HydrophobicContact CG2-CG2 4.32Å
130	C	85	Confident	74	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-40.7	177.9	-67.3	0	0	0	0	112	A126 K127 K132 V133 L134 I527	A126-C130 PolarHBondContact O-N 2.94Å; A126-C130 PolarHBondContact O-SG 2.89Å; K127-C130 PolarHBondContact O-N 3Å; K127-C130 VanDerWaalsContact O-N 3.14Å; C130-K132 VanDerWaalsContact C-N 3.35Å; C130-V133 PolarHBondContact O-N 3.42Å; C130-L134 WeakPolarHBondContact O-CG 3.07Å; C130-L134 PolarHBondContact O-N 3.14Å; C130-I527 HydrophobicContact CB-CD1 3.97Å; C130-I527 HydrophobicContact CB-CG2 4.09Å
131	L	85.8	Confident	70.8	Confident	26 Å²	26	62 Å²	62	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-36.8	174.2	-68.6	173.3	0	0	0	112.1	K127 I129 L134 N135 K524 I527 N528	K127-L131 HydrophobicContact CG-CD1 4.16Å; K127-L131 WeakPolarHBondContact O-CG 3.48Å; K127-L131 PolarHBondContact O-N 2.95Å; I129-L131 VanDerWaalsContact C-N 3.31Å; I129-L131 PolarHBondContact O-N 3.18Å; L131-L134 HydrophobicContact CD2-CD1 4.34Å; L131-L134 WeakPolarHBondContact O-CB 3.37Å; L131-L134 PolarHBondContact O-N 3.13Å; L131-N135 VanDerWaalsContact O-CB 3.26Å; L131-N135 WeakPolarHBondContact O-CB 3.37Å; L131-N135 PolarHBondContact O-N 2.81Å; L131-N135 PolarHBondContact O-ND2 3.18Å; L131-K524 HydrophobicContact CD2-CG 4.2Å; L131-I527 HydrophobicContact CD2-CG2 4.33Å; L131-I527 HydrophobicContact CG-CG2 4.41Å; L131-N528 VanDerWaalsContact CD1-OD1 3.32Å; L131-N528 WeakPolarHBondContact CD1-OD1 3.46Å
132	K	82.7	Confident	67.5	Low	135 Å²	135	68 Å²	68	59%	0.587	34%	0.343	S	S	*	.	H	α-helix	trans	-63	-47.5	172	-74.6	168.4	-173.9	176.5	0	110.5	D128 I129 C130 L134 N135 V136	D128-K132 WeakPolarHBondContact O-CB 3.44Å; D128-K132 WeakPolarHBondContact O-CG 3.34Å; D128-K132 PolarHBondContact O-N 2.66Å; I129-K132 WeakPolarHBondContact O-CB 3.45Å; I129-K132 PolarHBondContact O-N 3.34Å; I129-K132 VanDerWaalsContact O-N 3.1Å; C130-K132 VanDerWaalsContact C-N 3.35Å; K132-L134 PolarHBondContact O-N 3.12Å; K132-N135 PolarHBondContact O-N 2.99Å; K132-V136 WeakPolarHBondContact O-CG2 3.46Å; K132-V136 PolarHBondContact O-N 2.81Å
133	V	74.5	Confident	64.2	Low	18 Å²	18	72.7 Å²	72.7	11%	0.109	37%	0.374	C	S	.	.	H	α-helix	trans	-55.2	-36	175.7	173.4	0	0	0	0	111.5	I129 C130 M155 F436 E443	I129-V133 HydrophobicContact CG2-CG2 4.44Å; I129-V133 WeakPolarHBondContact O-CG2 3.39Å; I129-V133 PolarHBondContact O-N 3.32Å; C130-V133 PolarHBondContact O-N 3.42Å; V133-M155 HydrophobicContact CG1-CE 3.38Å; V133-F436 HydrophobicContact CG1-CE2 4.27Å; V133-E443 HydrophobicContact CG2-CB 4.05Å; V133-E443 HydrophobicContact CG2-CG 4.14Å
134	L	72	Confident	61	Low	4 Å²	4	81.4 Å²	81.4	2%	0.021	42%	0.417	C	S	.	.	H	α-helix	trans	-72.2	-32	173.2	-77	170.4	0	0	0	114.5	C130 L131 K132 K156 L430 F436 Y520 K523 K524 I527	C130-L134 WeakPolarHBondContact O-CG 3.07Å; C130-L134 PolarHBondContact O-N 3.14Å; L131-L134 HydrophobicContact CD2-CD1 4.34Å; L131-L134 WeakPolarHBondContact O-CB 3.37Å; L131-L134 PolarHBondContact O-N 3.13Å; K132-L134 PolarHBondContact O-N 3.12Å; L134-K156 WeakPolarHBondContact O-CE 3.36Å; L134-K156 PolarHBondContact O-NZ 3.24Å; L134-L430 HydrophobicContact CD2-CD1 3.57Å; L134-L430 HydrophobicContact CD2-CD2 4.45Å; L134-F436 HydrophobicContact CD1-CE2 4.25Å; L134-F436 HydrophobicContact CD1-CZ 3.89Å; L134-F436 HydrophobicContact CD2-CD2 3.72Å; L134-F436 HydrophobicContact CD2-CE1 4.47Å; L134-F436 HydrophobicContact CD2-CE2 3.21Å; L134-F436 HydrophobicContact CD2-CZ 3.65Å; L134-F436 HydrophobicContact CG-CD2 4.38Å; L134-F436 HydrophobicContact CG-CE2 3.39Å; L134-F436 HydrophobicContact CG-CZ 3.53Å; L134-Y520 HydrophobicContact CB-CE2 4.03Å; L134-Y520 HydrophobicContact CD2-CD2 4.38Å; L134-Y520 HydrophobicContact CD2-CE2 4.48Å; L134-Y520 WeakPolarHBondContact O-CE2 3.24Å; L134-K523 HydrophobicContact CD2-CB 4.23Å; L134-K524 HydrophobicContact CD1-CB 4.41Å; L134-I527 HydrophobicContact CD1-CD1 3.57Å; L134-I527 HydrophobicContact CG-CD1 4.48Å
135	N	64	Low	57.8	Low	59 Å²	59	90.4 Å²	90.4	32%	0.316	45%	0.449	S	S	.	.	H	α-helix	trans	-97.5	-7.1	-167.1	-73	-15.7	0	0	0	115.8	L131 K132 Q137 N138 Y520	L131-N135 VanDerWaalsContact O-CB 3.26Å; L131-N135 WeakPolarHBondContact O-CB 3.37Å; L131-N135 PolarHBondContact O-N 2.81Å; L131-N135 PolarHBondContact O-ND2 3.18Å; K132-N135 PolarHBondContact O-N 2.99Å; N135-Q137 PolarHBondContact O-N 2.98Å; N135-N138 PolarHBondContact O-N 3.48Å; N135-N138 VanDerWaalsContact O-N 3.15Å; N135-Y520 PolarHBondContact OD1-OH 3.12Å
136	V	53.2	Low	54.7	Low	83 Å²	83	92.3 Å²	92.3	50%	0.503	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	16.6	-166.5	165.7	0	0	0	0	116.4	K132 L152	K132-V136 WeakPolarHBondContact O-CG2 3.46Å; K132-V136 PolarHBondContact O-N 2.81Å; V136-L152 HydrophobicContact CB-CD2 4.37Å; V136-L152 HydrophobicContact CG1-CB 4.16Å; V136-L152 HydrophobicContact CG1-CD2 3.99Å; V136-L152 HydrophobicContact CG1-CG 4.47Å
137	Q	40.1	Very low	51.5	Low	77 Å²	77	100.9 Å²	100.9	36%	0.36	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	0.1	167.3	-73.5	-168.2	-17.8	0	0	115.9	N135 K156	N135-Q137 PolarHBondContact O-N 2.98Å; Q137-K156 HydrophobicContact CB-CD 4.5Å; Q137-K156 VanDerWaalsContact OE1-CB 3.23Å
138	N	31.6	Very low	48.6	Very low	143 Å²	143	105 Å²	105	77%	0.765	54%	0.537	S	S	*	.	S	Bend	trans	-121.8	16.6	-177.4	-80.8	-16.5	0	0	0	116.5	N135	N135-N138 PolarHBondContact O-N 3.48Å; N135-N138 VanDerWaalsContact O-N 3.15Å
139	V	29.4	Very low	45.8	Very low	118 Å²	118	106 Å²	106	72%	0.715	55%	0.55	S	S	*	*			trans	-141.5	99	176.4	-171.1	0	0	0	0	111.6	L141	V139-L141 HydrophobicContact CG1-CB 4.06Å; V139-L141 PolarHBondContact O-N 3.07Å
140	E	25.4	Very low	43.3	Very low	194 Å²	194	114.1 Å²	114.1	91%	0.907	59%	0.585	S	S	*	*			trans	-59.6	104.5	150.7	-69.7	-175.8	147.5	0	0	108.3
141	L	24.7	Very low	41	Very low	148 Å²	148	116.5 Å²	116.5	78%	0.775	60%	0.599	S	S	*	*			trans	-160	111.7	156.8	-133.9	80.3	0	0	0	112.4	V139	V139-L141 HydrophobicContact CG1-CB 4.06Å; V139-L141 PolarHBondContact O-N 3.07Å
142	F	23.1	Very low	38.8	Very low	187 Å²	187	117.5 Å²	117.5	82%	0.82	60%	0.604	S	S	*	*			trans	63.6	100.7	146.3	-108.6	-106.4	0	0	0	121.2
143	C	23.1	Very low	36.7	Very low	98 Å²	98	117.3 Å²	117.3	66%	0.662	61%	0.605	S	S	*	*				62.7	66.3	125.7	-60.2	0	0	0	0	120
144	M	24.9	Very low	35.2	Very low	183 Å²	183	117.9 Å²	117.9	90%	0.901	61%	0.61	S	S	*	*			trans	-153.1	55.9	131	-107.4	-175.7	106.9	0	0	111.4
145	R	25.2	Very low	33.9	Very low	244 Å²	244	118.1 Å²	118.1	92%	0.921	61%	0.611	S	S	*	*				36.7	107.5	125.5	-143	159.4	148.9	146.5	-7.2	118.4
146	A	26.1	Very low	32.9	Very low	93 Å²	93	116 Å²	116	77%	0.769	60%	0.599	S	S	*	*	S	Bend		99.6	2.4	128.9	0	0	0	0	0	122.5
147	M	24.3	Very low	32.5	Very low	181 Å²	181	114.4 Å²	114.4	89%	0.892	59%	0.587	S	S	*	*	S	Bend	trans	-128.8	-9.2	168.8	-116.5	-179.6	-177.8	0	0	115.8
148	I	30.9	Very low	32.8	Very low	110 Å²	110	115.1 Å²	115.1	56%	0.564	60%	0.601	S	S	*	*	S	Bend	trans	-99.6	-11.5	-168.9	-64.5	171.4	0	0	0	112.2	K150 V151 L152	I148-K150 VanDerWaalsContact C-N 3.35Å; I148-K150 PolarHBondContact O-N 3.45Å; I148-V151 PolarHBondContact O-N 3.43Å; I148-L152 HydrophobicContact CG2-CD1 3.22Å
149	S	31.3	Very low	33.6	Very low	101 Å²	101	110 Å²	110	71%	0.706	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-15.4	-170.6	-170.9	0	0	0	0	115.7
150	K	31.8	Very low	34.6	Very low	195 Å²	195	108.9 Å²	108.9	85%	0.848	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-8	175.1	-87.1	-174	173.9	-176.3	0	113.9	I148	I148-K150 VanDerWaalsContact C-N 3.35Å; I148-K150 PolarHBondContact O-N 3.45Å
151	V	36.7	Very low	36.2	Very low	50 Å²	50	104.4 Å²	104.4	30%	0.303	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.3	-23.2	-165.3	175.5	0	0	0	0	112.7	I148 S154 N496	I148-V151 PolarHBondContact O-N 3.43Å; V151-S154 PolarHBondContact O-OG 3.44Å; V151-S154 VanDerWaalsContact O-OG 3.13Å; V151-N496 HydrophobicContact CG1-CB 3.51Å
152	L	40.9	Very low	38.4	Very low	47 Å²	47	101.1 Å²	101.1	25%	0.246	53%	0.534	C	S	.	.	S	Bend	trans	-100.6	-3.4	-177.9	-86.8	130.5	0	0	0	115.2	V136 I148 S154	V136-L152 HydrophobicContact CB-CD2 4.37Å; V136-L152 HydrophobicContact CG1-CB 4.16Å; V136-L152 HydrophobicContact CG1-CD2 3.99Å; V136-L152 HydrophobicContact CG1-CG 4.47Å; I148-L152 HydrophobicContact CG2-CD1 3.22Å; L152-S154 PolarHBondContact O-N 3.27Å
153	E	38.2	Very low	41.4	Very low	130 Å²	130	97.2 Å²	97.2	61%	0.607	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-71.4	-14.2	170.3	-79.9	175.6	159.7	0	0	113	M155	E153-M155 VanDerWaalsContact C-N 3.29Å; E153-M155 PolarHBondContact O-N 3.14Å
154	S	42.8	Very low	44.5	Very low	30 Å²	30	99.4 Å²	99.4	21%	0.21	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-76.2	-4.7	-176.3	60.8	0	0	0	0	115.6	V151 L152	V151-S154 PolarHBondContact O-OG 3.44Å; V151-S154 VanDerWaalsContact O-OG 3.13Å; L152-S154 PolarHBondContact O-N 3.27Å
155	M	44.3	Very low	47.4	Very low	10 Å²	10	91.7 Å²	91.7	5%	0.049	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-99.1	-14.6	-174.7	-70	-102.7	-85.4	0	0	112.9	V133 E153 L430 P431 F436 A439	V133-M155 HydrophobicContact CG1-CE 3.38Å; E153-M155 VanDerWaalsContact C-N 3.29Å; E153-M155 PolarHBondContact O-N 3.14Å; M155-L430 WeakPolarHBondContact O-CD2 3.3Å; M155-P431 VanDerWaalsContact O-CD 3.31Å; M155-P431 WeakPolarHBondContact O-CD 3.41Å; M155-F436 HydrophobicContact CE-CD2 3.8Å; M155-F436 HydrophobicContact CE-CE2 4.18Å; M155-A439 HydrophobicContact CE-CB 3.75Å; M155-A439 HydrophobicContact SD-CB 3.84Å
156	K	42	Very low	50.4	Low	15 Å²	15	80.2 Å²	80.2	7%	0.065	43%	0.433	C	S	.	.			trans	-136.2	108	178.3	-79.6	-178.4	172.6	-176.5	0	109.6	L134 Q137 V428 L430 Y520	L134-K156 WeakPolarHBondContact O-CE 3.36Å; L134-K156 PolarHBondContact O-NZ 3.24Å; Q137-K156 HydrophobicContact CB-CD 4.5Å; Q137-K156 VanDerWaalsContact OE1-CB 3.23Å; K156-V428 HydrophobicContact CD-CB 4.05Å; K156-V428 HydrophobicContact CD-CG1 4.1Å; K156-V428 HydrophobicContact CD-CG2 4.2Å; K156-V428 HydrophobicContact CG-CB 4.21Å; K156-L430 HydrophobicContact CG-CD2 3.88Å; K156-Y520 VanDerWaalsContact CE-CD2 3.44Å
157	I	45.6	Very low	53.5	Low	49 Å²	49	76.9 Å²	76.9	25%	0.251	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-82.3	117.7	165.5	-41.3	-178.7	0	0	0	105.1	P159 V429 E512 Y517	I157-P159 HydrophobicContact CG2-CB 4.12Å; I157-P159 HydrophobicContact CG2-CG 4.01Å; I157-P159 WeakPolarHBondContact O-CD 3.18Å; I157-V429 HydrophobicContact CB-CG2 4.39Å; I157-E512 HydrophobicContact CD1-CB 4.38Å; I157-E512 HydrophobicContact CD1-CG 4Å; I157-Y517 HydrophobicContact CD1-CE1 3.65Å
158	S	47.4	Very low	56.6	Low	91 Å²	91	69.9 Å²	69.9	64%	0.636	37%	0.368	S	S	*	.			trans	-101.9	68.4	164.1	177.2	0	0	0	0	108
159	P	48	Very low	59.4	Low	37 Å²	37	64.6 Å²	64.6	24%	0.24	34%	0.342	C	S	.	.			trans	-72.7	159.4	174	37.4	-35	0	0	0	108.8	I157 M161 L165	I157-P159 HydrophobicContact CG2-CB 4.12Å; I157-P159 HydrophobicContact CG2-CG 4.01Å; I157-P159 WeakPolarHBondContact O-CD 3.18Å; P159-M161 PolarHBondContact O-N 2.93Å; P159-L165 HydrophobicContact CG-CD1 4.22Å; P159-L165 HydrophobicContact CG-CD2 3.47Å; P159-L165 VanDerWaalsContact CG-CD2 3.47Å; P159-L165 HydrophobicContact CG-CG 4.32Å
160	P	49.9	Very low	62.3	Low	94 Å²	94	59.8 Å²	59.8	61%	0.61	31%	0.308	S	S	*	.			trans	-50.2	138	160.7	24.6	-32.8	0	0	0	107.8	N162	P160-N162 PolarHBondContact O-N 3.47Å; P160-N162 PolarHBondContact O-OD1 3.41Å
161	M	58.4	Low	65.2	Low	100 Å²	100	53.3 Å²	53.3	49%	0.493	28%	0.278	S	S	.	.			trans	-65.7	80.1	-176.3	-66.9	-147.6	-150.2	0	0	110.5	P159 L424	P159-M161 PolarHBondContact O-N 2.93Å; M161-L424 HydrophobicContact CE-CD2 4.46Å; M161-L424 WeakPolarHBondContact CE-O 3.48Å; M161-L424 HydrophobicContact SD-CD2 3.3Å; M161-L424 WeakPolarHBondContact SD-CD2 3.32Å; M161-L424 HydrophobicContact SD-CG 4.45Å
162	N	72.1	Confident	67.8	Low	79 Å²	79	52 Å²	52	42%	0.422	27%	0.27	S	S	.	.			trans	-82.1	140.8	-179.4	-70.4	-12.6	0	0	0	108	P160 E164 L165 L166	P160-N162 PolarHBondContact O-N 3.47Å; P160-N162 PolarHBondContact O-OD1 3.41Å; N162-E164 PolarHBondContact O-N 3.17Å; N162-E164 VanDerWaalsContact O-N 3.09Å; N162-L165 PolarHBondContact O-N 2.81Å; N162-L166 PolarHBondContact O-N 3.39Å
163	R	85.9	Confident	70.2	Confident	105 Å²	105	50 Å²	50	40%	0.396	26%	0.26	S	S	.	.	H	α-helix	trans	-49.8	-36.5	173.9	-176.6	174.4	179.9	-89.9	2.8	111.8	L166 M167 V191 D192 L195	R163-L166 PolarHBondContact O-N 3.21Å; R163-M167 HydrophobicContact CG-SD 4.36Å; R163-M167 PolarHBondContact NH1-SD 3.13Å; R163-M167 VanDerWaalsContact NH1-SD 3.37Å; R163-M167 VanDerWaalsContact O-CG 3.31Å; R163-M167 WeakPolarHBondContact O-CG 3.34Å; R163-M167 PolarHBondContact O-N 3.4Å; R163-V191 HydrophobicContact CG-CG1 4.08Å; R163-D192 IonicContact CZ-OD1 3.44Å; R163-D192 IonicContact NE-OD1 3.72Å; R163-D192 PolarHBondContact NE-OD1 3.04Å; R163-D192 VanDerWaalsContact NE-OD1 3.1Å; R163-D192 IonicContact NH2-OD1 3.83Å; R163-D192 PolarHBondContact NH2-OD1 3.4Å; R163-D192 IonicContact NH2-OD2 2.69Å; R163-D192 PolarHBondContact NH2-OD2 3.4Å; R163-L195 HydrophobicContact CG-CD1 4.17Å
164	E	87.3	Confident	72.7	Confident	143 Å²	143	43.9 Å²	43.9	67%	0.668	23%	0.232	S	C	*	.	H	α-helix	trans	-60.5	-45.1	178.1	-64.8	178.9	171.6	0	0	112.9	N162 L166 M167 D168	N162-E164 PolarHBondContact O-N 3.17Å; N162-E164 VanDerWaalsContact O-N 3.09Å; E164-L166 VanDerWaalsContact C-N 3.31Å; E164-L166 PolarHBondContact O-N 3.47Å; E164-M167 WeakPolarHBondContact O-CB 3.36Å; E164-M167 PolarHBondContact O-N 2.96Å; E164-M167 VanDerWaalsContact O-N 3.15Å; E164-D168 PolarHBondContact O-N 2.7Å
165	L	86.1	Confident	75.1	Confident	21 Å²	21	47 Å²	47	11%	0.11	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-40.8	177.2	-172.5	79	0	0	0	111.4	P159 N162 M167 D168 V169 V429 Y517	P159-L165 HydrophobicContact CG-CD1 4.22Å; P159-L165 HydrophobicContact CG-CD2 3.47Å; P159-L165 VanDerWaalsContact CG-CD2 3.47Å; P159-L165 HydrophobicContact CG-CG 4.32Å; N162-L165 PolarHBondContact O-N 2.81Å; L165-M167 VanDerWaalsContact C-N 3.29Å; L165-M167 PolarHBondContact O-N 2.86Å; L165-D168 PolarHBondContact O-N 3.4Å; L165-V169 WeakPolarHBondContact O-CG2 3.39Å; L165-V169 PolarHBondContact O-N 2.94Å; L165-V429 HydrophobicContact CD1-CG2 4.2Å; L165-V429 HydrophobicContact CD2-CG1 4.26Å; L165-V429 HydrophobicContact CD2-CG2 4.26Å; L165-Y517 HydrophobicContact CD1-CD2 4.03Å; L165-Y517 HydrophobicContact CD1-CE2 3.59Å
166	L	88.1	Confident	77.2	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-65.1	-36.3	177.3	-61.8	176.3	0	0	0	111.3	N162 R163 E164 A170 V191 L195 V420 T423 L424	N162-L166 PolarHBondContact O-N 3.39Å; R163-L166 PolarHBondContact O-N 3.21Å; E164-L166 VanDerWaalsContact C-N 3.31Å; E164-L166 PolarHBondContact O-N 3.47Å; L166-A170 VanDerWaalsContact O-CB 3.28Å; L166-A170 WeakPolarHBondContact O-CB 3.08Å; L166-A170 PolarHBondContact O-N 3.48Å; L166-V191 HydrophobicContact CB-CG1 3.96Å; L166-V191 HydrophobicContact CB-CG2 4.15Å; L166-V191 WeakPolarHBondContact O-CG2 3.31Å; L166-L195 HydrophobicContact CD1-CD2 3.94Å; L166-L195 HydrophobicContact CD1-CG 4.49Å; L166-V420 HydrophobicContact CB-CG1 4.46Å; L166-V420 HydrophobicContact CD2-CG1 4.13Å; L166-T423 HydrophobicContact CD2-CG2 3.9Å; L166-L424 HydrophobicContact CD1-CD2 4.06Å; L166-L424 HydrophobicContact CD2-CD2 3.94Å; L166-L424 HydrophobicContact CD2-CG 4.33Å
167	M	91.6	Very high	79.3	Confident	23 Å²	23	48.6 Å²	48.6	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-42.1	172.4	-69.9	179.2	71.9	0	0	111.5	R163 E164 L165 A170 R171 T187 E188 V191	R163-M167 HydrophobicContact CG-SD 4.36Å; R163-M167 PolarHBondContact NH1-SD 3.13Å; R163-M167 VanDerWaalsContact NH1-SD 3.37Å; R163-M167 VanDerWaalsContact O-CG 3.31Å; R163-M167 WeakPolarHBondContact O-CG 3.34Å; R163-M167 PolarHBondContact O-N 3.4Å; E164-M167 WeakPolarHBondContact O-CB 3.36Å; E164-M167 PolarHBondContact O-N 2.96Å; E164-M167 VanDerWaalsContact O-N 3.15Å; L165-M167 VanDerWaalsContact C-N 3.29Å; L165-M167 PolarHBondContact O-N 2.86Å; M167-A170 PolarHBondContact O-N 3Å; M167-R171 WeakPolarHBondContact O-CB 3.38Å; M167-R171 PolarHBondContact O-N 3.35Å; M167-T187 HydrophobicContact CB-CG2 3.9Å; M167-T187 HydrophobicContact CE-CG2 4.47Å; M167-T187 HydrophobicContact CG-CG2 4.26Å; M167-T187 WeakPolarHBondContact O-CG2 3.28Å; M167-E188 HydrophobicContact CE-CG 3.81Å; M167-V191 HydrophobicContact CG-CB 4.35Å; M167-V191 HydrophobicContact CG-CG1 4.29Å; M167-V191 HydrophobicContact CG-CG2 4.01Å
168	D	90.4	Very high	81.4	Confident	34 Å²	34	46.9 Å²	46.9	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-42	178.7	-71.2	-13.5	0	0	0	112.4	E164 L165 R171 T172 G515 Y517	E164-D168 PolarHBondContact O-N 2.7Å; L165-D168 PolarHBondContact O-N 3.4Å; D168-R171 IonicContact OD1-CZ 2.68Å; D168-R171 IonicContact OD1-NH1 2.8Å; D168-R171 PolarHBondContact OD1-NH1 3.07Å; D168-R171 IonicContact OD1-NH2 2.66Å; D168-T172 WeakPolarHBondContact O-CB 3.44Å; D168-T172 PolarHBondContact O-N 3.13Å; D168-T172 PolarHBondContact O-OG1 3.07Å; D168-G515 WeakPolarHBondContact CB-O 3.35Å; D168-Y517 HydrophobicContact CB-CD2 3.87Å; D168-Y517 HydrophobicContact CB-CE2 3.96Å
169	V	89.5	Confident	83.3	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-51.5	173.2	174	0	0	0	0	110.9	L165 R171 T172 S173 A419 T423 V429 Y517	L165-V169 WeakPolarHBondContact O-CG2 3.39Å; L165-V169 PolarHBondContact O-N 2.94Å; V169-R171 VanDerWaalsContact C-N 3.29Å; V169-R171 PolarHBondContact O-N 3.4Å; V169-T172 WeakPolarHBondContact O-CB 3.24Å; V169-T172 PolarHBondContact O-N 3.23Å; V169-T172 VanDerWaalsContact O-N 3.11Å; V169-S173 PolarHBondContact O-N 3.12Å; V169-S173 VanDerWaalsContact O-N 3.08Å; V169-A419 HydrophobicContact CG1-CB 4.29Å; V169-T423 WeakPolarHBondContact CG1-OG1 3.47Å; V169-T423 HydrophobicContact CG2-CG2 4.35Å; V169-V429 HydrophobicContact CG2-CG1 3.96Å; V169-Y517 HydrophobicContact CG2-CD2 4.46Å
170	A	92	Very high	85.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.3	-42.6	-179.8	0	0	0	0	0	111.4	L166 M167 T172 S173 L174 T187 V190 V191 V420	L166-A170 VanDerWaalsContact O-CB 3.28Å; L166-A170 WeakPolarHBondContact O-CB 3.08Å; L166-A170 PolarHBondContact O-N 3.48Å; M167-A170 PolarHBondContact O-N 3Å; A170-T172 VanDerWaalsContact C-N 3.33Å; A170-T172 PolarHBondContact O-N 3.46Å; A170-S173 PolarHBondContact O-N 3.15Å; A170-L174 VanDerWaalsContact O-CB 3.3Å; A170-L174 WeakPolarHBondContact O-CB 3.47Å; A170-L174 WeakPolarHBondContact O-CD1 3.29Å; A170-L174 WeakPolarHBondContact O-CG 3.21Å; A170-L174 PolarHBondContact O-N 3.28Å; A170-T187 HydrophobicContact CB-CG2 4.04Å; A170-V190 HydrophobicContact CB-CG1 4.41Å; A170-V191 HydrophobicContact CB-CG2 3.83Å; A170-V420 HydrophobicContact CB-CG2 3.68Å
171	R	93.2	Very high	87.3	Confident	59 Å²	59	51.3 Å²	51.3	22%	0.223	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-40.9	176.3	-174.1	-171.8	-66.2	133.9	7.8	111.5	M167 D168 V169 R175 D184 T187	M167-R171 WeakPolarHBondContact O-CB 3.38Å; M167-R171 PolarHBondContact O-N 3.35Å; D168-R171 IonicContact OD1-CZ 2.68Å; D168-R171 IonicContact OD1-NH1 2.8Å; D168-R171 PolarHBondContact OD1-NH1 3.07Å; D168-R171 IonicContact OD1-NH2 2.66Å; V169-R171 VanDerWaalsContact C-N 3.29Å; V169-R171 PolarHBondContact O-N 3.4Å; R171-R175 VanDerWaalsContact CD-CZ 3.44Å; R171-R175 HydrophobicContact CG-CG 4.29Å; R171-R175 VanDerWaalsContact CG-NE 3.33Å; R171-R175 VanDerWaalsContact O-CB 3.25Å; R171-R175 WeakPolarHBondContact O-CB 3.35Å; R171-R175 WeakPolarHBondContact O-CG 3.26Å; R171-R175 PolarHBondContact O-N 3.25Å; R171-D184 IonicContact NE-OD1 3.58Å; R171-T187 WeakPolarHBondContact CA-OG1 3.48Å; R171-T187 HydrophobicContact CB-CG2 4.06Å
172	T	90.2	Very high	88.9	Confident	22 Å²	22	47 Å²	47	14%	0.135	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-51.4	177.7	-60.2	0	0	0	0	110.9	D168 V169 A170 G515 I516 Y517	D168-T172 WeakPolarHBondContact O-CB 3.44Å; D168-T172 PolarHBondContact O-N 3.13Å; D168-T172 PolarHBondContact O-OG1 3.07Å; V169-T172 WeakPolarHBondContact O-CB 3.24Å; V169-T172 PolarHBondContact O-N 3.23Å; V169-T172 VanDerWaalsContact O-N 3.11Å; A170-T172 VanDerWaalsContact C-N 3.33Å; A170-T172 PolarHBondContact O-N 3.46Å; T172-G515 PolarHBondContact OG1-O 3.16Å; T172-I516 HydrophobicContact CG2-CG2 3.88Å; T172-Y517 VanDerWaalsContact CG2-O 3.31Å; T172-Y517 WeakPolarHBondContact CG2-O 3.45Å; T172-Y517 PolarHBondContact OG1-N 2.99Å
173	S	90.9	Very high	89.8	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-45.1	178.7	-61.4	0	0	0	0	112.4	V169 A170 R175 T176 A419	V169-S173 PolarHBondContact O-N 3.12Å; V169-S173 VanDerWaalsContact O-N 3.08Å; A170-S173 PolarHBondContact O-N 3.15Å; S173-R175 PolarHBondContact O-N 2.97Å; S173-T176 PolarHBondContact O-N 3.21Å; S173-T176 PolarHBondContact O-OG1 3.49Å; S173-A419 VanDerWaalsContact OG-CB 3.23Å; S173-A419 WeakPolarHBondContact OG-CB 3.04Å
174	L	92.2	Very high	90.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-40	-177.6	-72.1	168.7	0	0	0	112.8	A170 T176 K177 V178 A183 L186 V190 A412	A170-L174 VanDerWaalsContact O-CB 3.3Å; A170-L174 WeakPolarHBondContact O-CB 3.47Å; A170-L174 WeakPolarHBondContact O-CD1 3.29Å; A170-L174 WeakPolarHBondContact O-CG 3.21Å; A170-L174 PolarHBondContact O-N 3.28Å; L174-T176 PolarHBondContact O-N 3.08Å; L174-T176 VanDerWaalsContact O-N 3.13Å; L174-K177 PolarHBondContact O-N 3.1Å; L174-V178 HydrophobicContact CB-CG2 4.42Å; L174-V178 VanDerWaalsContact O-CG2 3.26Å; L174-V178 WeakPolarHBondContact O-CG2 3.23Å; L174-V178 PolarHBondContact O-N 3.39Å; L174-A183 HydrophobicContact CB-CB 3.97Å; L174-L186 HydrophobicContact CD1-CB 3.83Å; L174-L186 HydrophobicContact CD2-CB 4.47Å; L174-V190 HydrophobicContact CD1-CG2 4.36Å; L174-A412 HydrophobicContact CD2-CB 4.05Å; L174-A412 VanDerWaalsContact CD2-O 3.29Å; L174-A412 WeakPolarHBondContact CD2-O 3.5Å
175	R	91.4	Very high	90.3	Very high	96 Å²	96	37.5 Å²	37.5	36%	0.362	20%	0.196	S	C	.	.	H	α-helix	trans	-62	-20.9	178.6	-78	177.5	176.4	-174.4	-2.9	113.1	P40 R171 S173 K177 A183 D184	P40-R175 WeakPolarHBondContact CA-O 3.39Å; P40-R175 HydrophobicContact CB-CB 4.41Å; P40-R175 VanDerWaalsContact CB-O 3.23Å; P40-R175 WeakPolarHBondContact CB-O 3.47Å; R171-R175 VanDerWaalsContact CD-CZ 3.44Å; R171-R175 HydrophobicContact CG-CG 4.29Å; R171-R175 VanDerWaalsContact CG-NE 3.33Å; R171-R175 VanDerWaalsContact O-CB 3.25Å; R171-R175 WeakPolarHBondContact O-CB 3.35Å; R171-R175 WeakPolarHBondContact O-CG 3.26Å; R171-R175 PolarHBondContact O-N 3.25Å; S173-R175 PolarHBondContact O-N 2.97Å; R175-K177 VanDerWaalsContact C-N 3.32Å; R175-A183 HydrophobicContact CG-CB 3.69Å; R175-D184 IonicContact CZ-OD1 3.11Å; R175-D184 IonicContact NE-OD1 2.79Å; R175-D184 PolarHBondContact NE-OD1 3.26Å; R175-D184 IonicContact NH2-OD1 3.16Å; R175-D184 PolarHBondContact NH2-OD1 2.85Å; R175-D184 IonicContact NH2-OD2 3.33Å
176	T	89.6	Confident	90.7	Very high	39 Å²	39	36.5 Å²	36.5	24%	0.239	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-29.3	173.7	69.1	0	0	0	0	112.3	K58 S173 L174	K58-T176 WeakPolarHBondContact CD-O 3.43Å; K58-T176 WeakPolarHBondContact CE-O 3.44Å; K58-T176 PolarHBondContact NZ-O 3.39Å; S173-T176 PolarHBondContact O-N 3.21Å; S173-T176 PolarHBondContact O-OG1 3.49Å; L174-T176 PolarHBondContact O-N 3.08Å; L174-T176 VanDerWaalsContact O-N 3.13Å
177	K	86.4	Confident	91	Very high	19 Å²	19	36.4 Å²	36.4	8%	0.083	19%	0.191	C	C	.	.	H	α-helix	trans	-107	-35.8	-170.3	-70.1	-176.3	169.5	-152.1	0	115.1	D59 L174 R175 Q408 D411 A412 D415	D59-K177 IonicContact OD2-NZ 3.93Å; L174-K177 PolarHBondContact O-N 3.1Å; R175-K177 VanDerWaalsContact C-N 3.32Å; K177-Q408 PolarHBondContact O-NE2 3.15Å; K177-D411 PolarHBondContact NZ-O 3.35Å; K177-A412 HydrophobicContact CB-CB 3.88Å; K177-A412 HydrophobicContact CD-CB 3.99Å; K177-D415 HydrophobicContact CD-CB 4.38Å; K177-D415 VanDerWaalsContact CE-CG 3.45Å; K177-D415 WeakPolarHBondContact CE-OD2 3.45Å; K177-D415 IonicContact NZ-OD1 2.69Å; K177-D415 PolarHBondContact NZ-OD1 3.05Å; K177-D415 VanDerWaalsContact NZ-OD1 3.1Å; K177-D415 IonicContact NZ-OD2 2.78Å; K177-D415 PolarHBondContact NZ-OD2 3.4Å
178	V	88.7	Confident	91	Very high	14 Å²	14	40 Å²	40	9%	0.085	21%	0.208	C	C	.	.	S	Bend	trans	-120.2	165.1	-175.1	-67	0	0	0	0	111.9	L174 L182 A183 L186 A412	L174-V178 HydrophobicContact CB-CG2 4.42Å; L174-V178 VanDerWaalsContact O-CG2 3.26Å; L174-V178 WeakPolarHBondContact O-CG2 3.23Å; L174-V178 PolarHBondContact O-N 3.39Å; V178-L182 HydrophobicContact CB-CD2 4.27Å; V178-L182 HydrophobicContact CG1-CD2 4.37Å; V178-A183 HydrophobicContact CG2-CB 3.86Å; V178-L186 HydrophobicContact CG2-CD1 4.31Å; V178-A412 HydrophobicContact CG1-CB 3.66Å
179	A	88.7	Confident	91.2	Very high	73 Å²	73	39 Å²	39	60%	0.603	20%	0.202	S	C	*	.			trans	-58.8	146.8	175.1	0	0	0	0	0	111.2	K181 L182 A183	A179-K181 PolarHBondContact O-N 2.83Å; A179-L182 PolarHBondContact O-N 3.47Å; A179-L182 VanDerWaalsContact O-N 3.07Å; A179-A183 PolarHBondContact O-N 2.9Å
180	S	88.6	Confident	91.4	Very high	74 Å²	74	39 Å²	39	52%	0.517	20%	0.202	S	C	.	.	H	α-helix	trans	-55.5	-44.5	-173	54.5	0	0	0	0	113.8	L182 A183 D184	S180-L182 VanDerWaalsContact C-N 3.31Å; S180-L182 PolarHBondContact O-N 3.45Å; S180-A183 WeakPolarHBondContact O-CB 3.29Å; S180-A183 PolarHBondContact O-N 3.09Å; S180-D184 VanDerWaalsContact O-CG 3.3Å; S180-D184 PolarHBondContact O-N 3.39Å
181	K	91.8	Very high	91.4	Very high	168 Å²	168	39 Å²	39	73%	0.73	20%	0.202	S	C	*	.	H	α-helix	trans	-60.5	-40.7	178.7	-66.8	-176.1	178	-178.2	0	112.5	A179 H185	A179-K181 PolarHBondContact O-N 2.83Å; K181-H185 PolarHBondContact O-N 3.31Å
182	L	91.7	Very high	91.3	Very high	10 Å²	10	38 Å²	38	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-73.9	-37	178.3	-177	60.2	0	0	0	110.9	V178 A179 S180 D184 H185 L186 M220 I409	V178-L182 HydrophobicContact CB-CD2 4.27Å; V178-L182 HydrophobicContact CG1-CD2 4.37Å; A179-L182 PolarHBondContact O-N 3.47Å; A179-L182 VanDerWaalsContact O-N 3.07Å; S180-L182 VanDerWaalsContact C-N 3.31Å; S180-L182 PolarHBondContact O-N 3.45Å; L182-D184 VanDerWaalsContact C-N 3.32Å; L182-D184 PolarHBondContact O-N 3.44Å; L182-H185 PolarHBondContact O-N 2.94Å; L182-L186 HydrophobicContact CD1-CD1 4.24Å; L182-L186 HydrophobicContact CD1-CG 4.13Å; L182-L186 HydrophobicContact CD2-CD1 4.46Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.22Å; L182-L186 WeakPolarHBondContact O-CB 3.43Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.35Å; L182-L186 PolarHBondContact O-N 3.48Å; L182-M220 HydrophobicContact CB-SD 4.44Å; L182-M220 HydrophobicContact CD1-SD 4Å; L182-I409 HydrophobicContact CD2-CD1 3.84Å; L182-I409 HydrophobicContact CD2-CG1 3.84Å
183	A	90.9	Very high	91.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.3	-45	174.9	0	0	0	0	0	111.5	L174 R175 V178 A179 S180 H185 L186 T187	L174-A183 HydrophobicContact CB-CB 3.97Å; R175-A183 HydrophobicContact CG-CB 3.69Å; V178-A183 HydrophobicContact CG2-CB 3.86Å; A179-A183 PolarHBondContact O-N 2.9Å; S180-A183 WeakPolarHBondContact O-CB 3.29Å; S180-A183 PolarHBondContact O-N 3.09Å; A183-H185 PolarHBondContact O-N 3.46Å; A183-L186 PolarHBondContact O-N 3.26Å; A183-T187 WeakPolarHBondContact O-CB 3.48Å; A183-T187 PolarHBondContact O-N 3.02Å; A183-T187 PolarHBondContact O-OG1 3.13Å
184	D	92.5	Very high	91.4	Very high	66 Å²	66	36.7 Å²	36.7	35%	0.353	19%	0.193	S	C	.	.	H	α-helix	trans	-64	-40.8	-179.1	-63	-28.3	0	0	0	111.1	R171 R175 S180 L182 T187	R171-D184 IonicContact NE-OD1 3.58Å; R175-D184 IonicContact CZ-OD1 3.11Å; R175-D184 IonicContact NE-OD1 2.79Å; R175-D184 PolarHBondContact NE-OD1 3.26Å; R175-D184 IonicContact NH2-OD1 3.16Å; R175-D184 PolarHBondContact NH2-OD1 2.85Å; R175-D184 IonicContact NH2-OD2 3.33Å; S180-D184 VanDerWaalsContact O-CG 3.3Å; S180-D184 PolarHBondContact O-N 3.39Å; L182-D184 VanDerWaalsContact C-N 3.32Å; L182-D184 PolarHBondContact O-N 3.44Å; D184-T187 WeakPolarHBondContact O-CB 3.37Å; D184-T187 PolarHBondContact O-N 3.25Å
185	H	93.1	Very high	91.1	Very high	60 Å²	60	39.7 Å²	39.7	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-65.4	-46.2	174.3	-174.8	66.2	0	0	0	112.9	K181 L182 A183 T187 M220 T222	K181-H185 PolarHBondContact O-N 3.31Å; L182-H185 PolarHBondContact O-N 2.94Å; A183-H185 PolarHBondContact O-N 3.46Å; H185-T187 VanDerWaalsContact C-N 3.25Å; H185-T187 PolarHBondContact O-N 2.98Å; H185-M220 HydrophobicContact CB-CE 4.04Å; H185-M220 PolarHBondContact CD2-O 2.85Å; H185-M220 PolarHBondContact NE2-O 3.17Å; H185-T222 PolarHBondContact CD2-OG1 3.22Å; H185-T222 VanDerWaalsContact CD2-OG1 3.25Å; H185-T222 PolarHBondContact NE2-O 2.82Å; H185-T222 PolarHBondContact NE2-OG1 3.48Å
186	L	93.9	Very high	90.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67	-26.8	178.2	-69.6	176.6	0	0	0	112.7	L174 V178 L182 A183 E188 I189 V190 T222 I409 I413	L174-L186 HydrophobicContact CD1-CB 3.83Å; L174-L186 HydrophobicContact CD2-CB 4.47Å; V178-L186 HydrophobicContact CG2-CD1 4.31Å; L182-L186 HydrophobicContact CD1-CD1 4.24Å; L182-L186 HydrophobicContact CD1-CG 4.13Å; L182-L186 HydrophobicContact CD2-CD1 4.46Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.22Å; L182-L186 WeakPolarHBondContact O-CB 3.43Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.35Å; L182-L186 PolarHBondContact O-N 3.48Å; A183-L186 PolarHBondContact O-N 3.26Å; L186-E188 VanDerWaalsContact C-N 3.35Å; L186-E188 PolarHBondContact O-N 3.31Å; L186-I189 HydrophobicContact CD2-CD1 4.41Å; L186-I189 PolarHBondContact O-N 3.39Å; L186-V190 WeakPolarHBondContact O-CB 3.44Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.44Å; L186-V190 PolarHBondContact O-N 2.87Å; L186-T222 HydrophobicContact CD2-CG2 4.37Å; L186-I409 HydrophobicContact CD1-CG2 4.03Å; L186-I409 HydrophobicContact CD2-CG2 4.34Å; L186-I413 HydrophobicContact CD1-CG1 4.45Å; L186-I413 HydrophobicContact CD2-CD1 4.03Å; L186-I413 HydrophobicContact CD2-CG1 4.2Å
187	T	93.4	Very high	90.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-46.4	180	-65.4	0	0	0	0	111	M167 A170 R171 A183 D184 H185 V191	M167-T187 HydrophobicContact CB-CG2 3.9Å; M167-T187 HydrophobicContact CE-CG2 4.47Å; M167-T187 HydrophobicContact CG-CG2 4.26Å; M167-T187 WeakPolarHBondContact O-CG2 3.28Å; A170-T187 HydrophobicContact CB-CG2 4.04Å; R171-T187 WeakPolarHBondContact CA-OG1 3.48Å; R171-T187 HydrophobicContact CB-CG2 4.06Å; A183-T187 WeakPolarHBondContact O-CB 3.48Å; A183-T187 PolarHBondContact O-N 3.02Å; A183-T187 PolarHBondContact O-OG1 3.13Å; D184-T187 WeakPolarHBondContact O-CB 3.37Å; D184-T187 PolarHBondContact O-N 3.25Å; H185-T187 VanDerWaalsContact C-N 3.25Å; H185-T187 PolarHBondContact O-N 2.98Å; T187-V191 WeakPolarHBondContact O-CG2 3.35Å; T187-V191 PolarHBondContact O-N 3.34Å; T187-V191 VanDerWaalsContact O-N 3.13Å
188	E	92.9	Very high	90.3	Very high	100 Å²	100	39 Å²	39	47%	0.467	21%	0.211	S	C	.	.	H	α-helix	trans	-63.2	-45.6	178.9	-66.6	-176.3	176.5	0	0	111.3	M167 L186 V190 V191 D192	M167-E188 HydrophobicContact CE-CG 3.81Å; L186-E188 VanDerWaalsContact C-N 3.35Å; L186-E188 PolarHBondContact O-N 3.31Å; E188-V190 PolarHBondContact O-N 3.44Å; E188-V191 PolarHBondContact O-N 2.92Å; E188-D192 VanDerWaalsContact O-CB 3.31Å; E188-D192 WeakPolarHBondContact O-CB 3.5Å; E188-D192 VanDerWaalsContact O-CG 3.28Å; E188-D192 PolarHBondContact O-N 3.37Å
