A0A077ZLA7_TRITR Loading...

SCAN domain-containing protein 3

AlphaFold DB , UniProt , Accession A0A077ZLA7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 532 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	37	Very low	56.5	Low	240 Å²	240	148.5 Å²	148.5	100%	1.182	73%	0.731	S	S	*	*				0	109.6	0	-72.5	-173.2	171.4	0	0	107.9	E3	M1-E3 PolarHBondContact O-N 3.28Å
2	S	41.4	Very low	58.5	Low	119 Å²	119	141.8 Å²	141.8	83%	0.832	70%	0.701	S	S	*	*			trans	-67.2	113.9	170.7	54	0	0	0	0	108	S4	S2-S4 PolarHBondContact O-N 2.84Å
3	E	41.9	Very low	60.4	Low	186 Å²	186	136.8 Å²	136.8	87%	0.869	70%	0.696	S	S	*	*			trans	-53.6	112.3	171.1	-77.4	-176.1	148.8	0	0	108.6	M1 K5	M1-E3 PolarHBondContact O-N 3.28Å; E3-K5 PolarHBondContact O-N 3.16Å
4	S	47.1	Very low	62.2	Low	106 Å²	106	134.6 Å²	134.6	74%	0.741	68%	0.682	S	S	*	*			trans	-58.8	113.4	172.6	53.5	0	0	0	0	107.3	S2 K6	S2-S4 PolarHBondContact O-N 2.84Å; S4-K6 PolarHBondContact O-N 3.4Å
5	K	47.5	Very low	64	Low	203 Å²	203	127.3 Å²	127.3	88%	0.883	64%	0.643	S	S	*	*			trans	-53.5	99.5	176.7	-76.9	-179	176.3	176.8	0	108.2	E3 K7	E3-K5 PolarHBondContact O-N 3.16Å; K5-K7 PolarHBondContact O-N 2.9Å
6	K	55.9	Low	65.5	Low	164 Å²	164	120.7 Å²	120.7	71%	0.713	61%	0.61	S	S	*	*			trans	-57.4	115.6	174.9	-77.4	-172.5	175.9	-170.9	0	107.3	S4 C8 E42	S4-K6 PolarHBondContact O-N 3.4Å; K6-C8 PolarHBondContact O-N 3.13Å; K6-E42 IonicContact NZ-OE1 3.66Å; K6-E42 PolarHBondContact NZ-OE1 2.92Å
7	K	58.9	Low	66.8	Low	201 Å²	201	118.8 Å²	118.8	87%	0.874	60%	0.596	S	S	*	*			trans	-60.7	103.5	176.8	-80	-175.3	176.5	179.7	0	109	K5 R9	K5-K7 PolarHBondContact O-N 2.9Å; K7-R9 PolarHBondContact O-N 3.38Å
8	C	64.1	Low	68	Low	75 Å²	75	114 Å²	114	51%	0.507	57%	0.572	S	S	.	*			trans	-73.4	111.8	173.6	-172.6	0	0	0	0	108.5	K6 N41	K6-C8 PolarHBondContact O-N 3.13Å; C8-N41 PolarHBondContact SG-ND2 3.02Å
9	R	70.5	Confident	69.2	Low	103 Å²	103	108 Å²	108	39%	0.389	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-73.9	136.1	175.8	-66.2	177.4	177.5	-142.8	-3.8	109.2	K7 N41 M44	K7-R9 PolarHBondContact O-N 3.38Å; R9-N41 PolarHBondContact N-OD1 2.76Å; R9-N41 PolarHBondContact O-ND2 3.18Å; R9-M44 HydrophobicContact CB-CB 4.12Å; R9-M44 HydrophobicContact CB-SD 3.89Å; R9-M44 WeakPolarHBondContact CD-O 3.18Å; R9-M44 PolarHBondContact NH1-O 2.83Å
10	Q	77.1	Confident	70.2	Confident	171 Å²	171	102.7 Å²	102.7	80%	0.799	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-85.5	154.7	170.8	-68.8	-177.5	-11.4	0	0	110.1	N12	Q10-N12 PolarHBondContact O-N 3.09Å
11	Y	79.6	Confident	71	Confident	65 Å²	65	98 Å²	98	26%	0.255	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-61.8	135	172.2	176.9	-94.2	0	0	0	110	Y15 F20 V22 Q30	Y11-Y15 AromaticContact CD2-CD2 3.84Å; Y11-Y15 HydrophobicContact CD2-CD2 3.84Å; Y11-Y15 HydrophobicContact CE2-CD2 4.06Å; Y11-Y15 HydrophobicContact CG-CD2 4.43Å; Y11-F20 PolarHBondContact OH-O 3.26Å; Y11-V22 HydrophobicContact CD1-CG2 3.62Å; Y11-V22 HydrophobicContact CD2-CG2 3.81Å; Y11-V22 HydrophobicContact CE1-CG2 4.13Å; Y11-V22 HydrophobicContact CE2-CG2 4.32Å; Y11-V22 HydrophobicContact CG-CG2 3.44Å; Y11-V22 VanDerWaalsContact CG-CG2 3.44Å; Y11-Q30 HydrophobicContact CD2-CG 3.99Å
12	N	81.4	Confident	73.3	Confident	68 Å²	68	89.2 Å²	89.2	36%	0.364	45%	0.451	S	S	.	.			trans	-108.5	132.6	172.2	-175.2	-24.8	0	0	0	107.9	Q10 E14 Y15	Q10-N12 PolarHBondContact O-N 3.09Å; N12-E14 PolarHBondContact O-N 3.32Å; N12-E14 VanDerWaalsContact O-N 3.09Å; N12-E14 PolarHBondContact OD1-N 2.97Å; N12-Y15 HydrophobicContact CB-CD1 4.14Å; N12-Y15 HydrophobicContact CB-CD2 4.02Å; N12-Y15 HydrophobicContact CB-CE1 3.78Å; N12-Y15 HydrophobicContact CB-CE2 3.66Å; N12-Y15 HydrophobicContact CB-CG 4.25Å; N12-Y15 VanDerWaalsContact N-CD2 3.31Å; N12-Y15 WeakPolarHBondContact O-CB 3.5Å; N12-Y15 VanDerWaalsContact O-CD2 3.31Å; N12-Y15 WeakPolarHBondContact O-CD2 3.23Å; N12-Y15 VanDerWaalsContact O-CG 3.25Å; N12-Y15 PolarHBondContact O-N 3.1Å
13	A	82.5	Confident	75	Confident	77 Å²	77	83.7 Å²	83.7	64%	0.636	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-54.4	-27.6	176.9	0	0	0	0	0	113	Y15 L16	A13-Y15 PolarHBondContact O-N 3.34Å; A13-L16 WeakPolarHBondContact O-CB 3.48Å; A13-L16 PolarHBondContact O-N 2.94Å
14	E	85.7	Confident	76.4	Confident	107 Å²	107	78.4 Å²	78.4	50%	0.5	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-61.7	-22.5	174.1	-72.4	-167.6	-161.3	0	0	114.1	N12 L16 K17	N12-E14 PolarHBondContact O-N 3.32Å; N12-E14 VanDerWaalsContact O-N 3.09Å; N12-E14 PolarHBondContact OD1-N 2.97Å; E14-L16 PolarHBondContact O-N 3.03Å; E14-L16 VanDerWaalsContact O-N 3.15Å; E14-K17 HydrophobicContact CB-CD 4.42Å; E14-K17 WeakPolarHBondContact O-CB 3.42Å; E14-K17 VanDerWaalsContact O-CD 3.23Å; E14-K17 WeakPolarHBondContact O-CD 3.38Å; E14-K17 WeakPolarHBondContact O-CG 3.4Å; E14-K17 PolarHBondContact O-N 2.97Å; E14-K17 IonicContact OE2-NZ 2.76Å; E14-K17 PolarHBondContact OE2-NZ 3.32Å
15	Y	88.9	Confident	77.5	Confident	24 Å²	24	77.9 Å²	77.9	9%	0.094	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-65.2	-18	-179.7	-58.4	-24.9	0	0	0	113	Y11 N12 A13 K17 H18 G19 F20 P46 M49	Y11-Y15 AromaticContact CD2-CD2 3.84Å; Y11-Y15 HydrophobicContact CD2-CD2 3.84Å; Y11-Y15 HydrophobicContact CE2-CD2 4.06Å; Y11-Y15 HydrophobicContact CG-CD2 4.43Å; N12-Y15 HydrophobicContact CB-CD1 4.14Å; N12-Y15 HydrophobicContact CB-CD2 4.02Å; N12-Y15 HydrophobicContact CB-CE1 3.78Å; N12-Y15 HydrophobicContact CB-CE2 3.66Å; N12-Y15 HydrophobicContact CB-CG 4.25Å; N12-Y15 VanDerWaalsContact N-CD2 3.31Å; N12-Y15 WeakPolarHBondContact O-CB 3.5Å; N12-Y15 VanDerWaalsContact O-CD2 3.31Å; N12-Y15 WeakPolarHBondContact O-CD2 3.23Å; N12-Y15 VanDerWaalsContact O-CG 3.25Å; N12-Y15 PolarHBondContact O-N 3.1Å; A13-Y15 PolarHBondContact O-N 3.34Å; Y15-K17 PolarHBondContact O-N 3.48Å; Y15-H18 PolarHBondContact O-N 2.92Å; Y15-G19 PolarHBondContact O-N 3.3Å; Y15-F20 CarbonylContact C-O 3.43Å; Y15-F20 PolarHBondContact O-N 3.22Å; Y15-P46 HydrophobicContact CE1-CG 4.01Å; Y15-M49 HydrophobicContact CD1-CE 4.15Å; Y15-M49 HydrophobicContact CD1-SD 3.83Å; Y15-M49 HydrophobicContact CD2-CE 3.75Å; Y15-M49 HydrophobicContact CD2-SD 4.25Å; Y15-M49 HydrophobicContact CE1-CE 4.33Å; Y15-M49 HydrophobicContact CE1-SD 4.42Å; Y15-M49 HydrophobicContact CE2-CE 3.94Å; Y15-M49 HydrophobicContact CG-CE 3.86Å; Y15-M49 HydrophobicContact CG-SD 3.73Å
16	L	88.2	Confident	78.7	Confident	22 Å²	22	72 Å²	72	12%	0.115	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-58.7	-29.6	171.1	-174	61.6	0	0	0	112	A13 E14 H18 G19 F20 V21 L33 L65 F68 Q69 H72	A13-L16 WeakPolarHBondContact O-CB 3.48Å; A13-L16 PolarHBondContact O-N 2.94Å; E14-L16 PolarHBondContact O-N 3.03Å; E14-L16 VanDerWaalsContact O-N 3.15Å; L16-H18 PolarHBondContact O-N 2.89Å; L16-H18 VanDerWaalsContact O-N 3.13Å; L16-G19 PolarHBondContact O-N 3.39Å; L16-F20 WeakPolarHBondContact CA-O 3.23Å; L16-F20 PolarHBondContact N-O 3.48Å; L16-V21 HydrophobicContact CD1-CG1 3.89Å; L16-L33 HydrophobicContact CD1-CD1 3.83Å; L16-L65 HydrophobicContact CB-CD1 4.11Å; L16-L65 HydrophobicContact CD2-CD1 4.21Å; L16-L65 HydrophobicContact CG-CD1 3.97Å; L16-F68 HydrophobicContact CD1-CB 4.13Å; L16-F68 HydrophobicContact CG-CB 4.32Å; L16-F68 WeakPolarHBondContact O-CB 3.21Å; L16-F68 WeakPolarHBondContact O-CG 3.34Å; L16-Q69 HydrophobicContact CD2-CG 3.68Å; L16-H72 HydrophobicContact CD1-CB 4.21Å