189	I	94.2	Very high	89.7	Confident	12 Å²	12	41.9 Å²	41.9	6%	0.062	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-46.9	179.6	-66.4	172.2	0	0	0	111.4	L186 A193 T222 L224 I396	L186-I189 HydrophobicContact CD2-CD1 4.41Å; L186-I189 PolarHBondContact O-N 3.39Å; I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 3.09Å; I189-T222 VanDerWaalsContact CD1-O 3.25Å; I189-T222 WeakPolarHBondContact CD1-O 3.12Å; I189-L224 HydrophobicContact CB-CB 4.47Å; I189-L224 HydrophobicContact CG1-CB 4.4Å; I189-L224 HydrophobicContact CG2-CB 4.02Å; I189-I396 HydrophobicContact CG2-CB 4.42Å; I189-I396 HydrophobicContact CG2-CD1 4.15Å; I189-I396 HydrophobicContact CG2-CG1 3.93Å; I189-I396 HydrophobicContact CG2-CG2 3.77Å
190	V	93.7	Very high	88.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.2	-45.6	-177.6	168	0	0	0	0	110.9	A170 L174 L186 E188 A193 V194 I413 L417 V420	A170-V190 HydrophobicContact CB-CG1 4.41Å; L174-V190 HydrophobicContact CD1-CG2 4.36Å; L186-V190 WeakPolarHBondContact O-CB 3.44Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.44Å; L186-V190 PolarHBondContact O-N 2.87Å; E188-V190 PolarHBondContact O-N 3.44Å; V190-A193 PolarHBondContact O-N 2.72Å; V190-V194 WeakPolarHBondContact O-CG2 3.33Å; V190-V194 PolarHBondContact O-N 3.26Å; V190-V194 VanDerWaalsContact O-N 3.11Å; V190-I413 HydrophobicContact CG2-CG1 4.48Å; V190-I413 HydrophobicContact CG2-CG2 4.34Å; V190-L417 HydrophobicContact CG1-CD2 3.99Å; V190-L417 HydrophobicContact CG1-CG 4.27Å; V190-V420 HydrophobicContact CG1-CG2 4.07Å
191	V	92.4	Very high	87.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-47	-179.5	173.3	0	0	0	0	110.9	R163 L166 M167 A170 T187 E188 A193 V194 L195 V420	R163-V191 HydrophobicContact CG-CG1 4.08Å; L166-V191 HydrophobicContact CB-CG1 3.96Å; L166-V191 HydrophobicContact CB-CG2 4.15Å; L166-V191 WeakPolarHBondContact O-CG2 3.31Å; M167-V191 HydrophobicContact CG-CB 4.35Å; M167-V191 HydrophobicContact CG-CG1 4.29Å; M167-V191 HydrophobicContact CG-CG2 4.01Å; A170-V191 HydrophobicContact CB-CG2 3.83Å; T187-V191 WeakPolarHBondContact O-CG2 3.35Å; T187-V191 PolarHBondContact O-N 3.34Å; T187-V191 VanDerWaalsContact O-N 3.13Å; E188-V191 PolarHBondContact O-N 2.92Å; V191-A193 VanDerWaalsContact C-N 3.26Å; V191-A193 PolarHBondContact O-N 2.82Å; V191-V194 PolarHBondContact O-N 2.91Å; V191-L195 HydrophobicContact CG1-CD1 3.76Å; V191-L195 HydrophobicContact CG1-CG 4.27Å; V191-L195 WeakPolarHBondContact O-CB 3.03Å; V191-L195 VanDerWaalsContact O-CG 3.31Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 3.4Å; V191-V420 HydrophobicContact CG2-CG2 4.42Å
192	D	91.2	Very high	87.2	Confident	37 Å²	37	45.7 Å²	45.7	20%	0.198	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-32.6	179.4	-70.9	-8.3	0	0	0	111.6	R163 E188 S196 L224	R163-D192 IonicContact CZ-OD1 3.44Å; R163-D192 IonicContact NE-OD1 3.72Å; R163-D192 PolarHBondContact NE-OD1 3.04Å; R163-D192 VanDerWaalsContact NE-OD1 3.1Å; R163-D192 IonicContact NH2-OD1 3.83Å; R163-D192 PolarHBondContact NH2-OD1 3.4Å; R163-D192 IonicContact NH2-OD2 2.69Å; R163-D192 PolarHBondContact NH2-OD2 3.4Å; E188-D192 VanDerWaalsContact O-CB 3.31Å; E188-D192 WeakPolarHBondContact O-CB 3.5Å; E188-D192 VanDerWaalsContact O-CG 3.28Å; E188-D192 PolarHBondContact O-N 3.37Å; D192-S196 WeakPolarHBondContact O-CB 3.33Å; D192-S196 PolarHBondContact O-N 3.07Å; D192-S196 VanDerWaalsContact O-N 3.09Å; D192-S196 PolarHBondContact O-OG 3.41Å; D192-L224 HydrophobicContact CB-CD2 3.44Å; D192-L224 VanDerWaalsContact CB-CD2 3.44Å
193	A	91.7	Very high	86.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-46.2	174.2	0	0	0	0	0	112.3	I189 V190 V191 S196 I197 L224 V394 I396 L417	I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 3.09Å; V190-A193 PolarHBondContact O-N 2.72Å; V191-A193 VanDerWaalsContact C-N 3.26Å; V191-A193 PolarHBondContact O-N 2.82Å; A193-S196 PolarHBondContact O-N 3.02Å; A193-I197 PolarHBondContact O-N 3.01Å; A193-L224 HydrophobicContact CB-CD1 3.74Å; A193-L224 HydrophobicContact CB-CD2 4.45Å; A193-V394 HydrophobicContact CB-CG2 3.92Å; A193-I396 HydrophobicContact CB-CD1 3.96Å; A193-I396 HydrophobicContact CB-CG1 4.22Å; A193-L417 HydrophobicContact CB-CD2 4.36Å
194	V	89.9	Confident	86	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-42	-179.5	177.8	0	0	0	0	111.1	V190 V191 S196 I197 Q198 L204 L417 V420 L424	V190-V194 WeakPolarHBondContact O-CG2 3.33Å; V190-V194 PolarHBondContact O-N 3.26Å; V190-V194 VanDerWaalsContact O-N 3.11Å; V191-V194 PolarHBondContact O-N 2.91Å; V194-S196 VanDerWaalsContact C-N 3.27Å; V194-S196 PolarHBondContact O-N 3.26Å; V194-I197 PolarHBondContact O-N 3.12Å; V194-Q198 PolarHBondContact O-N 3.34Å; V194-Q198 VanDerWaalsContact O-N 3.16Å; V194-L204 HydrophobicContact CG1-CD2 3.51Å; V194-L417 HydrophobicContact CG2-CD2 3.53Å; V194-V420 HydrophobicContact CB-CG1 3.93Å; V194-V420 HydrophobicContact CG1-CG1 3.82Å; V194-V420 HydrophobicContact CG2-CB 4.21Å; V194-V420 HydrophobicContact CG2-CG1 4.01Å; V194-L424 HydrophobicContact CG1-CD1 3.52Å
195	L	87.4	Confident	85.6	Confident	62 Å²	62	51.8 Å²	51.8	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-35.2	176.3	-71.3	174.4	0	0	0	112.2	R163 L166 V191 I197 Q198	R163-L195 HydrophobicContact CG-CD1 4.17Å; L166-L195 HydrophobicContact CD1-CD2 3.94Å; L166-L195 HydrophobicContact CD1-CG 4.49Å; V191-L195 HydrophobicContact CG1-CD1 3.76Å; V191-L195 HydrophobicContact CG1-CG 4.27Å; V191-L195 WeakPolarHBondContact O-CB 3.03Å; V191-L195 VanDerWaalsContact O-CG 3.31Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 3.4Å; L195-I197 VanDerWaalsContact C-N 3.29Å; L195-I197 PolarHBondContact O-N 3.35Å; L195-Q198 PolarHBondContact O-N 3.01Å
196	S	85.2	Confident	85.3	Confident	35 Å²	35	50.6 Å²	50.6	25%	0.245	28%	0.278	C	S	.	.	H	α-helix	trans	-68.8	-26.3	178.2	-58.7	0	0	0	0	113.4	D192 A193 V194	D192-S196 WeakPolarHBondContact O-CB 3.33Å; D192-S196 PolarHBondContact O-N 3.07Å; D192-S196 VanDerWaalsContact O-N 3.09Å; D192-S196 PolarHBondContact O-OG 3.41Å; A193-S196 PolarHBondContact O-N 3.02Å; V194-S196 VanDerWaalsContact C-N 3.27Å; V194-S196 PolarHBondContact O-N 3.26Å
197	I	84	Confident	84.9	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-90	-22.1	-179.1	-68.5	165.5	0	0	0	111.7	A193 V194 L195 R199 M208 V209 V394	A193-I197 PolarHBondContact O-N 3.01Å; V194-I197 PolarHBondContact O-N 3.12Å; L195-I197 VanDerWaalsContact C-N 3.29Å; L195-I197 PolarHBondContact O-N 3.35Å; I197-R199 PolarHBondContact O-N 2.89Å; I197-R199 VanDerWaalsContact O-N 3.17Å; I197-M208 HydrophobicContact CD1-CB 3.94Å; I197-M208 HydrophobicContact CG1-CB 4.11Å; I197-M208 HydrophobicContact CG2-CB 4.06Å; I197-V209 HydrophobicContact CD1-CB 4.11Å; I197-V209 HydrophobicContact CD1-CG2 3.08Å; I197-V394 HydrophobicContact CD1-CG2 3.91Å; I197-V394 HydrophobicContact CG1-CG2 4.19Å
198	Q	79.7	Confident	84.5	Confident	92 Å²	92	58.9 Å²	58.9	43%	0.43	32%	0.317	S	S	.	.			trans	-59.1	121.1	-175.7	-171.2	174.4	8.7	0	0	111	V194 L195 L204	V194-Q198 PolarHBondContact O-N 3.34Å; V194-Q198 VanDerWaalsContact O-N 3.16Å; L195-Q198 PolarHBondContact O-N 3.01Å; Q198-L204 HydrophobicContact CB-CD2 4.39Å
199	R	76.5	Confident	84.4	Confident	75 Å²	75	54.4 Å²	54.4	28%	0.283	30%	0.296	S	S	.	.			trans	-113	139.1	168.7	-67.3	174.4	-173.6	-179.2	11.1	108.4	I197 G201 E202 L348	I197-R199 PolarHBondContact O-N 2.89Å; I197-R199 VanDerWaalsContact O-N 3.17Å; R199-G201 PolarHBondContact O-N 3.49Å; R199-E202 HydrophobicContact CB-CB 4.26Å; R199-E202 WeakPolarHBondContact CD-OE2 3.28Å; R199-E202 IonicContact CZ-OE2 3.72Å; R199-E202 IonicContact NE-OE2 3.67Å; R199-E202 IonicContact NH1-OE1 3.82Å; R199-E202 IonicContact NH1-OE2 2.75Å; R199-E202 PolarHBondContact NH1-OE2 3.36Å; R199-E202 PolarHBondContact O-N 3.41Å; R199-L348 VanDerWaalsContact NH2-CD2 3.31Å
200	E	71.9	Confident	84.4	Confident	200 Å²	200	54.1 Å²	54.1	94%	0.935	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	120.6	174.7	-62	-174.4	168.6	0	0	109.6	E202	E200-E202 PolarHBondContact O-N 3.06Å
201	G	69	Low	84.4	Confident	88 Å²	88	55 Å²	55	91%	0.907	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-7.6	174.1	0	0	0	0	0	117.1	R199	R199-G201 PolarHBondContact O-N 3.49Å
202	E	75.7	Confident	84.4	Confident	106 Å²	106	55.7 Å²	55.7	50%	0.495	30%	0.303	S	S	.	.	S	Bend	trans	-102.5	143.6	175	-70.7	-175.9	170.1	0	0	111.5	R199 E200 L204	R199-E202 HydrophobicContact CB-CB 4.26Å; R199-E202 WeakPolarHBondContact CD-OE2 3.28Å; R199-E202 IonicContact CZ-OE2 3.72Å; R199-E202 IonicContact NE-OE2 3.67Å; R199-E202 IonicContact NH1-OE1 3.82Å; R199-E202 IonicContact NH1-OE2 2.75Å; R199-E202 PolarHBondContact NH1-OE2 3.36Å; R199-E202 PolarHBondContact O-N 3.41Å; E200-E202 PolarHBondContact O-N 3.06Å; E202-L204 PolarHBondContact O-N 3.39Å
203	P	78.1	Confident	84.5	Confident	119 Å²	119	56.8 Å²	56.8	77%	0.773	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-63.2	133.3	173.8	27.5	-33.5	0	0	0	109.8	D205	P203-D205 PolarHBondContact O-N 3.35Å; P203-D205 VanDerWaalsContact O-N 3.13Å
204	L	80.7	Confident	84.5	Confident	21 Å²	21	57 Å²	57	11%	0.11	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-62	117.7	177.7	-76.8	100.1	0	0	0	111	V194 Q198 E202 K421 L424	V194-L204 HydrophobicContact CG1-CD2 3.51Å; Q198-L204 HydrophobicContact CB-CD2 4.39Å; E202-L204 PolarHBondContact O-N 3.39Å; L204-K421 HydrophobicContact CB-CD 4.39Å; L204-K421 HydrophobicContact CB-CG 4.32Å; L204-K421 VanDerWaalsContact O-CE 3.31Å; L204-K421 WeakPolarHBondContact O-CE 3.47Å; L204-K421 PolarHBondContact O-NZ 3.02Å; L204-L424 HydrophobicContact CD1-CB 4.2Å; L204-L424 HydrophobicContact CD1-CD1 4.02Å; L204-L424 HydrophobicContact CD2-CD1 3.62Å; L204-L424 HydrophobicContact CG-CD1 4.5Å
205	D	83.9	Confident	84.5	Confident	64 Å²	64	61.6 Å²	61.6	34%	0.342	33%	0.329	S	S	.	.			trans	-97	113.9	173.1	-171.9	5.9	0	0	0	111.1	P203 H207 M208	P203-D205 PolarHBondContact O-N 3.35Å; P203-D205 VanDerWaalsContact O-N 3.13Å; D205-H207 PolarHBondContact O-N 3.47Å; D205-H207 WeakPolarHBondContact OD1-CB 3.3Å; D205-H207 IonicContact OD1-CD2 2.56Å; D205-H207 PolarHBondContact OD1-CD2 3.44Å; D205-H207 IonicContact OD1-CG 3.57Å; D205-H207 PolarHBondContact OD1-N 2.75Å; D205-H207 IonicContact OD2-CD2 3.64Å; D205-M208 HydrophobicContact CB-CG 4.31Å; D205-M208 PolarHBondContact O-N 3.04Å; D205-M208 WeakPolarHBondContact OD2-CE 3.34Å
206	L	85.3	Confident	84.6	Confident	36 Å²	36	61.9 Å²	61.9	19%	0.188	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-72.7	-14.8	179.1	-63.8	178.7	0	0	0	112.4	M208 V209 L417 R418 K421	L206-M208 PolarHBondContact O-N 2.98Å; L206-V209 PolarHBondContact O-N 3.19Å; L206-V209 VanDerWaalsContact O-N 3.09Å; L206-L417 HydrophobicContact CD2-CB 4.16Å; L206-R418 HydrophobicContact CD1-CB 4.48Å; L206-R418 HydrophobicContact CD1-CG 3.56Å; L206-K421 HydrophobicContact CD1-CD 3.85Å; L206-K421 HydrophobicContact CD2-CB 4.27Å; L206-K421 HydrophobicContact CD2-CD 4.13Å; L206-K421 HydrophobicContact CG-CD 3.77Å
207	H	86.5	Confident	84.6	Confident	138 Å²	138	68.7 Å²	68.7	64%	0.639	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-63.8	-21	175.3	-67.6	-60.5	0	0	0	112.8	D205 V209 R345	D205-H207 PolarHBondContact O-N 3.47Å; D205-H207 WeakPolarHBondContact OD1-CB 3.3Å; D205-H207 IonicContact OD1-CD2 2.56Å; D205-H207 PolarHBondContact OD1-CD2 3.44Å; D205-H207 IonicContact OD1-CG 3.57Å; D205-H207 PolarHBondContact OD1-N 2.75Å; D205-H207 IonicContact OD2-CD2 3.64Å; H207-V209 VanDerWaalsContact C-N 3.27Å; H207-V209 PolarHBondContact O-N 2.93Å; H207-R345 PolarHBondContact O-NE 3.32Å; H207-R345 PolarHBondContact O-NH2 3.48Å
208	M	85.3	Confident	84.9	Confident	36 Å²	36	69.9 Å²	69.9	18%	0.177	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-74.3	-16.3	176.1	-55.9	-53.2	155.7	0	0	113.3	I197 D205 L206 L348 S393 V394	I197-M208 HydrophobicContact CD1-CB 3.94Å; I197-M208 HydrophobicContact CG1-CB 4.11Å; I197-M208 HydrophobicContact CG2-CB 4.06Å; D205-M208 HydrophobicContact CB-CG 4.31Å; D205-M208 PolarHBondContact O-N 3.04Å; D205-M208 WeakPolarHBondContact OD2-CE 3.34Å; L206-M208 PolarHBondContact O-N 2.98Å; M208-L348 HydrophobicContact CE-CD1 3.79Å; M208-L348 HydrophobicContact CG-CD1 4.43Å; M208-L348 HydrophobicContact SD-CD1 3.29Å; M208-L348 WeakPolarHBondContact SD-CD1 3.19Å; M208-S393 WeakPolarHBondContact O-CA 3.42Å; M208-S393 WeakPolarHBondContact O-CB 3.31Å; M208-S393 PolarHBondContact O-OG 3.34Å; M208-V394 PolarHBondContact O-N 2.97Å
209	V	91	Very high	85.3	Confident	6 Å²	6	68.9 Å²	68.9	4%	0.036	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.2	164.1	-170.3	0	0	0	0	108.1	I197 L206 H207 I211 V394 I396 L417	I197-V209 HydrophobicContact CD1-CB 4.11Å; I197-V209 HydrophobicContact CD1-CG2 3.08Å; L206-V209 PolarHBondContact O-N 3.19Å; L206-V209 VanDerWaalsContact O-N 3.09Å; H207-V209 VanDerWaalsContact C-N 3.27Å; H207-V209 PolarHBondContact O-N 2.93Å; V209-I211 HydrophobicContact CG1-CG1 4.39Å; V209-V394 CarbonylContact C-O 3.5Å; V209-V394 WeakPolarHBondContact CA-O 3.44Å; V209-V394 HydrophobicContact CG2-CG2 4.42Å; V209-I396 HydrophobicContact CG1-CD1 3.65Å; V209-I396 HydrophobicContact CG1-CG1 3.83Å; V209-L417 HydrophobicContact CB-CD1 4.26Å; V209-L417 HydrophobicContact CG1-CD1 3.99Å; V209-L417 HydrophobicContact CG2-CD1 4.25Å; V209-L417 HydrophobicContact CG2-CD2 4.13Å
210	E	92.8	Very high	85.9	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.028	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.1	166	-174.5	154.6	-166.8	0	0	109.8	M212 L228 N342 R345 V394 T395 I396	E210-M212 HydrophobicContact CG-CG 3.9Å; E210-M212 HydrophobicContact CG-SD 4.09Å; E210-L228 HydrophobicContact CB-CD1 4.25Å; E210-L228 WeakPolarHBondContact OE2-CD1 3.26Å; E210-N342 PolarHBondContact OE1-ND2 3.07Å; E210-N342 PolarHBondContact OE1-OD1 3.35Å; E210-N342 PolarHBondContact OE2-OD1 3.18Å; E210-R345 VanDerWaalsContact CB-NH1 3.33Å; E210-R345 IonicContact OE1-NH1 3.1Å; E210-R345 PolarHBondContact OE1-NH1 3.06Å; E210-R345 WeakPolarHBondContact OE2-CD 3.5Å; E210-R345 IonicContact OE2-CZ 2.75Å; E210-R345 IonicContact OE2-NH1 3.67Å; E210-R345 PolarHBondContact OE2-NH1 3.48Å; E210-V394 PolarHBondContact N-O 3.15Å; E210-T395 HydrophobicContact CB-CG2 4.02Å; E210-T395 HydrophobicContact CG-CG2 4.1Å; E210-T395 CarbonylContact O-C 3.58Å; E210-T395 VanDerWaalsContact O-CA 3.29Å; E210-T395 WeakPolarHBondContact O-CA 3.39Å; E210-I396 PolarHBondContact O-N 2.66Å
211	I	93.9	Very high	86.8	Confident	19 Å²	19	63.1 Å²	63.1	10%	0.097	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	112.6	172.2	-57.2	-177.8	0	0	0	106.8	V209 I396 I398 K410 I413 Y414 L417	V209-I211 HydrophobicContact CG1-CG1 4.39Å; I211-I396 WeakPolarHBondContact CA-O 3.29Å; I211-I398 HydrophobicContact CG2-CD1 3.35Å; I211-I398 HydrophobicContact CG2-CG1 4Å; I211-K410 HydrophobicContact CG2-CG 4.19Å; I211-I413 HydrophobicContact CD1-CG2 3.81Å; I211-Y414 HydrophobicContact CD1-CD1 3.98Å; I211-Y414 HydrophobicContact CD1-CD2 4.08Å; I211-Y414 HydrophobicContact CD1-CE1 3.66Å; I211-Y414 HydrophobicContact CD1-CE2 3.78Å; I211-Y414 HydrophobicContact CD1-CG 4.17Å; I211-L417 HydrophobicContact CD1-CD1 4.3Å
212	M	93.1	Very high	87.8	Confident	14 Å²	14	59 Å²	59	7%	0.069	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	145.8	178.8	-74.7	-52.7	-71.3	0	0	111	E210 V229 D231 F382 T395 I396 L397 I398	E210-M212 HydrophobicContact CG-CG 3.9Å; E210-M212 HydrophobicContact CG-SD 4.09Å; M212-V229 HydrophobicContact CG-CB 4.12Å; M212-V229 HydrophobicContact CG-CG1 4.49Å; M212-D231 HydrophobicContact CE-CB 3.76Å; M212-F382 HydrophobicContact CE-CE1 4.3Å; M212-T395 HydrophobicContact CB-CG2 4.03Å; M212-T395 HydrophobicContact CG-CG2 3.72Å; M212-I396 PolarHBondContact N-O 3.35Å; M212-L397 HydrophobicContact CB-CD1 3.71Å; M212-I398 PolarHBondContact O-N 3.37Å
213	E	93.1	Very high	88.6	Confident	61 Å²	61	55.9 Å²	55.9	29%	0.285	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	129.6	-177.4	-52.7	176.9	-142.8	0	0	108.4	Q403 I406 K410	E213-Q403 PolarHBondContact OE2-NE2 2.81Å; E213-I406 HydrophobicContact CB-CG2 3.97Å; E213-I406 HydrophobicContact CG-CG2 3.89Å; E213-K410 IonicContact OE1-NZ 2.7Å; E213-K410 PolarHBondContact OE1-NZ 3.46Å
214	M	91	Very high	89.3	Confident	4 Å²	4	52 Å²	52	2%	0.02	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126	172.3	-81.3	-177.3	69.9	0	0	110	H216 L377 F382 F384 L397 I398 K399 G400	M214-H216 PolarHBondContact O-N 3.01Å; M214-L377 HydrophobicContact CE-CB 4.25Å; M214-L377 HydrophobicContact CE-CD2 3.81Å; M214-F382 HydrophobicContact CE-CD2 3.65Å; M214-F382 HydrophobicContact CE-CE2 3.89Å; M214-F382 HydrophobicContact CE-CG 4.26Å; M214-F382 HydrophobicContact CG-CD1 4.22Å; M214-F382 HydrophobicContact CG-CD2 4.14Å; M214-F382 HydrophobicContact CG-CE1 3.84Å; M214-F382 HydrophobicContact CG-CE2 3.77Å; M214-F382 HydrophobicContact CG-CG 4.36Å; M214-F382 HydrophobicContact CG-CZ 3.6Å; M214-F382 HydrophobicContact SD-CD1 4.23Å; M214-F382 HydrophobicContact SD-CD2 3.88Å; M214-F382 HydrophobicContact SD-CE1 4.45Å; M214-F382 HydrophobicContact SD-CE2 4.12Å; M214-F382 HydrophobicContact SD-CG 3.94Å; M214-F382 HydrophobicContact SD-CZ 4.4Å; M214-F384 HydrophobicContact SD-CZ 4.09Å; M214-L397 HydrophobicContact CB-CD1 4.25Å; M214-L397 HydrophobicContact CG-CD1 3.73Å; M214-L397 HydrophobicContact SD-CD1 3.6Å; M214-L397 HydrophobicContact SD-CD2 3.66Å; M214-L397 HydrophobicContact SD-CG 4.12Å; M214-I398 PolarHBondContact N-O 3.4Å; M214-K399 HydrophobicContact CB-CG 4.15Å; M214-K399 WeakPolarHBondContact O-CA 3.48Å; M214-G400 PolarHBondContact O-N 2.87Å
215	H	91.1	Very high	89.9	Confident	99 Å²	99	51.4 Å²	51.4	46%	0.458	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	110.1	175.6	-71.3	86.8	0	0	0	109.8	L377 G400 Q403	H215-L377 WeakPolarHBondContact O-CD2 3.16Å; H215-G400 WeakPolarHBondContact CA-O 3.31Å; H215-Q403 PolarHBondContact CE1-OE1 2.68Å; H215-Q403 PolarHBondContact NE2-OE1 2.89Å
216	H	88.9	Confident	90.1	Very high	67 Å²	67	55.7 Å²	55.7	31%	0.31	27%	0.271	S	S	.	.			trans	-145.3	164.2	-177.2	-157.1	54.6	0	0	0	111.7	M214 S218 D221 K399 G400 P401	M214-H216 PolarHBondContact O-N 3.01Å; H216-S218 VanDerWaalsContact C-N 3.32Å; H216-S218 PolarHBondContact O-N 2.86Å; H216-D221 IonicContact CD2-OD2 3.65Å; H216-D221 PolarHBondContact CD2-OD2 3.2Å; H216-D221 IonicContact NE2-OD2 2.85Å; H216-K399 HydrophobicContact CB-CB 3.99Å; H216-K399 HydrophobicContact CB-CD 4.27Å; H216-K399 HydrophobicContact CB-CG 4.2Å; H216-G400 PolarHBondContact N-O 3.35Å; H216-G400 CarbonylContact O-C 3.56Å; H216-P401 WeakPolarHBondContact O-CA 3.34Å
217	Q	86	Confident	90.3	Very high	179 Å²	179	54 Å²	54	84%	0.836	26%	0.262	S	S	*	.	S	Bend	trans	-66.8	-31.1	-171.4	-65.4	-179.4	-4.4	0	0	114.1
218	S	89.1	Confident	90.5	Very high	38 Å²	38	47.4 Å²	47.4	27%	0.266	23%	0.231	S	C	.	.			trans	-116.7	137.5	-171.8	175.3	0	0	0	0	112.3	H216 M220 D221 K399	H216-S218 VanDerWaalsContact C-N 3.32Å; H216-S218 PolarHBondContact O-N 2.86Å; S218-M220 PolarHBondContact OG-N 3.09Å; S218-D221 PolarHBondContact OG-OD1 3.07Å; S218-K399 CarbonylContact O-C 3.55Å
219	E	87.6	Confident	90.9	Very high	70 Å²	70	45.7 Å²	45.7	33%	0.327	22%	0.223	S	C	.	.	S	Bend	trans	-77.3	-23.9	172.3	-46.7	-176.8	-163.5	0	0	112.1	D221 T222 K399 P401 I409	E219-D221 PolarHBondContact O-N 3.01Å; E219-T222 VanDerWaalsContact O-CG2 3.22Å; E219-T222 WeakPolarHBondContact O-CG2 3.37Å; E219-K399 WeakPolarHBondContact CA-O 3.32Å; E219-P401 HydrophobicContact CG-CG 4.45Å; E219-I409 HydrophobicContact CB-CD1 4.05Å; E219-I409 HydrophobicContact CG-CD1 4.43Å
220	M	90	Very high	91	Very high	87 Å²	87	45.5 Å²	45.5	43%	0.429	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-11.8	-176.4	-63.1	-62.5	-60.1	0	0	112.7	L182 H185 S218 T222	L182-M220 HydrophobicContact CB-SD 4.44Å; L182-M220 HydrophobicContact CD1-SD 4Å; H185-M220 HydrophobicContact CB-CE 4.04Å; H185-M220 PolarHBondContact CD2-O 2.85Å; H185-M220 PolarHBondContact NE2-O 3.17Å; S218-M220 PolarHBondContact OG-N 3.09Å; M220-T222 PolarHBondContact O-N 3.3Å
221	D	90.1	Very high	90.9	Very high	67 Å²	67	47.4 Å²	47.4	36%	0.358	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	8.8	-176.7	-58.6	-3.6	0	0	0	112.2	H216 S218 E219 A223 K399	H216-D221 IonicContact CD2-OD2 3.65Å; H216-D221 PolarHBondContact CD2-OD2 3.2Å; H216-D221 IonicContact NE2-OD2 2.85Å; S218-D221 PolarHBondContact OG-OD1 3.07Å; E219-D221 PolarHBondContact O-N 3.01Å; D221-A223 PolarHBondContact O-N 3.13Å; D221-K399 HydrophobicContact CB-CB 4.19Å; D221-K399 HydrophobicContact CB-CD 3.67Å; D221-K399 WeakPolarHBondContact O-CD 3.29Å
222	T	91.4	Very high	90.6	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.018	24%	0.239	C	C	.	.			trans	-58.4	133.9	171.9	58.7	0	0	0	0	109.4	H185 L186 I189 E219 M220 L397 I398	H185-T222 PolarHBondContact CD2-OG1 3.22Å; H185-T222 VanDerWaalsContact CD2-OG1 3.25Å; H185-T222 PolarHBondContact NE2-O 2.82Å; H185-T222 PolarHBondContact NE2-OG1 3.48Å; L186-T222 HydrophobicContact CD2-CG2 4.37Å; I189-T222 VanDerWaalsContact CD1-O 3.25Å; I189-T222 WeakPolarHBondContact CD1-O 3.12Å; E219-T222 VanDerWaalsContact O-CG2 3.22Å; E219-T222 WeakPolarHBondContact O-CG2 3.37Å; M220-T222 PolarHBondContact O-N 3.3Å; T222-L397 CarbonylContact C-O 3.58Å; T222-L397 WeakPolarHBondContact CA-O 3.48Å; T222-I398 HydrophobicContact CG2-CB 4.44Å; T222-I398 HydrophobicContact CG2-CG2 4.12Å
223	A	92.4	Very high	90.3	Very high	39 Å²	39	48.7 Å²	48.7	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	147.1	-174.3	0	0	0	0	0	111.7	D221 L397	D221-A223 PolarHBondContact O-N 3.13Å; A223-L397 PolarHBondContact N-O 2.9Å; A223-L397 PolarHBondContact O-N 3.34Å
224	L	93.1	Very high	90	Very high	37 Å²	37	46 Å²	46	19%	0.194	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.2	164.9	-176.8	61.3	0	0	0	109.1	I189 D192 A193 V394 I396	I189-L224 HydrophobicContact CB-CB 4.47Å; I189-L224 HydrophobicContact CG1-CB 4.4Å; I189-L224 HydrophobicContact CG2-CB 4.02Å; D192-L224 HydrophobicContact CB-CD2 3.44Å; D192-L224 VanDerWaalsContact CB-CD2 3.44Å; A193-L224 HydrophobicContact CB-CD1 3.74Å; A193-L224 HydrophobicContact CB-CD2 4.45Å; L224-V394 HydrophobicContact CD1-CB 4.12Å; L224-V394 HydrophobicContact CD1-CG2 4.26Å; L224-I396 HydrophobicContact CD1-CG1 3.96Å
225	I	91.9	Very high	89.7	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.8	177.9	-58.8	170	0	0	0	106.8	G227 V229 F384 E386 T395 L397	I225-G227 PolarHBondContact O-N 2.9Å; I225-V229 HydrophobicContact CB-CG2 4.41Å; I225-V229 HydrophobicContact CD1-CG2 3.26Å; I225-V229 HydrophobicContact CG1-CG2 4.42Å; I225-V229 HydrophobicContact CG2-CG2 4.24Å; I225-F384 HydrophobicContact CD1-CD1 3.68Å; I225-F384 HydrophobicContact CD1-CE1 3.4Å; I225-F384 VanDerWaalsContact CD1-CE1 3.4Å; I225-E386 HydrophobicContact CG2-CG 3.67Å; I225-T395 PolarHBondContact N-O 3.17Å; I225-T395 PolarHBondContact O-N 3.19Å; I225-L397 HydrophobicContact CD1-CB 3.66Å; I225-L397 HydrophobicContact CD1-CD2 3.91Å; I225-L397 HydrophobicContact CD1-CG 4.39Å; I225-L397 HydrophobicContact CG1-CB 4.48Å
226	R	88.2	Confident	89.6	Confident	153 Å²	153	50.1 Å²	50.1	58%	0.577	24%	0.241	S	C	*	.	S	Bend	trans	-77	70.3	178.1	-67.8	-173.9	-178.9	-176.6	0.6	110.1	P391	R226-P391 HydrophobicContact CB-CG 4.24Å
227	G	88.9	Confident	89.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	157.7	-145.8	-177.2	0	0	0	0	0	110.6	I225 I385 V394 T395	I225-G227 PolarHBondContact O-N 2.9Å; G227-I385 CarbonylContact C-O 3.54Å; G227-I385 VanDerWaalsContact CA-O 3.3Å; G227-I385 WeakPolarHBondContact CA-O 3.43Å; G227-V394 CarbonylContact O-C 3.56Å; G227-V394 WeakPolarHBondContact O-CA 3.5Å; G227-T395 PolarHBondContact O-N 2.72Å; G227-T395 PolarHBondContact O-OG1 3.29Å
228	L	92.1	Very high	89.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.6	-171.5	-152.7	72.2	0	0	0	112.4	E210 L230 N342 R345 L346 I385 T395	E210-L228 HydrophobicContact CB-CD1 4.25Å; E210-L228 WeakPolarHBondContact OE2-CD1 3.26Å; L228-L230 HydrophobicContact CD2-CD2 3.7Å; L228-L230 HydrophobicContact CD2-CG 4.48Å; L228-L230 HydrophobicContact CG-CD2 4.32Å; L228-N342 HydrophobicContact CD2-CB 4.02Å; L228-R345 HydrophobicContact CD1-CB 3.83Å; L228-R345 HydrophobicContact CD1-CG 4.5Å; L228-R345 HydrophobicContact CD2-CB 4.27Å; L228-L346 HydrophobicContact CB-CD2 4.37Å; L228-L346 HydrophobicContact CD2-CD1 4.44Å; L228-L346 HydrophobicContact CD2-CD2 3.5Å; L228-L346 VanDerWaalsContact CD2-CD2 3.5Å; L228-L346 HydrophobicContact CD2-CG 3.54Å; L228-I385 PolarHBondContact N-O 3.41Å; L228-I385 WeakPolarHBondContact O-CB 3.27Å; L228-I385 PolarHBondContact O-N 3.32Å; L228-T395 VanDerWaalsContact CA-OG1 3.3Å; L228-T395 WeakPolarHBondContact CA-OG1 3.35Å
229	V	93.2	Very high	89.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.5	166	-175.1	0	0	0	0	109.6	M212 I225 F382 T383 F384 T395	M212-V229 HydrophobicContact CG-CB 4.12Å; M212-V229 HydrophobicContact CG-CG1 4.49Å; I225-V229 HydrophobicContact CB-CG2 4.41Å; I225-V229 HydrophobicContact CD1-CG2 3.26Å; I225-V229 HydrophobicContact CG1-CG2 4.42Å; I225-V229 HydrophobicContact CG2-CG2 4.24Å; V229-F382 HydrophobicContact CG1-CB 4.21Å; V229-F382 HydrophobicContact CG1-CD1 4.25Å; V229-T383 WeakPolarHBondContact CA-O 3.25Å; V229-F384 HydrophobicContact CG1-CD1 4.5Å; V229-F384 HydrophobicContact CG1-CE1 4.26Å; V229-F384 HydrophobicContact CG1-CE2 4.22Å; V229-F384 HydrophobicContact CG1-CZ 4.09Å; V229-F384 HydrophobicContact CG2-CD1 3.67Å; V229-F384 HydrophobicContact CG2-CE1 3.72Å; V229-F384 HydrophobicContact CG2-CG 4.32Å; V229-F384 HydrophobicContact CG2-CZ 4.37Å; V229-T395 HydrophobicContact CB-CG2 3.92Å; V229-T395 HydrophobicContact CG2-CG2 3.88Å; V229-T395 PolarHBondContact N-OG1 3.08Å
230	L	93.1	Very high	89.4	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.8	176.6	-60.2	175.9	0	0	0	109.9	L228 H232 I314 L335 N342 F382 T383 I385	L228-L230 HydrophobicContact CD2-CD2 3.7Å; L228-L230 HydrophobicContact CD2-CG 4.48Å; L228-L230 HydrophobicContact CG-CD2 4.32Å; L230-H232 PolarHBondContact O-N 2.91Å; L230-I314 HydrophobicContact CD1-CD1 4Å; L230-I314 HydrophobicContact CD1-CG2 4.21Å; L230-L335 HydrophobicContact CD1-CD1 3.46Å; L230-L335 VanDerWaalsContact CD1-CD1 3.46Å; L230-N342 HydrophobicContact CD2-CB 3.86Å; L230-N342 WeakPolarHBondContact CD2-ND2 3.06Å; L230-F382 CarbonylContact O-C 3.56Å; L230-F382 VanDerWaalsContact O-CA 3.26Å; L230-F382 WeakPolarHBondContact O-CA 3.43Å; L230-T383 PolarHBondContact N-O 3.46Å; L230-T383 PolarHBondContact O-N 3.48Å; L230-I385 HydrophobicContact CD1-CD1 4.04Å
231	D	90.8	Very high	89.3	Confident	45 Å²	45	50.3 Å²	50.3	24%	0.241	25%	0.247	C	C	.	.	S	Bend	trans	-78.9	15	174.6	60.3	-32.7	0	0	0	113.8	M212 K339 K381	M212-D231 HydrophobicContact CE-CB 3.76Å; D231-K339 VanDerWaalsContact CG-NZ 3.34Å; D231-K339 IonicContact OD1-NZ 3.8Å; D231-K339 WeakPolarHBondContact OD2-CE 3.44Å; D231-K339 IonicContact OD2-NZ 3.96Å; D231-K339 PolarHBondContact OD2-NZ 3.12Å; D231-K381 CarbonylContact C-O 3.59Å
232	H	87.9	Confident	89.3	Confident	50 Å²	50	53.3 Å²	53.3	23%	0.231	26%	0.258	C	S	.	.			trans	-127.1	136.9	178.5	-59	-27.3	0	0	0	109.1	L230 R337 K381 T383	L230-H232 PolarHBondContact O-N 2.91Å; H232-R337 PolarHBondContact CD2-O 3.38Å; H232-R337 VanDerWaalsContact CD2-O 3.29Å; H232-R337 PolarHBondContact NE2-O 3.34Å; H232-K381 CarbonylContact C-O 3.53Å; H232-K381 PolarHBondContact N-O 3.16Å; H232-T383 WeakPolarHBondContact O-CB 3.2Å; H232-T383 PolarHBondContact O-OG1 2.96Å
233	G	85.8	Confident	89.1	Confident	10 Å²	10	53.3 Å²	53.3	10%	0.103	26%	0.258	C	S	.	.			trans	-110	176.3	170.1	0	0	0	0	0	113	R235 E374 K381	G233-R235 PolarHBondContact O-N 3.39Å; G233-E374 VanDerWaalsContact CA-OE2 3.28Å; G233-E374 WeakPolarHBondContact CA-OE2 3.16Å; G233-K381 PolarHBondContact N-O 3.17Å
234	A	87.3	Confident	88.9	Confident	6 Å²	6	60 Å²	60	5%	0.05	28%	0.276	C	S	.	.			trans	-62.6	125.5	169	0	0	0	0	0	109.7	M239 V333 E374 K381	A234-M239 HydrophobicContact CB-CB 3.75Å; A234-M239 HydrophobicContact CB-CG 4.31Å; A234-M239 HydrophobicContact CB-SD 3.7Å; A234-V333 HydrophobicContact CB-CG1 4.37Å; A234-E374 WeakPolarHBondContact CA-OE2 3.44Å; A234-E374 WeakPolarHBondContact CB-OE2 3Å; A234-E374 PolarHBondContact N-OE2 2.97Å; A234-K381 PolarHBondContact O-NZ 3.06Å
235	R	85.2	Confident	88.6	Confident	154 Å²	154	61.7 Å²	61.7	58%	0.581	28%	0.284	S	S	*	.			trans	-87.2	-26.7	-179.9	-70.2	-150.8	-170.7	-158.7	-1.3	113.9	G233 L324 R336	G233-R235 PolarHBondContact O-N 3.39Å; R235-L324 HydrophobicContact CB-CD1 4.39Å; R235-R336 VanDerWaalsContact CD-CZ 3.46Å; R235-R336 VanDerWaalsContact CD-NE 3.31Å; R235-R336 VanDerWaalsContact CD-NH2 3.27Å; R235-R336 VanDerWaalsContact NE-NE 3.12Å
236	H	87.9	Confident	88.4	Confident	34 Å²	34	61.3 Å²	61.3	16%	0.157	28%	0.283	C	S	.	.	S	Bend	trans	-80.5	130.1	177.4	-167.9	-73	0	0	0	109.3	D238 M239 L324 D325 V328	H236-D238 VanDerWaalsContact C-N 3.27Å; H236-D238 IonicContact CE1-OD2 3.81Å; H236-D238 PolarHBondContact CE1-OD2 2.82Å; H236-D238 PolarHBondContact ND1-N 3.3Å; H236-D238 VanDerWaalsContact ND1-N 3.17Å; H236-D238 PolarHBondContact O-N 2.94Å; H236-M239 HydrophobicContact CB-CE 3.98Å; H236-M239 HydrophobicContact CB-CG 4.01Å; H236-M239 HydrophobicContact CB-SD 4.11Å; H236-M239 PolarHBondContact O-N 2.89Å; H236-L324 HydrophobicContact CB-CB 4.32Å; H236-D325 IonicContact CD2-OD1 3.92Å; H236-D325 PolarHBondContact CD2-OD1 3.49Å; H236-D325 IonicContact NE2-OD1 3.6Å; H236-D325 PolarHBondContact NE2-OD1 2.97Å; H236-D325 VanDerWaalsContact NE2-OD1 3.11Å; H236-V328 HydrophobicContact CB-CG2 3.83Å; H236-V328 VanDerWaalsContact CG-CG2 3.42Å; H236-V328 VanDerWaalsContact ND1-CG2 3.33Å; H236-V328 WeakPolarHBondContact ND1-CG2 3.45Å
237	P	86.3	Confident	88.5	Confident	103 Å²	103	56.3 Å²	56.3	67%	0.669	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.3	-174.1	23.6	-34.1	0	0	0	113.2	M239	P237-M239 VanDerWaalsContact C-N 3.28Å; P237-M239 PolarHBondContact O-N 3.39Å
238	D	88.4	Confident	88.6	Confident	119 Å²	119	56.3 Å²	56.3	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	4.3	-177.1	-55.8	-26.8	0	0	0	114.4	H236 V328	H236-D238 VanDerWaalsContact C-N 3.27Å; H236-D238 IonicContact CE1-OD2 3.81Å; H236-D238 PolarHBondContact CE1-OD2 2.82Å; H236-D238 PolarHBondContact ND1-N 3.3Å; H236-D238 VanDerWaalsContact ND1-N 3.17Å; H236-D238 PolarHBondContact O-N 2.94Å; D238-V328 HydrophobicContact CB-CG1 3.69Å
239	M	88.1	Confident	88.7	Confident	11 Å²	11	56.3 Å²	56.3	5%	0.054	26%	0.264	C	S	.	.	S	Bend	trans	-70.4	143.9	172.8	-77.2	-179.5	177.9	0	0	110.8	A234 H236 P237 K241 L324 F327 V328 A334	A234-M239 HydrophobicContact CB-CB 3.75Å; A234-M239 HydrophobicContact CB-CG 4.31Å; A234-M239 HydrophobicContact CB-SD 3.7Å; H236-M239 HydrophobicContact CB-CE 3.98Å; H236-M239 HydrophobicContact CB-CG 4.01Å; H236-M239 HydrophobicContact CB-SD 4.11Å; H236-M239 PolarHBondContact O-N 2.89Å; P237-M239 VanDerWaalsContact C-N 3.28Å; P237-M239 PolarHBondContact O-N 3.39Å; M239-K241 PolarHBondContact O-N 2.87Å; M239-L324 HydrophobicContact CE-CB 4.1Å; M239-L324 HydrophobicContact CE-CD2 3.63Å; M239-L324 HydrophobicContact CE-CG 4.46Å; M239-F327 HydrophobicContact CE-CB 4.22Å; M239-V328 HydrophobicContact CE-CG2 3.78Å; M239-V328 HydrophobicContact CG-CG2 3.62Å; M239-A334 HydrophobicContact CE-CB 3.93Å