17	K	88.3	Confident	79.4	Confident	88 Å²	88	72.3 Å²	72.3	38%	0.383	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.9	-16.9	175.4	83.8	-158.9	172.4	-176.3	0	113.4	E14 Y15 L65	E14-K17 HydrophobicContact CB-CD 4.42Å; E14-K17 WeakPolarHBondContact O-CB 3.42Å; E14-K17 VanDerWaalsContact O-CD 3.23Å; E14-K17 WeakPolarHBondContact O-CD 3.38Å; E14-K17 WeakPolarHBondContact O-CG 3.4Å; E14-K17 PolarHBondContact O-N 2.97Å; E14-K17 IonicContact OE2-NZ 2.76Å; E14-K17 PolarHBondContact OE2-NZ 3.32Å; Y15-K17 PolarHBondContact O-N 3.48Å; K17-L65 HydrophobicContact CB-CD1 4.02Å
18	H	88.2	Confident	80	Confident	33 Å²	33	69.8 Å²	69.8	15%	0.153	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-106.7	7.6	175.1	-54.3	-53	0	0	0	112.4	Y15 L16 F20 M49 V50	Y15-H18 PolarHBondContact O-N 2.92Å; L16-H18 PolarHBondContact O-N 2.89Å; L16-H18 VanDerWaalsContact O-N 3.13Å; H18-F20 HydrophobicContact CB-CD2 4.08Å; H18-F20 VanDerWaalsContact O-CD2 3.25Å; H18-F20 WeakPolarHBondContact O-CD2 3.39Å; H18-F20 WeakPolarHBondContact O-CE2 3.48Å; H18-M49 HydrophobicContact CB-CB 4.12Å; H18-V50 VanDerWaalsContact CE1-CG2 3.48Å; H18-V50 WeakPolarHBondContact CE1-CG2 3.04Å
19	G	89.6	Confident	80.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	21.4	179.5	0	0	0	0	0	115.6	Y15 L16 L33 F68	Y15-G19 PolarHBondContact O-N 3.3Å; L16-G19 PolarHBondContact O-N 3.39Å; G19-L33 WeakPolarHBondContact O-CB 3.27Å; G19-L33 PolarHBondContact O-N 3.09Å; G19-F68 VanDerWaalsContact CA-CE1 3.45Å
20	F	90.3	Very high	81.2	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.009	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.6	179.6	-73.4	-99.3	0	0	0	112.1	Y11 Y15 L16 H18 Q30 M31 C32 F39 M49 H52	Y11-F20 PolarHBondContact OH-O 3.26Å; Y15-F20 CarbonylContact C-O 3.43Å; Y15-F20 PolarHBondContact O-N 3.22Å; L16-F20 WeakPolarHBondContact CA-O 3.23Å; L16-F20 PolarHBondContact N-O 3.48Å; H18-F20 HydrophobicContact CB-CD2 4.08Å; H18-F20 VanDerWaalsContact O-CD2 3.25Å; H18-F20 WeakPolarHBondContact O-CD2 3.39Å; H18-F20 WeakPolarHBondContact O-CE2 3.48Å; F20-Q30 HydrophobicContact CD1-CB 4.37Å; F20-M31 WeakPolarHBondContact CA-O 3.49Å; F20-C32 HydrophobicContact CD1-CB 4.37Å; F20-C32 HydrophobicContact CE1-CB 4.01Å; F20-C32 HydrophobicContact CZ-CB 4.22Å; F20-F39 HydrophobicContact CD1-CD2 4.37Å; F20-F39 AromaticContact CE1-CD2 3.57Å; F20-F39 HydrophobicContact CE1-CD2 3.57Å; F20-F39 AromaticContact CE1-CE2 3.59Å; F20-F39 HydrophobicContact CE1-CE2 3.59Å; F20-F39 HydrophobicContact CE1-CG 4.13Å; F20-F39 HydrophobicContact CE1-CZ 4.17Å; F20-F39 HydrophobicContact CZ-CD2 4.5Å; F20-F39 HydrophobicContact CZ-CE2 4.15Å; F20-F39 HydrophobicContact CZ-CZ 4.35Å; F20-M49 HydrophobicContact CB-SD 4.46Å; F20-M49 HydrophobicContact CD1-CG 4.41Å; F20-M49 HydrophobicContact CD2-CB 3.78Å; F20-M49 HydrophobicContact CD2-CG 3.85Å; F20-M49 HydrophobicContact CD2-SD 4.19Å; F20-M49 HydrophobicContact CE1-CG 4.31Å; F20-M49 HydrophobicContact CE2-CB 3.48Å; F20-M49 VanDerWaalsContact CE2-CB 3.48Å; F20-M49 HydrophobicContact CE2-CG 3.79Å; F20-M49 HydrophobicContact CG-CG 4.17Å; F20-M49 HydrophobicContact CG-SD 4.25Å; F20-M49 HydrophobicContact CZ-CB 4.03Å; F20-M49 HydrophobicContact CZ-CG 4Å; F20-H52 AromaticContact CE2-CD2 3.96Å; F20-H52 HydrophobicContact CZ-CB 4.15Å; F20-H52 AromaticContact CZ-CD2 3.4Å; F20-H52 WeakPolarHBondContact CZ-CD2 3.4Å; F20-H52 AromaticContact CZ-CG 3.99Å