240	K	86.2	Confident	88.7	Confident	95 Å²	95	56.4 Å²	56.4	41%	0.413	27%	0.265	S	S	.	.			trans	-59.8	126.2	176	-66.3	-173.9	-179.7	-172.9	0	110.1	V243 N310 V333	K240-V243 HydrophobicContact CB-CG2 3.98Å; K240-N310 PolarHBondContact NZ-OD1 3.45Å; K240-V333 HydrophobicContact CB-CG2 4.11Å; K240-V333 VanDerWaalsContact O-CG2 3.29Å; K240-V333 WeakPolarHBondContact O-CG2 3.28Å
241	K	87.7	Confident	88.6	Confident	117 Å²	117	56.3 Å²	56.3	51%	0.509	27%	0.265	S	S	.	.	S	Bend	trans	-80.8	-27.7	175.8	-65.3	-177	179.8	179.9	0	113.4	M239 Y373 E374	M239-K241 PolarHBondContact O-N 2.87Å; K241-Y373 CarbonylContact O-C 2.82Å; K241-Y373 VanDerWaalsContact O-CA 3.22Å; K241-Y373 WeakPolarHBondContact O-CA 3.4Å; K241-E374 PolarHBondContact O-N 2.79Å
242	H	89.1	Confident	88.7	Confident	130 Å²	130	56.5 Å²	56.5	60%	0.602	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.7	178.4	-64.7	-78.1	0	0	0	109	Y373	H242-Y373 VanDerWaalsContact ND1-CB 3.29Å; H242-Y373 WeakPolarHBondContact ND1-CB 3.22Å
243	V	88.5	Confident	88.8	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	117.4	-175.9	176.2	0	0	0	0	108.3	K240 A246 N310 V312 V333 V372	K240-V243 HydrophobicContact CB-CG2 3.98Å; V243-A246 HydrophobicContact CG1-CB 3.84Å; V243-N310 HydrophobicContact CB-CB 4.44Å; V243-N310 HydrophobicContact CG1-CB 3.13Å; V243-V312 HydrophobicContact CG1-CG2 4.24Å; V243-V333 HydrophobicContact CG2-CG2 3.66Å; V243-V372 WeakPolarHBondContact CA-O 3.44Å; V243-V372 HydrophobicContact CB-CB 4.23Å; V243-V372 WeakPolarHBondContact CB-O 3.3Å; V243-V372 PolarHBondContact N-O 3.38Å; V243-V372 PolarHBondContact O-N 3.4Å; V243-V372 VanDerWaalsContact O-O 3.13Å
244	R	88.3	Confident	89	Confident	181 Å²	181	54.2 Å²	54.2	68%	0.683	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	150	171.8	-66.5	-177.7	177.7	-178.3	-1.6	110.1	A246 N310 G370 L371	R244-A246 PolarHBondContact O-N 3.45Å; R244-N310 PolarHBondContact O-ND2 3.3Å; R244-G370 CarbonylContact C-O 3.5Å; R244-G370 WeakPolarHBondContact CA-O 3.1Å; R244-L371 HydrophobicContact CG-CD1 4.02Å
245	N	86.7	Confident	89	Confident	71 Å²	71	54 Å²	54	38%	0.38	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.1	63.9	-179.6	-63.3	-3.3	0	0	0	112	E307 A369 G370	N245-E307 PolarHBondContact ND2-OE2 3.08Å; N245-A369 CarbonylContact C-O 3.56Å; N245-G370 PolarHBondContact N-O 3.29Å
246	A	87.7	Confident	89.2	Confident	2 Å²	2	49 Å²	49	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.5	-177.2	0	0	0	0	0	111.9	V243 R244 I248 V312 A369 V372	V243-A246 HydrophobicContact CG1-CB 3.84Å; R244-A246 PolarHBondContact O-N 3.45Å; A246-I248 HydrophobicContact CB-CG1 4.43Å; A246-V312 HydrophobicContact CB-CG2 3.85Å; A246-A369 PolarHBondContact N-O 3.19Å; A246-A369 PolarHBondContact O-N 2.94Å; A246-V372 HydrophobicContact CB-CB 4.35Å; A246-V372 HydrophobicContact CB-CG2 3.66Å
247	Y	90.3	Very high	88.9	Confident	49 Å²	49	51.9 Å²	51.9	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.5	157.3	-69.5	-85.6	0	0	0	109.5	V299 N310 F311 V312 L366 G367 R368	Y247-V299 HydrophobicContact CD1-CG1 4.27Å; Y247-V299 HydrophobicContact CD2-CG1 3.86Å; Y247-V299 HydrophobicContact CE1-CG1 4.31Å; Y247-V299 HydrophobicContact CE2-CG1 3.92Å; Y247-V299 HydrophobicContact CG-CG1 4.03Å; Y247-N310 PolarHBondContact N-O 3.48Å; Y247-F311 WeakPolarHBondContact O-CA 3.45Å; Y247-V312 PolarHBondContact O-N 3.02Å; Y247-L366 HydrophobicContact CD1-CB 4.27Å; Y247-L366 HydrophobicContact CD1-CD1 4.43Å; Y247-G367 CarbonylContact C-O 3.58Å; Y247-G367 WeakPolarHBondContact CA-O 2.9Å; Y247-R368 HydrophobicContact CD1-CG 4.17Å; Y247-R368 HydrophobicContact CE1-CG 4.05Å
248	I	91.1	Very high	88.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.3	-174.8	-60.6	171.9	0	0	0	109.2	A246 I250 V312 I314 C350 G367 A369 V372 I385	A246-I248 HydrophobicContact CB-CG1 4.43Å; I248-I250 HydrophobicContact CG2-CG1 4Å; I248-V312 CarbonylContact C-O 3.37Å; I248-V312 WeakPolarHBondContact CA-O 3.02Å; I248-V312 HydrophobicContact CG1-CB 4.34Å; I248-I314 HydrophobicContact CG2-CD1 3.56Å; I248-I314 HydrophobicContact CG2-CG1 4.07Å; I248-C350 HydrophobicContact CD1-CB 4.19Å; I248-C350 WeakPolarHBondContact CD1-SG 3.18Å; I248-G367 PolarHBondContact N-O 2.84Å; I248-G367 PolarHBondContact O-N 2.64Å; I248-A369 HydrophobicContact CD1-CB 3.56Å; I248-A369 HydrophobicContact CG1-CB 4.49Å; I248-V372 HydrophobicContact CD1-CG2 4.38Å; I248-I385 HydrophobicContact CD1-CD1 4.36Å; I248-I385 HydrophobicContact CD1-CG2 3.76Å
249	L	93	Very high	88.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.3	169.7	179.7	64.7	0	0	0	109.8	C251 I292 L295 F311 V312 V313 I314 V355 L361 L366	L249-C251 WeakPolarHBondContact CG-SG 3.43Å; L249-I292 HydrophobicContact CD2-CG1 4.31Å; L249-I292 HydrophobicContact CD2-CG2 3.9Å; L249-L295 HydrophobicContact CD1-CD2 4.39Å; L249-L295 HydrophobicContact CD2-CD2 4.46Å; L249-F311 HydrophobicContact CB-CE1 3.76Å; L249-F311 HydrophobicContact CB-CZ 3.65Å; L249-F311 HydrophobicContact CD2-CE1 4.09Å; L249-F311 HydrophobicContact CD2-CZ 4.12Å; L249-F311 HydrophobicContact CG-CZ 4.42Å; L249-V312 PolarHBondContact N-O 3.22Å; L249-V313 HydrophobicContact CB-CG2 4.39Å; L249-V313 HydrophobicContact CD2-CG2 4.31Å; L249-I314 PolarHBondContact O-N 3.17Å; L249-V355 HydrophobicContact CD1-CG2 4.44Å; L249-L361 HydrophobicContact CD1-CD2 3.85Å; L249-L366 HydrophobicContact CB-CD2 3.66Å; L249-L366 HydrophobicContact CD1-CD2 3.75Å; L249-L366 HydrophobicContact CG-CD2 4.26Å
250	I	93.6	Very high	87.9	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	113.7	-179.8	-57.3	164.8	0	0	0	107.8	I248 M343 L346 P347 A354 V355	I248-I250 HydrophobicContact CG2-CG1 4Å; I250-M343 HydrophobicContact CG2-CE 3.24Å; I250-M343 HydrophobicContact CG2-SD 3.82Å; I250-L346 HydrophobicContact CD1-CB 3.61Å; I250-L346 HydrophobicContact CG1-CB 4.06Å; I250-P347 HydrophobicContact CD1-CG 4Å; I250-A354 HydrophobicContact CG2-CB 3.87Å; I250-V355 PolarHBondContact O-N 2.63Å
251	C	91.7	Very high	87.8	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.4	-172.6	-80.7	0	0	0	0	113.8	L249 I314 N315 Q316 M343 V355	L249-C251 WeakPolarHBondContact CG-SG 3.43Å; C251-I314 PolarHBondContact N-O 3.3Å; C251-N315 CarbonylContact O-C 3.59Å; C251-N315 WeakPolarHBondContact O-CA 3.44Å; C251-N315 PolarHBondContact O-OD1 3.44Å; C251-N315 VanDerWaalsContact O-OD1 3.11Å; C251-Q316 PolarHBondContact O-N 2.88Å; C251-M343 VanDerWaalsContact O-CE 3.23Å; C251-M343 WeakPolarHBondContact O-CE 3.43Å; C251-V355 CarbonylContact C-O 3.54Å; C251-V355 WeakPolarHBondContact CA-O 3.3Å
252	N	92.7	Very high	87.9	Confident	48 Å²	48	61 Å²	61	26%	0.257	30%	0.297	S	S	.	.			trans	-122.4	52	169.3	-177.6	23.5	0	0	0	110.7	Q316 V355	N252-Q316 HydrophobicContact CB-CB 4.26Å; N252-Q316 PolarHBondContact ND2-OE1 2.62Å; N252-Q316 PolarHBondContact OD1-OE1 2.9Å; N252-V355 PolarHBondContact N-O 3.4Å
253	V	89.9	Confident	87.7	Confident	8 Å²	8	62.8 Å²	62.8	5%	0.048	31%	0.311	C	S	.	.			trans	-116.7	137.9	-174.3	178.9	0	0	0	0	109.6	L255 N315 K317 N356 V358	V253-L255 HydrophobicContact CG1-CD2 4.24Å; V253-L255 PolarHBondContact O-N 3.39Å; V253-N315 PolarHBondContact N-OD1 3.38Å; V253-N315 VanDerWaalsContact O-CG 3.28Å; V253-N315 PolarHBondContact O-ND2 3.37Å; V253-N315 PolarHBondContact O-OD1 3.48Å; V253-K317 WeakPolarHBondContact O-CB 2.85Å; V253-N356 WeakPolarHBondContact CG2-O 3.24Å; V253-V358 HydrophobicContact CB-CG2 4.2Å; V253-V358 HydrophobicContact CG1-CG2 3.74Å; V253-V358 HydrophobicContact CG2-CG2 3.81Å
254	A	89.8	Confident	87.2	Confident	5 Å²	5	66.4 Å²	66.4	4%	0.041	33%	0.333	C	S	.	.			trans	-74.7	115.2	172.7	0	0	0	0	0	109.9	D256 E258 R288 K317	A254-D256 VanDerWaalsContact C-N 3.32Å; A254-E258 HydrophobicContact CB-CG 3.72Å; A254-E258 WeakPolarHBondContact CB-OE1 3.41Å; A254-E258 WeakPolarHBondContact CB-OE2 3.24Å; A254-R288 PolarHBondContact O-NH1 3.11Å; A254-K317 HydrophobicContact CB-CD 3.7Å
255	L	88.1	Confident	86.8	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-106.2	29.6	170.6	-58.5	176.9	0	0	0	109.9	V253 R288 V289 I292 G318 I319 D320 F327	V253-L255 HydrophobicContact CG1-CD2 4.24Å; V253-L255 PolarHBondContact O-N 3.39Å; L255-R288 HydrophobicContact CD2-CB 3.97Å; L255-V289 HydrophobicContact CD2-CG2 4.16Å; L255-I292 HydrophobicContact CD1-CD1 3.9Å; L255-I292 HydrophobicContact CD2-CD1 4.1Å; L255-G318 PolarHBondContact N-O 3.04Å; L255-I319 HydrophobicContact CB-CB 4.45Å; L255-I319 HydrophobicContact CB-CG1 4.23Å; L255-I319 HydrophobicContact CB-CG2 4.25Å; L255-I319 HydrophobicContact CD1-CD1 4.45Å; L255-I319 HydrophobicContact CD1-CG1 4.25Å; L255-I319 WeakPolarHBondContact O-CA 3.35Å; L255-D320 PolarHBondContact O-N 3.23Å; L255-F327 HydrophobicContact CD1-CE2 3.98Å; L255-F327 HydrophobicContact CD1-CZ 3.91Å
256	D	87.6	Confident	86.3	Confident	50 Å²	50	62.7 Å²	62.7	27%	0.267	33%	0.334	S	S	.	.	S	Bend	trans	-125.3	164.3	178.9	-158.7	-9	0	0	0	108.6	A254 E258	A254-D256 VanDerWaalsContact C-N 3.32Å; D256-E258 PolarHBondContact O-N 2.97Å
257	F	82.9	Confident	86	Confident	93 Å²	93	70.2 Å²	70.2	41%	0.408	37%	0.371	S	S	.	.			trans	-65.4	104.2	174.1	-174.6	-91.6	0	0	0	109.8	K259 E281	F257-K259 HydrophobicContact CE1-CG 4.26Å; F257-E281 HydrophobicContact CD2-CB 4.46Å; F257-E281 HydrophobicContact CE2-CB 3.67Å; F257-E281 HydrophobicContact CE2-CG 4.23Å; F257-E281 WeakPolarHBondContact CE2-OE2 3.44Å; F257-E281 HydrophobicContact CZ-CB 4.49Å; F257-E281 VanDerWaalsContact CZ-OE2 3.24Å; F257-E281 WeakPolarHBondContact CZ-OE2 3.37Å
258	E	77.4	Confident	85.7	Confident	101 Å²	101	72.8 Å²	72.8	47%	0.472	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-88.8	124.8	173	-77.3	-176.8	149.5	0	0	109.4	A254 D256 K317	A254-E258 HydrophobicContact CB-CG 3.72Å; A254-E258 WeakPolarHBondContact CB-OE1 3.41Å; A254-E258 WeakPolarHBondContact CB-OE2 3.24Å; D256-E258 PolarHBondContact O-N 2.97Å; E258-K317 IonicContact OE1-NZ 3.46Å; E258-K317 PolarHBondContact OE1-NZ 2.88Å
259	K	80.9	Confident	85.6	Confident	177 Å²	177	82.4 Å²	82.4	77%	0.77	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-67.9	146.2	163.2	-68	-176.9	178.7	-179.2	0	108.5	F257	F257-K259 HydrophobicContact CE1-CG 4.26Å
260	T	82.6	Confident	85.5	Confident	77 Å²	77	85.5 Å²	85.5	47%	0.472	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-64.6	140.7	174	55.9	0	0	0	0	110.5	V262 T264	T260-V262 CarbonylContact C-O 3.59Å; T260-V262 WeakPolarHBondContact CB-O 3.4Å; T260-V262 PolarHBondContact O-N 2.66Å; T260-V262 VanDerWaalsContact O-O 3.09Å; T260-V262 PolarHBondContact OG1-O 3.44Å; T260-T264 HydrophobicContact CG2-CG2 4.34Å; T260-T264 WeakPolarHBondContact OG1-CG2 3.35Å; T260-T264 PolarHBondContact OG1-OG1 2.83Å
261	D	84.5	Confident	85.3	Confident	172 Å²	172	89.4 Å²	89.4	92%	0.92	47%	0.469	S	S	*	.	S	Bend	trans	-62.4	-32	177.2	-68.6	-33.7	0	0	0	112.3
262	V	88.9	Confident	85.2	Confident	111 Å²	111	93.7 Å²	93.7	67%	0.673	50%	0.495	S	S	*	.	S	Bend	trans	-79.6	134.9	169.2	-175.7	0	0	0	0	108.1	T260 T264	T260-V262 CarbonylContact C-O 3.59Å; T260-V262 WeakPolarHBondContact CB-O 3.4Å; T260-V262 PolarHBondContact O-N 2.66Å; T260-V262 VanDerWaalsContact O-O 3.09Å; T260-V262 PolarHBondContact OG1-O 3.44Å; V262-T264 VanDerWaalsContact C-N 3.29Å; V262-T264 PolarHBondContact O-N 2.96Å
263	N	84.8	Confident	85.1	Confident	166 Å²	166	95.5 Å²	95.5	89%	0.888	50%	0.502	S	S	*	.			trans	-61.1	90.4	173.1	-73.5	-25.6	0	0	0	110.1
264	T	79.6	Confident	84.8	Confident	80 Å²	80	102 Å²	102	49%	0.491	53%	0.525	S	S	.	.			trans	-93.4	111	173.5	60.2	0	0	0	0	108.2	T260 V262	T260-T264 HydrophobicContact CG2-CG2 4.34Å; T260-T264 WeakPolarHBondContact OG1-CG2 3.35Å; T260-T264 PolarHBondContact OG1-OG1 2.83Å; V262-T264 VanDerWaalsContact C-N 3.29Å; V262-T264 PolarHBondContact O-N 2.96Å
265	S	79.5	Confident	84.7	Confident	91 Å²	91	107.2 Å²	107.2	64%	0.636	55%	0.549	S	S	*	.			trans	-89.1	105.3	166.9	59.1	0	0	0	0	108.2	M267	S265-M267 PolarHBondContact O-N 2.73Å
266	L	75.6	Confident	84.7	Confident	83 Å²	83	110 Å²	110	44%	0.435	57%	0.573	S	S	.	*			trans	-72.5	112.4	172.3	-67.3	172.9	0	0	0	109.2	E281	L266-E281 VanDerWaalsContact CD1-OE1 3.24Å; L266-E281 WeakPolarHBondContact CD1-OE1 3.13Å
267	M	81.4	Confident	84.5	Confident	160 Å²	160	110.8 Å²	110.8	79%	0.788	57%	0.574	S	S	*	*			trans	-97.8	126.6	173.3	-61.2	-66.4	-174.9	0	0	108.9	S265	S265-M267 PolarHBondContact O-N 2.73Å
268	Y	85.2	Confident	84.4	Confident	103 Å²	103	111.5 Å²	111.5	40%	0.404	58%	0.582	S	S	.	*			trans	-128.4	145.3	174.4	49.4	-95.3	0	0	0	109.5	R274	Y268-R274 HydrophobicContact CD1-CB 4.12Å; Y268-R274 HydrophobicContact CD1-CG 4.13Å; Y268-R274 HydrophobicContact CD2-CB 3.75Å; Y268-R274 HydrophobicContact CD2-CG 4.21Å; Y268-R274 HydrophobicContact CE1-CB 4.29Å; Y268-R274 HydrophobicContact CE1-CG 3.83Å; Y268-R274 HydrophobicContact CE2-CB 3.92Å; Y268-R274 HydrophobicContact CE2-CG 3.91Å; Y268-R274 HydrophobicContact CG-CB 3.86Å; Y268-R274 HydrophobicContact CG-CG 4.32Å; Y268-R274 PolarHBondContact OH-NE 3.1Å
269	K	88.2	Confident	84.8	Confident	202 Å²	202	113.5 Å²	113.5	88%	0.878	59%	0.589	S	S	*	*	S	Bend	trans	-100.7	-29.9	177.7	-66.9	-178.3	-178.9	177.7	0	111.8	E273	K269-E273 PolarHBondContact N-OE2 3.07Å
270	T	90.2	Very high	85	Confident	64 Å²	64	107.1 Å²	107.1	39%	0.393	57%	0.574	S	S	.	*	S	Bend	trans	-116.1	149.1	-174.5	-43.7	0	0	0	0	111.1	T272 E273 R274	T270-T272 VanDerWaalsContact C-N 3.27Å; T270-T272 VanDerWaalsContact CG2-OG1 3.3Å; T270-T272 WeakPolarHBondContact CG2-OG1 3.3Å; T270-T272 PolarHBondContact O-N 2.9Å; T270-E273 PolarHBondContact N-OE2 3.29Å; T270-E273 PolarHBondContact O-N 3.42Å; T270-R274 PolarHBondContact O-N 2.86Å
271	S	89.3	Confident	84.9	Confident	84 Å²	84	106.9 Å²	106.9	59%	0.587	57%	0.567	S	S	*	*	H	α-helix	trans	-59.5	-36.8	175.6	52.8	0	0	0	0	112.9	R274 E275	S271-R274 WeakPolarHBondContact O-CB 3.41Å; S271-R274 PolarHBondContact O-N 3.28Å; S271-E275 PolarHBondContact O-N 3.42Å; S271-E275 VanDerWaalsContact O-N 3.16Å
272	T	91.3	Very high	85	Confident	91 Å²	91	103.2 Å²	103.2	56%	0.558	54%	0.54	S	S	*	.	H	α-helix	trans	-64.6	-38.9	178.2	52.6	0	0	0	0	112.6	T270 E275 A276	T270-T272 VanDerWaalsContact C-N 3.27Å; T270-T272 VanDerWaalsContact CG2-OG1 3.3Å; T270-T272 WeakPolarHBondContact CG2-OG1 3.3Å; T270-T272 PolarHBondContact O-N 2.9Å; T272-E275 PolarHBondContact O-N 3.13Å; T272-A276 WeakPolarHBondContact O-CB 3.41Å; T272-A276 PolarHBondContact O-N 2.8Å
273	E	88.8	Confident	84.9	Confident	86 Å²	86	99.7 Å²	99.7	40%	0.402	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-42.2	175.7	-67.8	170.4	176.4	0	0	111	K269 T270 E275 A276 Q277	K269-E273 PolarHBondContact N-OE2 3.07Å; T270-E273 PolarHBondContact N-OE2 3.29Å; T270-E273 PolarHBondContact O-N 3.42Å; E273-E275 PolarHBondContact O-N 3.07Å; E273-A276 PolarHBondContact O-N 3.16Å; E273-Q277 WeakPolarHBondContact O-CG 3.27Å; E273-Q277 PolarHBondContact O-N 2.87Å
274	R	85	Confident	85	Confident	145 Å²	145	97.3 Å²	97.3	55%	0.547	51%	0.505	S	S	.	.	H	α-helix	trans	-59	-46.9	176.4	-175.8	-173.3	178.1	172.4	-2.1	111.7	Y268 T270 S271 Q277 L278	Y268-R274 HydrophobicContact CD1-CB 4.12Å; Y268-R274 HydrophobicContact CD1-CG 4.13Å; Y268-R274 HydrophobicContact CD2-CB 3.75Å; Y268-R274 HydrophobicContact CD2-CG 4.21Å; Y268-R274 HydrophobicContact CE1-CB 4.29Å; Y268-R274 HydrophobicContact CE1-CG 3.83Å; Y268-R274 HydrophobicContact CE2-CB 3.92Å; Y268-R274 HydrophobicContact CE2-CG 3.91Å; Y268-R274 HydrophobicContact CG-CB 3.86Å; Y268-R274 HydrophobicContact CG-CG 4.32Å; Y268-R274 PolarHBondContact OH-NE 3.1Å; T270-R274 PolarHBondContact O-N 2.86Å; S271-R274 WeakPolarHBondContact O-CB 3.41Å; S271-R274 PolarHBondContact O-N 3.28Å; R274-Q277 PolarHBondContact O-N 3Å; R274-L278 PolarHBondContact O-N 3.06Å
275	E	87.9	Confident	85.5	Confident	114 Å²	114	94 Å²	94	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-39.5	178.9	-71.5	-175.6	-173.5	0	0	112.4	S271 T272 E273 L278 K279	S271-E275 PolarHBondContact O-N 3.42Å; S271-E275 VanDerWaalsContact O-N 3.16Å; T272-E275 PolarHBondContact O-N 3.13Å; E273-E275 PolarHBondContact O-N 3.07Å; E275-L278 PolarHBondContact O-N 2.75Å; E275-K279 WeakPolarHBondContact O-CB 3.25Å; E275-K279 VanDerWaalsContact O-CG 3.29Å; E275-K279 WeakPolarHBondContact O-CG 3.36Å; E275-K279 PolarHBondContact O-N 3.45Å
276	A	87.4	Confident	86	Confident	61 Å²	61	91.1 Å²	91.1	50%	0.504	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-41.4	177.2	0	0	0	0	0	111.8	T272 E273 K279 G280	T272-A276 WeakPolarHBondContact O-CB 3.41Å; T272-A276 PolarHBondContact O-N 2.8Å; E273-A276 PolarHBondContact O-N 3.16Å; A276-K279 PolarHBondContact O-N 3.42Å; A276-G280 PolarHBondContact O-N 3.05Å
277	Q	82.4	Confident	86.7	Confident	65 Å²	65	91.1 Å²	91.1	30%	0.304	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-47.5	176.5	-73.6	175.1	-3.3	0	0	111.8	E273 R274 K279 G280 E281	E273-Q277 WeakPolarHBondContact O-CG 3.27Å; E273-Q277 PolarHBondContact O-N 2.87Å; R274-Q277 PolarHBondContact O-N 3Å; Q277-K279 VanDerWaalsContact C-N 3.27Å; Q277-K279 PolarHBondContact O-N 3.36Å; Q277-G280 WeakPolarHBondContact O-CA 3.13Å; Q277-G280 PolarHBondContact O-N 2.96Å; Q277-E281 PolarHBondContact O-N 3.24Å
278	L	82.4	Confident	87.1	Confident	109 Å²	109	86.4 Å²	86.4	57%	0.571	44%	0.436	S	S	*	.	H	α-helix	trans	-59.9	-38.6	177.3	-173	69.2	0	0	0	111.8	R274 E275 R282	R274-L278 PolarHBondContact O-N 3.06Å; E275-L278 PolarHBondContact O-N 2.75Å; L278-R282 WeakPolarHBondContact O-CB 3.42Å; L278-R282 PolarHBondContact O-N 2.9Å; L278-R282 VanDerWaalsContact O-N 3.16Å
279	K	86.1	Confident	87.4	Confident	143 Å²	143	81.5 Å²	81.5	62%	0.622	42%	0.417	S	S	*	.	H	α-helix	trans	-65.5	-38.1	172.5	-74.7	172.6	-176.8	170.2	0	112.1	E275 A276 Q277 R282 A283	E275-K279 WeakPolarHBondContact O-CB 3.25Å; E275-K279 VanDerWaalsContact O-CG 3.29Å; E275-K279 WeakPolarHBondContact O-CG 3.36Å; E275-K279 PolarHBondContact O-N 3.45Å; A276-K279 PolarHBondContact O-N 3.42Å; Q277-K279 VanDerWaalsContact C-N 3.27Å; Q277-K279 PolarHBondContact O-N 3.36Å; K279-R282 PolarHBondContact O-N 2.92Å; K279-A283 VanDerWaalsContact O-CB 3.25Å; K279-A283 WeakPolarHBondContact O-CB 3.29Å; K279-A283 PolarHBondContact O-N 3.2Å
280	G	84.5	Confident	87.5	Confident	43 Å²	43	76.9 Å²	76.9	44%	0.443	40%	0.396	S	S	.	.	H	α-helix	trans	-65.5	-46.4	178.6	0	0	0	0	0	113	A276 Q277 R282 A283 F284	A276-G280 PolarHBondContact O-N 3.05Å; Q277-G280 WeakPolarHBondContact O-CA 3.13Å; Q277-G280 PolarHBondContact O-N 2.96Å; G280-R282 VanDerWaalsContact C-N 3.3Å; G280-R282 PolarHBondContact O-N 2.8Å; G280-A283 WeakPolarHBondContact O-CB 3.1Å; G280-A283 PolarHBondContact O-N 3.13Å; G280-F284 PolarHBondContact O-N 2.66Å
281	E	81.1	Confident	87.5	Confident	71 Å²	71	77.6 Å²	77.6	33%	0.332	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-43.3	175.1	-65.8	178.4	142.4	0	0	111	F257 L266 Q277 F284	F257-E281 HydrophobicContact CD2-CB 4.46Å; F257-E281 HydrophobicContact CE2-CB 3.67Å; F257-E281 HydrophobicContact CE2-CG 4.23Å; F257-E281 WeakPolarHBondContact CE2-OE2 3.44Å; F257-E281 HydrophobicContact CZ-CB 4.49Å; F257-E281 VanDerWaalsContact CZ-OE2 3.24Å; F257-E281 WeakPolarHBondContact CZ-OE2 3.37Å; L266-E281 VanDerWaalsContact CD1-OE1 3.24Å; L266-E281 WeakPolarHBondContact CD1-OE1 3.13Å; Q277-E281 PolarHBondContact O-N 3.24Å; E281-F284 WeakPolarHBondContact O-CB 3.34Å; E281-F284 PolarHBondContact O-N 3.47Å
282	R	84.8	Confident	87.6	Confident	96 Å²	96	73.6 Å²	73.6	36%	0.362	37%	0.366	S	S	.	.	H	α-helix	trans	-68.5	-36.1	177.6	-175	168.4	169	-177.1	-4.2	112.9	L278 K279 G280 F284 V285 D286 L322	L278-R282 WeakPolarHBondContact O-CB 3.42Å; L278-R282 PolarHBondContact O-N 2.9Å; L278-R282 VanDerWaalsContact O-N 3.16Å; K279-R282 PolarHBondContact O-N 2.92Å; G280-R282 VanDerWaalsContact C-N 3.3Å; G280-R282 PolarHBondContact O-N 2.8Å; R282-F284 PolarHBondContact O-N 2.84Å; R282-F284 VanDerWaalsContact O-N 3.15Å; R282-V285 PolarHBondContact O-N 3.32Å; R282-D286 IonicContact NE-OD1 2.66Å; R282-D286 IonicContact NE-OD2 2.63Å; R282-D286 PolarHBondContact O-N 2.98Å; R282-L322 VanDerWaalsContact NH2-CB 3.3Å
283	A	88.3	Confident	87.5	Confident	37 Å²	37	70 Å²	70	31%	0.306	34%	0.344	S	S	.	.	H	α-helix	trans	-57.6	-31	177.5	0	0	0	0	0	111.9	K279 G280 N287	K279-A283 VanDerWaalsContact O-CB 3.25Å; K279-A283 WeakPolarHBondContact O-CB 3.29Å; K279-A283 PolarHBondContact O-N 3.2Å; G280-A283 WeakPolarHBondContact O-CB 3.1Å; G280-A283 PolarHBondContact O-N 3.13Å; A283-N287 VanDerWaalsContact O-CB 3.24Å; A283-N287 WeakPolarHBondContact O-CB 3.41Å; A283-N287 PolarHBondContact O-N 3.21Å; A283-N287 PolarHBondContact O-ND2 2.75Å; A283-N287 VanDerWaalsContact O-ND2 3.16Å; A283-N287 PolarHBondContact O-OD1 3.05Å
284	F	86.8	Confident	87.5	Confident	115 Å²	115	71 Å²	71	50%	0.504	35%	0.348	S	S	.	.	H	α-helix	trans	-63.7	-46	174.6	-176.1	-106.9	0	0	0	112.6	G280 E281 R282 R288	G280-F284 PolarHBondContact O-N 2.66Å; E281-F284 WeakPolarHBondContact O-CB 3.34Å; E281-F284 PolarHBondContact O-N 3.47Å; R282-F284 PolarHBondContact O-N 2.84Å; R282-F284 VanDerWaalsContact O-N 3.15Å; F284-R288 PolarHBondContact O-N 3.37Å
285	V	89.4	Confident	87.7	Confident	10 Å²	10	64.2 Å²	64.2	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-66.9	-45.7	175.8	-177.5	0	0	0	0	110.1	R282 N287 R288 V289	R282-V285 PolarHBondContact O-N 3.32Å; V285-N287 VanDerWaalsContact C-N 3.28Å; V285-N287 PolarHBondContact O-N 2.87Å; V285-R288 WeakPolarHBondContact O-CB 3.47Å; V285-R288 PolarHBondContact O-N 3.45Å; V285-R288 VanDerWaalsContact O-N 3.07Å; V285-V289 HydrophobicContact CG1-CG2 4.47Å; V285-V289 WeakPolarHBondContact O-CG2 3.34Å; V285-V289 PolarHBondContact O-N 3.34Å
286	D	90.3	Very high	87.6	Confident	31 Å²	31	59.7 Å²	59.7	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-38.1	179.1	-67.3	-5.6	0	0	0	111.4	R282 V289 K290 M326	R282-D286 IonicContact NE-OD1 2.66Å; R282-D286 IonicContact NE-OD2 2.63Å; R282-D286 PolarHBondContact O-N 2.98Å; D286-V289 PolarHBondContact O-N 2.98Å; D286-K290 WeakPolarHBondContact O-CB 3.23Å; D286-K290 WeakPolarHBondContact O-CG 3.25Å; D286-K290 PolarHBondContact O-N 3.4Å; D286-M326 HydrophobicContact CB-CE 4.44Å; D286-M326 WeakPolarHBondContact OD1-CE 3.4Å
287	N	90.5	Very high	87.5	Confident	84 Å²	84	63.8 Å²	63.8	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-37.8	176.3	-73.5	-17.3	0	0	0	112.1	A283 V285 K291	A283-N287 VanDerWaalsContact O-CB 3.24Å; A283-N287 WeakPolarHBondContact O-CB 3.41Å; A283-N287 PolarHBondContact O-N 3.21Å; A283-N287 PolarHBondContact O-ND2 2.75Å; A283-N287 VanDerWaalsContact O-ND2 3.16Å; A283-N287 PolarHBondContact O-OD1 3.05Å; V285-N287 VanDerWaalsContact C-N 3.28Å; V285-N287 PolarHBondContact O-N 2.87Å; N287-K291 WeakPolarHBondContact O-CG 3.3Å; N287-K291 PolarHBondContact O-N 2.99Å
288	R	89.7	Confident	87.6	Confident	61 Å²	61	66.5 Å²	66.5	23%	0.23	31%	0.314	C	S	.	.	H	α-helix	trans	-65.9	-45.6	173.6	-69.7	175.8	171.7	-179.4	-2.3	111	A254 L255 F284 V285 K290 K291 I292 V358	A254-R288 PolarHBondContact O-NH1 3.11Å; L255-R288 HydrophobicContact CD2-CB 3.97Å; F284-R288 PolarHBondContact O-N 3.37Å; V285-R288 WeakPolarHBondContact O-CB 3.47Å; V285-R288 PolarHBondContact O-N 3.45Å; V285-R288 VanDerWaalsContact O-N 3.07Å; R288-K290 PolarHBondContact O-N 3.1Å; R288-K291 PolarHBondContact O-N 2.93Å; R288-I292 PolarHBondContact O-N 3.08Å; R288-V358 HydrophobicContact CB-CG2 4.33Å; R288-V358 HydrophobicContact CG-CG2 4.47Å; R288-V358 WeakPolarHBondContact O-CG1 3.38Å
289	V	90.5	Very high	87.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-42.7	178.2	176.6	0	0	0	0	111	L255 V285 D286 K291 I292 I293 M326 F327	L255-V289 HydrophobicContact CD2-CG2 4.16Å; V285-V289 HydrophobicContact CG1-CG2 4.47Å; V285-V289 WeakPolarHBondContact O-CG2 3.34Å; V285-V289 PolarHBondContact O-N 3.34Å; D286-V289 PolarHBondContact O-N 2.98Å; V289-K291 VanDerWaalsContact C-N 3.34Å; V289-K291 PolarHBondContact O-N 3.38Å; V289-I292 WeakPolarHBondContact O-CB 3.4Å; V289-I292 PolarHBondContact O-N 3.15Å; V289-I292 VanDerWaalsContact O-N 3.09Å; V289-I293 HydrophobicContact CG1-CD1 3.88Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 WeakPolarHBondContact O-CG1 2.96Å; V289-I293 PolarHBondContact O-N 2.89Å; V289-M326 HydrophobicContact CG1-CB 3.97Å; V289-M326 HydrophobicContact CG1-SD 4.08Å; V289-F327 HydrophobicContact CG1-CD1 4.39Å; V289-F327 HydrophobicContact CG1-CE1 3.9Å; V289-F327 HydrophobicContact CG1-CE2 4.48Å; V289-F327 HydrophobicContact CG1-CZ 3.96Å; V289-F327 HydrophobicContact CG2-CZ 4.36Å
290	K	91.1	Very high	87.1	Confident	104 Å²	104	57 Å²	57	45%	0.452	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-42.6	175.9	-77	171	-173.1	173	0	112.5	D286 R288 I292 I293 E294	D286-K290 WeakPolarHBondContact O-CB 3.23Å; D286-K290 WeakPolarHBondContact O-CG 3.25Å; D286-K290 PolarHBondContact O-N 3.4Å; R288-K290 PolarHBondContact O-N 3.1Å; K290-I292 VanDerWaalsContact C-N 3.3Å; K290-I292 PolarHBondContact O-N 2.56Å; K290-I293 CarbonylContact O-C 3.58Å; K290-I293 WeakPolarHBondContact O-CB 3.35Å; K290-I293 PolarHBondContact O-N 3.04Å; K290-I293 VanDerWaalsContact O-N 3.13Å; K290-E294 WeakPolarHBondContact O-CG 3.48Å; K290-E294 PolarHBondContact O-N 2.82Å
291	K	90.1	Very high	86.7	Confident	79 Å²	79	58.6 Å²	58.6	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-37.1	175.4	-73.9	175.4	174.4	175.2	0	112.7	N287 R288 V289 E294 L295 V358 D359	N287-K291 WeakPolarHBondContact O-CG 3.3Å; N287-K291 PolarHBondContact O-N 2.99Å; R288-K291 PolarHBondContact O-N 2.93Å; V289-K291 VanDerWaalsContact C-N 3.34Å; V289-K291 PolarHBondContact O-N 3.38Å; K291-E294 PolarHBondContact O-N 3.44Å; K291-L295 PolarHBondContact O-N 2.73Å; K291-V358 HydrophobicContact CB-CG1 3.51Å; K291-V358 HydrophobicContact CD-CG1 4.25Å; K291-D359 IonicContact NZ-OD1 3.92Å; K291-D359 PolarHBondContact NZ-OD1 3.22Å
292	I	90.7	Very high	86	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-40.9	174.3	-61.6	170.3	0	0	0	110.6	L249 L255 R288 V289 K290 L295 K296 F311 V313 F327 V358 L361	L249-I292 HydrophobicContact CD2-CG1 4.31Å; L249-I292 HydrophobicContact CD2-CG2 3.9Å; L255-I292 HydrophobicContact CD1-CD1 3.9Å; L255-I292 HydrophobicContact CD2-CD1 4.1Å; R288-I292 PolarHBondContact O-N 3.08Å; V289-I292 WeakPolarHBondContact O-CB 3.4Å; V289-I292 PolarHBondContact O-N 3.15Å; V289-I292 VanDerWaalsContact O-N 3.09Å; K290-I292 VanDerWaalsContact C-N 3.3Å; K290-I292 PolarHBondContact O-N 2.56Å; I292-L295 WeakPolarHBondContact O-CB 3.49Å; I292-L295 PolarHBondContact O-N 2.87Å; I292-K296 PolarHBondContact O-N 3.46Å; I292-F311 HydrophobicContact CG2-CE1 4.17Å; I292-V313 HydrophobicContact CG2-CG2 3.96Å; I292-F327 HydrophobicContact CB-CE1 4.28Å; I292-F327 HydrophobicContact CD1-CZ 4.16Å; I292-F327 HydrophobicContact CG2-CE1 3.89Å; I292-F327 HydrophobicContact CG2-CZ 4.42Å; I292-V358 HydrophobicContact CD1-CG1 4.42Å; I292-V358 HydrophobicContact CG1-CG1 3.71Å; I292-L361 HydrophobicContact CG1-CD1 4.31Å
293	I	90	Very high	84.8	Confident	16 Å²	16	58.6 Å²	58.6	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-41.1	175.8	-65.9	169.5	0	0	0	110.9	V289 K290 L295 K296 R297 M326 E330	V289-I293 HydrophobicContact CG1-CD1 3.88Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 WeakPolarHBondContact O-CG1 2.96Å; V289-I293 PolarHBondContact O-N 2.89Å; K290-I293 CarbonylContact O-C 3.58Å; K290-I293 WeakPolarHBondContact O-CB 3.35Å; K290-I293 PolarHBondContact O-N 3.04Å; K290-I293 VanDerWaalsContact O-N 3.13Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 3.43Å; I293-K296 WeakPolarHBondContact O-CB 3.28Å; I293-K296 PolarHBondContact O-N 3.34Å; I293-R297 WeakPolarHBondContact O-CG 3.26Å; I293-R297 PolarHBondContact O-N 3.36Å; I293-M326 HydrophobicContact CD1-CB 4.29Å; I293-E330 HydrophobicContact CD1-CG 4.08Å; I293-E330 HydrophobicContact CG1-CG 4.1Å; I293-E330 HydrophobicContact CG2-CG 3.72Å
294	E	89.7	Confident	83	Confident	105 Å²	105	59.4 Å²	59.4	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-60.3	-43.1	174.1	-74.9	172.6	-165	0	0	111.6	K290 K291 K296 R297 K298	K290-E294 WeakPolarHBondContact O-CG 3.48Å; K290-E294 PolarHBondContact O-N 2.82Å; K291-E294 PolarHBondContact O-N 3.44Å; E294-K296 PolarHBondContact O-N 2.98Å; E294-R297 PolarHBondContact O-N 3.4Å; E294-K298 WeakPolarHBondContact O-CG 3.15Å; E294-K298 PolarHBondContact O-N 3.31Å
295	L	87.4	Confident	81.4	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-58.9	-47.6	174.4	-176	73.6	0	0	0	111	L249 K291 I292 I293 R297 K298 V299 F311 L361 L366	L249-L295 HydrophobicContact CD1-CD2 4.39Å; L249-L295 HydrophobicContact CD2-CD2 4.46Å; K291-L295 PolarHBondContact O-N 2.73Å; I292-L295 WeakPolarHBondContact O-CB 3.49Å; I292-L295 PolarHBondContact O-N 2.87Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 3.43Å; L295-R297 VanDerWaalsContact C-N 3.3Å; L295-R297 PolarHBondContact O-N 3.01Å; L295-K298 WeakPolarHBondContact O-CB 2.98Å; L295-K298 PolarHBondContact O-N 2.85Å; L295-V299 WeakPolarHBondContact O-CG2 3.47Å; L295-V299 PolarHBondContact O-N 3.43Å; L295-F311 HydrophobicContact CD2-CE2 4.44Å; L295-F311 HydrophobicContact CD2-CZ 3.95Å; L295-L361 HydrophobicContact CD1-CB 3.96Å; L295-L361 HydrophobicContact CD2-CB 4.01Å; L295-L361 HydrophobicContact CD2-CD1 4.12Å; L295-L361 HydrophobicContact CD2-CD2 4.36Å; L295-L361 HydrophobicContact CD2-CG 4.41Å; L295-L361 HydrophobicContact CG-CB 4.41Å; L295-L366 HydrophobicContact CD2-CD1 4.33Å; L295-L366 HydrophobicContact CD2-CD2 4.02Å; L295-L366 HydrophobicContact CD2-CG 4.45Å
296	K	86.3	Confident	79.6	Confident	18 Å²	18	66.9 Å²	66.9	8%	0.078	36%	0.36	C	S	.	.	H	α-helix	trans	-55.6	-47.1	176	171.5	173	-176.6	171.8	0	111.4	I292 I293 E294 K298 V299 C300 F311 E330 G331 I332	I292-K296 PolarHBondContact O-N 3.46Å; I293-K296 WeakPolarHBondContact O-CB 3.28Å; I293-K296 PolarHBondContact O-N 3.34Å; E294-K296 PolarHBondContact O-N 2.98Å; K296-K298 VanDerWaalsContact C-N 3.31Å; K296-K298 PolarHBondContact O-N 3.1Å; K296-V299 PolarHBondContact O-N 2.88Å; K296-C300 WeakPolarHBondContact O-CB 2.87Å; K296-C300 PolarHBondContact O-N 2.77Å; K296-C300 PolarHBondContact O-SG 3.48Å; K296-F311 HydrophobicContact CB-CD1 4.5Å; K296-F311 HydrophobicContact CB-CD2 4.37Å; K296-F311 HydrophobicContact CB-CG 4.26Å; K296-F311 HydrophobicContact CD-CB 3.89Å; K296-F311 HydrophobicContact CD-CG 4.38Å; K296-F311 HydrophobicContact CG-CB 4.17Å; K296-F311 HydrophobicContact CG-CG 4.33Å; K296-E330 PolarHBondContact NZ-O 3.3Å; K296-G331 PolarHBondContact NZ-O 3.47Å; K296-G331 VanDerWaalsContact NZ-O 3.12Å; K296-I332 HydrophobicContact CB-CD1 4.09Å; K296-I332 HydrophobicContact CD-CD1 3.39Å; K296-I332 HydrophobicContact CD-CG1 3.38Å; K296-I332 HydrophobicContact CG-CD1 4.35Å