21	V	87.5	Confident	81.7	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	167.9	173.7	-65.7	0	0	0	0	110.7	L16 S23 Q30 M31 L33	L16-V21 HydrophobicContact CD1-CG1 3.89Å; V21-S23 PolarHBondContact O-N 3.48Å; V21-Q30 CarbonylContact O-C 2.97Å; V21-Q30 VanDerWaalsContact O-CA 3.22Å; V21-Q30 WeakPolarHBondContact O-CA 3.46Å; V21-M31 HydrophobicContact CG2-CE 4.13Å; V21-M31 PolarHBondContact N-O 2.89Å; V21-M31 PolarHBondContact O-N 2.86Å; V21-L33 HydrophobicContact CB-CD2 4.38Å; V21-L33 HydrophobicContact CB-CG 4.49Å; V21-L33 HydrophobicContact CG1-CD1 3.69Å; V21-L33 HydrophobicContact CG1-CD2 3.9Å; V21-L33 HydrophobicContact CG1-CG 3.82Å; V21-L33 HydrophobicContact CG2-CD2 3.57Å; V21-L33 HydrophobicContact CG2-CG 3.93Å
22	V	84	Confident	82.1	Confident	55 Å²	55	51 Å²	51	33%	0.333	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	133.5	170	-178.4	0	0	0	0	109.3	Y11	Y11-V22 HydrophobicContact CD1-CG2 3.62Å; Y11-V22 HydrophobicContact CD2-CG2 3.81Å; Y11-V22 HydrophobicContact CE1-CG2 4.13Å; Y11-V22 HydrophobicContact CE2-CG2 4.32Å; Y11-V22 HydrophobicContact CG-CG2 3.44Å; Y11-V22 VanDerWaalsContact CG-CG2 3.44Å
23	S	78.6	Confident	82.4	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.028	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	132.4	176.4	177.6	0	0	0	0	110	V21 G25 N26 A29 K38	V21-S23 PolarHBondContact O-N 3.48Å; S23-G25 PolarHBondContact O-N 3.02Å; S23-N26 CarbonylContact O-C 3.58Å; S23-N26 PolarHBondContact O-N 3.37Å; S23-N26 VanDerWaalsContact O-N 3.09Å; S23-A29 WeakPolarHBondContact CB-O 3.48Å; S23-A29 PolarHBondContact N-O 3.44Å; S23-K38 WeakPolarHBondContact OG-CE 3.34Å
24	P	70.3	Confident	82.5	Confident	75 Å²	75	46.8 Å²	46.8	49%	0.487	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	127.6	169.2	-23.2	32.8	0	0	0	110.2	N26 F75	P24-N26 PolarHBondContact O-N 3.22Å; P24-F75 HydrophobicContact CG-CE1 4.04Å; P24-F75 HydrophobicContact CG-CZ 4.13Å
25	G	70.1	Confident	82.5	Confident	94 Å²	94	44 Å²	44	97%	0.969	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-5.2	179.8	0	0	0	0	0	116.6	S23	S23-G25 PolarHBondContact O-N 3.02Å
26	N	72.4	Confident	82.1	Confident	79 Å²	79	47.3 Å²	47.3	42%	0.422	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	100.1	176.2	-173	-12.9	0	0	0	111.7	S23 P24 K28 A29	S23-N26 CarbonylContact O-C 3.58Å; S23-N26 PolarHBondContact O-N 3.37Å; S23-N26 VanDerWaalsContact O-N 3.09Å; P24-N26 PolarHBondContact O-N 3.22Å; N26-K28 PolarHBondContact O-N 3.4Å; N26-K28 VanDerWaalsContact O-N 3.1Å; N26-K28 PolarHBondContact OD1-N 3.47Å; N26-A29 HydrophobicContact CB-CB 4.12Å; N26-A29 PolarHBondContact O-N 3.03Å; N26-A29 VanDerWaalsContact O-N 3.13Å
27	M	70.4	Confident	81.9	Confident	172 Å²	172	53.9 Å²	53.9	85%	0.847	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	-15.6	179.9	-69	-176.5	167.5	0	0	114.4
28	K	71.4	Confident	81.6	Confident	147 Å²	147	56 Å²	56	64%	0.639	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	1.8	-179.9	-63.4	-178.9	-179	174.3	0	113.4	N26 M44	N26-K28 PolarHBondContact O-N 3.4Å; N26-K28 VanDerWaalsContact O-N 3.1Å; N26-K28 PolarHBondContact OD1-N 3.47Å; K28-M44 WeakPolarHBondContact O-CE 3.39Å