297	R	85.6	Confident	78	Confident	148 Å²	148	71.6 Å²	71.6	56%	0.558	38%	0.381	S	S	*	.	H	α-helix	trans	-62.8	-38.7	-178.8	-71.6	176.6	-178.8	-173.1	1.2	111.7	I293 E294 L295 A301 E330	I293-R297 WeakPolarHBondContact O-CG 3.26Å; I293-R297 PolarHBondContact O-N 3.36Å; E294-R297 PolarHBondContact O-N 3.4Å; L295-R297 VanDerWaalsContact C-N 3.3Å; L295-R297 PolarHBondContact O-N 3.01Å; R297-A301 VanDerWaalsContact O-CB 3.3Å; R297-A301 WeakPolarHBondContact O-CB 3.31Å; R297-A301 PolarHBondContact O-N 3.45Å; R297-E330 IonicContact CZ-OE1 3.89Å; R297-E330 IonicContact CZ-OE2 3.35Å; R297-E330 IonicContact NE-OE1 3.43Å; R297-E330 IonicContact NE-OE2 3.34Å; R297-E330 PolarHBondContact NE-OE2 2.95Å; R297-E330 IonicContact NH2-OE1 2.59Å; R297-E330 PolarHBondContact NH2-OE1 3.46Å; R297-E330 IonicContact NH2-OE2 2.9Å
298	K	84.4	Confident	76.8	Confident	121 Å²	121	74.3 Å²	74.3	53%	0.526	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-50.3	173.5	-70.8	175.8	-176.9	178.9	0	111.7	E294 L295 K296 C300 A301 E302	E294-K298 WeakPolarHBondContact O-CG 3.15Å; E294-K298 PolarHBondContact O-N 3.31Å; L295-K298 WeakPolarHBondContact O-CB 2.98Å; L295-K298 PolarHBondContact O-N 2.85Å; K296-K298 VanDerWaalsContact C-N 3.31Å; K296-K298 PolarHBondContact O-N 3.1Å; K298-C300 PolarHBondContact O-N 3.45Å; K298-A301 WeakPolarHBondContact O-CB 3.32Å; K298-A301 PolarHBondContact O-N 2.93Å; K298-E302 WeakPolarHBondContact O-CG 3.47Å; K298-E302 PolarHBondContact O-N 3.47Å
299	V	82.9	Confident	75.6	Confident	7 Å²	7	72.7 Å²	72.7	4%	0.042	39%	0.389	C	S	.	.	H	α-helix	trans	-63.8	-43	-179.5	176.9	0	0	0	0	111.5	Y247 L295 K296 A301 E302 A303 P363 L366	Y247-V299 HydrophobicContact CD1-CG1 4.27Å; Y247-V299 HydrophobicContact CD2-CG1 3.86Å; Y247-V299 HydrophobicContact CE1-CG1 4.31Å; Y247-V299 HydrophobicContact CE2-CG1 3.92Å; Y247-V299 HydrophobicContact CG-CG1 4.03Å; L295-V299 WeakPolarHBondContact O-CG2 3.47Å; L295-V299 PolarHBondContact O-N 3.43Å; K296-V299 PolarHBondContact O-N 2.88Å; V299-A301 VanDerWaalsContact C-N 3.28Å; V299-A301 PolarHBondContact O-N 2.95Å; V299-E302 PolarHBondContact O-N 3.14Å; V299-A303 WeakPolarHBondContact O-CB 3.23Å; V299-A303 PolarHBondContact O-N 3.3Å; V299-P363 HydrophobicContact CG2-CB 4.02Å; V299-L366 HydrophobicContact CG1-CD1 4.45Å; V299-L366 HydrophobicContact CG2-CD1 3.5Å
300	C	75.3	Confident	75.2	Confident	47 Å²	47	73.2 Å²	73.2	32%	0.318	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-32.9	176.9	-66.1	0	0	0	0	112.1	K296 K298	K296-C300 WeakPolarHBondContact O-CB 2.87Å; K296-C300 PolarHBondContact O-N 2.77Å; K296-C300 PolarHBondContact O-SG 3.48Å; K298-C300 PolarHBondContact O-N 3.45Å
301	A	75.5	Confident	75	Confident	75 Å²	75	68.4 Å²	68.4	62%	0.62	37%	0.37	S	S	*	.	H	α-helix	trans	-70.9	-42.6	175.4	0	0	0	0	0	111.9	R297 K298 V299 A303 G304	R297-A301 VanDerWaalsContact O-CB 3.3Å; R297-A301 WeakPolarHBondContact O-CB 3.31Å; R297-A301 PolarHBondContact O-N 3.45Å; K298-A301 WeakPolarHBondContact O-CB 3.32Å; K298-A301 PolarHBondContact O-N 2.93Å; V299-A301 VanDerWaalsContact C-N 3.28Å; V299-A301 PolarHBondContact O-N 2.95Å; A301-A303 VanDerWaalsContact C-N 3.33Å; A301-A303 PolarHBondContact O-N 3.29Å; A301-G304 PolarHBondContact O-N 3.42Å
302	E	67.3	Low	75	Confident	135 Å²	135	64.7 Å²	64.7	63%	0.631	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-35.5	178.2	-74.2	172.9	-174.7	0	0	112.7	K298 V299 G304	K298-E302 WeakPolarHBondContact O-CG 3.47Å; K298-E302 PolarHBondContact O-N 3.47Å; V299-E302 PolarHBondContact O-N 3.14Å; E302-G304 PolarHBondContact O-N 3.26Å
303	A	59.9	Low	75.1	Confident	33 Å²	33	64.6 Å²	64.6	27%	0.273	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.7	-179.6	0	0	0	0	0	114.8	V299 A301 G305 C309	V299-A303 WeakPolarHBondContact O-CB 3.23Å; V299-A303 PolarHBondContact O-N 3.3Å; A301-A303 VanDerWaalsContact C-N 3.33Å; A301-A303 PolarHBondContact O-N 3.29Å; A303-G305 PolarHBondContact O-N 3.02Å; A303-G305 VanDerWaalsContact O-N 3.16Å; A303-C309 HydrophobicContact CB-CB 4.49Å; A303-C309 WeakPolarHBondContact CB-SG 3.46Å
304	G	50	Low	75.3	Confident	54 Å²	54	63.9 Å²	63.9	56%	0.557	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	40	154.3	0	0	0	0	0	117	A301 E302 K306	A301-G304 PolarHBondContact O-N 3.42Å; E302-G304 PolarHBondContact O-N 3.26Å; G304-K306 VanDerWaalsContact C-N 3.26Å; G304-K306 PolarHBondContact O-N 3.22Å
305	G	53.6	Low	75.5	Confident	82 Å²	82	58.9 Å²	58.9	85%	0.845	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	3.6	162.8	0	0	0	0	0	118	A303	A303-G305 PolarHBondContact O-N 3.02Å; A303-G305 VanDerWaalsContact O-N 3.16Å
306	K	50.4	Low	75.8	Confident	199 Å²	199	61.2 Å²	61.2	87%	0.865	34%	0.337	S	S	*	.	S	Bend	trans	-92.7	-18.2	-179.2	-72.8	-178.7	179.3	177.8	0	114.4	G304	G304-K306 VanDerWaalsContact C-N 3.26Å; G304-K306 PolarHBondContact O-N 3.22Å
307	E	57.6	Low	76	Confident	130 Å²	130	64.2 Å²	64.2	61%	0.607	35%	0.351	S	S	*	.	S	Bend	trans	-139.3	146.3	177.5	-64.1	-173.3	-177.1	0	0	111.3	N245 C309	N245-E307 PolarHBondContact ND2-OE2 3.08Å; E307-C309 PolarHBondContact O-N 3.39Å; E307-C309 PolarHBondContact O-SG 2.84Å; E307-C309 VanDerWaalsContact O-SG 3.41Å
308	E	63.9	Low	76.3	Confident	142 Å²	142	57.8 Å²	57.8	66%	0.664	33%	0.33	S	S	*	.			trans	-64.3	96.6	174.3	-69.9	-171	174.5	0	0	110	N310	E308-N310 PolarHBondContact O-N 3.46Å; E308-N310 PolarHBondContact O-ND2 3.24Å
309	C	66.1	Low	76.7	Confident	27 Å²	27	52 Å²	52	18%	0.182	31%	0.305	C	S	.	.			trans	-77.1	96.4	178.1	-67	0	0	0	0	109.9	A303 E307	A303-C309 HydrophobicContact CB-CB 4.49Å; A303-C309 WeakPolarHBondContact CB-SG 3.46Å; E307-C309 PolarHBondContact O-N 3.39Å; E307-C309 PolarHBondContact O-SG 2.84Å; E307-C309 VanDerWaalsContact O-SG 3.41Å
310	N	81.1	Confident	77	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.053	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	151.8	175.2	-65.5	-63	0	0	0	110.7	K240 V243 R244 Y247 E308	K240-N310 PolarHBondContact NZ-OD1 3.45Å; V243-N310 HydrophobicContact CB-CB 4.44Å; V243-N310 HydrophobicContact CG1-CB 3.13Å; R244-N310 PolarHBondContact O-ND2 3.3Å; Y247-N310 PolarHBondContact N-O 3.48Å; E308-N310 PolarHBondContact O-N 3.46Å; E308-N310 PolarHBondContact O-ND2 3.24Å
311	F	86.9	Confident	77.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.1	-173.7	-160.1	-93.6	0	0	0	109.6	Y247 L249 I292 L295 K296 V313 I332 V333 L366	Y247-F311 WeakPolarHBondContact O-CA 3.45Å; L249-F311 HydrophobicContact CB-CE1 3.76Å; L249-F311 HydrophobicContact CB-CZ 3.65Å; L249-F311 HydrophobicContact CD2-CE1 4.09Å; L249-F311 HydrophobicContact CD2-CZ 4.12Å; L249-F311 HydrophobicContact CG-CZ 4.42Å; I292-F311 HydrophobicContact CG2-CE1 4.17Å; L295-F311 HydrophobicContact CD2-CE2 4.44Å; L295-F311 HydrophobicContact CD2-CZ 3.95Å; K296-F311 HydrophobicContact CB-CD1 4.5Å; K296-F311 HydrophobicContact CB-CD2 4.37Å; K296-F311 HydrophobicContact CB-CG 4.26Å; K296-F311 HydrophobicContact CD-CB 3.89Å; K296-F311 HydrophobicContact CD-CG 4.38Å; K296-F311 HydrophobicContact CG-CB 4.17Å; K296-F311 HydrophobicContact CG-CG 4.33Å; F311-V313 HydrophobicContact CD1-CG2 3.85Å; F311-V313 HydrophobicContact CE1-CG2 3.61Å; F311-I332 HydrophobicContact CB-CG1 4.34Å; F311-I332 HydrophobicContact CD1-CD1 4.05Å; F311-I332 HydrophobicContact CD1-CG1 4.41Å; F311-I332 HydrophobicContact CD1-CG2 4.06Å; F311-V333 PolarHBondContact O-N 2.82Å; F311-L366 HydrophobicContact CE2-CD1 3.7Å; F311-L366 HydrophobicContact CE2-CD2 3.71Å; F311-L366 HydrophobicContact CE2-CG 4.37Å; F311-L366 HydrophobicContact CZ-CD1 4.42Å; F311-L366 HydrophobicContact CZ-CD2 3.69Å
312	V	91.2	Very high	78.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.4	-179.5	-177.9	0	0	0	0	108.3	V243 A246 Y247 I248 L249 I314 V333 V372	V243-V312 HydrophobicContact CG1-CG2 4.24Å; A246-V312 HydrophobicContact CB-CG2 3.85Å; Y247-V312 PolarHBondContact O-N 3.02Å; I248-V312 CarbonylContact C-O 3.37Å; I248-V312 WeakPolarHBondContact CA-O 3.02Å; I248-V312 HydrophobicContact CG1-CB 4.34Å; L249-V312 PolarHBondContact N-O 3.22Å; V312-I314 HydrophobicContact CG1-CG1 4.12Å; V312-V333 CarbonylContact C-O 3.45Å; V312-V333 WeakPolarHBondContact CA-O 3.39Å; V312-V333 HydrophobicContact CG1-CB 4.42Å; V312-V333 HydrophobicContact CG1-CG1 4.49Å; V312-V333 HydrophobicContact CG2-CB 4.28Å; V312-V372 HydrophobicContact CG2-CB 4.42Å; V312-V372 HydrophobicContact CG2-CG1 4.28Å; V312-V372 HydrophobicContact CG2-CG2 4.46Å
313	V	92.5	Very high	79.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.6	175.9	177.8	0	0	0	0	108.4	L249 I292 F311 I332 V333 A334 L335	L249-V313 HydrophobicContact CB-CG2 4.39Å; L249-V313 HydrophobicContact CD2-CG2 4.31Å; I292-V313 HydrophobicContact CG2-CG2 3.96Å; F311-V313 HydrophobicContact CD1-CG2 3.85Å; F311-V313 HydrophobicContact CE1-CG2 3.61Å; V313-I332 HydrophobicContact CB-CG2 4.37Å; V313-I332 HydrophobicContact CG2-CG2 3.67Å; V313-V333 PolarHBondContact N-O 3.42Å; V313-A334 HydrophobicContact CB-CB 4.43Å; V313-A334 WeakPolarHBondContact O-CA 3.38Å; V313-L335 PolarHBondContact O-N 3.38Å
314	I	93.9	Very high	81.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	109.3	174.9	-52.3	175.1	0	0	0	107.8	L230 I248 L249 C251 V312 L335 A338 L346 I385	L230-I314 HydrophobicContact CD1-CD1 4Å; L230-I314 HydrophobicContact CD1-CG2 4.21Å; I248-I314 HydrophobicContact CG2-CD1 3.56Å; I248-I314 HydrophobicContact CG2-CG1 4.07Å; L249-I314 PolarHBondContact O-N 3.17Å; C251-I314 PolarHBondContact N-O 3.3Å; V312-I314 HydrophobicContact CG1-CG1 4.12Å; I314-L335 HydrophobicContact CG1-CD1 4.27Å; I314-A338 HydrophobicContact CG2-CB 3.71Å; I314-L346 HydrophobicContact CB-CD1 4.18Å; I314-L346 HydrophobicContact CD1-CD1 3.7Å; I314-L346 HydrophobicContact CD1-CD2 3.71Å; I314-L346 HydrophobicContact CD1-CG 4.37Å; I314-L346 HydrophobicContact CG2-CD1 3.7Å; I314-I385 HydrophobicContact CD1-CD1 3.7Å
315	N	93.5	Very high	83.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.5	-177.6	-168.1	12.3	0	0	0	111.8	C251 V253 K317 G318 I319 L335 R336 R337 A338	C251-N315 CarbonylContact O-C 3.59Å; C251-N315 WeakPolarHBondContact O-CA 3.44Å; C251-N315 PolarHBondContact O-OD1 3.44Å; C251-N315 VanDerWaalsContact O-OD1 3.11Å; V253-N315 PolarHBondContact N-OD1 3.38Å; V253-N315 VanDerWaalsContact O-CG 3.28Å; V253-N315 PolarHBondContact O-ND2 3.37Å; V253-N315 PolarHBondContact O-OD1 3.48Å; N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact ND2-O 2.99Å; N315-K317 PolarHBondContact OD1-N 3.33Å; N315-K317 VanDerWaalsContact OD1-N 3.11Å; N315-G318 PolarHBondContact ND2-O 3.16Å; N315-I319 HydrophobicContact CB-CD1 4.16Å; N315-I319 HydrophobicContact CB-CG1 4.3Å; N315-L335 WeakPolarHBondContact CB-O 3.4Å; N315-L335 PolarHBondContact N-O 2.89Å; N315-R336 CarbonylContact O-C 3.58Å; N315-R337 PolarHBondContact O-N 2.79Å; N315-A338 PolarHBondContact O-N 3.38Å
316	Q	93	Very high	84.9	Confident	53 Å²	53	44.8 Å²	44.8	25%	0.248	22%	0.223	C	C	.	.	S	Bend	trans	-67.2	-32.2	171.1	-176.2	-179.4	-11.5	0	0	112.1	C251 N252 R337 M343	C251-Q316 PolarHBondContact O-N 2.88Å; N252-Q316 HydrophobicContact CB-CB 4.26Å; N252-Q316 PolarHBondContact ND2-OE1 2.62Å; N252-Q316 PolarHBondContact OD1-OE1 2.9Å; Q316-R337 VanDerWaalsContact O-CA 3.29Å; Q316-R337 WeakPolarHBondContact O-CA 3.28Å; Q316-M343 HydrophobicContact CB-CE 4.32Å; Q316-M343 HydrophobicContact CB-CG 4.11Å; Q316-M343 HydrophobicContact CB-SD 4.16Å; Q316-M343 HydrophobicContact CG-CG 4.4Å
317	K	92	Very high	86.9	Confident	82 Å²	82	35.3 Å²	35.3	36%	0.357	18%	0.182	S	C	.	.	S	Bend	trans	-93.4	-178.1	179.1	-71	-168.4	173.1	-170	0	111.9	V253 A254 E258 N315 R337	V253-K317 WeakPolarHBondContact O-CB 2.85Å; A254-K317 HydrophobicContact CB-CD 3.7Å; E258-K317 IonicContact OE1-NZ 3.46Å; E258-K317 PolarHBondContact OE1-NZ 2.88Å; N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact ND2-O 2.99Å; N315-K317 PolarHBondContact OD1-N 3.33Å; N315-K317 VanDerWaalsContact OD1-N 3.11Å; K317-R337 PolarHBondContact O-N 3.22Å
318	G	90.9	Very high	88.5	Confident	12 Å²	12	30.5 Å²	30.5	12%	0.124	16%	0.161	C	C	.	.			trans	-68.1	158.6	176.8	0	0	0	0	0	113.4	L255 N315	L255-G318 PolarHBondContact N-O 3.04Å; N315-G318 PolarHBondContact ND2-O 3.16Å
319	I	92.3	Very high	89.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-130.5	123.2	168.1	-52.2	178.3	0	0	0	106.6	L255 N315 L324 F327 A334 R336	L255-I319 HydrophobicContact CB-CB 4.45Å; L255-I319 HydrophobicContact CB-CG1 4.23Å; L255-I319 HydrophobicContact CB-CG2 4.25Å; L255-I319 HydrophobicContact CD1-CD1 4.45Å; L255-I319 HydrophobicContact CD1-CG1 4.25Å; L255-I319 WeakPolarHBondContact O-CA 3.35Å; N315-I319 HydrophobicContact CB-CD1 4.16Å; N315-I319 HydrophobicContact CB-CG1 4.3Å; I319-L324 HydrophobicContact CB-CD2 4.06Å; I319-L324 HydrophobicContact CB-CG 4.41Å; I319-L324 HydrophobicContact CD1-CD2 4.42Å; I319-L324 HydrophobicContact CG2-CD2 3.63Å; I319-L324 HydrophobicContact CG2-CG 3.84Å; I319-F327 HydrophobicContact CD1-CE2 4.49Å; I319-F327 HydrophobicContact CG2-CD2 4.31Å; I319-F327 HydrophobicContact CG2-CE2 4.02Å; I319-A334 HydrophobicContact CD1-CB 3.76Å; I319-R336 HydrophobicContact CB-CB 4.06Å; I319-R336 HydrophobicContact CD1-CB 4.04Å; I319-R336 HydrophobicContact CG1-CB 3.75Å; I319-R336 PolarHBondContact O-NH1 3.07Å
320	D	91.2	Very high	90.8	Very high	35 Å²	35	33.7 Å²	33.7	19%	0.187	17%	0.171	C	C	.	.			trans	-66.1	146.4	177.1	179	65.3	0	0	0	111.3	L255 L322 S323 L324	L255-D320 PolarHBondContact O-N 3.23Å; D320-L322 VanDerWaalsContact C-N 3.25Å; D320-L322 PolarHBondContact O-N 3.08Å; D320-L322 VanDerWaalsContact OD2-CB 3.25Å; D320-L322 WeakPolarHBondContact OD2-CB 3.13Å; D320-L322 WeakPolarHBondContact OD2-CD1 3.47Å; D320-L322 PolarHBondContact OD2-N 3.23Å; D320-S323 WeakPolarHBondContact O-CB 3.37Å; D320-S323 PolarHBondContact O-N 3.46Å; D320-L324 PolarHBondContact O-N 3.11Å
321	P	90.5	Very high	91	Very high	74 Å²	74	34.3 Å²	34.3	48%	0.481	18%	0.18	S	C	.	.	H	α-helix	trans	-53.9	-37.7	178.5	-29.5	38.9	0	0	0	114.3	S323 L324 D325	P321-S323 VanDerWaalsContact C-N 3.27Å; P321-S323 PolarHBondContact O-N 2.9Å; P321-L324 WeakPolarHBondContact O-CB 3.41Å; P321-L324 PolarHBondContact O-N 3.42Å; P321-L324 VanDerWaalsContact O-N 3.13Å; P321-D325 PolarHBondContact O-N 2.81Å
322	L	90.2	Very high	91.1	Very high	66 Å²	66	34.2 Å²	34.2	35%	0.346	18%	0.179	S	C	.	.	H	α-helix	trans	-71.3	-29.8	-178.4	-60.5	151.7	0	0	0	111.6	R282 D320 D325 M326	R282-L322 VanDerWaalsContact NH2-CB 3.3Å; D320-L322 VanDerWaalsContact C-N 3.25Å; D320-L322 PolarHBondContact O-N 3.08Å; D320-L322 VanDerWaalsContact OD2-CB 3.25Å; D320-L322 WeakPolarHBondContact OD2-CB 3.13Å; D320-L322 WeakPolarHBondContact OD2-CD1 3.47Å; D320-L322 PolarHBondContact OD2-N 3.23Å; L322-D325 PolarHBondContact O-N 3.42Å; L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 3.13Å
323	S	91.2	Very high	91.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-71.9	-36.2	172.7	-62.1	0	0	0	0	111	D320 P321 D325 M326 F327	D320-S323 WeakPolarHBondContact O-CB 3.37Å; D320-S323 PolarHBondContact O-N 3.46Å; P321-S323 VanDerWaalsContact C-N 3.27Å; P321-S323 PolarHBondContact O-N 2.9Å; S323-D325 VanDerWaalsContact C-N 3.34Å; S323-M326 PolarHBondContact O-N 2.81Å; S323-F327 WeakPolarHBondContact O-CD2 3.22Å; S323-F327 WeakPolarHBondContact O-CG 3.32Å; S323-F327 PolarHBondContact O-N 3.37Å
324	L	92	Very high	91.1	Very high	9 Å²	9	34.7 Å²	34.7	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-41.8	171.1	-64.9	173.3	0	0	0	111.3	R235 H236 M239 I319 D320 P321 M326 F327 V328 A334	R235-L324 HydrophobicContact CB-CD1 4.39Å; H236-L324 HydrophobicContact CB-CB 4.32Å; M239-L324 HydrophobicContact CE-CB 4.1Å; M239-L324 HydrophobicContact CE-CD2 3.63Å; M239-L324 HydrophobicContact CE-CG 4.46Å; I319-L324 HydrophobicContact CB-CD2 4.06Å; I319-L324 HydrophobicContact CB-CG 4.41Å; I319-L324 HydrophobicContact CD1-CD2 4.42Å; I319-L324 HydrophobicContact CG2-CD2 3.63Å; I319-L324 HydrophobicContact CG2-CG 3.84Å; D320-L324 PolarHBondContact O-N 3.11Å; P321-L324 WeakPolarHBondContact O-CB 3.41Å; P321-L324 PolarHBondContact O-N 3.42Å; P321-L324 VanDerWaalsContact O-N 3.13Å; L324-M326 VanDerWaalsContact C-N 3.31Å; L324-M326 PolarHBondContact O-N 2.95Å; L324-F327 WeakPolarHBondContact O-CB 3.49Å; L324-F327 PolarHBondContact O-N 3.35Å; L324-F327 VanDerWaalsContact O-N 3.16Å; L324-V328 WeakPolarHBondContact O-CG2 3.44Å; L324-V328 PolarHBondContact O-N 2.81Å; L324-A334 HydrophobicContact CD2-CB 4.06Å
325	D	91.9	Very high	91.1	Very high	60 Å²	60	34.8 Å²	34.8	32%	0.321	18%	0.183	S	C	.	.	H	α-helix	trans	-62	-39	176.5	-61.6	-10.1	0	0	0	111.9	H236 P321 L322 S323 F327 V328 K329	H236-D325 IonicContact CD2-OD1 3.92Å; H236-D325 PolarHBondContact CD2-OD1 3.49Å; H236-D325 IonicContact NE2-OD1 3.6Å; H236-D325 PolarHBondContact NE2-OD1 2.97Å; H236-D325 VanDerWaalsContact NE2-OD1 3.11Å; P321-D325 PolarHBondContact O-N 2.81Å; L322-D325 PolarHBondContact O-N 3.42Å; S323-D325 VanDerWaalsContact C-N 3.34Å; D325-F327 VanDerWaalsContact C-N 3.35Å; D325-V328 PolarHBondContact O-N 3Å; D325-K329 WeakPolarHBondContact O-CG 3.22Å; D325-K329 PolarHBondContact O-N 3.43Å
326	M	91.7	Very high	91	Very high	37 Å²	37	37.1 Å²	37.1	18%	0.182	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-40.7	174.6	-66.9	-172.9	-139.7	0	0	111.7	D286 V289 I293 L322 S323 L324 E330	D286-M326 HydrophobicContact CB-CE 4.44Å; D286-M326 WeakPolarHBondContact OD1-CE 3.4Å; V289-M326 HydrophobicContact CG1-CB 3.97Å; V289-M326 HydrophobicContact CG1-SD 4.08Å; I293-M326 HydrophobicContact CD1-CB 4.29Å; L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 3.13Å; S323-M326 PolarHBondContact O-N 2.81Å; L324-M326 VanDerWaalsContact C-N 3.31Å; L324-M326 PolarHBondContact O-N 2.95Å; M326-E330 PolarHBondContact O-N 2.84Å
327	F	91.9	Very high	90.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-40.4	175.4	-71.8	-45.6	0	0	0	112.4	M239 L255 V289 I292 I319 S323 L324 D325 E330 G331 I332 A334	M239-F327 HydrophobicContact CE-CB 4.22Å; L255-F327 HydrophobicContact CD1-CE2 3.98Å; L255-F327 HydrophobicContact CD1-CZ 3.91Å; V289-F327 HydrophobicContact CG1-CD1 4.39Å; V289-F327 HydrophobicContact CG1-CE1 3.9Å; V289-F327 HydrophobicContact CG1-CE2 4.48Å; V289-F327 HydrophobicContact CG1-CZ 3.96Å; V289-F327 HydrophobicContact CG2-CZ 4.36Å; I292-F327 HydrophobicContact CB-CE1 4.28Å; I292-F327 HydrophobicContact CD1-CZ 4.16Å; I292-F327 HydrophobicContact CG2-CE1 3.89Å; I292-F327 HydrophobicContact CG2-CZ 4.42Å; I319-F327 HydrophobicContact CD1-CE2 4.49Å; I319-F327 HydrophobicContact CG2-CD2 4.31Å; I319-F327 HydrophobicContact CG2-CE2 4.02Å; S323-F327 WeakPolarHBondContact O-CD2 3.22Å; S323-F327 WeakPolarHBondContact O-CG 3.32Å; S323-F327 PolarHBondContact O-N 3.37Å; L324-F327 WeakPolarHBondContact O-CB 3.49Å; L324-F327 PolarHBondContact O-N 3.35Å; L324-F327 VanDerWaalsContact O-N 3.16Å; D325-F327 VanDerWaalsContact C-N 3.35Å; F327-E330 CarbonylContact O-C 3.57Å; F327-E330 PolarHBondContact O-N 3.13Å; F327-G331 PolarHBondContact O-N 3.31Å; F327-I332 HydrophobicContact CB-CB 3.99Å; F327-I332 HydrophobicContact CB-CG2 4.39Å; F327-I332 HydrophobicContact CD1-CB 4.05Å; F327-I332 HydrophobicContact CD1-CD1 3.92Å; F327-I332 HydrophobicContact CD1-CG1 4.48Å; F327-I332 HydrophobicContact CD1-CG2 4.01Å; F327-I332 HydrophobicContact CE1-CD1 4.4Å; F327-I332 HydrophobicContact CG-CB 4.37Å; F327-I332 HydrophobicContact CG-CG2 4.35Å; F327-I332 PolarHBondContact O-N 3.26Å; F327-A334 HydrophobicContact CB-CB 4.36Å; F327-A334 HydrophobicContact CD2-CB 3.64Å; F327-A334 HydrophobicContact CE2-CB 4.17Å; F327-A334 HydrophobicContact CG-CB 4.13Å
328	V	91.3	Very high	90.9	Very high	29 Å²	29	38.5 Å²	38.5	18%	0.176	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-44.2	177.5	170.2	0	0	0	0	111.3	H236 D238 M239 L324 D325 E330 G331	H236-V328 HydrophobicContact CB-CG2 3.83Å; H236-V328 VanDerWaalsContact CG-CG2 3.42Å; H236-V328 VanDerWaalsContact ND1-CG2 3.33Å; H236-V328 WeakPolarHBondContact ND1-CG2 3.45Å; D238-V328 HydrophobicContact CB-CG1 3.69Å; M239-V328 HydrophobicContact CE-CG2 3.78Å; M239-V328 HydrophobicContact CG-CG2 3.62Å; L324-V328 WeakPolarHBondContact O-CG2 3.44Å; L324-V328 PolarHBondContact O-N 2.81Å; D325-V328 PolarHBondContact O-N 3Å; V328-E330 PolarHBondContact O-N 3.28Å; V328-G331 WeakPolarHBondContact O-CA 3.34Å; V328-G331 PolarHBondContact O-N 2.87Å
329	K	89.8	Confident	91	Very high	176 Å²	176	42.2 Å²	42.2	77%	0.765	21%	0.206	S	C	*	.	H	α-helix	trans	-57.2	-35.7	177.6	-76.2	174.8	-176.5	179.2	0	112.7	D325	D325-K329 WeakPolarHBondContact O-CG 3.22Å; D325-K329 PolarHBondContact O-N 3.43Å
330	E	87.3	Confident	91	Very high	61 Å²	61	50.7 Å²	50.7	29%	0.285	24%	0.238	S	C	.	.	H	α-helix	trans	-87.2	-9.2	176.2	-63.3	-72.8	148	0	0	112.1	I293 K296 R297 M326 F327 V328 I332	I293-E330 HydrophobicContact CD1-CG 4.08Å; I293-E330 HydrophobicContact CG1-CG 4.1Å; I293-E330 HydrophobicContact CG2-CG 3.72Å; K296-E330 PolarHBondContact NZ-O 3.3Å; R297-E330 IonicContact CZ-OE1 3.89Å; R297-E330 IonicContact CZ-OE2 3.35Å; R297-E330 IonicContact NE-OE1 3.43Å; R297-E330 IonicContact NE-OE2 3.34Å; R297-E330 PolarHBondContact NE-OE2 2.95Å; R297-E330 IonicContact NH2-OE1 2.59Å; R297-E330 PolarHBondContact NH2-OE1 3.46Å; R297-E330 IonicContact NH2-OE2 2.9Å; M326-E330 PolarHBondContact O-N 2.84Å; F327-E330 CarbonylContact O-C 3.57Å; F327-E330 PolarHBondContact O-N 3.13Å; V328-E330 PolarHBondContact O-N 3.28Å; E330-I332 HydrophobicContact CB-CD1 4.41Å; E330-I332 HydrophobicContact CB-CG1 4.23Å
331	G	85.4	Confident	91	Very high	23 Å²	23	57.9 Å²	57.9	24%	0.237	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	38.7	-176.2	0	0	0	0	0	113.7	K296 F327 V328	K296-G331 PolarHBondContact NZ-O 3.47Å; K296-G331 VanDerWaalsContact NZ-O 3.12Å; F327-G331 PolarHBondContact O-N 3.31Å; V328-G331 WeakPolarHBondContact O-CA 3.34Å; V328-G331 PolarHBondContact O-N 2.87Å
332	I	90	Very high	91	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.9	174.8	-60.7	-174.1	0	0	0	109.3	K296 F311 V313 F327 E330	K296-I332 HydrophobicContact CB-CD1 4.09Å; K296-I332 HydrophobicContact CD-CD1 3.39Å; K296-I332 HydrophobicContact CD-CG1 3.38Å; K296-I332 HydrophobicContact CG-CD1 4.35Å; F311-I332 HydrophobicContact CB-CG1 4.34Å; F311-I332 HydrophobicContact CD1-CD1 4.05Å; F311-I332 HydrophobicContact CD1-CG1 4.41Å; F311-I332 HydrophobicContact CD1-CG2 4.06Å; V313-I332 HydrophobicContact CB-CG2 4.37Å; V313-I332 HydrophobicContact CG2-CG2 3.67Å; F327-I332 HydrophobicContact CB-CB 3.99Å; F327-I332 HydrophobicContact CB-CG2 4.39Å; F327-I332 HydrophobicContact CD1-CB 4.05Å; F327-I332 HydrophobicContact CD1-CD1 3.92Å; F327-I332 HydrophobicContact CD1-CG1 4.48Å; F327-I332 HydrophobicContact CD1-CG2 4.01Å; F327-I332 HydrophobicContact CE1-CD1 4.4Å; F327-I332 HydrophobicContact CG-CB 4.37Å; F327-I332 HydrophobicContact CG-CG2 4.35Å; F327-I332 PolarHBondContact O-N 3.26Å; E330-I332 HydrophobicContact CB-CD1 4.41Å; E330-I332 HydrophobicContact CB-CG1 4.23Å
333	V	91	Very high	91	Very high	8 Å²	8	51.9 Å²	51.9	5%	0.048	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.9	169.4	179	0	0	0	0	108	A234 K240 V243 F311 V312 V313	A234-V333 HydrophobicContact CB-CG1 4.37Å; K240-V333 HydrophobicContact CB-CG2 4.11Å; K240-V333 VanDerWaalsContact O-CG2 3.29Å; K240-V333 WeakPolarHBondContact O-CG2 3.28Å; V243-V333 HydrophobicContact CG2-CG2 3.66Å; F311-V333 PolarHBondContact O-N 2.82Å; V312-V333 CarbonylContact C-O 3.45Å; V312-V333 WeakPolarHBondContact CA-O 3.39Å; V312-V333 HydrophobicContact CG1-CB 4.42Å; V312-V333 HydrophobicContact CG1-CG1 4.49Å; V312-V333 HydrophobicContact CG2-CB 4.28Å; V313-V333 PolarHBondContact N-O 3.42Å
334	A	92.5	Very high	90.8	Very high	2 Å²	2	57.5 Å²	57.5	2%	0.017	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.9	-179	0	0	0	0	0	111.1	M239 V313 I319 L324 F327	M239-A334 HydrophobicContact CE-CB 3.93Å; V313-A334 HydrophobicContact CB-CB 4.43Å; V313-A334 WeakPolarHBondContact O-CA 3.38Å; I319-A334 HydrophobicContact CD1-CB 3.76Å; L324-A334 HydrophobicContact CD2-CB 4.06Å; F327-A334 HydrophobicContact CB-CB 4.36Å; F327-A334 HydrophobicContact CD2-CB 3.64Å; F327-A334 HydrophobicContact CE2-CB 4.17Å; F327-A334 HydrophobicContact CG-CB 4.13Å
335	L	93	Very high	90.8	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.2	172.2	-61.4	-178.8	0	0	0	109.7	L230 V313 I314 N315 T383	L230-L335 HydrophobicContact CD1-CD1 3.46Å; L230-L335 VanDerWaalsContact CD1-CD1 3.46Å; V313-L335 PolarHBondContact O-N 3.38Å; I314-L335 HydrophobicContact CG1-CD1 4.27Å; N315-L335 WeakPolarHBondContact CB-O 3.4Å; N315-L335 PolarHBondContact N-O 2.89Å; L335-T383 HydrophobicContact CD1-CG2 4.08Å
336	R	92	Very high	90.7	Very high	50 Å²	50	55.7 Å²	55.7	19%	0.189	24%	0.241	C	C	.	.			trans	-115.4	151.1	179.7	69.6	-179.3	-168.4	-179.3	3.9	111.3	R235 N315 I319 A338	R235-R336 VanDerWaalsContact CD-CZ 3.46Å; R235-R336 VanDerWaalsContact CD-NE 3.31Å; R235-R336 VanDerWaalsContact CD-NH2 3.27Å; R235-R336 VanDerWaalsContact NE-NE 3.12Å; N315-R336 CarbonylContact O-C 3.58Å; I319-R336 HydrophobicContact CB-CB 4.06Å; I319-R336 HydrophobicContact CD1-CB 4.04Å; I319-R336 HydrophobicContact CG1-CB 3.75Å; I319-R336 PolarHBondContact O-NH1 3.07Å; R336-A338 VanDerWaalsContact C-N 3.33Å; R336-A338 PolarHBondContact O-N 2.69Å
337	R	91.5	Very high	90.6	Very high	157 Å²	157	55.2 Å²	55.2	59%	0.592	24%	0.241	S	C	*	.	S	Bend	trans	61.2	33.6	175	-57.7	-173.1	178.6	-154.7	-0.8	114.8	H232 N315 Q316 K317 K339	H232-R337 PolarHBondContact CD2-O 3.38Å; H232-R337 VanDerWaalsContact CD2-O 3.29Å; H232-R337 PolarHBondContact NE2-O 3.34Å; N315-R337 PolarHBondContact O-N 2.79Å; Q316-R337 VanDerWaalsContact O-CA 3.29Å; Q316-R337 WeakPolarHBondContact O-CA 3.28Å; K317-R337 PolarHBondContact O-N 3.22Å; R337-K339 PolarHBondContact O-N 3.45Å
338	A	91.9	Very high	90.4	Very high	6 Å²	6	57.5 Å²	57.5	5%	0.05	25%	0.253	C	S	.	.			trans	-54.7	139.5	174.6	0	0	0	0	0	111.7	I314 N315 R336 R340	I314-A338 HydrophobicContact CG2-CB 3.71Å; N315-A338 PolarHBondContact O-N 3.38Å; R336-A338 VanDerWaalsContact C-N 3.33Å; R336-A338 PolarHBondContact O-N 2.69Å; A338-R340 PolarHBondContact O-N 2.97Å
339	K	92.4	Very high	90.2	Very high	90 Å²	90	56.2 Å²	56.2	39%	0.391	25%	0.245	S	C	.	.			trans	-58.9	138.9	176.7	-71.6	176.8	-177.1	156.3	0	110.4	D231 R337 R341 N342 M343	D231-K339 VanDerWaalsContact CG-NZ 3.34Å; D231-K339 IonicContact OD1-NZ 3.8Å; D231-K339 WeakPolarHBondContact OD2-CE 3.44Å; D231-K339 IonicContact OD2-NZ 3.96Å; D231-K339 PolarHBondContact OD2-NZ 3.12Å; R337-K339 PolarHBondContact O-N 3.45Å; K339-R341 PolarHBondContact O-N 2.91Å; K339-N342 WeakPolarHBondContact O-CB 3.17Å; K339-N342 PolarHBondContact O-N 2.95Å; K339-M343 PolarHBondContact O-N 2.81Å
340	R	91.5	Very high	90	Very high	178 Å²	178	48.3 Å²	48.3	67%	0.672	21%	0.212	S	C	*	.	H	α-helix	trans	-54.4	-37.8	176.6	-177.1	177.8	172.6	175.1	-0.6	112.8	A338 N342 M343	A338-R340 PolarHBondContact O-N 2.97Å; R340-N342 PolarHBondContact O-N 3.06Å; R340-M343 VanDerWaalsContact O-CB 3.3Å; R340-M343 WeakPolarHBondContact O-CB 3.33Å; R340-M343 PolarHBondContact O-N 3.24Å; R340-M343 VanDerWaalsContact O-N 3.09Å
341	R	91.2	Very high	89.9	Confident	186 Å²	186	48.3 Å²	48.3	70%	0.702	23%	0.228	S	C	*	.	H	α-helix	trans	-58.6	-35.3	176.7	-61.5	179.7	-176.9	175.8	-0.5	112.1	K339 M343 E344 R345	K339-R341 PolarHBondContact O-N 2.91Å; R341-M343 VanDerWaalsContact C-N 3.28Å; R341-M343 PolarHBondContact O-N 3.21Å; R341-E344 PolarHBondContact O-N 2.57Å; R341-R345 PolarHBondContact O-N 3.21Å
342	N	91.3	Very high	89.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-76.5	-23.2	-177.5	-62.3	12.1	0	0	0	110.5	E210 L228 L230 K339 R340 E344 R345 L346	E210-N342 PolarHBondContact OE1-ND2 3.07Å; E210-N342 PolarHBondContact OE1-OD1 3.35Å; E210-N342 PolarHBondContact OE2-OD1 3.18Å; L228-N342 HydrophobicContact CD2-CB 4.02Å; L230-N342 HydrophobicContact CD2-CB 3.86Å; L230-N342 WeakPolarHBondContact CD2-ND2 3.06Å; K339-N342 WeakPolarHBondContact O-CB 3.17Å; K339-N342 PolarHBondContact O-N 2.95Å; R340-N342 PolarHBondContact O-N 3.06Å; N342-E344 PolarHBondContact O-N 3.29Å; N342-R345 PolarHBondContact O-N 3.49Å; N342-L346 WeakPolarHBondContact O-CB 3.43Å; N342-L346 WeakPolarHBondContact O-CD1 3.03Å; N342-L346 WeakPolarHBondContact O-CG 3.21Å; N342-L346 PolarHBondContact O-N 3.31Å
343	M	89.3	Confident	89.9	Confident	13 Å²	13	51.5 Å²	51.5	6%	0.064	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-21.7	172.5	-60.1	-62.4	-69.8	0	0	113.4	I250 C251 Q316 K339 R340 R341 P347 A354	I250-M343 HydrophobicContact CG2-CE 3.24Å; I250-M343 HydrophobicContact CG2-SD 3.82Å; C251-M343 VanDerWaalsContact O-CE 3.23Å; C251-M343 WeakPolarHBondContact O-CE 3.43Å; Q316-M343 HydrophobicContact CB-CE 4.32Å; Q316-M343 HydrophobicContact CB-CG 4.11Å; Q316-M343 HydrophobicContact CB-SD 4.16Å; Q316-M343 HydrophobicContact CG-CG 4.4Å; K339-M343 PolarHBondContact O-N 2.81Å; R340-M343 VanDerWaalsContact O-CB 3.3Å; R340-M343 WeakPolarHBondContact O-CB 3.33Å; R340-M343 PolarHBondContact O-N 3.24Å; R340-M343 VanDerWaalsContact O-N 3.09Å; R341-M343 VanDerWaalsContact C-N 3.28Å; R341-M343 PolarHBondContact O-N 3.21Å; M343-P347 WeakPolarHBondContact O-CD 3.46Å; M343-P347 WeakPolarHBondContact O-CG 3.31Å; M343-A354 HydrophobicContact CE-CB 4.48Å
344	E	88.7	Confident	89.9	Confident	119 Å²	119	53.1 Å²	53.1	56%	0.556	26%	0.258	S	S	*	.	H	α-helix	trans	-86.5	-32.6	172.9	-67.4	169.9	-172	0	0	111.1	R341 N342	R341-E344 PolarHBondContact O-N 2.57Å; N342-E344 PolarHBondContact O-N 3.29Å
345	R	90.3	Very high	89.9	Confident	30 Å²	30	53.9 Å²	53.9	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-78.2	-40.4	-179.9	-67.5	176.7	179.9	157.5	-8.7	113.8	H207 E210 L228 R341 N342 L348 A349 S393	H207-R345 PolarHBondContact O-NE 3.32Å; H207-R345 PolarHBondContact O-NH2 3.48Å; E210-R345 VanDerWaalsContact CB-NH1 3.33Å; E210-R345 IonicContact OE1-NH1 3.1Å; E210-R345 PolarHBondContact OE1-NH1 3.06Å; E210-R345 WeakPolarHBondContact OE2-CD 3.5Å; E210-R345 IonicContact OE2-CZ 2.75Å; E210-R345 IonicContact OE2-NH1 3.67Å; E210-R345 PolarHBondContact OE2-NH1 3.48Å; L228-R345 HydrophobicContact CD1-CB 3.83Å; L228-R345 HydrophobicContact CD1-CG 4.5Å; L228-R345 HydrophobicContact CD2-CB 4.27Å; R341-R345 PolarHBondContact O-N 3.21Å; N342-R345 PolarHBondContact O-N 3.49Å; R345-L348 PolarHBondContact O-N 3.44Å; R345-A349 PolarHBondContact O-N 3.25Å; R345-S393 WeakPolarHBondContact CB-OG 3.29Å
346	L	90.8	Very high	89.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.3	-44.8	-179	-76.1	165.4	0	0	0	112.9	L228 I250 I314 N342 L348 A349 C350 I385	L228-L346 HydrophobicContact CB-CD2 4.37Å; L228-L346 HydrophobicContact CD2-CD1 4.44Å; L228-L346 HydrophobicContact CD2-CD2 3.5Å; L228-L346 VanDerWaalsContact CD2-CD2 3.5Å; L228-L346 HydrophobicContact CD2-CG 3.54Å; I250-L346 HydrophobicContact CD1-CB 3.61Å; I250-L346 HydrophobicContact CG1-CB 4.06Å; I314-L346 HydrophobicContact CB-CD1 4.18Å; I314-L346 HydrophobicContact CD1-CD1 3.7Å; I314-L346 HydrophobicContact CD1-CD2 3.71Å; I314-L346 HydrophobicContact CD1-CG 4.37Å; I314-L346 HydrophobicContact CG2-CD1 3.7Å; N342-L346 WeakPolarHBondContact O-CB 3.43Å; N342-L346 WeakPolarHBondContact O-CD1 3.03Å; N342-L346 WeakPolarHBondContact O-CG 3.21Å; N342-L346 PolarHBondContact O-N 3.31Å; L346-L348 PolarHBondContact O-N 2.84Å; L346-A349 PolarHBondContact O-N 3.35Å; L346-C350 WeakPolarHBondContact O-CB 3.45Å; L346-C350 PolarHBondContact O-N 3.43Å; L346-I385 HydrophobicContact CD2-CD1 3.51Å
347	P	90.2	Very high	89.5	Confident	28 Å²	28	60 Å²	60	18%	0.182	30%	0.304	C	S	.	.	H	α-helix	trans	-55.8	-40.1	172.3	-31.8	39.9	0	0	0	113.4	I250 M343 G351 G352 A354	I250-P347 HydrophobicContact CD1-CG 4Å; M343-P347 WeakPolarHBondContact O-CD 3.46Å; M343-P347 WeakPolarHBondContact O-CG 3.31Å; P347-G351 WeakPolarHBondContact O-CA 3.3Å; P347-G351 PolarHBondContact O-N 3.43Å; P347-G352 WeakPolarHBondContact CA-O 3.31Å; P347-G352 WeakPolarHBondContact CB-O 3.37Å; P347-A354 HydrophobicContact CG-CB 4.32Å
348	L	86.8	Confident	89.3	Confident	48 Å²	48	52.8 Å²	52.8	25%	0.251	28%	0.277	S	S	.	.	H	α-helix	trans	-77.5	-33.1	-177.2	-63.8	-179.8	0	0	0	112.7	R199 M208 R345 L346 K392	R199-L348 VanDerWaalsContact NH2-CD2 3.31Å; M208-L348 HydrophobicContact CE-CD1 3.79Å; M208-L348 HydrophobicContact CG-CD1 4.43Å; M208-L348 HydrophobicContact SD-CD1 3.29Å; M208-L348 WeakPolarHBondContact SD-CD1 3.19Å; R345-L348 PolarHBondContact O-N 3.44Å; L346-L348 PolarHBondContact O-N 2.84Å; L348-K392 HydrophobicContact CB-CB 4.23Å; L348-K392 WeakPolarHBondContact O-CB 3.46Å; L348-K392 PolarHBondContact O-N 3.1Å
349	A	87.1	Confident	88.9	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-74	-53	174.9	0	0	0	0	0	111.4	R345 L346 C388	R345-A349 PolarHBondContact O-N 3.25Å; L346-A349 PolarHBondContact O-N 3.35Å; A349-C388 WeakPolarHBondContact O-CB 3.28Å
350	C	86.3	Confident	88.3	Confident	10 Å²	10	60 Å²	60	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-97.1	-11	-168.8	-49.8	0	0	0	0	114.3	I248 L346 G352 G367 R368	I248-C350 HydrophobicContact CD1-CB 4.19Å; I248-C350 WeakPolarHBondContact CD1-SG 3.18Å; L346-C350 WeakPolarHBondContact O-CB 3.45Å; L346-C350 PolarHBondContact O-N 3.43Å; C350-G352 VanDerWaalsContact C-N 3.34Å; C350-G367 CarbonylContact O-C 3.57Å; C350-G367 VanDerWaalsContact O-CA 3.28Å; C350-G367 WeakPolarHBondContact O-CA 3.38Å; C350-R368 PolarHBondContact O-N 3.43Å
351	G	84.6	Confident	87.9	Confident	61 Å²	61	52.7 Å²	52.7	63%	0.629	29%	0.293	S	S	*	.			trans	79.8	7.1	-177.6	0	0	0	0	0	115.6	P347	P347-G351 WeakPolarHBondContact O-CA 3.3Å; P347-G351 PolarHBondContact O-N 3.43Å
352	G	85.9	Confident	87.5	Confident	4 Å²	4	46.8 Å²	46.8	4%	0.041	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-83.8	165.7	179.9	0	0	0	0	0	113.7	P347 C350 V365	P347-G352 WeakPolarHBondContact CA-O 3.31Å; P347-G352 WeakPolarHBondContact CB-O 3.37Å; C350-G352 VanDerWaalsContact C-N 3.34Å; G352-V365 WeakPolarHBondContact CA-O 3.3Å
353	V	90.3	Very high	87.1	Confident	88 Å²	88	49.2 Å²	49.2	53%	0.533	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-103.7	134.7	174	-179.6	0	0	0	0	109.7	V355 V365	V353-V355 PolarHBondContact O-N 2.93Å; V353-V365 HydrophobicContact CB-CG1 4.12Å; V353-V365 PolarHBondContact N-O 3.13Å
354	A	90.9	Very high	86.9	Confident	42 Å²	42	56.9 Å²	56.9	35%	0.347	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-73	121.6	176.2	0	0	0	0	0	111	I250 M343 P347	I250-A354 HydrophobicContact CG2-CB 3.87Å; M343-A354 HydrophobicContact CE-CB 4.48Å; P347-A354 HydrophobicContact CG-CB 4.32Å
355	V	91.2	Very high	86.9	Confident	18 Å²	18	52.5 Å²	52.5	11%	0.109	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-103.4	133.7	-173.7	-175	0	0	0	0	112	L249 I250 C251 N252 V353 S357 L361 V365	L249-V355 HydrophobicContact CD1-CG2 4.44Å; I250-V355 PolarHBondContact O-N 2.63Å; C251-V355 CarbonylContact C-O 3.54Å; C251-V355 WeakPolarHBondContact CA-O 3.3Å; N252-V355 PolarHBondContact N-O 3.4Å; V353-V355 PolarHBondContact O-N 2.93Å; V355-S357 WeakPolarHBondContact CG1-O 3.22Å; V355-L361 HydrophobicContact CB-CD2 4.4Å; V355-L361 HydrophobicContact CG1-CD2 3.91Å; V355-L361 HydrophobicContact CG2-CD2 4.12Å; V355-V365 HydrophobicContact CG2-CG1 3.18Å
356	N	90.3	Very high	86.8	Confident	120 Å²	120	51.7 Å²	51.7	64%	0.642	31%	0.309	S	S	*	.	S	Bend	trans	-99.6	-20.7	176.5	-66.7	-39.7	0	0	0	114.3	V253	V253-N356 WeakPolarHBondContact CG2-O 3.24Å
357	S	87.4	Confident	86.7	Confident	60 Å²	60	51.8 Å²	51.8	42%	0.42	31%	0.309	S	S	.	.			trans	-134.9	144	177.8	-175.3	0	0	0	0	111.6	V355 D359	V355-S357 WeakPolarHBondContact CG1-O 3.22Å; S357-D359 VanDerWaalsContact C-N 3.32Å; S357-D359 PolarHBondContact OG-OD2 3.01Å
358	V	86.4	Confident	86.6	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.036	32%	0.323	C	S	.	.	S	Bend	trans	-82.6	-10.6	-176.5	-164.2	0	0	0	0	112.1	V253 R288 K291 I292 N360 L361	V253-V358 HydrophobicContact CB-CG2 4.2Å; V253-V358 HydrophobicContact CG1-CG2 3.74Å; V253-V358 HydrophobicContact CG2-CG2 3.81Å; R288-V358 HydrophobicContact CB-CG2 4.33Å; R288-V358 HydrophobicContact CG-CG2 4.47Å; R288-V358 WeakPolarHBondContact O-CG1 3.38Å; K291-V358 HydrophobicContact CB-CG1 3.51Å; K291-V358 HydrophobicContact CD-CG1 4.25Å; I292-V358 HydrophobicContact CD1-CG1 4.42Å; I292-V358 HydrophobicContact CG1-CG1 3.71Å; V358-N360 PolarHBondContact O-N 3.22Å; V358-L361 HydrophobicContact CB-CD1 4.3Å; V358-L361 HydrophobicContact CG1-CD1 3.47Å; V358-L361 VanDerWaalsContact CG1-CD1 3.47Å; V358-L361 HydrophobicContact CG1-CG 4.43Å; V358-L361 WeakPolarHBondContact O-CG 3.36Å
359	D	83.1	Confident	86.7	Confident	99 Å²	99	54.3 Å²	54.3	53%	0.529	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.7	-169.5	-61.9	-39.8	0	0	0	113.7	K291 S357	K291-D359 IonicContact NZ-OD1 3.92Å; K291-D359 PolarHBondContact NZ-OD1 3.22Å; S357-D359 VanDerWaalsContact C-N 3.32Å; S357-D359 PolarHBondContact OG-OD2 3.01Å
360	N	80.5	Confident	86.7	Confident	147 Å²	147	54.9 Å²	54.9	79%	0.786	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	55.3	-175.2	-66.6	-23.4	0	0	0	111.1	V358	V358-N360 PolarHBondContact O-N 3.22Å
361	L	82.5	Confident	87	Confident	25 Å²	25	56.2 Å²	56.2	13%	0.131	33%	0.325	C	S	.	.			trans	-83.1	115	176.2	-72.7	171.6	0	0	0	110.9	L249 I292 L295 V355 V358	L249-L361 HydrophobicContact CD1-CD2 3.85Å; I292-L361 HydrophobicContact CG1-CD1 4.31Å; L295-L361 HydrophobicContact CD1-CB 3.96Å; L295-L361 HydrophobicContact CD2-CB 4.01Å; L295-L361 HydrophobicContact CD2-CD1 4.12Å; L295-L361 HydrophobicContact CD2-CD2 4.36Å; L295-L361 HydrophobicContact CD2-CG 4.41Å; L295-L361 HydrophobicContact CG-CB 4.41Å; V355-L361 HydrophobicContact CB-CD2 4.4Å; V355-L361 HydrophobicContact CG1-CD2 3.91Å; V355-L361 HydrophobicContact CG2-CD2 4.12Å; V358-L361 HydrophobicContact CB-CD1 4.3Å; V358-L361 HydrophobicContact CG1-CD1 3.47Å; V358-L361 VanDerWaalsContact CG1-CD1 3.47Å; V358-L361 HydrophobicContact CG1-CG 4.43Å; V358-L361 WeakPolarHBondContact O-CG 3.36Å
362	T	82.8	Confident	87.3	Confident	63 Å²	63	53.4 Å²	53.4	39%	0.387	30%	0.296	S	S	.	.			trans	-104.1	154.2	169.5	59.1	0	0	0	0	110.8	E364 V365	T362-E364 PolarHBondContact O-N 2.92Å; T362-V365 PolarHBondContact O-N 3.47Å; T362-V365 WeakPolarHBondContact OG1-CG2 3.23Å
363	P	83.9	Confident	87.7	Confident	51 Å²	51	55.5 Å²	55.5	33%	0.331	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-65.2	-26	178.3	25.2	-33.8	0	0	0	113	V299 V365 L366	V299-P363 HydrophobicContact CG2-CB 4.02Å; P363-V365 PolarHBondContact O-N 3.44Å; P363-L366 WeakPolarHBondContact O-CB 3.07Å; P363-L366 PolarHBondContact O-N 3.31Å
364	E	84.7	Confident	87.8	Confident	175 Å²	175	52.2 Å²	52.2	82%	0.818	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-64.7	-22.7	178.8	-61.6	177.9	174.5	0	0	113.9	T362 L366	T362-E364 PolarHBondContact O-N 2.92Å; E364-L366 PolarHBondContact O-N 3.45Å
365	V	88.1	Confident	87.8	Confident	27 Å²	27	53.9 Å²	53.9	16%	0.164	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-76.6	-14.6	-178.1	163.5	0	0	0	0	112.1	G352 V353 V355 T362 P363	G352-V365 WeakPolarHBondContact CA-O 3.3Å; V353-V365 HydrophobicContact CB-CG1 4.12Å; V353-V365 PolarHBondContact N-O 3.13Å; V355-V365 HydrophobicContact CG2-CG1 3.18Å; T362-V365 PolarHBondContact O-N 3.47Å; T362-V365 WeakPolarHBondContact OG1-CG2 3.23Å; P363-V365 PolarHBondContact O-N 3.44Å
366	L	88.6	Confident	87.7	Confident	13 Å²	13	56.2 Å²	56.2	7%	0.068	30%	0.296	C	S	.	.			trans	-77.7	136.6	-176.5	-62	169.3	0	0	0	111.7	Y247 L249 L295 V299 F311 P363 E364	Y247-L366 HydrophobicContact CD1-CB 4.27Å; Y247-L366 HydrophobicContact CD1-CD1 4.43Å; L249-L366 HydrophobicContact CB-CD2 3.66Å; L249-L366 HydrophobicContact CD1-CD2 3.75Å; L249-L366 HydrophobicContact CG-CD2 4.26Å; L295-L366 HydrophobicContact CD2-CD1 4.33Å; L295-L366 HydrophobicContact CD2-CD2 4.02Å; L295-L366 HydrophobicContact CD2-CG 4.45Å; V299-L366 HydrophobicContact CG1-CD1 4.45Å; V299-L366 HydrophobicContact CG2-CD1 3.5Å; F311-L366 HydrophobicContact CE2-CD1 3.7Å; F311-L366 HydrophobicContact CE2-CD2 3.71Å; F311-L366 HydrophobicContact CE2-CG 4.37Å; F311-L366 HydrophobicContact CZ-CD1 4.42Å; F311-L366 HydrophobicContact CZ-CD2 3.69Å; P363-L366 WeakPolarHBondContact O-CB 3.07Å; P363-L366 PolarHBondContact O-N 3.31Å; E364-L366 PolarHBondContact O-N 3.45Å
367	G	88.3	Confident	87.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	165.6	167.8	0	0	0	0	0	111.6	Y247 I248 C350	Y247-G367 CarbonylContact C-O 3.58Å; Y247-G367 WeakPolarHBondContact CA-O 2.9Å; I248-G367 PolarHBondContact N-O 2.84Å; I248-G367 PolarHBondContact O-N 2.64Å; C350-G367 CarbonylContact O-C 3.57Å; C350-G367 VanDerWaalsContact O-CA 3.28Å; C350-G367 WeakPolarHBondContact O-CA 3.38Å
368	R	89.3	Confident	87.4	Confident	125 Å²	125	53.2 Å²	53.2	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.6	174.5	-69.4	179.8	178	178.3	-2.1	111.4	Y247 C350 E389	Y247-R368 HydrophobicContact CD1-CG 4.17Å; Y247-R368 HydrophobicContact CE1-CG 4.05Å; C350-R368 PolarHBondContact O-N 3.43Å; R368-E389 WeakPolarHBondContact CD-OE1 3.38Å; R368-E389 IonicContact NH1-OE1 3.59Å; R368-E389 PolarHBondContact NH1-OE1 3.18Å
369	A	89.3	Confident	87.4	Confident	5 Å²	5	62.1 Å²	62.1	4%	0.041	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	136.5	169	0	0	0	0	0	110.4	N245 A246 I248 V372 I385	N245-A369 CarbonylContact C-O 3.56Å; A246-A369 PolarHBondContact N-O 3.19Å; A246-A369 PolarHBondContact O-N 2.94Å; I248-A369 HydrophobicContact CD1-CB 3.56Å; I248-A369 HydrophobicContact CG1-CB 4.49Å; A369-V372 HydrophobicContact CB-CG2 4.04Å; A369-I385 HydrophobicContact CB-CG2 3.62Å
370	G	87.5	Confident	87.7	Confident	12 Å²	12	62.1 Å²	62.1	12%	0.124	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-38.2	-179.9	0	0	0	0	0	112.8	R244 N245 E386 E387	R244-G370 CarbonylContact C-O 3.5Å; R244-G370 WeakPolarHBondContact CA-O 3.1Å; N245-G370 PolarHBondContact N-O 3.29Å; G370-E386 PolarHBondContact N-O 3.39Å; G370-E387 PolarHBondContact N-O 2.97Å
371	L	91.2	Very high	88.2	Confident	38 Å²	38	58.3 Å²	58.3	20%	0.199	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	124.3	-178.7	-173.1	69	0	0	0	111.6	R244 Y373 E386	R244-L371 HydrophobicContact CG-CD1 4.02Å; L371-Y373 HydrophobicContact CD2-CD1 3.81Å; L371-Y373 HydrophobicContact CD2-CE1 3.99Å; L371-Y373 HydrophobicContact CG-CD1 3.93Å; L371-E386 HydrophobicContact CB-CB 4.38Å; L371-E386 PolarHBondContact N-O 3.39Å; L371-E386 VanDerWaalsContact N-O 3.1Å; L371-E386 PolarHBondContact O-N 3.22Å
372	V	92.3	Very high	88.7	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.1	169.4	-179	0	0	0	0	108.7	V243 A246 I248 V312 A369 T383 F384 I385	V243-V372 WeakPolarHBondContact CA-O 3.44Å; V243-V372 HydrophobicContact CB-CB 4.23Å; V243-V372 WeakPolarHBondContact CB-O 3.3Å; V243-V372 PolarHBondContact N-O 3.38Å; V243-V372 PolarHBondContact O-N 3.4Å; V243-V372 VanDerWaalsContact O-O 3.13Å; A246-V372 HydrophobicContact CB-CB 4.35Å; A246-V372 HydrophobicContact CB-CG2 3.66Å; I248-V372 HydrophobicContact CD1-CG2 4.38Å; V312-V372 HydrophobicContact CG2-CB 4.42Å; V312-V372 HydrophobicContact CG2-CG1 4.28Å; V312-V372 HydrophobicContact CG2-CG2 4.46Å; A369-V372 HydrophobicContact CB-CG2 4.04Å; V372-T383 HydrophobicContact CG1-CG2 3.69Å; V372-F384 CarbonylContact C-O 3.59Å; V372-F384 VanDerWaalsContact CA-O 3.23Å; V372-F384 WeakPolarHBondContact CA-O 3.34Å; V372-I385 HydrophobicContact CG1-CG1 4.3Å; V372-I385 HydrophobicContact CG2-CG1 4.19Å; V372-I385 HydrophobicContact CG2-CG2 4.24Å
373	Y	93.1	Very high	89.2	Confident	48 Å²	48	55 Å²	55	19%	0.188	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	147.8	177.3	66.5	-83.9	0	0	0	113.3	K241 H242 L371 H375 T383 F384 E386	K241-Y373 CarbonylContact O-C 2.82Å; K241-Y373 VanDerWaalsContact O-CA 3.22Å; K241-Y373 WeakPolarHBondContact O-CA 3.4Å; H242-Y373 VanDerWaalsContact ND1-CB 3.29Å; H242-Y373 WeakPolarHBondContact ND1-CB 3.22Å; L371-Y373 HydrophobicContact CD2-CD1 3.81Å; L371-Y373 HydrophobicContact CD2-CE1 3.99Å; L371-Y373 HydrophobicContact CG-CD1 3.93Å; Y373-H375 HydrophobicContact CD2-CB 4.49Å; Y373-H375 HydrophobicContact CE2-CB 4.33Å; Y373-T383 CarbonylContact O-C 3.5Å; Y373-T383 WeakPolarHBondContact O-CA 3.17Å; Y373-F384 HydrophobicContact CD1-CB 3.8Å; Y373-F384 HydrophobicContact CD2-CB 4.19Å; Y373-F384 HydrophobicContact CD2-CD2 4.2Å; Y373-F384 HydrophobicContact CD2-CG 4.36Å; Y373-F384 HydrophobicContact CE1-CB 3.41Å; Y373-F384 VanDerWaalsContact CE1-CB 3.41Å; Y373-F384 HydrophobicContact CE1-CD1 4.49Å; Y373-F384 HydrophobicContact CE1-CG 4.02Å; Y373-F384 HydrophobicContact CE2-CB 3.82Å; Y373-F384 HydrophobicContact CE2-CD1 4.3Å; Y373-F384 AromaticContact CE2-CD2 3.66Å; Y373-F384 HydrophobicContact CE2-CD2 3.66Å; Y373-F384 HydrophobicContact CE2-CE2 4.38Å; Y373-F384 AromaticContact CE2-CG 3.66Å; Y373-F384 HydrophobicContact CE2-CG 3.66Å; Y373-F384 HydrophobicContact CG-CB 4.18Å; Y373-F384 VanDerWaalsContact CZ-CB 3.41Å; Y373-F384 AromaticContact CZ-CD1 3.81Å; Y373-F384 AromaticContact CZ-CD2 3.98Å; Y373-F384 AromaticContact CZ-CG 3.46Å; Y373-F384 VanDerWaalsContact CZ-CG 3.46Å; Y373-F384 PolarHBondContact N-O 3.26Å; Y373-F384 PolarHBondContact O-N 3.28Å; Y373-F384 VanDerWaalsContact OH-CD1 3.28Å; Y373-F384 WeakPolarHBondContact OH-CD1 3.26Å; Y373-F384 WeakPolarHBondContact OH-CG 3.38Å; Y373-E386 HydrophobicContact CE1-CG 4.41Å; Y373-E386 WeakPolarHBondContact CE1-OE1 3.42Å; Y373-E386 PolarHBondContact OH-OE1 2.88Å
374	E	91.8	Very high	89.6	Confident	18 Å²	18	53 Å²	53	8%	0.084	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.6	171.2	178.7	177.1	113.4	0	0	109.6	G233 A234 K241 V376 K381 F382	G233-E374 VanDerWaalsContact CA-OE2 3.28Å; G233-E374 WeakPolarHBondContact CA-OE2 3.16Å; A234-E374 WeakPolarHBondContact CA-OE2 3.44Å; A234-E374 WeakPolarHBondContact CB-OE2 3Å; A234-E374 PolarHBondContact N-OE2 2.97Å; K241-E374 PolarHBondContact O-N 2.79Å; E374-V376 HydrophobicContact CG-CG2 4.02Å; E374-V376 WeakPolarHBondContact OE1-CG2 3.41Å; E374-K381 HydrophobicContact CG-CB 4.43Å; E374-K381 IonicContact OE1-NZ 3.86Å; E374-K381 PolarHBondContact OE1-NZ 3.31Å; E374-K381 IonicContact OE2-NZ 2.84Å; E374-F382 CarbonylContact C-O 3.5Å; E374-F382 WeakPolarHBondContact CA-O 3.45Å
375	H	90.8	Very high	90	Very high	77 Å²	77	44.7 Å²	44.7	36%	0.356	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121	168	-173.8	-82.7	0	0	0	109.1	Y373 F382 F384	Y373-H375 HydrophobicContact CD2-CB 4.49Å; Y373-H375 HydrophobicContact CE2-CB 4.33Å; H375-F382 PolarHBondContact N-O 3.01Å; H375-F382 PolarHBondContact O-N 3.47Å; H375-F384 HydrophobicContact CB-CD2 3.95Å; H375-F384 HydrophobicContact CB-CE2 3.56Å
376	V	89.7	Confident	90	Very high	67 Å²	67	45.7 Å²	45.7	41%	0.406	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.4	178.5	-173.7	0	0	0	0	108.7	E374 D380 K381	E374-V376 HydrophobicContact CG-CG2 4.02Å; E374-V376 WeakPolarHBondContact OE1-CG2 3.41Å; V376-D380 WeakPolarHBondContact CA-O 3.1Å; V376-K381 HydrophobicContact CG1-CG 4.35Å; V376-K381 HydrophobicContact CG2-CG 4.15Å
377	L	86.9	Confident	90	Very high	45 Å²	45	51.3 Å²	51.3	24%	0.236	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	106.8	176.2	-169	74.3	0	0	0	109.1	M214 H215 E379 D380	M214-L377 HydrophobicContact CE-CB 4.25Å; M214-L377 HydrophobicContact CE-CD2 3.81Å; H215-L377 WeakPolarHBondContact O-CD2 3.16Å; L377-E379 PolarHBondContact O-N 3.36Å; L377-D380 PolarHBondContact N-O 2.83Å; L377-D380 PolarHBondContact O-N 2.91Å; L377-D380 VanDerWaalsContact O-N 3.13Å
378	G	83.9	Confident	89.7	Confident	73 Å²	73	51.8 Å²	51.8	75%	0.753	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-122.7	-170.7	0	0	0	0	0	110.9
379	E	86.9	Confident	89	Confident	193 Å²	193	52.3 Å²	52.3	90%	0.902	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-16	175.2	-61.4	-173.7	172.4	0	0	112.9	L377	L377-E379 PolarHBondContact O-N 3.36Å
380	D	89.4	Confident	88.5	Confident	99 Å²	99	57.8 Å²	57.8	53%	0.529	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.9	-177	-68.7	-35.3	0	0	0	111.3	V376 L377 F382	V376-D380 WeakPolarHBondContact CA-O 3.1Å; L377-D380 PolarHBondContact N-O 2.83Å; L377-D380 PolarHBondContact O-N 2.91Å; L377-D380 VanDerWaalsContact O-N 3.13Å; D380-F382 HydrophobicContact CB-CD2 4.49Å; D380-F382 HydrophobicContact CB-CE2 3.69Å; D380-F382 HydrophobicContact CB-CZ 4.13Å
381	K	90.7	Very high	88	Confident	67 Å²	67	58.5 Å²	58.5	29%	0.291	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.8	177.8	-59.4	-177.3	162.7	-135.6	0	110	D231 H232 G233 A234 E374 V376	D231-K381 CarbonylContact C-O 3.59Å; H232-K381 CarbonylContact C-O 3.53Å; H232-K381 PolarHBondContact N-O 3.16Å; G233-K381 PolarHBondContact N-O 3.17Å; A234-K381 PolarHBondContact O-NZ 3.06Å; E374-K381 HydrophobicContact CG-CB 4.43Å; E374-K381 IonicContact OE1-NZ 3.86Å; E374-K381 PolarHBondContact OE1-NZ 3.31Å; E374-K381 IonicContact OE2-NZ 2.84Å; V376-K381 HydrophobicContact CG1-CG 4.35Å; V376-K381 HydrophobicContact CG2-CG 4.15Å
382	F	93	Very high	87.6	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.066	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.8	177.2	-63.4	-84.7	0	0	0	109.6	M212 M214 V229 L230 E374 H375 D380 F384	M212-F382 HydrophobicContact CE-CE1 4.3Å; M214-F382 HydrophobicContact CE-CD2 3.65Å; M214-F382 HydrophobicContact CE-CE2 3.89Å; M214-F382 HydrophobicContact CE-CG 4.26Å; M214-F382 HydrophobicContact CG-CD1 4.22Å; M214-F382 HydrophobicContact CG-CD2 4.14Å; M214-F382 HydrophobicContact CG-CE1 3.84Å; M214-F382 HydrophobicContact CG-CE2 3.77Å; M214-F382 HydrophobicContact CG-CG 4.36Å; M214-F382 HydrophobicContact CG-CZ 3.6Å; M214-F382 HydrophobicContact SD-CD1 4.23Å; M214-F382 HydrophobicContact SD-CD2 3.88Å; M214-F382 HydrophobicContact SD-CE1 4.45Å; M214-F382 HydrophobicContact SD-CE2 4.12Å; M214-F382 HydrophobicContact SD-CG 3.94Å; M214-F382 HydrophobicContact SD-CZ 4.4Å; V229-F382 HydrophobicContact CG1-CB 4.21Å; V229-F382 HydrophobicContact CG1-CD1 4.25Å; L230-F382 CarbonylContact O-C 3.56Å; L230-F382 VanDerWaalsContact O-CA 3.26Å; L230-F382 WeakPolarHBondContact O-CA 3.43Å; E374-F382 CarbonylContact C-O 3.5Å; E374-F382 WeakPolarHBondContact CA-O 3.45Å; H375-F382 PolarHBondContact N-O 3.01Å; H375-F382 PolarHBondContact O-N 3.47Å; D380-F382 HydrophobicContact CB-CD2 4.49Å; D380-F382 HydrophobicContact CB-CE2 3.69Å; D380-F382 HydrophobicContact CB-CZ 4.13Å; F382-F384 HydrophobicContact CB-CD2 4.32Å; F382-F384 HydrophobicContact CB-CE2 3.64Å; F382-F384 HydrophobicContact CB-CZ 4.41Å
383	T	93.2	Very high	87.4	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.4	172.7	-52.4	0	0	0	0	109.3	V229 L230 H232 L335 V372 Y373	V229-T383 WeakPolarHBondContact CA-O 3.25Å; L230-T383 PolarHBondContact N-O 3.46Å; L230-T383 PolarHBondContact O-N 3.48Å; H232-T383 WeakPolarHBondContact O-CB 3.2Å; H232-T383 PolarHBondContact O-OG1 2.96Å; L335-T383 HydrophobicContact CD1-CG2 4.08Å; V372-T383 HydrophobicContact CG1-CG2 3.69Å; Y373-T383 CarbonylContact O-C 3.5Å; Y373-T383 WeakPolarHBondContact O-CA 3.17Å
384	F	93.9	Very high	87.4	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.039	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	177.4	-69.8	-106.7	0	0	0	108.6	M214 I225 V229 V372 Y373 H375 F382 L397	M214-F384 HydrophobicContact SD-CZ 4.09Å; I225-F384 HydrophobicContact CD1-CD1 3.68Å; I225-F384 HydrophobicContact CD1-CE1 3.4Å; I225-F384 VanDerWaalsContact CD1-CE1 3.4Å; V229-F384 HydrophobicContact CG1-CD1 4.5Å; V229-F384 HydrophobicContact CG1-CE1 4.26Å; V229-F384 HydrophobicContact CG1-CE2 4.22Å; V229-F384 HydrophobicContact CG1-CZ 4.09Å; V229-F384 HydrophobicContact CG2-CD1 3.67Å; V229-F384 HydrophobicContact CG2-CE1 3.72Å; V229-F384 HydrophobicContact CG2-CG 4.32Å; V229-F384 HydrophobicContact CG2-CZ 4.37Å; V372-F384 CarbonylContact C-O 3.59Å; V372-F384 VanDerWaalsContact CA-O 3.23Å; V372-F384 WeakPolarHBondContact CA-O 3.34Å; Y373-F384 HydrophobicContact CD1-CB 3.8Å; Y373-F384 HydrophobicContact CD2-CB 4.19Å; Y373-F384 HydrophobicContact CD2-CD2 4.2Å; Y373-F384 HydrophobicContact CD2-CG 4.36Å; Y373-F384 HydrophobicContact CE1-CB 3.41Å; Y373-F384 VanDerWaalsContact CE1-CB 3.41Å; Y373-F384 HydrophobicContact CE1-CD1 4.49Å; Y373-F384 HydrophobicContact CE1-CG 4.02Å; Y373-F384 HydrophobicContact CE2-CB 3.82Å; Y373-F384 HydrophobicContact CE2-CD1 4.3Å; Y373-F384 AromaticContact CE2-CD2 3.66Å; Y373-F384 HydrophobicContact CE2-CD2 3.66Å; Y373-F384 HydrophobicContact CE2-CE2 4.38Å; Y373-F384 AromaticContact CE2-CG 3.66Å; Y373-F384 HydrophobicContact CE2-CG 3.66Å; Y373-F384 HydrophobicContact CG-CB 4.18Å; Y373-F384 VanDerWaalsContact CZ-CB 3.41Å; Y373-F384 AromaticContact CZ-CD1 3.81Å; Y373-F384 AromaticContact CZ-CD2 3.98Å; Y373-F384 AromaticContact CZ-CG 3.46Å; Y373-F384 VanDerWaalsContact CZ-CG 3.46Å; Y373-F384 PolarHBondContact N-O 3.26Å; Y373-F384 PolarHBondContact O-N 3.28Å; Y373-F384 VanDerWaalsContact OH-CD1 3.28Å; Y373-F384 WeakPolarHBondContact OH-CD1 3.26Å; Y373-F384 WeakPolarHBondContact OH-CG 3.38Å; H375-F384 HydrophobicContact CB-CD2 3.95Å; H375-F384 HydrophobicContact CB-CE2 3.56Å; F382-F384 HydrophobicContact CB-CD2 4.32Å; F382-F384 HydrophobicContact CB-CE2 3.64Å; F382-F384 HydrophobicContact CB-CZ 4.41Å; F384-L397 HydrophobicContact CE1-CD2 3.79Å; F384-L397 HydrophobicContact CZ-CD2 3.83Å
385	I	92.3	Very high	87.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	107.5	171.9	-58.4	169.6	0	0	0	105.8	G227 L228 L230 I248 I314 L346 A369 V372	G227-I385 CarbonylContact C-O 3.54Å; G227-I385 VanDerWaalsContact CA-O 3.3Å; G227-I385 WeakPolarHBondContact CA-O 3.43Å; L228-I385 PolarHBondContact N-O 3.41Å; L228-I385 WeakPolarHBondContact O-CB 3.27Å; L228-I385 PolarHBondContact O-N 3.32Å; L230-I385 HydrophobicContact CD1-CD1 4.04Å; I248-I385 HydrophobicContact CD1-CD1 4.36Å; I248-I385 HydrophobicContact CD1-CG2 3.76Å; I314-I385 HydrophobicContact CD1-CD1 3.7Å; L346-I385 HydrophobicContact CD2-CD1 3.51Å; A369-I385 HydrophobicContact CB-CG2 3.62Å; V372-I385 HydrophobicContact CG1-CG1 4.3Å; V372-I385 HydrophobicContact CG2-CG1 4.19Å; V372-I385 HydrophobicContact CG2-CG2 4.24Å
386	E	89.1	Confident	87.7	Confident	48 Å²	48	53.8 Å²	53.8	22%	0.224	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	167	-175.6	-71.9	178.6	-164.4	0	0	110.7	I225 G370 L371 Y373 C388	I225-E386 HydrophobicContact CG2-CG 3.67Å; G370-E386 PolarHBondContact N-O 3.39Å; L371-E386 HydrophobicContact CB-CB 4.38Å; L371-E386 PolarHBondContact N-O 3.39Å; L371-E386 VanDerWaalsContact N-O 3.1Å; L371-E386 PolarHBondContact O-N 3.22Å; Y373-E386 HydrophobicContact CE1-CG 4.41Å; Y373-E386 WeakPolarHBondContact CE1-OE1 3.42Å; Y373-E386 PolarHBondContact OH-OE1 2.88Å; E386-C388 PolarHBondContact O-N 2.84Å
387	E	86.6	Confident	87.9	Confident	132 Å²	132	50.7 Å²	50.7	62%	0.617	27%	0.266	S	S	*	.			trans	58.2	45.6	178.3	-57.5	179.1	171.6	0	0	113.2	G370	G370-E387 PolarHBondContact N-O 2.97Å
388	C	83.1	Confident	88.3	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.074	25%	0.254	C	S	.	.			trans	-75.9	145.1	168.9	-60.4	0	0	0	0	110.9	A349 E386 N390 P391	A349-C388 WeakPolarHBondContact O-CB 3.28Å; E386-C388 PolarHBondContact O-N 2.84Å; C388-N390 VanDerWaalsContact C-N 3.31Å; C388-N390 PolarHBondContact O-N 2.96Å; C388-P391 HydrophobicContact CB-CB 4.39Å
389	E	75.3	Confident	88.7	Confident	136 Å²	136	47.3 Å²	47.3	64%	0.636	23%	0.229	S	C	*	.	S	Bend	trans	-59.8	-39.8	-177.3	-67.7	179	-175.7	0	0	112.3	R368	R368-E389 WeakPolarHBondContact CD-OE1 3.38Å; R368-E389 IonicContact NH1-OE1 3.59Å; R368-E389 PolarHBondContact NH1-OE1 3.18Å
390	N	77.3	Confident	88.9	Confident	119 Å²	119	38.1 Å²	38.1	64%	0.636	19%	0.186	S	C	*	.	S	Bend	trans	-141.1	81.1	179.4	-76.5	-44.3	0	0	0	110.8	C388 K392	C388-N390 VanDerWaalsContact C-N 3.31Å; C388-N390 PolarHBondContact O-N 2.96Å; N390-K392 VanDerWaalsContact C-N 3.3Å; N390-K392 PolarHBondContact O-N 2.89Å
391	P	77.9	Confident	89	Confident	28 Å²	28	35.9 Å²	35.9	18%	0.182	18%	0.176	C	C	.	.			trans	-74.1	82.1	-175.4	31.1	-33.7	0	0	0	110.8	R226 C388 S393	R226-P391 HydrophobicContact CB-CG 4.24Å; C388-P391 HydrophobicContact CB-CB 4.39Å; P391-S393 PolarHBondContact O-N 3.35Å
392	K	83.5	Confident	89	Confident	84 Å²	84	37.2 Å²	37.2	37%	0.365	19%	0.187	S	C	.	.	S	Bend	trans	-74.3	-7.4	172.6	-68.6	164.3	160.9	-170.6	0	112.5	L348 N390	L348-K392 HydrophobicContact CB-CB 4.23Å; L348-K392 WeakPolarHBondContact O-CB 3.46Å; L348-K392 PolarHBondContact O-N 3.1Å; N390-K392 VanDerWaalsContact C-N 3.3Å; N390-K392 PolarHBondContact O-N 2.89Å
393	S	87.8	Confident	88.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-126.6	133.5	168.1	-178.4	0	0	0	0	107.9	M208 R345 P391	M208-S393 WeakPolarHBondContact O-CA 3.42Å; M208-S393 WeakPolarHBondContact O-CB 3.31Å; M208-S393 PolarHBondContact O-OG 3.34Å; R345-S393 WeakPolarHBondContact CB-OG 3.29Å; P391-S393 PolarHBondContact O-N 3.35Å
394	V	91.7	Very high	88.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	154.4	-176.8	-67	0	0	0	0	109.3	A193 I197 M208 V209 E210 L224 G227	A193-V394 HydrophobicContact CB-CG2 3.92Å; I197-V394 HydrophobicContact CD1-CG2 3.91Å; I197-V394 HydrophobicContact CG1-CG2 4.19Å; M208-V394 PolarHBondContact O-N 2.97Å; V209-V394 CarbonylContact C-O 3.5Å; V209-V394 WeakPolarHBondContact CA-O 3.44Å; V209-V394 HydrophobicContact CG2-CG2 4.42Å; E210-V394 PolarHBondContact N-O 3.15Å; L224-V394 HydrophobicContact CD1-CB 4.12Å; L224-V394 HydrophobicContact CD1-CG2 4.26Å; G227-V394 CarbonylContact O-C 3.56Å; G227-V394 WeakPolarHBondContact O-CA 3.5Å
395	T	94.4	Very high	88.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.1	177.5	-54.4	0	0	0	0	110.3	E210 M212 I225 G227 L228 V229	E210-T395 HydrophobicContact CB-CG2 4.02Å; E210-T395 HydrophobicContact CG-CG2 4.1Å; E210-T395 CarbonylContact O-C 3.58Å; E210-T395 VanDerWaalsContact O-CA 3.29Å; E210-T395 WeakPolarHBondContact O-CA 3.39Å; M212-T395 HydrophobicContact CB-CG2 4.03Å; M212-T395 HydrophobicContact CG-CG2 3.72Å; I225-T395 PolarHBondContact N-O 3.17Å; I225-T395 PolarHBondContact O-N 3.19Å; G227-T395 PolarHBondContact O-N 2.72Å; G227-T395 PolarHBondContact O-OG1 3.29Å; L228-T395 VanDerWaalsContact CA-OG1 3.3Å; L228-T395 WeakPolarHBondContact CA-OG1 3.35Å; V229-T395 HydrophobicContact CB-CG2 3.92Å; V229-T395 HydrophobicContact CG2-CG2 3.88Å; V229-T395 PolarHBondContact N-OG1 3.08Å
396	I	95.2	Very high	88.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	111.4	165.6	-60.4	175.2	0	0	0	107	I189 A193 V209 E210 I211 M212 L224 I398 I413 L417	I189-I396 HydrophobicContact CG2-CB 4.42Å; I189-I396 HydrophobicContact CG2-CD1 4.15Å; I189-I396 HydrophobicContact CG2-CG1 3.93Å; I189-I396 HydrophobicContact CG2-CG2 3.77Å; A193-I396 HydrophobicContact CB-CD1 3.96Å; A193-I396 HydrophobicContact CB-CG1 4.22Å; V209-I396 HydrophobicContact CG1-CD1 3.65Å; V209-I396 HydrophobicContact CG1-CG1 3.83Å; E210-I396 PolarHBondContact O-N 2.66Å; I211-I396 WeakPolarHBondContact CA-O 3.29Å; M212-I396 PolarHBondContact N-O 3.35Å; L224-I396 HydrophobicContact CD1-CG1 3.96Å; I396-I398 HydrophobicContact CG2-CG1 4.42Å; I396-I413 HydrophobicContact CD1-CG2 3.67Å; I396-I413 HydrophobicContact CG2-CD1 3.89Å; I396-L417 HydrophobicContact CD1-CD1 4.25Å; I396-L417 HydrophobicContact CD1-CD2 4.26Å
397	L	94.7	Very high	88.4	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.1	176.3	-177.1	64.3	0	0	0	109.8	M212 M214 T222 A223 I225 F384 K399	M212-L397 HydrophobicContact CB-CD1 3.71Å; M214-L397 HydrophobicContact CB-CD1 4.25Å; M214-L397 HydrophobicContact CG-CD1 3.73Å; M214-L397 HydrophobicContact SD-CD1 3.6Å; M214-L397 HydrophobicContact SD-CD2 3.66Å; M214-L397 HydrophobicContact SD-CG 4.12Å; T222-L397 CarbonylContact C-O 3.58Å; T222-L397 WeakPolarHBondContact CA-O 3.48Å; A223-L397 PolarHBondContact N-O 2.9Å; A223-L397 PolarHBondContact O-N 3.34Å; I225-L397 HydrophobicContact CD1-CB 3.66Å; I225-L397 HydrophobicContact CD1-CD2 3.91Å; I225-L397 HydrophobicContact CD1-CG 4.39Å; I225-L397 HydrophobicContact CG1-CB 4.48Å; F384-L397 HydrophobicContact CE1-CD2 3.79Å; F384-L397 HydrophobicContact CZ-CD2 3.83Å; L397-K399 HydrophobicContact CG-CG 4.47Å
398	I	94.7	Very high	88.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.5	174.9	-56.6	173.9	0	0	0	108.6	I211 M212 M214 T222 I396 I406 I409 K410 I413	I211-I398 HydrophobicContact CG2-CD1 3.35Å; I211-I398 HydrophobicContact CG2-CG1 4Å; M212-I398 PolarHBondContact O-N 3.37Å; M214-I398 PolarHBondContact N-O 3.4Å; T222-I398 HydrophobicContact CG2-CB 4.44Å; T222-I398 HydrophobicContact CG2-CG2 4.12Å; I396-I398 HydrophobicContact CG2-CG1 4.42Å; I398-I406 HydrophobicContact CG2-CG2 4.01Å; I398-I409 HydrophobicContact CD1-CG2 4.22Å; I398-I409 HydrophobicContact CG1-CG2 4.31Å; I398-I409 HydrophobicContact CG2-CB 4.13Å; I398-I409 HydrophobicContact CG2-CG2 3.78Å; I398-K410 HydrophobicContact CD1-CB 3.7Å; I398-K410 HydrophobicContact CD1-CG 4.31Å; I398-I413 HydrophobicContact CD1-CD1 3.54Å; I398-I413 HydrophobicContact CG1-CD1 3.63Å
399	K	92.4	Very high	89	Confident	48 Å²	48	37.9 Å²	37.9	21%	0.209	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.8	170	-72	-177.8	-170.3	169.2	0	109.1	M214 H216 S218 E219 D221 L397	M214-K399 HydrophobicContact CB-CG 4.15Å; M214-K399 WeakPolarHBondContact O-CA 3.48Å; H216-K399 HydrophobicContact CB-CB 3.99Å; H216-K399 HydrophobicContact CB-CD 4.27Å; H216-K399 HydrophobicContact CB-CG 4.2Å; S218-K399 CarbonylContact O-C 3.55Å; E219-K399 WeakPolarHBondContact CA-O 3.32Å; D221-K399 HydrophobicContact CB-CB 4.19Å; D221-K399 HydrophobicContact CB-CD 3.67Å; D221-K399 WeakPolarHBondContact O-CD 3.29Å; L397-K399 HydrophobicContact CG-CG 4.47Å
400	G	90.6	Very high	89.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	155.2	176.3	0	0	0	0	0	113.2	M214 H215 H216	M214-G400 PolarHBondContact O-N 2.87Å; H215-G400 WeakPolarHBondContact CA-O 3.31Å; H216-G400 PolarHBondContact N-O 3.35Å; H216-G400 CarbonylContact O-C 3.56Å
401	P	91.3	Very high	90.5	Very high	52 Å²	52	29.7 Å²	29.7	34%	0.338	15%	0.151	S	C	.	.	S	Bend	trans	-77	-35.1	-171.2	26.6	-32.9	0	0	0	112.7	H216 E219	H216-P401 WeakPolarHBondContact O-CA 3.34Å; E219-P401 HydrophobicContact CG-CG 4.45Å
402	N	90.3	Very high	91.1	Very high	95 Å²	95	28.4 Å²	28.4	51%	0.508	14%	0.143	S	C	.	.	S	Bend	trans	-121.4	140.4	-173.5	-60.2	-37.2	0	0	0	109.9	H404 S405 I406	N402-H404 PolarHBondContact O-N 2.97Å; N402-H404 VanDerWaalsContact O-N 3.16Å; N402-S405 PolarHBondContact O-N 3.19Å; N402-I406 WeakPolarHBondContact O-CG1 3.36Å; N402-I406 PolarHBondContact O-N 3.09Å