29	A	78.8	Confident	81.2	Confident	12 Å²	12	56.3 Å²	56.3	10%	0.099	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	148.6	177.2	0	0	0	0	0	110.2	S23 N26	S23-A29 WeakPolarHBondContact CB-O 3.48Å; S23-A29 PolarHBondContact N-O 3.44Å; N26-A29 HydrophobicContact CB-CB 4.12Å; N26-A29 PolarHBondContact O-N 3.03Å; N26-A29 VanDerWaalsContact O-N 3.13Å
30	Q	81.5	Confident	80.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	158.3	176.3	-47.9	-170.7	2.7	0	0	109.8	Y11 F20 V21 K38 F39 M44	Y11-Q30 HydrophobicContact CD2-CG 3.99Å; F20-Q30 HydrophobicContact CD1-CB 4.37Å; V21-Q30 CarbonylContact O-C 2.97Å; V21-Q30 VanDerWaalsContact O-CA 3.22Å; V21-Q30 WeakPolarHBondContact O-CA 3.46Å; Q30-K38 CarbonylContact O-C 3.56Å; Q30-K38 WeakPolarHBondContact O-CA 3.34Å; Q30-F39 PolarHBondContact O-N 2.97Å; Q30-M44 HydrophobicContact CG-CE 3.64Å; Q30-M44 HydrophobicContact CG-CG 4.11Å; Q30-M44 HydrophobicContact CG-SD 4.32Å; Q30-M44 PolarHBondContact NE2-SD 3.29Å; Q30-M44 VanDerWaalsContact NE2-SD 3.42Å
31	M	87.2	Confident	80	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.039	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	136.9	-179.3	-173.3	-172.3	77.4	0	0	108.9	F20 V21 E36 R37 F75	F20-M31 WeakPolarHBondContact CA-O 3.49Å; V21-M31 HydrophobicContact CG2-CE 4.13Å; V21-M31 PolarHBondContact N-O 2.89Å; V21-M31 PolarHBondContact O-N 2.86Å; M31-E36 HydrophobicContact CE-CG 4.49Å; M31-E36 WeakPolarHBondContact CG-O 3.24Å; M31-E36 HydrophobicContact SD-CB 4.15Å; M31-R37 WeakPolarHBondContact CA-O 3.37Å; M31-F75 HydrophobicContact CE-CE1 4.06Å; M31-F75 HydrophobicContact CE-CE2 3.82Å; M31-F75 HydrophobicContact CE-CZ 3.56Å
32	C	87.9	Confident	79.3	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.5	169.6	177.1	0	0	0	0	109.3	F20 L34 E36 R37 F39 H52	F20-C32 HydrophobicContact CD1-CB 4.37Å; F20-C32 HydrophobicContact CE1-CB 4.01Å; F20-C32 HydrophobicContact CZ-CB 4.22Å; C32-L34 PolarHBondContact O-N 3.01Å; C32-L34 PolarHBondContact SG-N 2.95Å; C32-L34 VanDerWaalsContact SG-N 3.42Å; C32-E36 WeakPolarHBondContact O-CA 3.33Å; C32-E36 PolarHBondContact O-N 2.72Å; C32-R37 PolarHBondContact N-O 3.14Å; C32-R37 VanDerWaalsContact N-O 3.11Å; C32-F39 HydrophobicContact CB-CE2 4.12Å; C32-H52 PolarHBondContact SG-NE2 3.18Å
33	L	87.5	Confident	78.8	Confident	10 Å²	10	65.6 Å²	65.6	5%	0.052	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.6	177.7	-73.7	170.7	0	0	0	113.4	L16 G19 V21 L71 H72 F75	L16-L33 HydrophobicContact CD1-CD1 3.83Å; G19-L33 WeakPolarHBondContact O-CB 3.27Å; G19-L33 PolarHBondContact O-N 3.09Å; V21-L33 HydrophobicContact CB-CD2 4.38Å; V21-L33 HydrophobicContact CB-CG 4.49Å; V21-L33 HydrophobicContact CG1-CD1 3.69Å; V21-L33 HydrophobicContact CG1-CD2 3.9Å; V21-L33 HydrophobicContact CG1-CG 3.82Å; V21-L33 HydrophobicContact CG2-CD2 3.57Å; V21-L33 HydrophobicContact CG2-CG 3.93Å; L33-L71 HydrophobicContact CB-CD2 3.63Å; L33-L71 HydrophobicContact CB-CG 4.13Å; L33-H72 HydrophobicContact CD1-CB 3.81Å; L33-H72 HydrophobicContact CD2-CB 4.48Å; L33-F75 HydrophobicContact CD2-CB 4.19Å; L33-F75 HydrophobicContact CD2-CD1 4.48Å; L33-F75 HydrophobicContact CD2-CG 4.2Å
34	L	86.1	Confident	78.5	Confident	45 Å²	45	65.4 Å²	65.4	24%	0.236	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-38.3	-176.3	-65.2	171.9	0	0	0	113.1	C32 L53 H57 K60 Y67 F68 L71	C32-L34 PolarHBondContact O-N 3.01Å; C32-L34 PolarHBondContact SG-N 2.95Å; C32-L34 VanDerWaalsContact SG-N 3.42Å; L34-L53 HydrophobicContact CD1-CD1 3.7Å; L34-H57 HydrophobicContact CD1-CB 3.74Å; L34-K60 HydrophobicContact CD1-CB 3.81Å; L34-K60 HydrophobicContact CD1-CG 4.26Å; L34-K60 HydrophobicContact CD2-CG 4.27Å; L34-Y67 HydrophobicContact CD2-CE1 4.21Å; L34-F68 HydrophobicContact CD1-CE1 4.03Å; L34-F68 HydrophobicContact CG-CE1 4.3Å; L34-L71 HydrophobicContact CD2-CD2 3.58Å; L34-L71 HydrophobicContact CG-CD2 4.22Å