403	Q	89.8	Confident	91.6	Very high	74 Å²	74	24.4 Å²	24.4	35%	0.346	13%	0.125	S	C	.	.	H	α-helix	trans	-56.2	-34.3	177.5	-174	62.3	37.5	0	0	112.7	E213 H215 I406 T407	E213-Q403 PolarHBondContact OE2-NE2 2.81Å; H215-Q403 PolarHBondContact CE1-OE1 2.68Å; H215-Q403 PolarHBondContact NE2-OE1 2.89Å; Q403-I406 PolarHBondContact O-N 2.67Å; Q403-T407 WeakPolarHBondContact O-CB 3.48Å; Q403-T407 PolarHBondContact O-N 3.21Å; Q403-T407 PolarHBondContact O-OG1 2.76Å
404	H	88.3	Confident	91.8	Very high	68 Å²	68	29.1 Å²	29.1	32%	0.315	14%	0.144	S	C	.	.	H	α-helix	trans	-66.8	-40.7	179	-45.6	-41.5	0	0	0	111.9	I54 L56 N402 T407 Q408	I54-H404 PolarHBondContact O-CE1 3.48Å; I54-H404 PolarHBondContact O-ND1 2.83Å; L56-H404 HydrophobicContact CD1-CB 4.48Å; N402-H404 PolarHBondContact O-N 2.97Å; N402-H404 VanDerWaalsContact O-N 3.16Å; H404-T407 PolarHBondContact O-N 2.98Å; H404-Q408 PolarHBondContact O-N 3.5Å
405	S	89.3	Confident	91.8	Very high	17 Å²	17	29.6 Å²	29.6	12%	0.119	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-44.8	174.4	-56.5	0	0	0	0	110.9	N402 T407 Q408 I409	N402-S405 PolarHBondContact O-N 3.19Å; S405-T407 VanDerWaalsContact C-N 3.29Å; S405-T407 PolarHBondContact O-N 3.08Å; S405-Q408 PolarHBondContact O-N 3.41Å; S405-I409 VanDerWaalsContact O-CG1 3.28Å; S405-I409 WeakPolarHBondContact O-CG1 3.48Å; S405-I409 PolarHBondContact O-N 2.67Å
406	I	92.3	Very high	91.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.9	-44.5	177	-64.4	172.5	0	0	0	110.5	E213 I398 N402 Q403 I409 K410	E213-I406 HydrophobicContact CB-CG2 3.97Å; E213-I406 HydrophobicContact CG-CG2 3.89Å; I398-I406 HydrophobicContact CG2-CG2 4.01Å; N402-I406 WeakPolarHBondContact O-CG1 3.36Å; N402-I406 PolarHBondContact O-N 3.09Å; Q403-I406 PolarHBondContact O-N 2.67Å; I406-I409 PolarHBondContact O-N 3.32Å; I406-K410 VanDerWaalsContact O-CB 3.23Å; I406-K410 WeakPolarHBondContact O-CB 3.46Å; I406-K410 PolarHBondContact O-N 3.27Å
407	T	90.8	Very high	91.6	Very high	31 Å²	31	29.8 Å²	29.8	19%	0.19	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-43.1	179	-53.4	0	0	0	0	111.3	Q403 H404 S405 K410 D411	Q403-T407 WeakPolarHBondContact O-CB 3.48Å; Q403-T407 PolarHBondContact O-N 3.21Å; Q403-T407 PolarHBondContact O-OG1 2.76Å; H404-T407 PolarHBondContact O-N 2.98Å; S405-T407 VanDerWaalsContact C-N 3.29Å; S405-T407 PolarHBondContact O-N 3.08Å; T407-K410 WeakPolarHBondContact O-CB 2.95Å; T407-K410 PolarHBondContact O-N 2.89Å; T407-D411 VanDerWaalsContact O-CG 3.25Å; T407-D411 PolarHBondContact O-N 2.95Å
408	Q	89.1	Confident	91.5	Very high	40 Å²	40	33 Å²	33	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-42.7	176.7	-176.7	179.5	5.3	0	0	112.3	K177 H404 S405 D411 A412	K177-Q408 PolarHBondContact O-NE2 3.15Å; H404-Q408 PolarHBondContact O-N 3.5Å; S405-Q408 PolarHBondContact O-N 3.41Å; Q408-D411 PolarHBondContact O-N 3.29Å; Q408-A412 WeakPolarHBondContact O-CB 3.27Å; Q408-A412 PolarHBondContact O-N 3.37Å
409	I	92.5	Very high	91.3	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-65.5	-41.9	177.3	-66.8	167.8	0	0	0	110.4	L182 L186 E219 I398 S405 I406 A412 I413	L182-I409 HydrophobicContact CD2-CD1 3.84Å; L182-I409 HydrophobicContact CD2-CG1 3.84Å; L186-I409 HydrophobicContact CD1-CG2 4.03Å; L186-I409 HydrophobicContact CD2-CG2 4.34Å; E219-I409 HydrophobicContact CB-CD1 4.05Å; E219-I409 HydrophobicContact CG-CD1 4.43Å; I398-I409 HydrophobicContact CD1-CG2 4.22Å; I398-I409 HydrophobicContact CG1-CG2 4.31Å; I398-I409 HydrophobicContact CG2-CB 4.13Å; I398-I409 HydrophobicContact CG2-CG2 3.78Å; S405-I409 VanDerWaalsContact O-CG1 3.28Å; S405-I409 WeakPolarHBondContact O-CG1 3.48Å; S405-I409 PolarHBondContact O-N 2.67Å; I406-I409 PolarHBondContact O-N 3.32Å; I409-A412 WeakPolarHBondContact O-CB 3.39Å; I409-A412 PolarHBondContact O-N 2.89Å; I409-A412 VanDerWaalsContact O-N 3.15Å; I409-I413 HydrophobicContact CG2-CD1 3.69Å; I409-I413 HydrophobicContact CG2-CG1 4.41Å; I409-I413 WeakPolarHBondContact O-CG1 3.31Å; I409-I413 PolarHBondContact O-N 3.4Å
410	K	92.7	Very high	91.3	Very high	50 Å²	50	30.8 Å²	30.8	22%	0.217	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-47.9	175.8	179.6	176.4	-176.1	177.2	0	111.7	I211 E213 I398 I406 T407 A412 I413 Y414	I211-K410 HydrophobicContact CG2-CG 4.19Å; E213-K410 IonicContact OE1-NZ 2.7Å; E213-K410 PolarHBondContact OE1-NZ 3.46Å; I398-K410 HydrophobicContact CD1-CB 3.7Å; I398-K410 HydrophobicContact CD1-CG 4.31Å; I406-K410 VanDerWaalsContact O-CB 3.23Å; I406-K410 WeakPolarHBondContact O-CB 3.46Å; I406-K410 PolarHBondContact O-N 3.27Å; T407-K410 WeakPolarHBondContact O-CB 2.95Å; T407-K410 PolarHBondContact O-N 2.89Å; K410-A412 PolarHBondContact O-N 2.79Å; K410-I413 PolarHBondContact O-N 2.97Å; K410-Y414 HydrophobicContact CD-CE2 4.34Å; K410-Y414 HydrophobicContact CG-CD2 3.95Å; K410-Y414 HydrophobicContact CG-CE2 3.68Å; K410-Y414 VanDerWaalsContact O-CD2 3.24Å; K410-Y414 WeakPolarHBondContact O-CD2 3.31Å; K410-Y414 PolarHBondContact O-N 3.47Å
411	D	90.2	Very high	91.3	Very high	32 Å²	32	33.6 Å²	33.6	17%	0.171	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-31.4	176.4	-66.8	-14.8	0	0	0	111.6	K177 T407 Q408 D415	K177-D411 PolarHBondContact NZ-O 3.35Å; T407-D411 VanDerWaalsContact O-CG 3.25Å; T407-D411 PolarHBondContact O-N 2.95Å; Q408-D411 PolarHBondContact O-N 3.29Å; D411-D415 PolarHBondContact O-N 3.03Å
412	A	91.8	Very high	91.2	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-70.8	-42.1	174.4	0	0	0	0	0	112.9	L174 K177 V178 Q408 I409 K410 D415 G416	L174-A412 HydrophobicContact CD2-CB 4.05Å; L174-A412 VanDerWaalsContact CD2-O 3.29Å; L174-A412 WeakPolarHBondContact CD2-O 3.5Å; K177-A412 HydrophobicContact CB-CB 3.88Å; K177-A412 HydrophobicContact CD-CB 3.99Å; V178-A412 HydrophobicContact CG1-CB 3.66Å; Q408-A412 WeakPolarHBondContact O-CB 3.27Å; Q408-A412 PolarHBondContact O-N 3.37Å; I409-A412 WeakPolarHBondContact O-CB 3.39Å; I409-A412 PolarHBondContact O-N 2.89Å; I409-A412 VanDerWaalsContact O-N 3.15Å; K410-A412 PolarHBondContact O-N 2.79Å; A412-D415 PolarHBondContact O-N 2.76Å; A412-G416 PolarHBondContact O-N 2.82Å
413	I	93.6	Very high	91	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.7	-41.9	176.7	-70.8	159.6	0	0	0	110.6	L186 V190 I211 I396 I398 I409 K410 D415 G416 L417	L186-I413 HydrophobicContact CD1-CG1 4.45Å; L186-I413 HydrophobicContact CD2-CD1 4.03Å; L186-I413 HydrophobicContact CD2-CG1 4.2Å; V190-I413 HydrophobicContact CG2-CG1 4.48Å; V190-I413 HydrophobicContact CG2-CG2 4.34Å; I211-I413 HydrophobicContact CD1-CG2 3.81Å; I396-I413 HydrophobicContact CD1-CG2 3.67Å; I396-I413 HydrophobicContact CG2-CD1 3.89Å; I398-I413 HydrophobicContact CD1-CD1 3.54Å; I398-I413 HydrophobicContact CG1-CD1 3.63Å; I409-I413 HydrophobicContact CG2-CD1 3.69Å; I409-I413 HydrophobicContact CG2-CG1 4.41Å; I409-I413 WeakPolarHBondContact O-CG1 3.31Å; I409-I413 PolarHBondContact O-N 3.4Å; K410-I413 PolarHBondContact O-N 2.97Å; I413-D415 PolarHBondContact O-N 3.11Å; I413-G416 PolarHBondContact O-N 3.24Å; I413-L417 HydrophobicContact CG2-CD1 3.75Å; I413-L417 HydrophobicContact CG2-CG 4.09Å; I413-L417 WeakPolarHBondContact O-CB 3.38Å; I413-L417 VanDerWaalsContact O-CG 3.22Å; I413-L417 WeakPolarHBondContact O-CG 3.49Å; I413-L417 PolarHBondContact O-N 3.4Å
414	Y	92	Very high	90.8	Very high	99 Å²	99	24.7 Å²	24.7	39%	0.388	11%	0.114	S	C	.	.	H	α-helix	trans	-58.5	-45.6	177.8	-86.5	-61	0	0	0	112.7	I211 K410 R418	I211-Y414 HydrophobicContact CD1-CD1 3.98Å; I211-Y414 HydrophobicContact CD1-CD2 4.08Å; I211-Y414 HydrophobicContact CD1-CE1 3.66Å; I211-Y414 HydrophobicContact CD1-CE2 3.78Å; I211-Y414 HydrophobicContact CD1-CG 4.17Å; K410-Y414 HydrophobicContact CD-CE2 4.34Å; K410-Y414 HydrophobicContact CG-CD2 3.95Å; K410-Y414 HydrophobicContact CG-CE2 3.68Å; K410-Y414 VanDerWaalsContact O-CD2 3.24Å; K410-Y414 WeakPolarHBondContact O-CD2 3.31Å; K410-Y414 PolarHBondContact O-N 3.47Å; Y414-R418 WeakPolarHBondContact O-CG 3.39Å; Y414-R418 PolarHBondContact O-N 2.97Å; Y414-R418 VanDerWaalsContact O-N 3.07Å
415	D	91.2	Very high	90.7	Very high	11 Å²	11	25.4 Å²	25.4	6%	0.059	12%	0.123	C	C	.	.	H	α-helix	trans	-70.9	-38.8	178.4	-75.2	36	0	0	0	111.4	K177 D411 A412 I413 L417 R418 A419	K177-D415 HydrophobicContact CD-CB 4.38Å; K177-D415 VanDerWaalsContact CE-CG 3.45Å; K177-D415 WeakPolarHBondContact CE-OD2 3.45Å; K177-D415 IonicContact NZ-OD1 2.69Å; K177-D415 PolarHBondContact NZ-OD1 3.05Å; K177-D415 VanDerWaalsContact NZ-OD1 3.1Å; K177-D415 IonicContact NZ-OD2 2.78Å; K177-D415 PolarHBondContact NZ-OD2 3.4Å; D411-D415 PolarHBondContact O-N 3.03Å; A412-D415 PolarHBondContact O-N 2.76Å; I413-D415 PolarHBondContact O-N 3.11Å; D415-L417 PolarHBondContact O-N 3.35Å; D415-R418 PolarHBondContact O-N 2.96Å; D415-A419 WeakPolarHBondContact O-CB 3.31Å; D415-A419 PolarHBondContact O-N 2.77Å
416	G	91.9	Very high	90.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.1	-45.7	173.7	0	0	0	0	0	112.5	A412 I413 R418 A419 V420	A412-G416 PolarHBondContact O-N 2.82Å; I413-G416 PolarHBondContact O-N 3.24Å; G416-R418 VanDerWaalsContact C-N 3.35Å; G416-R418 PolarHBondContact O-N 2.82Å; G416-A419 PolarHBondContact O-N 2.7Å; G416-V420 WeakPolarHBondContact O-CG2 3.4Å; G416-V420 PolarHBondContact O-N 3.17Å
417	L	93.3	Very high	89.7	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-41.6	176.2	-72.8	171.1	0	0	0	111.8	V190 A193 V194 L206 V209 I211 I396 I413 D415 K421	V190-L417 HydrophobicContact CG1-CD2 3.99Å; V190-L417 HydrophobicContact CG1-CG 4.27Å; A193-L417 HydrophobicContact CB-CD2 4.36Å; V194-L417 HydrophobicContact CG2-CD2 3.53Å; L206-L417 HydrophobicContact CD2-CB 4.16Å; V209-L417 HydrophobicContact CB-CD1 4.26Å; V209-L417 HydrophobicContact CG1-CD1 3.99Å; V209-L417 HydrophobicContact CG2-CD1 4.25Å; V209-L417 HydrophobicContact CG2-CD2 4.13Å; I211-L417 HydrophobicContact CD1-CD1 4.3Å; I396-L417 HydrophobicContact CD1-CD1 4.25Å; I396-L417 HydrophobicContact CD1-CD2 4.26Å; I413-L417 HydrophobicContact CG2-CD1 3.75Å; I413-L417 HydrophobicContact CG2-CG 4.09Å; I413-L417 WeakPolarHBondContact O-CB 3.38Å; I413-L417 VanDerWaalsContact O-CG 3.22Å; I413-L417 WeakPolarHBondContact O-CG 3.49Å; I413-L417 PolarHBondContact O-N 3.4Å; D415-L417 PolarHBondContact O-N 3.35Å; L417-K421 VanDerWaalsContact O-CB 3.31Å; L417-K421 WeakPolarHBondContact O-CB 3.21Å; L417-K421 PolarHBondContact O-N 2.94Å
418	R	92.7	Very high	89.3	Confident	71 Å²	71	27.9 Å²	27.9	27%	0.268	14%	0.142	S	C	.	.	H	α-helix	trans	-68.2	-41.3	177.1	-73.8	-179.7	-179.7	-170.4	-1.6	111.9	N85 L206 Y414 D415 G416 K421 N422	N85-R418 PolarHBondContact O-NH1 2.69Å; L206-R418 HydrophobicContact CD1-CB 4.48Å; L206-R418 HydrophobicContact CD1-CG 3.56Å; Y414-R418 WeakPolarHBondContact O-CG 3.39Å; Y414-R418 PolarHBondContact O-N 2.97Å; Y414-R418 VanDerWaalsContact O-N 3.07Å; D415-R418 PolarHBondContact O-N 2.96Å; G416-R418 VanDerWaalsContact C-N 3.35Å; G416-R418 PolarHBondContact O-N 2.82Å; R418-K421 PolarHBondContact O-N 3.05Å; R418-N422 WeakPolarHBondContact O-CB 3.5Å; R418-N422 PolarHBondContact O-N 3.12Å; R418-N422 PolarHBondContact O-ND2 3.48Å; R418-N422 PolarHBondContact O-OD1 3.4Å
419	A	91.6	Very high	89	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-46.5	176.1	0	0	0	0	0	111.8	V169 S173 D415 G416 N422 T423 N519	V169-A419 HydrophobicContact CG1-CB 4.29Å; S173-A419 VanDerWaalsContact OG-CB 3.23Å; S173-A419 WeakPolarHBondContact OG-CB 3.04Å; D415-A419 WeakPolarHBondContact O-CB 3.31Å; D415-A419 PolarHBondContact O-N 2.77Å; G416-A419 PolarHBondContact O-N 2.7Å; A419-N422 PolarHBondContact O-N 2.84Å; A419-T423 PolarHBondContact O-N 2.94Å; A419-T423 PolarHBondContact O-OG1 2.97Å; A419-N519 PolarHBondContact O-ND2 2.9Å
420	V	91.2	Very high	88.7	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-44	176.2	178.6	0	0	0	0	111	L166 A170 V190 V191 V194 G416 N422 T423 L424	L166-V420 HydrophobicContact CB-CG1 4.46Å; L166-V420 HydrophobicContact CD2-CG1 4.13Å; A170-V420 HydrophobicContact CB-CG2 3.68Å; V190-V420 HydrophobicContact CG1-CG2 4.07Å; V191-V420 HydrophobicContact CG2-CG2 4.42Å; V194-V420 HydrophobicContact CB-CG1 3.93Å; V194-V420 HydrophobicContact CG1-CG1 3.82Å; V194-V420 HydrophobicContact CG2-CB 4.21Å; V194-V420 HydrophobicContact CG2-CG1 4.01Å; G416-V420 WeakPolarHBondContact O-CG2 3.4Å; G416-V420 PolarHBondContact O-N 3.17Å; V420-N422 VanDerWaalsContact C-N 3.32Å; V420-N422 PolarHBondContact O-N 3.42Å; V420-T423 WeakPolarHBondContact O-CB 3.41Å; V420-T423 PolarHBondContact O-N 3.13Å; V420-L424 WeakPolarHBondContact O-CG 3.36Å; V420-L424 PolarHBondContact O-N 3.21Å; V420-L424 VanDerWaalsContact O-N 3.1Å
421	K	90.8	Very high	88.4	Confident	59 Å²	59	23.7 Å²	23.7	26%	0.257	12%	0.123	S	C	.	.	H	α-helix	trans	-56.2	-46.3	174.4	170	175.9	169.8	167	0	111.7	L204 L206 L417 R418 T423 L424 T425	L204-K421 HydrophobicContact CB-CD 4.39Å; L204-K421 HydrophobicContact CB-CG 4.32Å; L204-K421 VanDerWaalsContact O-CE 3.31Å; L204-K421 WeakPolarHBondContact O-CE 3.47Å; L204-K421 PolarHBondContact O-NZ 3.02Å; L206-K421 HydrophobicContact CD1-CD 3.85Å; L206-K421 HydrophobicContact CD2-CB 4.27Å; L206-K421 HydrophobicContact CD2-CD 4.13Å; L206-K421 HydrophobicContact CG-CD 3.77Å; L417-K421 VanDerWaalsContact O-CB 3.31Å; L417-K421 WeakPolarHBondContact O-CB 3.21Å; L417-K421 PolarHBondContact O-N 2.94Å; R418-K421 PolarHBondContact O-N 3.05Å; K421-T423 VanDerWaalsContact C-N 3.29Å; K421-T423 PolarHBondContact O-N 3.4Å; K421-L424 WeakPolarHBondContact O-CB 3.38Å; K421-L424 PolarHBondContact O-N 2.84Å; K421-T425 HydrophobicContact CG-CG2 4.42Å; K421-T425 WeakPolarHBondContact O-CG2 3.31Å; K421-T425 PolarHBondContact O-N 3.41Å; K421-T425 PolarHBondContact O-OG1 3.49Å
422	N	89.6	Confident	88.2	Confident	13 Å²	13	22.2 Å²	22.2	7%	0.07	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-37.3	-179.2	-71.3	-16.9	0	0	0	111.7	T88 R418 A419 V420 T425 D426 N519 C521	T88-N422 PolarHBondContact O-ND2 2.73Å; R418-N422 WeakPolarHBondContact O-CB 3.5Å; R418-N422 PolarHBondContact O-N 3.12Å; R418-N422 PolarHBondContact O-ND2 3.48Å; R418-N422 PolarHBondContact O-OD1 3.4Å; A419-N422 PolarHBondContact O-N 2.84Å; V420-N422 VanDerWaalsContact C-N 3.32Å; V420-N422 PolarHBondContact O-N 3.42Å; N422-T425 WeakPolarHBondContact CA-OG1 3.28Å; N422-T425 PolarHBondContact O-N 2.96Å; N422-T425 PolarHBondContact O-OG1 3.34Å; N422-D426 VanDerWaalsContact O-CB 3.27Å; N422-D426 WeakPolarHBondContact O-CB 3.26Å; N422-D426 VanDerWaalsContact O-CG 3.27Å; N422-D426 PolarHBondContact O-N 3Å; N422-N519 HydrophobicContact CB-CB 4.32Å; N422-N519 VanDerWaalsContact CB-ND2 3.29Å; N422-N519 WeakPolarHBondContact CB-ND2 3.48Å; N422-C521 VanDerWaalsContact CB-SG 3.58Å; N422-C521 VanDerWaalsContact CG-SG 3.51Å
423	T	86.9	Confident	87.9	Confident	4 Å²	4	23 Å²	23	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-63.2	-43.1	174.4	-61	0	0	0	0	111.5	L166 V169 A419 V420 K421 T425 G427 V429 N519	L166-T423 HydrophobicContact CD2-CG2 3.9Å; V169-T423 WeakPolarHBondContact CG1-OG1 3.47Å; V169-T423 HydrophobicContact CG2-CG2 4.35Å; A419-T423 PolarHBondContact O-N 2.94Å; A419-T423 PolarHBondContact O-OG1 2.97Å; V420-T423 WeakPolarHBondContact O-CB 3.41Å; V420-T423 PolarHBondContact O-N 3.13Å; K421-T423 VanDerWaalsContact C-N 3.29Å; K421-T423 PolarHBondContact O-N 3.4Å; T423-T425 VanDerWaalsContact C-N 3.34Å; T423-T425 PolarHBondContact O-N 2.92Å; T423-G427 PolarHBondContact O-N 3.47Å; T423-V429 HydrophobicContact CG2-CG1 3.54Å; T423-N519 PolarHBondContact N-ND2 2.96Å; T423-N519 VanDerWaalsContact N-ND2 3.16Å; T423-N519 PolarHBondContact OG1-ND2 3.41Å
424	L	86.1	Confident	87.6	Confident	17 Å²	17	23.1 Å²	23.1	9%	0.089	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-36.5	176.4	-66.1	176.9	0	0	0	112.3	M161 L166 V194 L204 V420 K421	M161-L424 HydrophobicContact CE-CD2 4.46Å; M161-L424 WeakPolarHBondContact CE-O 3.48Å; M161-L424 HydrophobicContact SD-CD2 3.3Å; M161-L424 WeakPolarHBondContact SD-CD2 3.32Å; M161-L424 HydrophobicContact SD-CG 4.45Å; L166-L424 HydrophobicContact CD1-CD2 4.06Å; L166-L424 HydrophobicContact CD2-CD2 3.94Å; L166-L424 HydrophobicContact CD2-CG 4.33Å; V194-L424 HydrophobicContact CG1-CD1 3.52Å; L204-L424 HydrophobicContact CD1-CB 4.2Å; L204-L424 HydrophobicContact CD1-CD1 4.02Å; L204-L424 HydrophobicContact CD2-CD1 3.62Å; L204-L424 HydrophobicContact CG-CD1 4.5Å; V420-L424 WeakPolarHBondContact O-CG 3.36Å; V420-L424 PolarHBondContact O-N 3.21Å; V420-L424 VanDerWaalsContact O-N 3.1Å; K421-L424 WeakPolarHBondContact O-CB 3.38Å; K421-L424 PolarHBondContact O-N 2.84Å
425	T	84.3	Confident	87.4	Confident	83 Å²	83	18.5 Å²	18.5	51%	0.509	11%	0.105	S	C	.	.	H	α-helix	trans	-77.8	-37.2	179.6	55.1	0	0	0	0	113.3	K421 N422 T423	K421-T425 HydrophobicContact CG-CG2 4.42Å; K421-T425 WeakPolarHBondContact O-CG2 3.31Å; K421-T425 PolarHBondContact O-N 3.41Å; K421-T425 PolarHBondContact O-OG1 3.49Å; N422-T425 WeakPolarHBondContact CA-OG1 3.28Å; N422-T425 PolarHBondContact O-N 2.96Å; N422-T425 PolarHBondContact O-OG1 3.34Å; T423-T425 VanDerWaalsContact C-N 3.34Å; T423-T425 PolarHBondContact O-N 2.92Å
426	D	81.3	Confident	87.2	Confident	48 Å²	48	18 Å²	18	26%	0.257	10%	0.103	S	C	.	.	H	α-helix	trans	-79.8	-31.1	-177	-72.3	-13.9	0	0	0	112	N422 V428 Y520 C521	N422-D426 VanDerWaalsContact O-CB 3.27Å; N422-D426 WeakPolarHBondContact O-CB 3.26Å; N422-D426 VanDerWaalsContact O-CG 3.27Å; N422-D426 PolarHBondContact O-N 3Å; D426-V428 HydrophobicContact CB-CG2 4.16Å; D426-V428 PolarHBondContact O-N 2.91Å; D426-V428 VanDerWaalsContact O-N 3.12Å; D426-Y520 HydrophobicContact CB-CD1 4.5Å; D426-C521 WeakPolarHBondContact OD2-CB 3.37Å; D426-C521 PolarHBondContact OD2-N 2.6Å; D426-C521 PolarHBondContact OD2-SG 2.84Å
427	G	80.3	Confident	87.1	Confident	30 Å²	30	18 Å²	18	31%	0.309	10%	0.103	S	C	.	.			trans	66.4	4.6	-173.8	0	0	0	0	0	114.3	T423	T423-G427 PolarHBondContact O-N 3.47Å
428	V	81.9	Confident	86.9	Confident	23 Å²	23	17.9 Å²	17.9	14%	0.139	10%	0.102	C	C	.	.			trans	-138.2	138.6	-178	-61.6	0	0	0	0	110.2	K156 D426 Y520	K156-V428 HydrophobicContact CD-CB 4.05Å; K156-V428 HydrophobicContact CD-CG1 4.1Å; K156-V428 HydrophobicContact CD-CG2 4.2Å; K156-V428 HydrophobicContact CG-CB 4.21Å; D426-V428 HydrophobicContact CB-CG2 4.16Å; D426-V428 PolarHBondContact O-N 2.91Å; D426-V428 VanDerWaalsContact O-N 3.12Å; V428-Y520 HydrophobicContact CG2-CD1 4.06Å; V428-Y520 HydrophobicContact CG2-CD2 4.32Å; V428-Y520 HydrophobicContact CG2-CG 3.75Å
429	V	83.6	Confident	86.7	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.006	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.7	173	-65.3	0	0	0	0	109.9	I157 L165 V169 T423 Y517	I157-V429 HydrophobicContact CB-CG2 4.39Å; L165-V429 HydrophobicContact CD1-CG2 4.2Å; L165-V429 HydrophobicContact CD2-CG1 4.26Å; L165-V429 HydrophobicContact CD2-CG2 4.26Å; V169-V429 HydrophobicContact CG2-CG1 3.96Å; T423-V429 HydrophobicContact CG2-CG1 3.54Å; V429-Y517 HydrophobicContact CB-CD1 4.27Å; V429-Y517 HydrophobicContact CB-CG 4.41Å; V429-Y517 HydrophobicContact CG2-CD1 3.87Å; V429-Y517 HydrophobicContact CG2-CE1 4.24Å; V429-Y517 HydrophobicContact CG2-CG 4.27Å
430	L	85.6	Confident	86.5	Confident	2 Å²	2	14.6 Å²	14.6	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	147.7	175.5	-60.2	175.5	0	0	0	109.5	L134 M155 K156 G432 Y517 D518 Y520 K523	L134-L430 HydrophobicContact CD2-CD1 3.57Å; L134-L430 HydrophobicContact CD2-CD2 4.45Å; M155-L430 WeakPolarHBondContact O-CD2 3.3Å; K156-L430 HydrophobicContact CG-CD2 3.88Å; L430-G432 PolarHBondContact O-N 3.41Å; L430-Y517 CarbonylContact O-C 3.38Å; L430-Y517 VanDerWaalsContact O-CA 3.3Å; L430-Y517 WeakPolarHBondContact O-CA 3.2Å; L430-D518 PolarHBondContact N-O 2.83Å; L430-D518 PolarHBondContact O-N 3.42Å; L430-Y520 HydrophobicContact CD1-CD2 4.38Å; L430-Y520 HydrophobicContact CD2-CD2 4.47Å; L430-K523 HydrophobicContact CD1-CB 3.9Å; L430-K523 HydrophobicContact CD1-CG 3.74Å
431	P	86.4	Confident	86.4	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.006	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	130.6	171.4	26.5	-32.4	0	0	0	110.3	M155 A435 A498 P511 E512	M155-P431 VanDerWaalsContact O-CD 3.31Å; M155-P431 WeakPolarHBondContact O-CD 3.41Å; P431-A435 HydrophobicContact CB-CB 4.24Å; P431-A435 HydrophobicContact CG-CB 4.29Å; P431-A498 HydrophobicContact CB-CB 4.08Å; P431-A498 HydrophobicContact CG-CB 3.56Å; P431-P511 HydrophobicContact CB-CB 4.07Å; P431-P511 HydrophobicContact CB-CG 4.26Å; P431-E512 HydrophobicContact CB-CG 4.39Å
432	G	85.9	Confident	86.3	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-150.2	-177.3	0	0	0	0	0	113.8	L430 G434 A435 P511 I516	L430-G432 PolarHBondContact O-N 3.41Å; G432-G434 PolarHBondContact O-N 2.92Å; G432-G434 VanDerWaalsContact O-N 3.13Å; G432-A435 WeakPolarHBondContact O-CB 3.42Å; G432-A435 PolarHBondContact O-N 3.24Å; G432-A435 VanDerWaalsContact O-N 3.1Å; G432-P511 WeakPolarHBondContact O-CG 3.41Å; G432-I516 PolarHBondContact N-O 2.87Å
433	A	86.5	Confident	86.1	Confident	18 Å²	18	14.6 Å²	14.6	15%	0.149	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	30.1	179.2	0	0	0	0	0	115.2	G500 I501 F509 P511 I516	A433-G500 VanDerWaalsContact O-CA 3.3Å; A433-G500 WeakPolarHBondContact O-CA 3.38Å; A433-I501 PolarHBondContact O-N 3.19Å; A433-F509 HydrophobicContact CB-CE1 3.71Å; A433-F509 HydrophobicContact CB-CZ 3.66Å; A433-P511 HydrophobicContact CB-CG 4.35Å; A433-I516 HydrophobicContact CB-CG2 4.33Å
434	G	85.6	Confident	86.2	Confident	3 Å²	3	14.4 Å²	14.4	3%	0.031	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	6.2	178.6	0	0	0	0	0	115	G432 F436 E437 V438	G432-G434 PolarHBondContact O-N 2.92Å; G432-G434 VanDerWaalsContact O-N 3.13Å; G434-F436 VanDerWaalsContact C-N 3.32Å; G434-F436 PolarHBondContact O-N 3.37Å; G434-E437 VanDerWaalsContact C-OE2 3.27Å; G434-E437 WeakPolarHBondContact CA-OE2 3.47Å; G434-E437 PolarHBondContact O-N 3.26Å; G434-V438 WeakPolarHBondContact O-CG2 3.01Å; G434-V438 PolarHBondContact O-N 3.36Å; G434-V438 VanDerWaalsContact O-N 3.12Å
435	A	88	Confident	86.3	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-37.2	-175.9	0	0	0	0	0	112.8	P431 G432 A439 A498 V499 P511	P431-A435 HydrophobicContact CB-CB 4.24Å; P431-A435 HydrophobicContact CG-CB 4.29Å; G432-A435 WeakPolarHBondContact O-CB 3.42Å; G432-A435 PolarHBondContact O-N 3.24Å; G432-A435 VanDerWaalsContact O-N 3.1Å; A435-A439 VanDerWaalsContact O-CB 3.31Å; A435-A439 WeakPolarHBondContact O-CB 3.46Å; A435-A439 PolarHBondContact O-N 3.06Å; A435-A498 HydrophobicContact CB-CB 4.25Å; A435-V499 WeakPolarHBondContact CA-O 3.47Å; A435-V499 WeakPolarHBondContact CB-O 3.19Å; A435-P511 HydrophobicContact CB-CG 3.97Å
436	F	88.2	Confident	86.4	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-44.2	175.3	173.1	-100.4	0	0	0	111.8	V133 L134 M155 G434 A439 A440 K523 I527	V133-F436 HydrophobicContact CG1-CE2 4.27Å; L134-F436 HydrophobicContact CD1-CE2 4.25Å; L134-F436 HydrophobicContact CD1-CZ 3.89Å; L134-F436 HydrophobicContact CD2-CD2 3.72Å; L134-F436 HydrophobicContact CD2-CE1 4.47Å; L134-F436 HydrophobicContact CD2-CE2 3.21Å; L134-F436 HydrophobicContact CD2-CZ 3.65Å; L134-F436 HydrophobicContact CG-CD2 4.38Å; L134-F436 HydrophobicContact CG-CE2 3.39Å; L134-F436 HydrophobicContact CG-CZ 3.53Å; M155-F436 HydrophobicContact CE-CD2 3.8Å; M155-F436 HydrophobicContact CE-CE2 4.18Å; G434-F436 VanDerWaalsContact C-N 3.32Å; G434-F436 PolarHBondContact O-N 3.37Å; F436-A439 PolarHBondContact O-N 2.91Å; F436-A440 HydrophobicContact CE1-CB 4.44Å; F436-A440 HydrophobicContact CZ-CB 4.26Å; F436-A440 VanDerWaalsContact O-CB 3.32Å; F436-A440 WeakPolarHBondContact O-CB 3.49Å; F436-A440 PolarHBondContact O-N 3.26Å; F436-K523 HydrophobicContact CD1-CD 4.16Å; F436-K523 HydrophobicContact CD1-CG 4.5Å; F436-I527 HydrophobicContact CE1-CD1 3.34Å; F436-I527 HydrophobicContact CE1-CG1 4.4Å; F436-I527 HydrophobicContact CZ-CD1 3.38Å
437	E	89.9	Confident	86.6	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.5	-42.4	-178.5	-69.2	75.7	-172.9	0	0	111.7	G434 A440 H441 I469 V470 K523	G434-E437 VanDerWaalsContact C-OE2 3.27Å; G434-E437 WeakPolarHBondContact CA-OE2 3.47Å; G434-E437 PolarHBondContact O-N 3.26Å; E437-A440 PolarHBondContact O-N 3.46Å; E437-H441 VanDerWaalsContact O-CB 3.3Å; E437-H441 WeakPolarHBondContact O-CB 3.29Å; E437-H441 PolarHBondContact O-N 3.21Å; E437-I469 HydrophobicContact CG-CB 4.15Å; E437-I469 HydrophobicContact CG-CD1 3.86Å; E437-I469 HydrophobicContact CG-CG1 4.47Å; E437-I469 HydrophobicContact CG-CG2 4.44Å; E437-I469 WeakPolarHBondContact OE1-CD1 3.3Å; E437-V470 HydrophobicContact CB-CG2 4.44Å; E437-K523 IonicContact OE1-NZ 3.4Å; E437-K523 PolarHBondContact OE1-NZ 3.09Å; E437-K523 IonicContact OE2-NZ 2.82Å
438	V	89.1	Confident	86.9	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.006	9%	0.085	C	C	.	.	H	α-helix	trans	-64.7	-44.2	174.9	178.9	0	0	0	0	110.5	G434 H441 C442 M467 V470 L488 V489 R492	G434-V438 WeakPolarHBondContact O-CG2 3.01Å; G434-V438 PolarHBondContact O-N 3.36Å; G434-V438 VanDerWaalsContact O-N 3.12Å; V438-H441 PolarHBondContact O-N 3.43Å; V438-C442 PolarHBondContact O-N 2.84Å; V438-C442 PolarHBondContact O-SG 3.28Å; V438-C442 VanDerWaalsContact O-SG 3.34Å; V438-M467 HydrophobicContact CG2-CE 4.38Å; V438-M467 HydrophobicContact CG2-SD 4.29Å; V438-V470 HydrophobicContact CG2-CG2 3.83Å; V438-L488 HydrophobicContact CG1-CB 4.32Å; V438-L488 HydrophobicContact CG2-CB 4.07Å; V438-L488 HydrophobicContact CG2-CD1 4.47Å; V438-V489 HydrophobicContact CG1-CG2 4.34Å; V438-R492 HydrophobicContact CG1-CB 3.93Å; V438-R492 HydrophobicContact CG1-CG 4.21Å
439	A	87	Confident	87.1	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-45.7	177.9	0	0	0	0	0	111.8	M155 A435 F436 C442 E443	M155-A439 HydrophobicContact CE-CB 3.75Å; M155-A439 HydrophobicContact SD-CB 3.84Å; A435-A439 VanDerWaalsContact O-CB 3.31Å; A435-A439 WeakPolarHBondContact O-CB 3.46Å; A435-A439 PolarHBondContact O-N 3.06Å; F436-A439 PolarHBondContact O-N 2.91Å; A439-C442 PolarHBondContact O-N 3.19Å; A439-E443 WeakPolarHBondContact O-CG 3.35Å; A439-E443 PolarHBondContact O-N 3.16Å
440	A	87.4	Confident	87.2	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-41.1	176.7	0	0	0	0	0	111.8	F436 E437 E443 L444 L466	F436-A440 HydrophobicContact CE1-CB 4.44Å; F436-A440 HydrophobicContact CZ-CB 4.26Å; F436-A440 VanDerWaalsContact O-CB 3.32Å; F436-A440 WeakPolarHBondContact O-CB 3.49Å; F436-A440 PolarHBondContact O-N 3.26Å; E437-A440 PolarHBondContact O-N 3.46Å; A440-E443 PolarHBondContact O-N 3.31Å; A440-L444 WeakPolarHBondContact O-CB 3.43Å; A440-L444 VanDerWaalsContact O-CG 3.24Å; A440-L444 WeakPolarHBondContact O-CG 3.49Å; A440-L444 PolarHBondContact O-N 3.37Å; A440-L466 HydrophobicContact CB-CD1 3.75Å
441	H	90.4	Very high	87.1	Confident	18 Å²	18	30.2 Å²	30.2	8%	0.083	15%	0.149	C	C	.	.	H	α-helix	trans	-58.7	-49.4	174.8	178.1	84.9	0	0	0	111.8	E437 V438 E443 L444 M445 A463 D464 M467	E437-H441 VanDerWaalsContact O-CB 3.3Å; E437-H441 WeakPolarHBondContact O-CB 3.29Å; E437-H441 PolarHBondContact O-N 3.21Å; V438-H441 PolarHBondContact O-N 3.43Å; H441-E443 VanDerWaalsContact C-N 3.34Å; H441-E443 PolarHBondContact O-N 3.29Å; H441-L444 PolarHBondContact O-N 3.11Å; H441-M445 VanDerWaalsContact O-CG 3.31Å; H441-M445 WeakPolarHBondContact O-CG 3.34Å; H441-M445 PolarHBondContact O-N 2.9Å; H441-A463 VanDerWaalsContact ND1-C 3.27Å; H441-A463 PolarHBondContact ND1-O 3.44Å; H441-D464 IonicContact CE1-OD1 3.49Å; H441-D464 PolarHBondContact CE1-OD1 3.25Å; H441-M467 HydrophobicContact CB-CG 4.2Å; H441-M467 HydrophobicContact CB-SD 3.9Å
442	C	87.5	Confident	86.9	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-40.6	178.4	-67.4	0	0	0	0	112.5	V438 A439 M445 K446 M493	V438-C442 PolarHBondContact O-N 2.84Å; V438-C442 PolarHBondContact O-SG 3.28Å; V438-C442 VanDerWaalsContact O-SG 3.34Å; A439-C442 PolarHBondContact O-N 3.19Å; C442-M445 PolarHBondContact O-N 3.03Å; C442-K446 WeakPolarHBondContact O-CG 3.39Å; C442-K446 PolarHBondContact O-N 2.93Å; C442-M493 HydrophobicContact CB-CE 4.1Å
443	E	86.7	Confident	86.9	Confident	51 Å²	51	39.5 Å²	39.5	24%	0.238	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-41.5	177.8	-71.7	-56	127.7	0	0	112.2	V133 A439 A440 H441 M445 K446 V447	V133-E443 HydrophobicContact CG2-CB 4.05Å; V133-E443 HydrophobicContact CG2-CG 4.14Å; A439-E443 WeakPolarHBondContact O-CG 3.35Å; A439-E443 PolarHBondContact O-N 3.16Å; A440-E443 PolarHBondContact O-N 3.31Å; H441-E443 VanDerWaalsContact C-N 3.34Å; H441-E443 PolarHBondContact O-N 3.29Å; E443-M445 VanDerWaalsContact C-N 3.29Å; E443-M445 PolarHBondContact O-N 3.48Å; E443-K446 PolarHBondContact O-N 3.41Å; E443-K446 IonicContact OE1-NZ 3.45Å; E443-K446 PolarHBondContact OE1-NZ 3.46Å; E443-V447 WeakPolarHBondContact O-CG2 3.25Å; E443-V447 PolarHBondContact O-N 3.19Å
444	L	88.7	Confident	86.9	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-38.2	174.8	-72.3	171.9	0	0	0	111.9	A126 I129 A440 H441 V447 K448 V459 Y462 A463 L466	A126-L444 HydrophobicContact CB-CD2 3.8Å; I129-L444 HydrophobicContact CB-CD2 3.93Å; I129-L444 HydrophobicContact CD1-CD2 4.07Å; I129-L444 HydrophobicContact CG2-CD2 3.85Å; A440-L444 WeakPolarHBondContact O-CB 3.43Å; A440-L444 VanDerWaalsContact O-CG 3.24Å; A440-L444 WeakPolarHBondContact O-CG 3.49Å; A440-L444 PolarHBondContact O-N 3.37Å; H441-L444 PolarHBondContact O-N 3.11Å; L444-V447 PolarHBondContact O-N 3.32Å; L444-K448 WeakPolarHBondContact O-CB 3.44Å; L444-K448 PolarHBondContact O-N 2.92Å; L444-V459 HydrophobicContact CB-CG1 4.41Å; L444-V459 HydrophobicContact CD2-CG1 4.18Å; L444-Y462 HydrophobicContact CD1-CD1 3.77Å; L444-Y462 HydrophobicContact CD1-CE1 4.43Å; L444-A463 HydrophobicContact CB-CB 3.77Å; L444-A463 HydrophobicContact CD1-CB 3.87Å; L444-L466 HydrophobicContact CD1-CD1 3.76Å
445	M	88.3	Confident	87.1	Confident	63 Å²	63	50.5 Å²	50.5	31%	0.31	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-36.8	176.1	-72.4	-66.6	-83.4	0	0	112.5	H441 C442 E443 K448	H441-M445 VanDerWaalsContact O-CG 3.31Å; H441-M445 WeakPolarHBondContact O-CG 3.34Å; H441-M445 PolarHBondContact O-N 2.9Å; C442-M445 PolarHBondContact O-N 3.03Å; E443-M445 VanDerWaalsContact C-N 3.29Å; E443-M445 PolarHBondContact O-N 3.48Å; M445-K448 WeakPolarHBondContact O-CB 3.48Å; M445-K448 HydrophobicContact SD-CD 4.11Å
446	K	87	Confident	87.3	Confident	86 Å²	86	53.8 Å²	53.8	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-36.2	172.3	-66.7	170.7	-170.6	169.8	0	112.3	C442 E443	C442-K446 WeakPolarHBondContact O-CG 3.39Å; C442-K446 PolarHBondContact O-N 2.93Å; E443-K446 PolarHBondContact O-N 3.41Å; E443-K446 IonicContact OE1-NZ 3.45Å; E443-K446 PolarHBondContact OE1-NZ 3.46Å