35	C	85.4	Confident	79	Confident	50 Å²	50	68.4 Å²	68.4	34%	0.338	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-0.4	179.3	59.2	0	0	0	0	114.6	R37 H52 H57	C35-R37 PolarHBondContact O-N 3.13Å; C35-R37 VanDerWaalsContact SG-CB 3.53Å; C35-H52 PolarHBondContact SG-NE2 3.38Å; C35-H57 WeakPolarHBondContact CB-NE2 3.42Å; C35-H57 PolarHBondContact SG-NE2 3.49Å; C35-H57 VanDerWaalsContact SG-NE2 3.39Å
36	E	81	Confident	79.6	Confident	93 Å²	93	66.6 Å²	66.6	44%	0.435	32%	0.324	S	S	.	.			trans	56.1	16.9	-177	-58.3	-177.8	-179.9	0	0	114	M31 C32 F75 R78	M31-E36 HydrophobicContact CE-CG 4.49Å; M31-E36 WeakPolarHBondContact CG-O 3.24Å; M31-E36 HydrophobicContact SD-CB 4.15Å; C32-E36 WeakPolarHBondContact O-CA 3.33Å; C32-E36 PolarHBondContact O-N 2.72Å; E36-F75 HydrophobicContact CG-CE2 4.38Å; E36-R78 IonicContact OE1-NH1 2.76Å; E36-R78 PolarHBondContact OE1-NH1 3.13Å
37	R	82.5	Confident	80.2	Confident	159 Å²	159	66.3 Å²	66.3	60%	0.6	33%	0.327	S	S	*	.			trans	-74.9	130.5	178.9	-167.6	175	-174.1	176.2	2.3	110.5	M31 C32 C35 F39	M31-R37 WeakPolarHBondContact CA-O 3.37Å; C32-R37 PolarHBondContact N-O 3.14Å; C32-R37 VanDerWaalsContact N-O 3.11Å; C35-R37 PolarHBondContact O-N 3.13Å; C35-R37 VanDerWaalsContact SG-CB 3.53Å; R37-F39 HydrophobicContact CB-CE2 4.02Å; R37-F39 HydrophobicContact CG-CE2 4.22Å; R37-F39 HydrophobicContact CG-CZ 4.49Å; R37-F39 WeakPolarHBondContact O-CD2 3.44Å; R37-F39 VanDerWaalsContact O-CE2 3.31Å; R37-F39 WeakPolarHBondContact O-CE2 3.44Å
38	K	83.2	Confident	80.9	Confident	134 Å²	134	62.1 Å²	62.1	58%	0.583	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.2	176.7	-63.5	180	-176.5	177.6	0	111.2	S23 Q30	S23-K38 WeakPolarHBondContact OG-CE 3.34Å; Q30-K38 CarbonylContact O-C 3.56Å; Q30-K38 WeakPolarHBondContact O-CA 3.34Å
39	F	78.6	Confident	81.6	Confident	39 Å²	39	55.3 Å²	55.3	17%	0.171	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.8	-179.1	-71.6	-98.3	0	0	0	111.1	F20 Q30 C32 R37 H52	F20-F39 HydrophobicContact CD1-CD2 4.37Å; F20-F39 AromaticContact CE1-CD2 3.57Å; F20-F39 HydrophobicContact CE1-CD2 3.57Å; F20-F39 AromaticContact CE1-CE2 3.59Å; F20-F39 HydrophobicContact CE1-CE2 3.59Å; F20-F39 HydrophobicContact CE1-CG 4.13Å; F20-F39 HydrophobicContact CE1-CZ 4.17Å; F20-F39 HydrophobicContact CZ-CD2 4.5Å; F20-F39 HydrophobicContact CZ-CE2 4.15Å; F20-F39 HydrophobicContact CZ-CZ 4.35Å; Q30-F39 PolarHBondContact O-N 2.97Å; C32-F39 HydrophobicContact CB-CE2 4.12Å; R37-F39 HydrophobicContact CB-CE2 4.02Å; R37-F39 HydrophobicContact CG-CE2 4.22Å; R37-F39 HydrophobicContact CG-CZ 4.49Å; R37-F39 WeakPolarHBondContact O-CD2 3.44Å; R37-F39 VanDerWaalsContact O-CE2 3.31Å; R37-F39 WeakPolarHBondContact O-CE2 3.44Å; F39-H52 HydrophobicContact CZ-CB 4.39Å; F39-H52 AromaticContact CZ-CD2 3.99Å; F39-H52 AromaticContact CZ-CE1 3.75Å; F39-H52 AromaticContact CZ-CG 3.71Å; F39-H52 AromaticContact CZ-ND1 3.56Å; F39-H52 AromaticContact CZ-NE2 3.99Å
40	S	79.8	Confident	81.9	Confident	66 Å²	66	57 Å²	57	46%	0.462	29%	0.286	S	S	.	.			trans	-69.4	161.8	174.5	66.6	0	0	0	0	111.5	E42 S43	S40-E42 PolarHBondContact O-N 3.23Å; S40-S43 WeakPolarHBondContact O-CB 3.44Å; S40-S43 PolarHBondContact O-N 3.15Å; S40-S43 PolarHBondContact OG-OG 3.23Å