447	V	83.6	Confident	87.5	Confident	34 Å²	34	56 Å²	56	21%	0.206	28%	0.277	C	S	.	.	H	α-helix	trans	-77.3	-29.7	180	179.5	0	0	0	0	111.7	I129 E443 L444 D449 K450 V451	I129-V447 HydrophobicContact CD1-CB 4.01Å; I129-V447 HydrophobicContact CD1-CG1 3.41Å; I129-V447 VanDerWaalsContact CD1-CG1 3.41Å; I129-V447 HydrophobicContact CD1-CG2 4.31Å; I129-V447 HydrophobicContact CG1-CG1 4.4Å; I129-V447 HydrophobicContact CG2-CG2 4.32Å; E443-V447 WeakPolarHBondContact O-CG2 3.25Å; E443-V447 PolarHBondContact O-N 3.19Å; L444-V447 PolarHBondContact O-N 3.32Å; V447-D449 PolarHBondContact O-N 3.36Å; V447-D449 VanDerWaalsContact O-N 3.13Å; V447-K450 WeakPolarHBondContact O-CA 2.99Å; V447-K450 WeakPolarHBondContact O-CB 3.29Å; V447-K450 PolarHBondContact O-N 2.82Å; V447-V451 HydrophobicContact CG1-CG2 3.87Å; V447-V451 WeakPolarHBondContact O-CG2 3.24Å; V447-V451 PolarHBondContact O-N 3.1Å; V447-V451 VanDerWaalsContact O-N 3.12Å
448	K	87.1	Confident	87.5	Confident	42 Å²	42	56 Å²	56	18%	0.183	28%	0.277	C	S	.	.	H	α-helix	trans	-50.1	-38.1	174.3	-177.4	-168.7	175.7	-174.1	0	112.3	L444 M445 K450 K456 Q460	L444-K448 WeakPolarHBondContact O-CB 3.44Å; L444-K448 PolarHBondContact O-N 2.92Å; M445-K448 WeakPolarHBondContact O-CB 3.48Å; M445-K448 HydrophobicContact SD-CD 4.11Å; K448-K450 VanDerWaalsContact C-N 3.27Å; K448-K450 PolarHBondContact O-N 2.8Å; K448-K456 HydrophobicContact CG-CB 4.39Å; K448-K456 WeakPolarHBondContact O-CD 3.3Å; K448-K456 VanDerWaalsContact O-CE 3.24Å; K448-K456 WeakPolarHBondContact O-CE 3.42Å; K448-K456 WeakPolarHBondContact O-CG 3.49Å; K448-Q460 HydrophobicContact CD-CB 4.29Å
449	D	86	Confident	87.7	Confident	124 Å²	124	56 Å²	56	66%	0.663	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.7	178.7	-67.4	-29.4	0	0	0	112.9	V447 K456	V447-D449 PolarHBondContact O-N 3.36Å; V447-D449 VanDerWaalsContact O-N 3.13Å; D449-K456 PolarHBondContact O-NZ 3.28Å
450	K	86.3	Confident	88	Confident	169 Å²	169	58.1 Å²	58.1	74%	0.735	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-21.6	-178.8	-59.7	-179.2	-179.3	177.7	0	114.5	V447 K448	V447-K450 WeakPolarHBondContact O-CA 2.99Å; V447-K450 WeakPolarHBondContact O-CB 3.29Å; V447-K450 PolarHBondContact O-N 2.82Å; K448-K450 VanDerWaalsContact C-N 3.27Å; K448-K450 PolarHBondContact O-N 2.8Å
451	V	83.9	Confident	88.3	Confident	17 Å²	17	58.1 Å²	58.1	10%	0.103	29%	0.287	C	S	.	.	S	Bend	trans	-78.8	132.6	-176.5	171.1	0	0	0	0	110.2	I125 V447 K455 K456 V459	I125-V451 HydrophobicContact CD1-CG1 4.45Å; I125-V451 HydrophobicContact CG2-CG2 4.24Å; V447-V451 HydrophobicContact CG1-CG2 3.87Å; V447-V451 WeakPolarHBondContact O-CG2 3.24Å; V447-V451 PolarHBondContact O-N 3.1Å; V447-V451 VanDerWaalsContact O-N 3.12Å; V451-K455 HydrophobicContact CG1-CB 3.95Å; V451-K456 HydrophobicContact CB-CG 4.34Å; V451-K456 HydrophobicContact CG1-CG 4.43Å; V451-K456 WeakPolarHBondContact O-CD 3.24Å; V451-K456 WeakPolarHBondContact O-CE 3.29Å; V451-K456 WeakPolarHBondContact O-CG 3.41Å; V451-V459 HydrophobicContact CG2-CG2 4.48Å
452	D	82.3	Confident	88.4	Confident	140 Å²	140	57.4 Å²	57.4	75%	0.749	28%	0.283	S	S	*	.			trans	-80.9	146.3	-177.5	-66.4	-44	0	0	0	114.8
453	G	85.5	Confident	88.7	Confident	57 Å²	57	57.3 Å²	57.3	59%	0.588	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-152.9	165.2	0	0	0	0	0	116	K455 K456	G453-K455 PolarHBondContact O-N 3.09Å; G453-K456 WeakPolarHBondContact O-CG 3.32Å; G453-K456 PolarHBondContact O-N 3.38Å
454	R	87.3	Confident	89	Confident	174 Å²	174	57 Å²	57	66%	0.657	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.8	-176.4	-63.4	-175.3	-177.2	-177.6	0.7	113.6	I118 K456 L457	I118-R454 HydrophobicContact CD1-CB 4.32Å; I118-R454 HydrophobicContact CG2-CB 3.7Å; R454-K456 PolarHBondContact O-N 2.64Å; R454-L457 WeakPolarHBondContact O-CB 3.28Å; R454-L457 PolarHBondContact O-N 2.82Å; R454-L457 VanDerWaalsContact O-N 3.12Å
455	K	89.3	Confident	89.3	Confident	77 Å²	77	57 Å²	57	34%	0.335	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-25.1	176.6	-57.2	-174.6	-173.4	-155.7	0	112.3	E121 I125 V451 G453 L457 G458 V459	E121-K455 HydrophobicContact CB-CD 4.35Å; E121-K455 WeakPolarHBondContact OE2-CE 3.16Å; E121-K455 IonicContact OE2-NZ 3.67Å; E121-K455 PolarHBondContact OE2-NZ 3.47Å; I125-K455 HydrophobicContact CD1-CD 4.01Å; V451-K455 HydrophobicContact CG1-CB 3.95Å; G453-K455 PolarHBondContact O-N 3.09Å; K455-L457 PolarHBondContact O-N 2.79Å; K455-G458 PolarHBondContact O-N 2.99Å; K455-V459 PolarHBondContact O-N 2.8Å
456	K	91.9	Very high	89.5	Confident	70 Å²	70	54.2 Å²	54.2	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-50.7	-36.6	172.1	-69.3	-172.4	175.9	-165.8	0	112.7	K448 D449 V451 G453 R454 V459 Q460	K448-K456 HydrophobicContact CG-CB 4.39Å; K448-K456 WeakPolarHBondContact O-CD 3.3Å; K448-K456 VanDerWaalsContact O-CE 3.24Å; K448-K456 WeakPolarHBondContact O-CE 3.42Å; K448-K456 WeakPolarHBondContact O-CG 3.49Å; D449-K456 PolarHBondContact O-NZ 3.28Å; V451-K456 HydrophobicContact CB-CG 4.34Å; V451-K456 HydrophobicContact CG1-CG 4.43Å; V451-K456 WeakPolarHBondContact O-CD 3.24Å; V451-K456 WeakPolarHBondContact O-CE 3.29Å; V451-K456 WeakPolarHBondContact O-CG 3.41Å; G453-K456 WeakPolarHBondContact O-CG 3.32Å; G453-K456 PolarHBondContact O-N 3.38Å; R454-K456 PolarHBondContact O-N 2.64Å; K456-V459 PolarHBondContact O-N 2.86Å; K456-Q460 WeakPolarHBondContact O-CB 3.45Å; K456-Q460 PolarHBondContact O-N 2.99Å
457	L	91.3	Very high	89.8	Confident	48 Å²	48	50.5 Å²	50.5	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-40.2	-179.8	-58.8	177.4	0	0	0	111.4	Y109 V114 R454 K455 Q460 A461	Y109-L457 HydrophobicContact CD1-CB 4.17Å; Y109-L457 HydrophobicContact CD1-CD1 4.37Å; Y109-L457 HydrophobicContact CD1-CD2 4.31Å; Y109-L457 HydrophobicContact CE1-CB 4.24Å; Y109-L457 HydrophobicContact CE1-CD2 3.9Å; Y109-L457 HydrophobicContact CG-CB 4.45Å; V114-L457 HydrophobicContact CG2-CD1 3.71Å; R454-L457 WeakPolarHBondContact O-CB 3.28Å; R454-L457 PolarHBondContact O-N 2.82Å; R454-L457 VanDerWaalsContact O-N 3.12Å; K455-L457 PolarHBondContact O-N 2.79Å; L457-Q460 PolarHBondContact O-N 2.7Å; L457-A461 WeakPolarHBondContact O-CB 3.22Å; L457-A461 PolarHBondContact O-N 3.34Å
458	G	91.5	Very high	90.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-39.3	175.4	0	0	0	0	0	112.7	F123 K455 A461 Y462	F123-G458 WeakPolarHBondContact CD1-O 3.4Å; F123-G458 WeakPolarHBondContact CE1-O 3.44Å; K455-G458 PolarHBondContact O-N 2.99Å; G458-A461 PolarHBondContact O-N 3.33Å; G458-Y462 PolarHBondContact O-N 3.17Å
459	V	92.8	Very high	90.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-41.3	175	178.6	0	0	0	0	111.1	I125 L444 V451 K455 K456 Y462 A463	I125-V459 HydrophobicContact CB-CG2 4.45Å; I125-V459 HydrophobicContact CG2-CG2 4.25Å; L444-V459 HydrophobicContact CB-CG1 4.41Å; L444-V459 HydrophobicContact CD2-CG1 4.18Å; V451-V459 HydrophobicContact CG2-CG2 4.48Å; K455-V459 PolarHBondContact O-N 2.8Å; K456-V459 PolarHBondContact O-N 2.86Å; V459-Y462 PolarHBondContact O-N 3.3Å; V459-A463 WeakPolarHBondContact O-CB 3.43Å; V459-A463 PolarHBondContact O-N 3.25Å
460	Q	92.7	Very high	90.9	Very high	47 Å²	47	41.7 Å²	41.7	22%	0.22	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-48.3	175.3	179.7	174.1	-8.1	0	0	111.6	Y109 K448 K456 L457 Y462 A463 D464	Y109-Q460 VanDerWaalsContact OH-CD 3.28Å; K448-Q460 HydrophobicContact CD-CB 4.29Å; K456-Q460 WeakPolarHBondContact O-CB 3.45Å; K456-Q460 PolarHBondContact O-N 2.99Å; L457-Q460 PolarHBondContact O-N 2.7Å; Q460-Y462 PolarHBondContact O-N 3.09Å; Q460-A463 PolarHBondContact O-N 3.38Å; Q460-A463 VanDerWaalsContact O-N 3.09Å; Q460-D464 WeakPolarHBondContact CG-OD2 3.41Å; Q460-D464 PolarHBondContact O-N 3.37Å
461	A	93.7	Very high	91.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-54.3	-42	176	0	0	0	0	0	111.9	Q105 Y109 F123 L457 G458 A465	Q105-A461 HydrophobicContact CB-CB 4.04Å; Y109-A461 HydrophobicContact CD2-CB 3.83Å; Y109-A461 HydrophobicContact CE2-CB 3.58Å; F123-A461 HydrophobicContact CE1-CB 3.85Å; F123-A461 HydrophobicContact CZ-CB 4.4Å; L457-A461 WeakPolarHBondContact O-CB 3.22Å; L457-A461 PolarHBondContact O-N 3.34Å; G458-A461 PolarHBondContact O-N 3.33Å; A461-A465 VanDerWaalsContact O-CB 3.3Å; A461-A465 WeakPolarHBondContact O-CB 3.3Å; A461-A465 PolarHBondContact O-N 3.34Å
462	Y	93.9	Very high	91.7	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-46	176.9	-162.9	-77.8	0	0	0	111.8	M102 F123 A126 L444 G458 V459 Q460 D464 A465 L466 S531	M102-Y462 HydrophobicContact CE-CD2 3.44Å; M102-Y462 VanDerWaalsContact CE-CD2 3.44Å; M102-Y462 HydrophobicContact CE-CE2 3.34Å; M102-Y462 HydrophobicContact SD-CD2 4.42Å; M102-Y462 HydrophobicContact SD-CE2 4.07Å; F123-Y462 HydrophobicContact CB-CD2 4.18Å; F123-Y462 AromaticContact CD1-CD2 3.75Å; F123-Y462 HydrophobicContact CD1-CD2 3.75Å; F123-Y462 HydrophobicContact CD1-CG 4.34Å; F123-Y462 HydrophobicContact CE1-CD2 4.25Å; F123-Y462 HydrophobicContact CG-CD2 4Å; A126-Y462 HydrophobicContact CB-CD1 3.69Å; A126-Y462 HydrophobicContact CB-CD2 3.9Å; A126-Y462 HydrophobicContact CB-CE1 4.32Å; A126-Y462 HydrophobicContact CB-CE2 4.49Å; A126-Y462 HydrophobicContact CB-CG 3.45Å; A126-Y462 VanDerWaalsContact CB-CG 3.45Å; L444-Y462 HydrophobicContact CD1-CD1 3.77Å; L444-Y462 HydrophobicContact CD1-CE1 4.43Å; G458-Y462 PolarHBondContact O-N 3.17Å; V459-Y462 PolarHBondContact O-N 3.3Å; Q460-Y462 PolarHBondContact O-N 3.09Å; Y462-D464 PolarHBondContact O-N 3.03Å; Y462-A465 PolarHBondContact O-N 3.41Å; Y462-L466 HydrophobicContact CD1-CD1 4.09Å; Y462-L466 HydrophobicContact CD1-CG 4.16Å; Y462-L466 HydrophobicContact CE1-CD1 3.97Å; Y462-L466 HydrophobicContact CE1-CD2 4.05Å; Y462-L466 HydrophobicContact CE1-CG 4.03Å; Y462-L466 PolarHBondContact O-N 3.45Å; Y462-L466 VanDerWaalsContact O-N 3.17Å; Y462-S531 WeakPolarHBondContact CE2-OG 3.47Å; Y462-S531 PolarHBondContact OH-OG 3.38Å
463	A	93	Very high	92.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61	-44.7	179.2	0	0	0	0	0	111.5	H441 L444 V459 Q460 A465 L466	H441-A463 VanDerWaalsContact ND1-C 3.27Å; H441-A463 PolarHBondContact ND1-O 3.44Å; L444-A463 HydrophobicContact CB-CB 3.77Å; L444-A463 HydrophobicContact CD1-CB 3.87Å; V459-A463 WeakPolarHBondContact O-CB 3.43Å; V459-A463 PolarHBondContact O-N 3.25Å; Q460-A463 PolarHBondContact O-N 3.38Å; Q460-A463 VanDerWaalsContact O-N 3.09Å; A463-A465 VanDerWaalsContact C-N 3.32Å; A463-A465 PolarHBondContact O-N 3.18Å; A463-L466 PolarHBondContact O-N 3.16Å
464	D	93.5	Very high	92.6	Very high	43 Å²	43	27.9 Å²	27.9	23%	0.23	12%	0.123	C	C	.	.	H	α-helix	trans	-67.8	-34	179	-69.5	-30.5	0	0	0	111.7	H441 Q460 Y462 M467	H441-D464 IonicContact CE1-OD1 3.49Å; H441-D464 PolarHBondContact CE1-OD1 3.25Å; Q460-D464 WeakPolarHBondContact CG-OD2 3.41Å; Q460-D464 PolarHBondContact O-N 3.37Å; Y462-D464 PolarHBondContact O-N 3.03Å; D464-M467 PolarHBondContact O-N 2.86Å
465	A	94.2	Very high	92.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-65.4	-37.1	175.9	0	0	0	0	0	113	E101 M102 Q105 A461 Y462 A463 M467 V468	E101-A465 HydrophobicContact CB-CB 4.32Å; E101-A465 HydrophobicContact CG-CB 4.08Å; M102-A465 HydrophobicContact CB-CB 4.35Å; M102-A465 HydrophobicContact CG-CB 3.66Å; Q105-A465 HydrophobicContact CG-CB 4.2Å; A461-A465 VanDerWaalsContact O-CB 3.3Å; A461-A465 WeakPolarHBondContact O-CB 3.3Å; A461-A465 PolarHBondContact O-N 3.34Å; Y462-A465 PolarHBondContact O-N 3.41Å; A463-A465 VanDerWaalsContact C-N 3.32Å; A463-A465 PolarHBondContact O-N 3.18Å; A465-M467 PolarHBondContact O-N 3.11Å; A465-V468 WeakPolarHBondContact O-CB 3.29Å; A465-V468 WeakPolarHBondContact O-CG1 3.23Å; A465-V468 PolarHBondContact O-N 3.16Å; A465-V468 VanDerWaalsContact O-N 3.12Å
466	L	92.7	Very high	93.1	Very high	6 Å²	6	22 Å²	22	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-31.7	177.9	-69.9	175.3	0	0	0	112.9	L98 A440 L444 Y462 A463 V468	L98-L466 HydrophobicContact CD2-CD2 4.11Å; A440-L466 HydrophobicContact CB-CD1 3.75Å; L444-L466 HydrophobicContact CD1-CD1 3.76Å; Y462-L466 HydrophobicContact CD1-CD1 4.09Å; Y462-L466 HydrophobicContact CD1-CG 4.16Å; Y462-L466 HydrophobicContact CE1-CD1 3.97Å; Y462-L466 HydrophobicContact CE1-CD2 4.05Å; Y462-L466 HydrophobicContact CE1-CG 4.03Å; Y462-L466 PolarHBondContact O-N 3.45Å; Y462-L466 VanDerWaalsContact O-N 3.17Å; A463-L466 PolarHBondContact O-N 3.16Å; L466-V468 PolarHBondContact O-N 2.81Å; L466-V468 VanDerWaalsContact O-N 3.13Å
467	M	93.1	Very high	93.1	Very high	8 Å²	8	19.9 Å²	19.9	4%	0.039	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-10.5	179.9	-68	-62.3	-64.2	0	0	113.5	V438 H441 D464 A465 I469 V470 K471 A485 V489	V438-M467 HydrophobicContact CG2-CE 4.38Å; V438-M467 HydrophobicContact CG2-SD 4.29Å; H441-M467 HydrophobicContact CB-CG 4.2Å; H441-M467 HydrophobicContact CB-SD 3.9Å; D464-M467 PolarHBondContact O-N 2.86Å; A465-M467 PolarHBondContact O-N 3.11Å; M467-I469 PolarHBondContact O-N 2.86Å; M467-V470 HydrophobicContact CE-CB 4.5Å; M467-V470 PolarHBondContact O-N 3.36Å; M467-K471 WeakPolarHBondContact O-CG 3.49Å; M467-K471 PolarHBondContact O-N 3.06Å; M467-A485 HydrophobicContact CE-CB 3.65Å; M467-V489 HydrophobicContact CE-CG2 3.92Å; M467-V489 HydrophobicContact SD-CG2 4.43Å
468	V	93.9	Very high	93.1	Very high	8 Å²	8	20.9 Å²	20.9	5%	0.048	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-34.5	178.1	74.4	0	0	0	0	112.6	V97 L98 E101 A465 L466 K471 S472	V97-V468 HydrophobicContact CG1-CB 4.32Å; V97-V468 HydrophobicContact CG1-CG1 3.71Å; V97-V468 HydrophobicContact CG1-CG2 3.64Å; L98-V468 HydrophobicContact CD2-CG1 3.93Å; E101-V468 HydrophobicContact CB-CB 3.92Å; E101-V468 HydrophobicContact CB-CG1 4.01Å; E101-V468 HydrophobicContact CB-CG2 3.96Å; E101-V468 HydrophobicContact CG-CB 3.85Å; E101-V468 HydrophobicContact CG-CG1 4.41Å; E101-V468 HydrophobicContact CG-CG2 4.03Å; A465-V468 WeakPolarHBondContact O-CB 3.29Å; A465-V468 WeakPolarHBondContact O-CG1 3.23Å; A465-V468 PolarHBondContact O-N 3.16Å; A465-V468 VanDerWaalsContact O-N 3.12Å; L466-V468 PolarHBondContact O-N 2.81Å; L466-V468 VanDerWaalsContact O-N 3.13Å; V468-K471 PolarHBondContact O-N 3.17Å; V468-S472 WeakPolarHBondContact O-CB 3.33Å; V468-S472 PolarHBondContact O-N 3.2Å; V468-S472 PolarHBondContact O-OG 3.42Å
469	I	92.9	Very high	93.1	Very high	6 Å²	6	23.4 Å²	23.4	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-48.9	-179	-69.7	177.5	0	0	0	109.2	L38 L98 E437 M467 S472 L473 M526	L38-I469 HydrophobicContact CD2-CG2 4.28Å; L98-I469 HydrophobicContact CD1-CD1 3.83Å; L98-I469 HydrophobicContact CD2-CD1 3.95Å; L98-I469 HydrophobicContact CD2-CG1 4.18Å; L98-I469 HydrophobicContact CG-CD1 3.87Å; L98-I469 HydrophobicContact CG-CG1 4.28Å; E437-I469 HydrophobicContact CG-CB 4.15Å; E437-I469 HydrophobicContact CG-CD1 3.86Å; E437-I469 HydrophobicContact CG-CG1 4.47Å; E437-I469 HydrophobicContact CG-CG2 4.44Å; E437-I469 WeakPolarHBondContact OE1-CD1 3.3Å; M467-I469 PolarHBondContact O-N 2.86Å; I469-S472 PolarHBondContact O-N 3.5Å; I469-L473 HydrophobicContact CG2-CD1 4.15Å; I469-L473 WeakPolarHBondContact O-CB 3.17Å; I469-L473 VanDerWaalsContact O-CG 3.26Å; I469-L473 WeakPolarHBondContact O-CG 3.44Å; I469-L473 PolarHBondContact O-N 3.16Å; I469-M526 HydrophobicContact CD1-CE 4.28Å
470	V	93	Very high	93.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-47.2	177.4	177.2	0	0	0	0	111.1	E437 V438 M467 S472 L473 A474 L488	E437-V470 HydrophobicContact CB-CG2 4.44Å; V438-V470 HydrophobicContact CG2-CG2 3.83Å; M467-V470 HydrophobicContact CE-CB 4.5Å; M467-V470 PolarHBondContact O-N 3.36Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3Å; V470-L473 PolarHBondContact O-N 3.38Å; V470-A474 WeakPolarHBondContact O-CB 3.19Å; V470-A474 PolarHBondContact O-N 3.13Å; V470-L488 HydrophobicContact CG1-CD1 3.28Å
471	K	93.5	Very high	93	Very high	74 Å²	74	27.4 Å²	27.4	32%	0.322	16%	0.16	S	C	.	.	H	α-helix	trans	-59.2	-44.2	178.1	-73.3	173.4	-178.9	174.5	0	111.5	M467 V468 A474 E475 A481 A485	M467-K471 WeakPolarHBondContact O-CG 3.49Å; M467-K471 PolarHBondContact O-N 3.06Å; V468-K471 PolarHBondContact O-N 3.17Å; K471-A474 PolarHBondContact O-N 3Å; K471-E475 WeakPolarHBondContact O-CB 3.48Å; K471-E475 PolarHBondContact O-N 3.04Å; K471-A481 HydrophobicContact CB-CB 3.99Å; K471-A481 HydrophobicContact CG-CB 4.25Å; K471-A485 HydrophobicContact CG-CB 4.23Å
472	S	93.4	Very high	92.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.6	-39.5	179.7	-58	0	0	0	0	112.1	K35 V468 I469 V470 E475 N476	K35-S472 WeakPolarHBondContact CG-OG 3.38Å; V468-S472 WeakPolarHBondContact O-CB 3.33Å; V468-S472 PolarHBondContact O-N 3.2Å; V468-S472 PolarHBondContact O-OG 3.42Å; I469-S472 PolarHBondContact O-N 3.5Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3Å; S472-E475 PolarHBondContact O-N 3.48Å; S472-N476 WeakPolarHBondContact O-CB 3.13Å; S472-N476 PolarHBondContact O-N 2.79Å; S472-N476 PolarHBondContact O-ND2 2.72Å
473	L	92.9	Very high	92.8	Very high	18 Å²	18	35.4 Å²	35.4	9%	0.094	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-42.9	173.8	-74.5	174.6	0	0	0	112	L38 G39 I469 V470 A477 I501 L503	L38-L473 HydrophobicContact CD2-CD2 4.32Å; L38-L473 HydrophobicContact CD2-CG 4.17Å; L38-L473 HydrophobicContact CG-CD2 4.04Å; L38-L473 HydrophobicContact CG-CG 4.43Å; G39-L473 VanDerWaalsContact CA-CD2 3.48Å; I469-L473 HydrophobicContact CG2-CD1 4.15Å; I469-L473 WeakPolarHBondContact O-CB 3.17Å; I469-L473 VanDerWaalsContact O-CG 3.26Å; I469-L473 WeakPolarHBondContact O-CG 3.44Å; I469-L473 PolarHBondContact O-N 3.16Å; V470-L473 PolarHBondContact O-N 3.38Å; L473-A477 WeakPolarHBondContact O-CB 3.47Å; L473-A477 PolarHBondContact O-N 3.11Å; L473-A477 VanDerWaalsContact O-N 3.16Å; L473-I501 HydrophobicContact CB-CG2 4.18Å; L473-I501 HydrophobicContact CD1-CG2 4.33Å; L473-L503 HydrophobicContact CB-CD2 4.04Å
474	A	93.7	Very high	92.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-46.3	176.4	0	0	0	0	0	111.9	V470 K471 A477 G478 H479 A484 I501	V470-A474 WeakPolarHBondContact O-CB 3.19Å; V470-A474 PolarHBondContact O-N 3.13Å; K471-A474 PolarHBondContact O-N 3Å; A474-A477 CarbonylContact O-C 3.56Å; A474-A477 WeakPolarHBondContact O-CB 3.5Å; A474-A477 PolarHBondContact O-N 3.25Å; A474-A477 VanDerWaalsContact O-N 3.13Å; A474-G478 PolarHBondContact O-N 3.03Å; A474-G478 VanDerWaalsContact O-N 3.17Å; A474-H479 PolarHBondContact O-N 2.88Å; A474-A484 HydrophobicContact CB-CB 3.9Å; A474-I501 HydrophobicContact CB-CD1 3.4Å; A474-I501 VanDerWaalsContact CB-CD1 3.4Å
475	E	93.7	Very high	92.5	Very high	95 Å²	95	34 Å²	34	44%	0.444	20%	0.204	S	C	.	.	H	α-helix	trans	-65.1	-42.6	-178.8	-169.4	173.2	148.7	0	0	111.7	K35 K471 S472 A477 G478	K35-E475 WeakPolarHBondContact CE-OE2 3.36Å; K35-E475 IonicContact NZ-OE1 3.08Å; K35-E475 PolarHBondContact NZ-OE1 2.91Å; K35-E475 IonicContact NZ-OE2 3.94Å; K35-E475 PolarHBondContact NZ-OE2 2.86Å; K471-E475 WeakPolarHBondContact O-CB 3.48Å; K471-E475 PolarHBondContact O-N 3.04Å; S472-E475 PolarHBondContact O-N 3.48Å; E475-A477 PolarHBondContact O-N 3.29Å; E475-G478 PolarHBondContact O-N 2.96Å
476	N	93.1	Very high	92.4	Very high	32 Å²	32	38.8 Å²	38.8	17%	0.171	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-25	174.7	-69.8	-16.7	0	0	0	112.8	K35 L38 S472 G478	K35-N476 PolarHBondContact O-ND2 3.06Å; L38-N476 PolarHBondContact O-ND2 3.22Å; S472-N476 WeakPolarHBondContact O-CB 3.13Å; S472-N476 PolarHBondContact O-N 2.79Å; S472-N476 PolarHBondContact O-ND2 2.72Å; N476-G478 VanDerWaalsContact C-N 3.32Å
477	A	91.9	Very high	92.2	Very high	26 Å²	26	42.8 Å²	42.8	22%	0.215	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.7	173	0	0	0	0	0	113.5	L473 A474 E475 L503	L473-A477 WeakPolarHBondContact O-CB 3.47Å; L473-A477 PolarHBondContact O-N 3.11Å; L473-A477 VanDerWaalsContact O-N 3.16Å; A474-A477 CarbonylContact O-C 3.56Å; A474-A477 WeakPolarHBondContact O-CB 3.5Å; A474-A477 PolarHBondContact O-N 3.25Å; A474-A477 VanDerWaalsContact O-N 3.13Å; E475-A477 PolarHBondContact O-N 3.29Å; A477-L503 HydrophobicContact CB-CB 4.14Å; A477-L503 HydrophobicContact CB-CD2 4.11Å; A477-L503 WeakPolarHBondContact CB-O 3.34Å
478	G	92.1	Very high	92	Very high	69 Å²	69	42.5 Å²	42.5	71%	0.711	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.9	10.7	-177.9	0	0	0	0	0	114.7	A474 E475 N476	A474-G478 PolarHBondContact O-N 3.03Å; A474-G478 VanDerWaalsContact O-N 3.17Å; E475-G478 PolarHBondContact O-N 2.96Å; N476-G478 VanDerWaalsContact C-N 3.32Å
479	H	92.1	Very high	91.8	Very high	53 Å²	53	43.6 Å²	43.6	25%	0.245	25%	0.252	C	S	.	.	S	Bend	trans	-92.1	156.1	176.1	-62.3	-65.4	0	0	0	111.2	A474 A481 L503 I504 G506	A474-H479 PolarHBondContact O-N 2.88Å; H479-A481 PolarHBondContact O-N 2.99Å; H479-A481 VanDerWaalsContact O-N 3.14Å; H479-L503 PolarHBondContact NE2-O 3.15Å; H479-I504 PolarHBondContact CE1-O 2.87Å; H479-I504 PolarHBondContact NE2-O 3.03Å; H479-G506 PolarHBondContact NE2-N 3.21Å
480	N	93.1	Very high	91.6	Very high	112 Å²	112	47.6 Å²	47.6	60%	0.599	27%	0.271	S	S	*	.			trans	-64.8	114.5	173.8	-73.9	-23	0	0	0	110.7	S482 D483 A484	N480-S482 VanDerWaalsContact C-N 3.3Å; N480-S482 PolarHBondContact O-N 3.48Å; N480-D483 HydrophobicContact CB-CB 4.06Å; N480-D483 VanDerWaalsContact CB-OD2 3.26Å; N480-D483 WeakPolarHBondContact CB-OD2 3.38Å; N480-D483 PolarHBondContact ND2-OD2 3.47Å; N480-D483 PolarHBondContact O-N 2.79Å; N480-A484 PolarHBondContact O-N 2.95Å; N480-A484 VanDerWaalsContact O-N 3.12Å
481	A	90.2	Very high	91.4	Very high	19 Å²	19	51 Å²	51	16%	0.157	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-38	-175.8	0	0	0	0	0	113.7	K471 H479 A485	K471-A481 HydrophobicContact CB-CB 3.99Å; K471-A481 HydrophobicContact CG-CB 4.25Å; H479-A481 PolarHBondContact O-N 2.99Å; H479-A481 VanDerWaalsContact O-N 3.14Å; A481-A485 VanDerWaalsContact O-CB 3.3Å; A481-A485 WeakPolarHBondContact O-CB 2.96Å; A481-A485 PolarHBondContact O-N 3.06Å; A481-A485 VanDerWaalsContact O-N 3.15Å
482	S	90.7	Very high	90.9	Very high	89 Å²	89	48.2 Å²	48.2	62%	0.622	27%	0.274	S	S	*	.	H	α-helix	trans	-68.9	-46	179.7	-57.1	0	0	0	0	112.6	N480 A485 L486	N480-S482 VanDerWaalsContact C-N 3.3Å; N480-S482 PolarHBondContact O-N 3.48Å; S482-A485 PolarHBondContact O-N 2.98Å; S482-L486 WeakPolarHBondContact O-CB 3.19Å; S482-L486 PolarHBondContact O-N 2.93Å
483	D	91.9	Very high	90.5	Very high	84 Å²	84	52.6 Å²	52.6	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-43.2	-178.1	-60.6	-21.7	0	0	0	110.7	N480 L486 K487	N480-D483 HydrophobicContact CB-CB 4.06Å; N480-D483 VanDerWaalsContact CB-OD2 3.26Å; N480-D483 WeakPolarHBondContact CB-OD2 3.38Å; N480-D483 PolarHBondContact ND2-OD2 3.47Å; N480-D483 PolarHBondContact O-N 2.79Å; D483-L486 PolarHBondContact O-N 3.36Å; D483-K487 WeakPolarHBondContact O-CB 3.42Å; D483-K487 VanDerWaalsContact O-CG 3.29Å; D483-K487 WeakPolarHBondContact O-CG 3.29Å; D483-K487 PolarHBondContact O-N 3.32Å
484	A	89.5	Confident	90.2	Very high	4 Å²	4	59.4 Å²	59.4	3%	0.033	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-45.3	177.2	0	0	0	0	0	111.8	A474 N480 L486 K487 L488 I501	A474-A484 HydrophobicContact CB-CB 3.9Å; N480-A484 PolarHBondContact O-N 2.95Å; N480-A484 VanDerWaalsContact O-N 3.12Å; A484-L486 PolarHBondContact O-N 3.32Å; A484-K487 PolarHBondContact O-N 3.42Å; A484-L488 VanDerWaalsContact O-CD1 3.31Å; A484-L488 WeakPolarHBondContact O-CD1 3.36Å; A484-L488 VanDerWaalsContact O-CG 3.26Å; A484-L488 WeakPolarHBondContact O-CG 3.23Å; A484-L488 PolarHBondContact O-N 3.16Å; A484-L488 VanDerWaalsContact O-N 3.1Å; A484-I501 HydrophobicContact CB-CD1 3.7Å
485	A	90.4	Very high	89.4	Confident	8 Å²	8	62.2 Å²	62.2	7%	0.066	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-43.9	177	0	0	0	0	0	112	M467 K471 A481 S482 L488 V489	M467-A485 HydrophobicContact CE-CB 3.65Å; K471-A485 HydrophobicContact CG-CB 4.23Å; A481-A485 VanDerWaalsContact O-CB 3.3Å; A481-A485 WeakPolarHBondContact O-CB 2.96Å; A481-A485 PolarHBondContact O-N 3.06Å; A481-A485 VanDerWaalsContact O-N 3.15Å; S482-A485 PolarHBondContact O-N 2.98Å; A485-L488 PolarHBondContact O-N 2.78Å; A485-V489 WeakPolarHBondContact O-CG2 3.3Å; A485-V489 PolarHBondContact O-N 3.45Å; A485-V489 VanDerWaalsContact O-N 3.14Å
486	L	91.7	Very high	88.6	Confident	103 Å²	103	60.5 Å²	60.5	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-49	178.3	-170.7	78.9	0	0	0	111.4	S482 D483 A484 L488 V489 E490	S482-L486 WeakPolarHBondContact O-CB 3.19Å; S482-L486 PolarHBondContact O-N 2.93Å; D483-L486 PolarHBondContact O-N 3.36Å; A484-L486 PolarHBondContact O-N 3.32Å; L486-L488 VanDerWaalsContact C-N 3.27Å; L486-L488 PolarHBondContact O-N 2.96Å; L486-V489 PolarHBondContact O-N 3.44Å; L486-E490 WeakPolarHBondContact O-CG 3.33Å; L486-E490 PolarHBondContact O-N 3.28Å
487	K	90.1	Very high	87.9	Confident	89 Å²	89	63 Å²	63	39%	0.387	35%	0.348	S	S	.	.	H	α-helix	trans	-54.4	-43.3	177.8	-76.8	176.9	176.5	-173.9	0	111.9	D483 A484 Q491 D507	D483-K487 WeakPolarHBondContact O-CB 3.42Å; D483-K487 VanDerWaalsContact O-CG 3.29Å; D483-K487 WeakPolarHBondContact O-CG 3.29Å; D483-K487 PolarHBondContact O-N 3.32Å; A484-K487 PolarHBondContact O-N 3.42Å; K487-Q491 WeakPolarHBondContact O-CB 3.33Å; K487-Q491 WeakPolarHBondContact O-CG 3.46Å; K487-Q491 PolarHBondContact O-N 3.01Å; K487-D507 IonicContact NZ-OD1 2.82Å; K487-D507 PolarHBondContact NZ-OD1 2.96Å
488	L	88.3	Confident	87.3	Confident	2 Å²	2	62 Å²	62	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-66.5	-45.4	-179.7	-72.2	160.6	0	0	0	112.3	V438 V470 A484 A485 L486 Q491 R492 V499 G500 I501 A508	V438-L488 HydrophobicContact CG1-CB 4.32Å; V438-L488 HydrophobicContact CG2-CB 4.07Å; V438-L488 HydrophobicContact CG2-CD1 4.47Å; V470-L488 HydrophobicContact CG1-CD1 3.28Å; A484-L488 VanDerWaalsContact O-CD1 3.31Å; A484-L488 WeakPolarHBondContact O-CD1 3.36Å; A484-L488 VanDerWaalsContact O-CG 3.26Å; A484-L488 WeakPolarHBondContact O-CG 3.23Å; A484-L488 PolarHBondContact O-N 3.16Å; A484-L488 VanDerWaalsContact O-N 3.1Å; A485-L488 PolarHBondContact O-N 2.78Å; L486-L488 VanDerWaalsContact C-N 3.27Å; L486-L488 PolarHBondContact O-N 2.96Å; L488-Q491 PolarHBondContact O-N 3.39Å; L488-R492 VanDerWaalsContact O-CB 3.28Å; L488-R492 WeakPolarHBondContact O-CB 3.44Å; L488-R492 PolarHBondContact O-N 3.34Å; L488-V499 HydrophobicContact CD2-CB 4.48Å; L488-V499 HydrophobicContact CD2-CG1 3.91Å; L488-G500 VanDerWaalsContact CD2-C 3.41Å; L488-G500 WeakPolarHBondContact CD2-O 3.25Å; L488-I501 HydrophobicContact CD1-CB 3.92Å; L488-I501 HydrophobicContact CD1-CG1 4.41Å; L488-A508 HydrophobicContact CD2-CB 3.36Å; L488-A508 HydrophobicContact CG-CB 3.99Å
489	V	88.8	Confident	87	Confident	31 Å²	31	58.9 Å²	58.9	19%	0.188	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-44.2	177.4	173.7	0	0	0	0	110.3	V438 M467 A485 L486 R492 M493	V438-V489 HydrophobicContact CG1-CG2 4.34Å; M467-V489 HydrophobicContact CE-CG2 3.92Å; M467-V489 HydrophobicContact SD-CG2 4.43Å; A485-V489 WeakPolarHBondContact O-CG2 3.3Å; A485-V489 PolarHBondContact O-N 3.45Å; A485-V489 VanDerWaalsContact O-N 3.14Å; L486-V489 PolarHBondContact O-N 3.44Å; V489-R492 PolarHBondContact O-N 2.8Å; V489-M493 HydrophobicContact CG1-CG 4.45Å; V489-M493 WeakPolarHBondContact O-CB 3.4Å; V489-M493 VanDerWaalsContact O-CG 3.22Å; V489-M493 WeakPolarHBondContact O-CG 3.49Å; V489-M493 PolarHBondContact O-N 3.04Å
490	E	90.5	Very high	86.7	Confident	90 Å²	90	56.3 Å²	56.3	42%	0.421	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-44.8	176.7	-74	-174.6	-172.1	0	0	112.7	L486 M493 K494	L486-E490 WeakPolarHBondContact O-CG 3.33Å; L486-E490 PolarHBondContact O-N 3.28Å; E490-M493 PolarHBondContact O-N 2.81Å; E490-K494 VanDerWaalsContact O-CG 3.32Å; E490-K494 WeakPolarHBondContact O-CG 3.44Å; E490-K494 PolarHBondContact O-N 3.1Å
491	Q	87.4	Confident	86.6	Confident	74 Å²	74	51.1 Å²	51.1	35%	0.346	27%	0.266	S	S	.	.	H	α-helix	trans	-66.6	-40.7	178.3	-77	-165.5	3	0	0	112	K487 L488 M493 K494 T495 V499 A508	K487-Q491 WeakPolarHBondContact O-CB 3.33Å; K487-Q491 WeakPolarHBondContact O-CG 3.46Å; K487-Q491 PolarHBondContact O-N 3.01Å; L488-Q491 PolarHBondContact O-N 3.39Å; Q491-M493 VanDerWaalsContact C-N 3.34Å; Q491-K494 PolarHBondContact O-N 3.46Å; Q491-T495 WeakPolarHBondContact O-CB 3.45Å; Q491-T495 PolarHBondContact O-N 2.86Å; Q491-T495 PolarHBondContact O-OG1 3.39Å; Q491-V499 HydrophobicContact CB-CG1 4.44Å; Q491-V499 HydrophobicContact CB-CG2 4.46Å; Q491-A508 HydrophobicContact CG-CB 4.28Å; Q491-A508 PolarHBondContact OE1-O 3.4Å
492	R	83.7	Confident	86.6	Confident	14 Å²	14	52.5 Å²	52.5	5%	0.053	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-43.4	174.2	177.3	63.2	-178	-158.1	1.5	111	V438 L488 V489 K494 N496 M497 A498	V438-R492 HydrophobicContact CG1-CB 3.93Å; V438-R492 HydrophobicContact CG1-CG 4.21Å; L488-R492 VanDerWaalsContact O-CB 3.28Å; L488-R492 WeakPolarHBondContact O-CB 3.44Å; L488-R492 PolarHBondContact O-N 3.34Å; V489-R492 PolarHBondContact O-N 2.8Å; R492-K494 VanDerWaalsContact C-N 3.31Å; R492-K494 PolarHBondContact O-N 3.24Å; R492-N496 PolarHBondContact NH1-O 3.4Å; R492-N496 WeakPolarHBondContact O-CA 3.45Å; R492-N496 PolarHBondContact O-N 2.99Å; R492-M497 WeakPolarHBondContact CD-O 3.1Å; R492-M497 PolarHBondContact NH1-O 3.28Å; R492-A498 VanDerWaalsContact NH1-CA 3.27Å; R492-A498 VanDerWaalsContact NH1-N 3.18Å
493	M	84.9	Confident	86.5	Confident	93 Å²	93	49.8 Å²	49.8	46%	0.458	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-35.2	177.6	-72.6	-67.2	-167.9	0	0	112.5	C442 V489 E490 Q491	C442-M493 HydrophobicContact CB-CE 4.1Å; V489-M493 HydrophobicContact CG1-CG 4.45Å; V489-M493 WeakPolarHBondContact O-CB 3.4Å; V489-M493 VanDerWaalsContact O-CG 3.22Å; V489-M493 WeakPolarHBondContact O-CG 3.49Å; V489-M493 PolarHBondContact O-N 3.04Å; E490-M493 PolarHBondContact O-N 2.81Å; Q491-M493 VanDerWaalsContact C-N 3.34Å
494	K	86.1	Confident	86.3	Confident	160 Å²	160	52.3 Å²	52.3	70%	0.696	26%	0.261	S	S	*	.	H	α-helix	trans	-75.3	-45	178.6	-71.9	170.8	-174.1	168.4	0	113	E490 Q491 R492	E490-K494 VanDerWaalsContact O-CG 3.32Å; E490-K494 WeakPolarHBondContact O-CG 3.44Å; E490-K494 PolarHBondContact O-N 3.1Å; Q491-K494 PolarHBondContact O-N 3.46Å; R492-K494 VanDerWaalsContact C-N 3.31Å; R492-K494 PolarHBondContact O-N 3.24Å
495	T	77.6	Confident	86.2	Confident	60 Å²	60	55.6 Å²	55.6	37%	0.368	28%	0.281	S	S	.	.	H	α-helix	trans	-98.4	-22.2	-169.9	60.9	0	0	0	0	113.4	Q491 M497	Q491-T495 WeakPolarHBondContact O-CB 3.45Å; Q491-T495 PolarHBondContact O-N 2.86Å; Q491-T495 PolarHBondContact O-OG1 3.39Å; T495-M497 HydrophobicContact CG2-CE 3.79Å; T495-M497 PolarHBondContact O-N 2.82Å; T495-M497 PolarHBondContact OG1-N 2.88Å
496	N	76.8	Confident	86	Confident	59 Å²	59	55.6 Å²	55.6	32%	0.316	28%	0.282	S	S	.	.			trans	50.2	13.9	-164.3	-68.4	-49.9	0	0	0	114.9	V151 R492	V151-N496 HydrophobicContact CG1-CB 3.51Å; R492-N496 PolarHBondContact NH1-O 3.4Å; R492-N496 WeakPolarHBondContact O-CA 3.45Å; R492-N496 PolarHBondContact O-N 2.99Å
497	M	78	Confident	85.8	Confident	85 Å²	85	54.2 Å²	54.2	42%	0.419	28%	0.275	S	S	.	.	S	Bend	trans	-85	159.1	178	-63.9	-170.2	-71.8	0	0	111.1	R492 T495 V499 L510	R492-M497 WeakPolarHBondContact CD-O 3.1Å; R492-M497 PolarHBondContact NH1-O 3.28Å; T495-M497 HydrophobicContact CG2-CE 3.79Å; T495-M497 PolarHBondContact O-N 2.82Å; T495-M497 PolarHBondContact OG1-N 2.88Å; M497-V499 WeakPolarHBondContact O-CG2 3.34Å; M497-V499 PolarHBondContact O-N 2.81Å; M497-L510 HydrophobicContact CB-CD2 3.7Å; M497-L510 HydrophobicContact CE-CD1 4.24Å; M497-L510 HydrophobicContact CE-CD2 4.26Å; M497-L510 HydrophobicContact SD-CD1 4.26Å; M497-L510 HydrophobicContact SD-CD2 4.16Å