41	N	75.7	Confident	82.3	Confident	32 Å²	32	63 Å²	63	17%	0.171	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-59	-35.4	179.4	-161	-75.3	0	0	0	112.9	C8 R9 S43 M44	C8-N41 PolarHBondContact SG-ND2 3.02Å; R9-N41 PolarHBondContact N-OD1 2.76Å; R9-N41 PolarHBondContact O-ND2 3.18Å; N41-S43 PolarHBondContact O-N 3.44Å; N41-M44 HydrophobicContact CB-CE 4.42Å; N41-M44 HydrophobicContact CB-SD 4.47Å; N41-M44 WeakPolarHBondContact ND2-CE 3.33Å; N41-M44 PolarHBondContact ND2-SD 3.24Å; N41-M44 VanDerWaalsContact ND2-SD 3.43Å; N41-M44 WeakPolarHBondContact O-CB 3.49Å; N41-M44 WeakPolarHBondContact O-CG 3.45Å; N41-M44 PolarHBondContact O-N 3.45Å
42	E	72.1	Confident	82.3	Confident	126 Å²	126	63.3 Å²	63.3	59%	0.589	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-62.7	-27.4	178.2	-64.2	179.6	172.4	0	0	112.4	K6 S40 M44	K6-E42 IonicContact NZ-OE1 3.66Å; K6-E42 PolarHBondContact NZ-OE1 2.92Å; S40-E42 PolarHBondContact O-N 3.23Å; E42-M44 VanDerWaalsContact C-N 3.29Å; E42-M44 PolarHBondContact O-N 2.92Å
43	S	74	Confident	82.4	Confident	31 Å²	31	63.5 Å²	63.5	22%	0.217	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-81.6	-2.1	176	-55	0	0	0	0	113.4	S40 N41 R45	S40-S43 WeakPolarHBondContact O-CB 3.44Å; S40-S43 PolarHBondContact O-N 3.15Å; S40-S43 PolarHBondContact OG-OG 3.23Å; N41-S43 PolarHBondContact O-N 3.44Å; S43-R45 PolarHBondContact O-N 2.92Å
44	M	71.9	Confident	82.3	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	33%	0.333	C	S	.	.			trans	-76	30.7	179.7	-63.9	-177.1	178.3	0	0	114	R9 K28 Q30 N41 E42 M49	R9-M44 HydrophobicContact CB-CB 4.12Å; R9-M44 HydrophobicContact CB-SD 3.89Å; R9-M44 WeakPolarHBondContact CD-O 3.18Å; R9-M44 PolarHBondContact NH1-O 2.83Å; K28-M44 WeakPolarHBondContact O-CE 3.39Å; Q30-M44 HydrophobicContact CG-CE 3.64Å; Q30-M44 HydrophobicContact CG-CG 4.11Å; Q30-M44 HydrophobicContact CG-SD 4.32Å; Q30-M44 PolarHBondContact NE2-SD 3.29Å; Q30-M44 VanDerWaalsContact NE2-SD 3.42Å; N41-M44 HydrophobicContact CB-CE 4.42Å; N41-M44 HydrophobicContact CB-SD 4.47Å; N41-M44 WeakPolarHBondContact ND2-CE 3.33Å; N41-M44 PolarHBondContact ND2-SD 3.24Å; N41-M44 VanDerWaalsContact ND2-SD 3.43Å; N41-M44 WeakPolarHBondContact O-CB 3.49Å; N41-M44 WeakPolarHBondContact O-CG 3.45Å; N41-M44 PolarHBondContact O-N 3.45Å; E42-M44 VanDerWaalsContact C-N 3.29Å; E42-M44 PolarHBondContact O-N 2.92Å; M44-M49 HydrophobicContact CB-CE 4.24Å
45	R	81.9	Confident	82.4	Confident	137 Å²	137	71.4 Å²	71.4	52%	0.517	35%	0.354	S	S	.	.			trans	-86.4	131	169	-64.5	178.8	-177	-160.2	2.8	108.1	S43 C47 M48 M49	S43-R45 PolarHBondContact O-N 2.92Å; R45-C47 PolarHBondContact O-N 3.42Å; R45-C47 VanDerWaalsContact O-N 3.1Å; R45-M48 HydrophobicContact CB-CB 4.37Å; R45-M48 HydrophobicContact CB-CG 3.9Å; R45-M48 WeakPolarHBondContact O-CA 3.5Å; R45-M48 WeakPolarHBondContact O-CB 3.25Å; R45-M48 PolarHBondContact O-N 3.21Å; R45-M49 PolarHBondContact O-N 3.39Å
46	P	81.9	Confident	82.4	Confident	57 Å²	57	73.3 Å²	73.3	37%	0.37	36%	0.359	S	S	.	.	H	α-helix	trans	-49.9	-38.8	175.2	-29.2	34.7	0	0	0	112.8	Y15 M48 M49 V50	Y15-P46 HydrophobicContact CE1-CG 4.01Å; P46-M48 VanDerWaalsContact C-N 3.29Å; P46-M48 PolarHBondContact O-N 3.31Å; P46-M49 PolarHBondContact O-N 3.5Å; P46-V50 WeakPolarHBondContact O-CG2 3.49Å; P46-V50 PolarHBondContact O-N 2.97Å
47	C	84.3	Confident	82.7	Confident	72 Å²	72	70.2 Å²	70.2	49%	0.486	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-30.6	176.1	62.9	0	0	0	0	114.2	R45 K51	R45-C47 PolarHBondContact O-N 3.42Å; R45-C47 VanDerWaalsContact O-N 3.1Å; C47-K51 WeakPolarHBondContact O-CB 3.49Å; C47-K51 VanDerWaalsContact O-CG 3.23Å; C47-K51 WeakPolarHBondContact O-CG 3.4Å; C47-K51 PolarHBondContact O-N 3.47Å