498	A	79.6	Confident	85.6	Confident	3 Å²	3	50.8 Å²	50.8	3%	0.025	26%	0.263	C	S	.	.			trans	-72.5	98.8	175.6	0	0	0	0	0	109.7	P431 A435 R492 L510 P511	P431-A498 HydrophobicContact CB-CB 4.08Å; P431-A498 HydrophobicContact CG-CB 3.56Å; A435-A498 HydrophobicContact CB-CB 4.25Å; R492-A498 VanDerWaalsContact NH1-CA 3.27Å; R492-A498 VanDerWaalsContact NH1-N 3.18Å; A498-L510 WeakPolarHBondContact O-CD2 3.11Å; A498-P511 WeakPolarHBondContact O-CD 3.45Å
499	V	84.9	Confident	85.6	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	27%	0.269	C	S	.	.			trans	-105.2	128.6	-176.8	-166.6	0	0	0	0	109.6	A435 L488 Q491 M497 A508 F509	A435-V499 WeakPolarHBondContact CA-O 3.47Å; A435-V499 WeakPolarHBondContact CB-O 3.19Å; L488-V499 HydrophobicContact CD2-CB 4.48Å; L488-V499 HydrophobicContact CD2-CG1 3.91Å; Q491-V499 HydrophobicContact CB-CG1 4.44Å; Q491-V499 HydrophobicContact CB-CG2 4.46Å; M497-V499 WeakPolarHBondContact O-CG2 3.34Å; M497-V499 PolarHBondContact O-N 2.81Å; V499-A508 HydrophobicContact CG1-CB 3.62Å; V499-F509 CarbonylContact C-O 3.57Å; V499-F509 WeakPolarHBondContact CA-O 3.34Å; V499-F509 WeakPolarHBondContact CG1-O 3.13Å
500	G	86.8	Confident	85.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	175.7	175.6	0	0	0	0	0	112.4	A433 L488 A508 F509	A433-G500 VanDerWaalsContact O-CA 3.3Å; A433-G500 WeakPolarHBondContact O-CA 3.38Å; L488-G500 VanDerWaalsContact CD2-C 3.41Å; L488-G500 WeakPolarHBondContact CD2-O 3.25Å; G500-A508 WeakPolarHBondContact O-CA 3Å; G500-F509 VanDerWaalsContact C-CE1 3.42Å; G500-F509 PolarHBondContact N-O 3.35Å; G500-F509 WeakPolarHBondContact O-CD1 3.43Å; G500-F509 PolarHBondContact O-N 2.88Å
501	I	90.2	Very high	85	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.015	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.9	-178.9	-168.3	174.6	0	0	0	113.4	A433 L473 A474 A484 L488 L503 F509	A433-I501 PolarHBondContact O-N 3.19Å; L473-I501 HydrophobicContact CB-CG2 4.18Å; L473-I501 HydrophobicContact CD1-CG2 4.33Å; A474-I501 HydrophobicContact CB-CD1 3.4Å; A474-I501 VanDerWaalsContact CB-CD1 3.4Å; A484-I501 HydrophobicContact CB-CD1 3.7Å; L488-I501 HydrophobicContact CD1-CB 3.92Å; L488-I501 HydrophobicContact CD1-CG1 4.41Å; I501-L503 HydrophobicContact CG2-CD2 4.05Å; I501-L503 PolarHBondContact O-N 2.89Å; I501-F509 VanDerWaalsContact C-CD1 3.41Å; I501-F509 WeakPolarHBondContact O-CE1 3.15Å
502	N	91.1	Very high	84.7	Confident	48 Å²	48	48 Å²	48	26%	0.257	25%	0.249	S	C	.	.			trans	-80	115	172.9	-173.4	-21.5	0	0	0	108.8	I504 T505 G506 D507 F509	N502-I504 PolarHBondContact O-N 2.87Å; N502-I504 PolarHBondContact OD1-N 3.34Å; N502-T505 WeakPolarHBondContact CB-OG1 3.5Å; N502-T505 PolarHBondContact ND2-OG1 3.23Å; N502-G506 VanDerWaalsContact O-CA 3.3Å; N502-G506 WeakPolarHBondContact O-CA 3.45Å; N502-G506 PolarHBondContact O-N 2.91Å; N502-D507 VanDerWaalsContact CB-O 3.31Å; N502-D507 WeakPolarHBondContact CB-O 3.45Å; N502-D507 PolarHBondContact N-O 2.85Å; N502-F509 HydrophobicContact CB-CB 4.39Å; N502-F509 HydrophobicContact CB-CD1 3.67Å; N502-F509 HydrophobicContact CB-CE1 4.29Å; N502-F509 HydrophobicContact CB-CG 4.12Å
503	L	87.3	Confident	84.6	Confident	32 Å²	32	55.1 Å²	55.1	17%	0.168	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.5	-176	-57.8	175.3	0	0	0	113.6	P40 K41 L473 A477 H479 I501	P40-L503 HydrophobicContact CG-CD1 3.27Å; K41-L503 HydrophobicContact CG-CB 4.43Å; L473-L503 HydrophobicContact CB-CD2 4.04Å; A477-L503 HydrophobicContact CB-CB 4.14Å; A477-L503 HydrophobicContact CB-CD2 4.11Å; A477-L503 WeakPolarHBondContact CB-O 3.34Å; H479-L503 PolarHBondContact NE2-O 3.15Å; I501-L503 HydrophobicContact CG2-CD2 4.05Å; I501-L503 PolarHBondContact O-N 2.89Å
504	I	89.3	Confident	84.5	Confident	136 Å²	136	53.9 Å²	53.9	70%	0.697	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-50.8	178.3	-58.9	174.9	0	0	0	110.2	H479 N502	H479-I504 PolarHBondContact CE1-O 2.87Å; H479-I504 PolarHBondContact NE2-O 3.03Å; N502-I504 PolarHBondContact O-N 2.87Å; N502-I504 PolarHBondContact OD1-N 3.34Å
505	T	87.4	Confident	84.4	Confident	74 Å²	74	46.5 Å²	46.5	45%	0.454	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-23.6	-174.4	58.5	0	0	0	0	113.8	N502 D507	N502-T505 WeakPolarHBondContact CB-OG1 3.5Å; N502-T505 PolarHBondContact ND2-OG1 3.23Å; T505-D507 PolarHBondContact O-N 3.49Å; T505-D507 PolarHBondContact OG1-N 2.84Å
506	G	84.9	Confident	84.9	Confident	7 Å²	7	46 Å²	46	7%	0.072	25%	0.247	C	C	.	.			trans	74.7	5.8	-170.9	0	0	0	0	0	113.3	H479 N502	H479-G506 PolarHBondContact NE2-N 3.21Å; N502-G506 VanDerWaalsContact O-CA 3.3Å; N502-G506 WeakPolarHBondContact O-CA 3.45Å; N502-G506 PolarHBondContact O-N 2.91Å
507	D	87.7	Confident	85.5	Confident	75 Å²	75	44.1 Å²	44.1	40%	0.401	24%	0.235	S	C	.	.	S	Bend	trans	-93.7	165.3	175.8	-67.9	-41	0	0	0	111.3	K487 N502 T505	K487-D507 IonicContact NZ-OD1 2.82Å; K487-D507 PolarHBondContact NZ-OD1 2.96Å; N502-D507 VanDerWaalsContact CB-O 3.31Å; N502-D507 WeakPolarHBondContact CB-O 3.45Å; N502-D507 PolarHBondContact N-O 2.85Å; T505-D507 PolarHBondContact O-N 3.49Å; T505-D507 PolarHBondContact OG1-N 2.84Å
508	A	87	Confident	86	Confident	16 Å²	16	41.9 Å²	41.9	13%	0.132	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.1	-175.9	0	0	0	0	0	109.7	L488 Q491 V499 G500	L488-A508 HydrophobicContact CD2-CB 3.36Å; L488-A508 HydrophobicContact CG-CB 3.99Å; Q491-A508 HydrophobicContact CG-CB 4.28Å; Q491-A508 PolarHBondContact OE1-O 3.4Å; V499-A508 HydrophobicContact CG1-CB 3.62Å; G500-A508 WeakPolarHBondContact O-CA 3Å
509	F	87.6	Confident	86.4	Confident	33 Å²	33	41.9 Å²	41.9	15%	0.145	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	163.6	-171.4	81.6	-68.7	0	0	0	110.7	A433 V499 G500 I501 N502 P511 S514 I516	A433-F509 HydrophobicContact CB-CE1 3.71Å; A433-F509 HydrophobicContact CB-CZ 3.66Å; V499-F509 CarbonylContact C-O 3.57Å; V499-F509 WeakPolarHBondContact CA-O 3.34Å; V499-F509 WeakPolarHBondContact CG1-O 3.13Å; G500-F509 VanDerWaalsContact C-CE1 3.42Å; G500-F509 PolarHBondContact N-O 3.35Å; G500-F509 WeakPolarHBondContact O-CD1 3.43Å; G500-F509 PolarHBondContact O-N 2.88Å; I501-F509 VanDerWaalsContact C-CD1 3.41Å; I501-F509 WeakPolarHBondContact O-CE1 3.15Å; N502-F509 HydrophobicContact CB-CB 4.39Å; N502-F509 HydrophobicContact CB-CD1 3.67Å; N502-F509 HydrophobicContact CB-CE1 4.29Å; N502-F509 HydrophobicContact CB-CG 4.12Å; F509-P511 HydrophobicContact CE2-CB 4.35Å; F509-P511 HydrophobicContact CE2-CG 4.5Å; F509-P511 HydrophobicContact CZ-CB 4.29Å; F509-P511 HydrophobicContact CZ-CG 4.24Å; F509-P511 WeakPolarHBondContact O-CD 3.19Å; F509-S514 WeakPolarHBondContact CD2-OG 3.45Å; F509-S514 WeakPolarHBondContact CE2-OG 3.48Å; F509-I516 HydrophobicContact CE2-CD1 4.04Å; F509-I516 HydrophobicContact CZ-CD1 3.79Å
510	L	85.9	Confident	86.6	Confident	37 Å²	37	42.9 Å²	42.9	19%	0.194	23%	0.228	C	C	.	.			trans	-85	114	174.1	-67.9	169.2	0	0	0	109.7	M497 A498 E512 E513	M497-L510 HydrophobicContact CB-CD2 3.7Å; M497-L510 HydrophobicContact CE-CD1 4.24Å; M497-L510 HydrophobicContact CE-CD2 4.26Å; M497-L510 HydrophobicContact SD-CD1 4.26Å; M497-L510 HydrophobicContact SD-CD2 4.16Å; A498-L510 WeakPolarHBondContact O-CD2 3.11Å; L510-E512 PolarHBondContact O-N 2.98Å; L510-E513 HydrophobicContact CB-CG 4.13Å; L510-E513 PolarHBondContact O-N 3.07Å
511	P	81.4	Confident	86.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.8	-178.9	-24.1	36.3	0	0	0	113.9	P431 G432 A433 A435 A498 F509 E513 S514 G515 I516	P431-P511 HydrophobicContact CB-CB 4.07Å; P431-P511 HydrophobicContact CB-CG 4.26Å; G432-P511 WeakPolarHBondContact O-CG 3.41Å; A433-P511 HydrophobicContact CB-CG 4.35Å; A435-P511 HydrophobicContact CB-CG 3.97Å; A498-P511 WeakPolarHBondContact O-CD 3.45Å; F509-P511 HydrophobicContact CE2-CB 4.35Å; F509-P511 HydrophobicContact CE2-CG 4.5Å; F509-P511 HydrophobicContact CZ-CB 4.29Å; F509-P511 HydrophobicContact CZ-CG 4.24Å; F509-P511 WeakPolarHBondContact O-CD 3.19Å; P511-E513 PolarHBondContact O-N 3.31Å; P511-S514 PolarHBondContact O-N 2.86Å; P511-G515 PolarHBondContact O-N 3.31Å; P511-G515 VanDerWaalsContact O-N 3.16Å; P511-I516 HydrophobicContact CB-CB 4.37Å; P511-I516 PolarHBondContact O-N 2.78Å
512	E	79.5	Confident	86.8	Confident	70 Å²	70	44 Å²	44	33%	0.327	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-42.3	179.8	-56.9	-173.9	159.7	0	0	111.7	I157 P431 L510 S514 G515	I157-E512 HydrophobicContact CD1-CB 4.38Å; I157-E512 HydrophobicContact CD1-CG 4Å; P431-E512 HydrophobicContact CB-CG 4.39Å; L510-E512 PolarHBondContact O-N 2.98Å; E512-S514 PolarHBondContact O-N 3.32Å; E512-G515 PolarHBondContact O-N 3.16Å
513	E	82.5	Confident	86.8	Confident	163 Å²	163	42.3 Å²	42.3	76%	0.762	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.2	179.6	-63.9	-177.3	167.1	0	0	112.6	L510 P511	L510-E513 HydrophobicContact CB-CG 4.13Å; L510-E513 PolarHBondContact O-N 3.07Å; P511-E513 PolarHBondContact O-N 3.31Å
514	S	82.3	Confident	86.9	Confident	66 Å²	66	44.4 Å²	44.4	46%	0.462	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	0.8	178.8	-56.3	0	0	0	0	113.7	F509 P511 E512 I516	F509-S514 WeakPolarHBondContact CD2-OG 3.45Å; F509-S514 WeakPolarHBondContact CE2-OG 3.48Å; P511-S514 PolarHBondContact O-N 2.86Å; E512-S514 PolarHBondContact O-N 3.32Å; S514-I516 PolarHBondContact O-N 3.39Å
515	G	83.8	Confident	87.1	Confident	6 Å²	6	39.8 Å²	39.8	6%	0.062	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	37.7	-177.4	0	0	0	0	0	113.4	D168 T172 P511 E512	D168-G515 WeakPolarHBondContact CB-O 3.35Å; T172-G515 PolarHBondContact OG1-O 3.16Å; P511-G515 PolarHBondContact O-N 3.31Å; P511-G515 VanDerWaalsContact O-N 3.16Å; E512-G515 PolarHBondContact O-N 3.16Å
516	I	88.7	Confident	87.4	Confident	49 Å²	49	36.3 Å²	36.3	25%	0.251	19%	0.189	S	C	.	.			trans	-103.2	110.6	178.7	-61	171.4	0	0	0	109	T172 G432 A433 F509 P511 S514	T172-I516 HydrophobicContact CG2-CG2 3.88Å; G432-I516 PolarHBondContact N-O 2.87Å; A433-I516 HydrophobicContact CB-CG2 4.33Å; F509-I516 HydrophobicContact CE2-CD1 4.04Å; F509-I516 HydrophobicContact CZ-CD1 3.79Å; P511-I516 HydrophobicContact CB-CB 4.37Å; P511-I516 PolarHBondContact O-N 2.78Å; S514-I516 PolarHBondContact O-N 3.39Å
517	Y	89.2	Confident	87.7	Confident	19 Å²	19	36 Å²	36	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.4	-172.7	-62.5	-67.2	0	0	0	112.5	I157 L165 D168 V169 T172 V429 L430	I157-Y517 HydrophobicContact CD1-CE1 3.65Å; L165-Y517 HydrophobicContact CD1-CD2 4.03Å; L165-Y517 HydrophobicContact CD1-CE2 3.59Å; D168-Y517 HydrophobicContact CB-CD2 3.87Å; D168-Y517 HydrophobicContact CB-CE2 3.96Å; V169-Y517 HydrophobicContact CG2-CD2 4.46Å; T172-Y517 VanDerWaalsContact CG2-O 3.31Å; T172-Y517 WeakPolarHBondContact CG2-O 3.45Å; T172-Y517 PolarHBondContact OG1-N 2.99Å; V429-Y517 HydrophobicContact CB-CD1 4.27Å; V429-Y517 HydrophobicContact CB-CG 4.41Å; V429-Y517 HydrophobicContact CG2-CD1 3.87Å; V429-Y517 HydrophobicContact CG2-CE1 4.24Å; V429-Y517 HydrophobicContact CG2-CG 4.27Å; L430-Y517 CarbonylContact O-C 3.38Å; L430-Y517 VanDerWaalsContact O-CA 3.3Å; L430-Y517 WeakPolarHBondContact O-CA 3.2Å
518	D	88.4	Confident	87.9	Confident	38 Å²	38	34.8 Å²	34.8	20%	0.203	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.8	171	-71.1	-15	0	0	0	109.9	L430 K523	L430-D518 PolarHBondContact N-O 2.83Å; L430-D518 PolarHBondContact O-N 3.42Å; D518-K523 WeakPolarHBondContact OD2-CE 3.42Å; D518-K523 IonicContact OD2-NZ 3.1Å; D518-K523 PolarHBondContact OD2-NZ 3.02Å
519	N	88.5	Confident	88.2	Confident	4 Å²	4	35.8 Å²	35.8	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	140.4	175	-66.6	86.5	0	0	0	112.2	A419 N422 T423 V522 K523	A419-N519 PolarHBondContact O-ND2 2.9Å; N422-N519 HydrophobicContact CB-CB 4.32Å; N422-N519 VanDerWaalsContact CB-ND2 3.29Å; N422-N519 WeakPolarHBondContact CB-ND2 3.48Å; T423-N519 PolarHBondContact N-ND2 2.96Å; T423-N519 VanDerWaalsContact N-ND2 3.16Å; T423-N519 PolarHBondContact OG1-ND2 3.41Å; N519-V522 HydrophobicContact CB-CB 4.2Å; N519-V522 HydrophobicContact CB-CG2 3.75Å; N519-V522 PolarHBondContact O-N 3.48Å; N519-K523 PolarHBondContact O-N 2.79Å
520	Y	88.7	Confident	88.5	Confident	25 Å²	25	34.2 Å²	34.2	10%	0.098	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-44.1	177.8	166.7	-96.9	0	0	0	112.5	L134 N135 K156 D426 V428 L430 V522 K523 K524	L134-Y520 HydrophobicContact CB-CE2 4.03Å; L134-Y520 HydrophobicContact CD2-CD2 4.38Å; L134-Y520 HydrophobicContact CD2-CE2 4.48Å; L134-Y520 WeakPolarHBondContact O-CE2 3.24Å; N135-Y520 PolarHBondContact OD1-OH 3.12Å; K156-Y520 VanDerWaalsContact CE-CD2 3.44Å; D426-Y520 HydrophobicContact CB-CD1 4.5Å; V428-Y520 HydrophobicContact CG2-CD1 4.06Å; V428-Y520 HydrophobicContact CG2-CD2 4.32Å; V428-Y520 HydrophobicContact CG2-CG 3.75Å; L430-Y520 HydrophobicContact CD1-CD2 4.38Å; L430-Y520 HydrophobicContact CD2-CD2 4.47Å; Y520-V522 VanDerWaalsContact C-N 3.28Å; Y520-V522 PolarHBondContact O-N 2.75Å; Y520-K523 PolarHBondContact O-N 2.79Å; Y520-K524 HydrophobicContact CE1-CD 3.93Å; Y520-K524 WeakPolarHBondContact O-CB 2.93Å; Y520-K524 PolarHBondContact O-N 3.13Å
521	C	89.4	Confident	88.8	Confident	16 Å²	16	32.5 Å²	32.5	11%	0.108	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-36.8	178.6	67.8	0	0	0	0	112.7	N422 D426 N525	N422-C521 VanDerWaalsContact CB-SG 3.58Å; N422-C521 VanDerWaalsContact CG-SG 3.51Å; D426-C521 WeakPolarHBondContact OD2-CB 3.37Å; D426-C521 PolarHBondContact OD2-N 2.6Å; D426-C521 PolarHBondContact OD2-SG 2.84Å; C521-N525 VanDerWaalsContact O-CB 3.3Å; C521-N525 WeakPolarHBondContact O-CB 3.46Å; C521-N525 PolarHBondContact O-N 2.9Å; C521-N525 PolarHBondContact O-ND2 2.91Å
522	V	92.1	Very high	89.3	Confident	11 Å²	11	35.6 Å²	35.6	7%	0.067	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-54.5	177.8	175.1	0	0	0	0	109.6	Q84 T88 D90 N519 Y520 K524 N525 M526	Q84-V522 PolarHBondContact NE2-O 3.28Å; T88-V522 HydrophobicContact CG2-CG2 4.35Å; D90-V522 HydrophobicContact CB-CG2 4.16Å; N519-V522 HydrophobicContact CB-CB 4.2Å; N519-V522 HydrophobicContact CB-CG2 3.75Å; N519-V522 PolarHBondContact O-N 3.48Å; Y520-V522 VanDerWaalsContact C-N 3.28Å; Y520-V522 PolarHBondContact O-N 2.75Å; V522-K524 PolarHBondContact O-N 3.43Å; V522-N525 PolarHBondContact O-N 2.9Å; V522-M526 WeakPolarHBondContact O-CB 3.38Å; V522-M526 PolarHBondContact O-N 3.48Å
523	K	90.4	Very high	90	Very high	12 Å²	12	33.3 Å²	33.3	5%	0.052	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-41.6	-179.4	-64.9	-64.7	-172	-179.7	0	112.6	L134 L430 F436 E437 D518 N519 Y520 M526 I527	L134-K523 HydrophobicContact CD2-CB 4.23Å; L430-K523 HydrophobicContact CD1-CB 3.9Å; L430-K523 HydrophobicContact CD1-CG 3.74Å; F436-K523 HydrophobicContact CD1-CD 4.16Å; F436-K523 HydrophobicContact CD1-CG 4.5Å; E437-K523 IonicContact OE1-NZ 3.4Å; E437-K523 PolarHBondContact OE1-NZ 3.09Å; E437-K523 IonicContact OE2-NZ 2.82Å; D518-K523 WeakPolarHBondContact OD2-CE 3.42Å; D518-K523 IonicContact OD2-NZ 3.1Å; D518-K523 PolarHBondContact OD2-NZ 3.02Å; N519-K523 PolarHBondContact O-N 2.79Å; Y520-K523 PolarHBondContact O-N 2.79Å; K523-M526 HydrophobicContact CD-CE 3.58Å; K523-M526 PolarHBondContact O-N 3.39Å; K523-I527 WeakPolarHBondContact O-CG1 3.28Å; K523-I527 PolarHBondContact O-N 2.96Å
524	K	90.7	Very high	90.5	Very high	75 Å²	75	25.6 Å²	25.6	33%	0.326	14%	0.142	S	C	.	.	H	α-helix	trans	-60.3	-50.7	177.7	-178.6	-176.9	-178.4	174.6	0	111.6	L131 L134 Y520 V522 M526 N528	L131-K524 HydrophobicContact CD2-CG 4.2Å; L134-K524 HydrophobicContact CD1-CB 4.41Å; Y520-K524 HydrophobicContact CE1-CD 3.93Å; Y520-K524 WeakPolarHBondContact O-CB 2.93Å; Y520-K524 PolarHBondContact O-N 3.13Å; V522-K524 PolarHBondContact O-N 3.43Å; K524-M526 VanDerWaalsContact C-N 3.35Å; K524-N528 PolarHBondContact O-N 3.3Å; K524-N528 PolarHBondContact O-ND2 3.45Å
525	N	92.7	Very high	90.9	Very high	39 Å²	39	22.5 Å²	22.5	21%	0.209	12%	0.12	C	C	.	.	H	α-helix	trans	-69.5	-35.6	-179.5	-71.3	-19.7	0	0	0	111.8	T88 C521 V522 N528 S529	T88-N525 HydrophobicContact CG2-CB 4.21Å; T88-N525 WeakPolarHBondContact CG2-ND2 2.92Å; C521-N525 VanDerWaalsContact O-CB 3.3Å; C521-N525 WeakPolarHBondContact O-CB 3.46Å; C521-N525 PolarHBondContact O-N 2.9Å; C521-N525 PolarHBondContact O-ND2 2.91Å; V522-N525 PolarHBondContact O-N 2.9Å; N525-N528 PolarHBondContact O-N 3.38Å; N525-S529 VanDerWaalsContact O-CB 3.27Å; N525-S529 WeakPolarHBondContact O-CB 3.39Å; N525-S529 PolarHBondContact O-N 2.83Å; N525-S529 PolarHBondContact O-OG 2.89Å
526	M	93.3	Very high	91.4	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-51.1	175.4	-178.5	-178.5	73	0	0	111.2	S94 I95 L98 I469 V522 K523 K524 N528 S529 C530	S94-M526 VanDerWaalsContact CB-SD 3.53Å; I95-M526 HydrophobicContact CB-CG 4.45Å; L98-M526 HydrophobicContact CD1-CE 3.68Å; L98-M526 HydrophobicContact CD1-CG 3.77Å; L98-M526 HydrophobicContact CD1-SD 3.62Å; I469-M526 HydrophobicContact CD1-CE 4.28Å; V522-M526 WeakPolarHBondContact O-CB 3.38Å; V522-M526 PolarHBondContact O-N 3.48Å; K523-M526 HydrophobicContact CD-CE 3.58Å; K523-M526 PolarHBondContact O-N 3.39Å; K524-M526 VanDerWaalsContact C-N 3.35Å; M526-N528 PolarHBondContact O-N 3.3Å; M526-S529 PolarHBondContact O-N 3.36Å; M526-C530 VanDerWaalsContact O-CB 3.29Å; M526-C530 WeakPolarHBondContact O-CB 3.37Å; M526-C530 PolarHBondContact O-N 2.9Å; M526-C530 PolarHBondContact O-SG 3.43Å
527	I	92.2	Very high	91.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-44.9	179.4	-73.5	169.1	0	0	0	111.5	K127 C130 L131 L134 F436 K523 S531	K127-I527 HydrophobicContact CG-CG2 4.12Å; C130-I527 HydrophobicContact CB-CD1 3.97Å; C130-I527 HydrophobicContact CB-CG2 4.09Å; L131-I527 HydrophobicContact CD2-CG2 4.33Å; L131-I527 HydrophobicContact CG-CG2 4.41Å; L134-I527 HydrophobicContact CD1-CD1 3.57Å; L134-I527 HydrophobicContact CG-CD1 4.48Å; F436-I527 HydrophobicContact CE1-CD1 3.34Å; F436-I527 HydrophobicContact CE1-CG1 4.4Å; F436-I527 HydrophobicContact CZ-CD1 3.38Å; K523-I527 WeakPolarHBondContact O-CG1 3.28Å; K523-I527 PolarHBondContact O-N 2.96Å; I527-S531 VanDerWaalsContact O-CB 3.28Å; I527-S531 WeakPolarHBondContact O-CB 3.34Å; I527-S531 PolarHBondContact O-N 3.15Å; I527-S531 VanDerWaalsContact O-N 3.09Å; I527-S531 PolarHBondContact O-OG 3.09Å
528	N	92.5	Very high	91.7	Very high	48 Å²	48	24 Å²	24	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-60.6	-51.3	177.7	-77.8	-28	0	0	0	111.7	L131 K524 N525 M526 S531 V532	L131-N528 VanDerWaalsContact CD1-OD1 3.32Å; L131-N528 WeakPolarHBondContact CD1-OD1 3.46Å; K524-N528 PolarHBondContact O-N 3.3Å; K524-N528 PolarHBondContact O-ND2 3.45Å; N525-N528 PolarHBondContact O-N 3.38Å; M526-N528 PolarHBondContact O-N 3.3Å; N528-S531 PolarHBondContact O-N 3.34Å; N528-V532 VanDerWaalsContact O-CG2 3.29Å; N528-V532 WeakPolarHBondContact O-CG2 3.46Å; N528-V532 PolarHBondContact O-N 3.02Å; N528-V532 VanDerWaalsContact O-N 3.08Å
529	S	92.6	Very high	91.8	Very high	37 Å²	37	26 Å²	26	26%	0.259	14%	0.139	S	C	.	.	H	α-helix	trans	-67.1	-46.2	-175.8	-56.1	0	0	0	0	111.5	N525 M526 S531 V532 I533	N525-S529 VanDerWaalsContact O-CB 3.27Å; N525-S529 WeakPolarHBondContact O-CB 3.39Å; N525-S529 PolarHBondContact O-N 2.83Å; N525-S529 PolarHBondContact O-OG 2.89Å; M526-S529 PolarHBondContact O-N 3.36Å; S529-S531 VanDerWaalsContact C-N 3.32Å; S529-S531 PolarHBondContact O-N 3.18Å; S529-V532 PolarHBondContact O-N 3.46Å; S529-I533 WeakPolarHBondContact O-CB 3.48Å; S529-I533 VanDerWaalsContact O-CD1 3.28Å; S529-I533 WeakPolarHBondContact O-CD1 3.1Å; S529-I533 WeakPolarHBondContact O-CG1 3.47Å; S529-I533 PolarHBondContact O-N 2.59Å
530	C	93.3	Very high	92	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-55.8	-49.1	176.8	-68.9	0	0	0	0	111.2	I95 L98 I99 M102 M526 I533 A534	I95-C530 WeakPolarHBondContact CG1-SG 3.45Å; L98-C530 HydrophobicContact CB-CB 4.42Å; L98-C530 VanDerWaalsContact CB-SG 3.57Å; I99-C530 HydrophobicContact CG1-CB 4.13Å; M102-C530 HydrophobicContact SD-CB 4.13Å; M526-C530 VanDerWaalsContact O-CB 3.29Å; M526-C530 WeakPolarHBondContact O-CB 3.37Å; M526-C530 PolarHBondContact O-N 2.9Å; M526-C530 PolarHBondContact O-SG 3.43Å; C530-I533 PolarHBondContact O-N 3.41Å; C530-A534 VanDerWaalsContact O-CB 3.22Å; C530-A534 WeakPolarHBondContact O-CB 3.45Å; C530-A534 PolarHBondContact O-N 2.87Å
531	S	91.8	Very high	92	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.7	-45	-175.7	-52.9	0	0	0	0	111.4	Y462 I527 N528 S529 I533 S535	Y462-S531 WeakPolarHBondContact CE2-OG 3.47Å; Y462-S531 PolarHBondContact OH-OG 3.38Å; I527-S531 VanDerWaalsContact O-CB 3.28Å; I527-S531 WeakPolarHBondContact O-CB 3.34Å; I527-S531 PolarHBondContact O-N 3.15Å; I527-S531 VanDerWaalsContact O-N 3.09Å; I527-S531 PolarHBondContact O-OG 3.09Å; N528-S531 PolarHBondContact O-N 3.34Å; S529-S531 VanDerWaalsContact C-N 3.32Å; S529-S531 PolarHBondContact O-N 3.18Å; S531-I533 PolarHBondContact O-N 3.49Å; S531-S535 WeakPolarHBondContact O-CB 3.42Å; S531-S535 PolarHBondContact O-N 3.21Å; S531-S535 PolarHBondContact O-OG 2.97Å
532	V	92.9	Very high	92	Very high	66 Å²	66	34.3 Å²	34.3	40%	0.4	18%	0.184	S	C	.	.	H	α-helix	trans	-63	-43.2	178.9	171.8	0	0	0	0	111.4	N528 S529 N536	N528-V532 VanDerWaalsContact O-CG2 3.29Å; N528-V532 WeakPolarHBondContact O-CG2 3.46Å; N528-V532 PolarHBondContact O-N 3.02Å; N528-V532 VanDerWaalsContact O-N 3.08Å; S529-V532 PolarHBondContact O-N 3.46Å; V532-N536 WeakPolarHBondContact O-CB 3.4Å; V532-N536 PolarHBondContact O-N 3.36Å; V532-N536 PolarHBondContact O-ND2 3.25Å
533	I	93.6	Very high	91.8	Very high	22 Å²	22	36 Å²	36	11%	0.113	19%	0.192	C	C	.	.	H	α-helix	trans	-74.3	-46.3	-175.9	-66.5	157.6	0	0	0	111.6	L76 I77 A80 I99 S529 C530 S531 S535 N536 L537	L76-I533 HydrophobicContact CD2-CG2 3.81Å; I77-I533 HydrophobicContact CG1-CG2 4.49Å; A80-I533 HydrophobicContact CB-CD1 3.03Å; A80-I533 HydrophobicContact CB-CG1 4.32Å; I99-I533 HydrophobicContact CD1-CB 4.07Å; I99-I533 HydrophobicContact CD1-CD1 3.99Å; I99-I533 HydrophobicContact CD1-CG2 3.94Å; I99-I533 HydrophobicContact CG2-CG2 4.3Å; S529-I533 WeakPolarHBondContact O-CB 3.48Å; S529-I533 VanDerWaalsContact O-CD1 3.28Å; S529-I533 WeakPolarHBondContact O-CD1 3.1Å; S529-I533 WeakPolarHBondContact O-CG1 3.47Å; S529-I533 PolarHBondContact O-N 2.59Å; C530-I533 PolarHBondContact O-N 3.41Å; S531-I533 PolarHBondContact O-N 3.49Å; I533-S535 VanDerWaalsContact C-N 3.29Å; I533-S535 PolarHBondContact O-N 2.97Å; I533-N536 PolarHBondContact O-N 3.24Å; I533-L537 HydrophobicContact CG2-CD1 3.87Å; I533-L537 HydrophobicContact CG2-CG 4.31Å; I533-L537 WeakPolarHBondContact O-CB 3.33Å; I533-L537 WeakPolarHBondContact O-CG 3.39Å; I533-L537 PolarHBondContact O-N 3.3Å
534	A	93	Very high	91.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-43.4	176.6	0	0	0	0	0	110.8	M102 F123 C530 L537 L538	M102-A534 HydrophobicContact CB-CB 4.04Å; M102-A534 HydrophobicContact CE-CB 3.72Å; M102-A534 HydrophobicContact SD-CB 4.05Å; F123-A534 HydrophobicContact CE2-CB 4.47Å; C530-A534 VanDerWaalsContact O-CB 3.22Å; C530-A534 WeakPolarHBondContact O-CB 3.45Å; C530-A534 PolarHBondContact O-N 2.87Å; A534-L537 PolarHBondContact O-N 3.47Å; A534-L538 WeakPolarHBondContact O-CB 3.46Å; A534-L538 PolarHBondContact O-N 3.44Å
535	S	91.9	Very high	91.4	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-47.7	174.2	-78.7	0	0	0	0	112.9	F120 S531 I533 L538 L539	F120-S535 VanDerWaalsContact CD2-CB 3.42Å; F120-S535 WeakPolarHBondContact CD2-OG 3.34Å; S531-S535 WeakPolarHBondContact O-CB 3.42Å; S531-S535 PolarHBondContact O-N 3.21Å; S531-S535 PolarHBondContact O-OG 2.97Å; I533-S535 VanDerWaalsContact C-N 3.29Å; I533-S535 PolarHBondContact O-N 2.97Å; S535-L538 PolarHBondContact O-N 3.5Å; S535-L539 WeakPolarHBondContact O-CG 3.38Å; S535-L539 PolarHBondContact O-N 3.01Å
536	N	92.9	Very high	90.8	Very high	92 Å²	92	47 Å²	47	49%	0.492	25%	0.248	S	C	.	.	H	α-helix	trans	-65.7	-43.8	179.9	-73	-17.8	0	0	0	111.7	V532 I533 L538 L539 V540	V532-N536 WeakPolarHBondContact O-CB 3.4Å; V532-N536 PolarHBondContact O-N 3.36Å; V532-N536 PolarHBondContact O-ND2 3.25Å; I533-N536 PolarHBondContact O-N 3.24Å; N536-L538 VanDerWaalsContact C-N 3.27Å; N536-L538 PolarHBondContact O-N 3.02Å; N536-L539 PolarHBondContact O-N 3.26Å; N536-V540 WeakPolarHBondContact O-CG2 3.5Å; N536-V540 PolarHBondContact O-N 3.34Å
537	L	92.9	Very high	90.2	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.052	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-32.1	178.9	-73.2	177.6	0	0	0	112.8	N23 T73 L76 I77 I99 L103 I533 A534 V540	N23-L537 PolarHBondContact ND2-O 3.44Å; T73-L537 HydrophobicContact CG2-CD1 3.87Å; T73-L537 HydrophobicContact CG2-CD2 3.75Å; T73-L537 HydrophobicContact CG2-CG 4.45Å; L76-L537 HydrophobicContact CD2-CD1 4.41Å; L76-L537 HydrophobicContact CD2-CD2 4.1Å; L76-L537 HydrophobicContact CD2-CG 4.28Å; I77-L537 HydrophobicContact CD1-CD1 4.11Å; I77-L537 HydrophobicContact CG1-CD1 4.05Å; I99-L537 HydrophobicContact CG2-CD1 4.48Å; L103-L537 HydrophobicContact CD1-CB 4.24Å; L103-L537 HydrophobicContact CD1-CD1 3.84Å; L103-L537 HydrophobicContact CD2-CB 4.16Å; I533-L537 HydrophobicContact CG2-CD1 3.87Å; I533-L537 HydrophobicContact CG2-CG 4.31Å; I533-L537 WeakPolarHBondContact O-CB 3.33Å; I533-L537 WeakPolarHBondContact O-CG 3.39Å; I533-L537 PolarHBondContact O-N 3.3Å; A534-L537 PolarHBondContact O-N 3.47Å; L537-V540 PolarHBondContact O-N 3.16Å
538	L	91.6	Very high	89.4	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-73.3	-27.5	177.3	-177.7	147	0	0	0	112.9	L103 A106 P116 I119 F120 F123 A534 S535 N536	L103-L538 HydrophobicContact CD2-CB 4.38Å; A106-L538 HydrophobicContact CB-CD1 3.45Å; A106-L538 VanDerWaalsContact CB-CD1 3.45Å; P116-L538 VanDerWaalsContact C-CD2 3.46Å; P116-L538 HydrophobicContact CB-CD2 3.38Å; P116-L538 HydrophobicContact CB-CG 4.04Å; P116-L538 WeakPolarHBondContact O-CD2 3.3Å; I119-L538 HydrophobicContact CB-CD1 4.14Å; I119-L538 HydrophobicContact CG2-CD1 3.81Å; F120-L538 HydrophobicContact CB-CD2 4.24Å; F123-L538 HydrophobicContact CE2-CD1 4.36Å; A534-L538 WeakPolarHBondContact O-CB 3.46Å; A534-L538 PolarHBondContact O-N 3.44Å; S535-L538 PolarHBondContact O-N 3.5Å; N536-L538 VanDerWaalsContact C-N 3.27Å; N536-L538 PolarHBondContact O-N 3.02Å
539	L	91.7	Very high	88.1	Confident	80 Å²	80	60.5 Å²	60.5	42%	0.419	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.1	177	-67.4	175.2	0	0	0	113.7	F120 S535 N536 D541	F120-L539 HydrophobicContact CB-CD2 4.38Å; F120-L539 HydrophobicContact CD2-CD1 3.93Å; F120-L539 HydrophobicContact CD2-CG 4.47Å; F120-L539 HydrophobicContact CE2-CD1 4.16Å; F120-L539 HydrophobicContact CG-CD1 4.18Å; S535-L539 WeakPolarHBondContact O-CG 3.38Å; S535-L539 PolarHBondContact O-N 3.01Å; N536-L539 PolarHBondContact O-N 3.26Å; L539-D541 PolarHBondContact O-N 3.05Å
540	V	91.7	Very high	86.5	Confident	48 Å²	48	65.8 Å²	65.8	29%	0.291	37%	0.369	S	S	.	.			trans	-72.3	111.7	175	-179.9	0	0	0	0	109.6	N536 L537 I543	N536-V540 WeakPolarHBondContact O-CG2 3.5Å; N536-V540 PolarHBondContact O-N 3.34Å; L537-V540 PolarHBondContact O-N 3.16Å; V540-I543 HydrophobicContact CG1-CG1 4.01Å
541	D	89.8	Confident	84.4	Confident	103 Å²	103	74.5 Å²	74.5	55%	0.551	41%	0.407	S	S	*	.			trans	-93.8	-34	176.7	64	-24.6	0	0	0	112.6	R15 S16 A19 L539	R15-D541 CarbonylContact C-O 3.54Å; S16-D541 WeakPolarHBondContact CA-O 3.46Å; S16-D541 PolarHBondContact N-O 2.92Å; A19-D541 WeakPolarHBondContact CB-O 3.07Å; L539-D541 PolarHBondContact O-N 3.05Å
542	E	88.9	Confident	81.7	Confident	68 Å²	68	87.7 Å²	87.7	32%	0.318	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.2	177.6	-59.4	-163.8	155.2	0	0	112.2	A14 R15	A14-E542 WeakPolarHBondContact O-CA 3.36Å; R15-E542 HydrophobicContact CB-CG 4.49Å; R15-E542 WeakPolarHBondContact CD-OE1 3.43Å; R15-E542 HydrophobicContact CG-CG 3.99Å; R15-E542 WeakPolarHBondContact CG-OE1 3.18Å
543	I	88.5	Confident	81.1	Confident	46 Å²	46	88.8 Å²	88.8	24%	0.236	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.7	168.5	-59	169.8	0	0	0	106.9	Y13 A14 A19 V22 V540	Y13-I543 VanDerWaalsContact CA-O 3.26Å; Y13-I543 WeakPolarHBondContact CA-O 3.47Å; A14-I543 HydrophobicContact CB-CB 4.37Å; A14-I543 PolarHBondContact N-O 3.28Å; A14-I543 PolarHBondContact O-N 2.94Å; A19-I543 HydrophobicContact CB-CD1 4.16Å; A19-I543 HydrophobicContact CB-CG1 4.03Å; V22-I543 HydrophobicContact CB-CD1 4.3Å; V22-I543 HydrophobicContact CG1-CD1 4.07Å; V540-I543 HydrophobicContact CG1-CG1 4.01Å
544	L	86.9	Confident	80.5	Confident	97 Å²	97	92.3 Å²	92.3	51%	0.508	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.2	-177.2	-62.3	172.1	0	0	0	110.2	L4	L4-L544 HydrophobicContact CD1-CD2 4.23Å
545	R	84.9	Confident	79.8	Confident	176 Å²	176	97.4 Å²	97.4	66%	0.664	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	98.2	166.3	-167	-173.8	-174.3	173.6	2	108.8	E12	E12-R545 HydrophobicContact CB-CB 4.09Å; E12-R545 PolarHBondContact N-O 3.33Å; E12-R545 PolarHBondContact O-N 3.45Å; E12-R545 IonicContact OE1-NH1 3.91Å; E12-R545 WeakPolarHBondContact OE2-CD 3.45Å; E12-R545 IonicContact OE2-CZ 3.79Å; E12-R545 IonicContact OE2-NE 3.87Å; E12-R545 IonicContact OE2-NH1 2.91Å; E12-R545 PolarHBondContact OE2-NH1 3.06Å
546	S	80.4	Confident	79.1	Confident	86 Å²	86	103.1 Å²	103.1	60%	0.601	54%	0.543	S	S	*	.			trans	-137.5	135.6	173.5	-171.9	0	0	0	0	109	N8	N8-S546 PolarHBondContact ND2-OG 2.99Å
547	G	79.4	Confident	78.2	Confident	62 Å²	62	103.8 Å²	103.8	64%	0.639	55%	0.546	S	S	*	.			trans	-170.3	154.2	179.4	0	0	0	0	0	110.3	S549	G547-S549 PolarHBondContact O-N 3.46Å
548	M	75.4	Confident	77.2	Confident	181 Å²	181	110.1 Å²	110.1	89%	0.892	58%	0.579	S	S	*	*			trans	-60.5	123	170.1	-70.3	-91.1	-78.1	0	0	108	T550	M548-T550 PolarHBondContact O-N 3.33Å
549	S	66.7	Low	76.2	Confident	90 Å²	90	117.6 Å²	117.6	63%	0.629	62%	0.619	S	S	*	*			trans	-61.2	110.9	166.8	173.1	0	0	0	0	107.3	G547 K551	G547-S549 PolarHBondContact O-N 3.46Å; S549-K551 PolarHBondContact O-N 3.4Å; S549-K551 VanDerWaalsContact O-N 3.12Å; S549-K551 PolarHBondContact OG-N 3Å; S549-K551 PolarHBondContact OG-O 3.18Å
550	T	58.3	Low	75	Confident	148 Å²	148	120.5 Å²	120.5	91%	0.908	63%	0.634	S	S	*	*	S	Bend	trans	-69	0	173.8	37.3	0	0	0	0	112.8	M548 K552	M548-T550 PolarHBondContact O-N 3.33Å; T550-K552 PolarHBondContact O-N 2.97Å
551	K	48.5	Very low	73.6	Confident	184 Å²	184	126.6 Å²	126.6	80%	0.8	66%	0.663	S	S	*	*			trans	-82	96.5	161.8	-63	-174	176.9	-175.3	0	109.3	S549	S549-K551 PolarHBondContact O-N 3.4Å; S549-K551 VanDerWaalsContact O-N 3.12Å; S549-K551 PolarHBondContact OG-N 3Å; S549-K551 PolarHBondContact OG-O 3.18Å
552	K	36	Very low	72.2	Confident	278 Å²	278	128.7 Å²	128.7	100%	1.209	67%	0.673	S	S	*	*			trans	-86.6	0	147.2	-90.8	-170.7	176.4	-178	0	108.8	T550	T550-K552 PolarHBondContact O-N 2.97Å

Retrieved 552 of 552 residues in 786.2 ms (Link to these results)

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