48	M	85	Confident	82.7	Confident	84 Å²	84	66.8 Å²	66.8	41%	0.414	34%	0.343	S	S	.	.	H	α-helix	trans	-76.5	-35.6	176.9	-64.2	-65.6	-77.9	0	0	111.4	R45 P46 K51 H52	R45-M48 HydrophobicContact CB-CB 4.37Å; R45-M48 HydrophobicContact CB-CG 3.9Å; R45-M48 WeakPolarHBondContact O-CA 3.5Å; R45-M48 WeakPolarHBondContact O-CB 3.25Å; R45-M48 PolarHBondContact O-N 3.21Å; P46-M48 VanDerWaalsContact C-N 3.29Å; P46-M48 PolarHBondContact O-N 3.31Å; M48-K51 PolarHBondContact O-N 3.22Å; M48-K51 HydrophobicContact SD-CD 4.47Å; M48-H52 WeakPolarHBondContact O-CB 3.42Å; M48-H52 PolarHBondContact O-N 3.3Å
49	M	86.3	Confident	82.8	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.02	34%	0.342	C	S	.	.	H	α-helix	trans	-65.8	-45.8	174.2	-63.1	173	-166.3	0	0	111.1	Y15 H18 F20 M44 R45 P46 K51 H52 L53	Y15-M49 HydrophobicContact CD1-CE 4.15Å; Y15-M49 HydrophobicContact CD1-SD 3.83Å; Y15-M49 HydrophobicContact CD2-CE 3.75Å; Y15-M49 HydrophobicContact CD2-SD 4.25Å; Y15-M49 HydrophobicContact CE1-CE 4.33Å; Y15-M49 HydrophobicContact CE1-SD 4.42Å; Y15-M49 HydrophobicContact CE2-CE 3.94Å; Y15-M49 HydrophobicContact CG-CE 3.86Å; Y15-M49 HydrophobicContact CG-SD 3.73Å; H18-M49 HydrophobicContact CB-CB 4.12Å; F20-M49 HydrophobicContact CB-SD 4.46Å; F20-M49 HydrophobicContact CD1-CG 4.41Å; F20-M49 HydrophobicContact CD2-CB 3.78Å; F20-M49 HydrophobicContact CD2-CG 3.85Å; F20-M49 HydrophobicContact CD2-SD 4.19Å; F20-M49 HydrophobicContact CE1-CG 4.31Å; F20-M49 HydrophobicContact CE2-CB 3.48Å; F20-M49 VanDerWaalsContact CE2-CB 3.48Å; F20-M49 HydrophobicContact CE2-CG 3.79Å; F20-M49 HydrophobicContact CG-CG 4.17Å; F20-M49 HydrophobicContact CG-SD 4.25Å; F20-M49 HydrophobicContact CZ-CB 4.03Å; F20-M49 HydrophobicContact CZ-CG 4Å; M44-M49 HydrophobicContact CB-CE 4.24Å; R45-M49 PolarHBondContact O-N 3.39Å; P46-M49 PolarHBondContact O-N 3.5Å; M49-K51 VanDerWaalsContact C-N 3.34Å; M49-K51 PolarHBondContact O-N 3.03Å; M49-H52 PolarHBondContact O-N 3.36Å; M49-L53 WeakPolarHBondContact O-CB 3.43Å; M49-L53 PolarHBondContact O-N 3.48Å
50	V	87	Confident	83.2	Confident	49 Å²	49	66.4 Å²	66.4	30%	0.297	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-44.3	174.9	174.3	0	0	0	0	110.6	H18 P46 L53 H54	H18-V50 VanDerWaalsContact CE1-CG2 3.48Å; H18-V50 WeakPolarHBondContact CE1-CG2 3.04Å; P46-V50 WeakPolarHBondContact O-CG2 3.49Å; P46-V50 PolarHBondContact O-N 2.97Å; V50-L53 PolarHBondContact O-N 3.3Å; V50-H54 PolarHBondContact O-N 2.98Å; V50-H54 PolarHBondContact O-ND1 2.92Å
51	K	88.6	Confident	83.4	Confident	125 Å²	125	64 Å²	64	54%	0.543	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-44.9	174.4	-80.7	178.9	178.7	-170.9	0	112.5	C47 M48 M49 L53 H54 N55	C47-K51 WeakPolarHBondContact O-CB 3.49Å; C47-K51 VanDerWaalsContact O-CG 3.23Å; C47-K51 WeakPolarHBondContact O-CG 3.4Å; C47-K51 PolarHBondContact O-N 3.47Å; M48-K51 PolarHBondContact O-N 3.22Å; M48-K51 HydrophobicContact SD-CD 4.47Å; M49-K51 VanDerWaalsContact C-N 3.34Å; M49-K51 PolarHBondContact O-N 3.03Å; K51-L53 VanDerWaalsContact C-N 3.33Å; K51-L53 PolarHBondContact O-N 3.22Å; K51-H54 PolarHBondContact O-N 3.43Å; K51-N55 VanDerWaalsContact O-CB 3.24Å; K51-N55 WeakPolarHBondContact O-CB 3.46Å; K51-N55 PolarHBondContact O-N 3.42Å
52	H	88.3	Confident	83.9	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.069	36%	0.361	C	S	.	.	H	α-helix	trans	-59.2	-46.4	176.2	170.5	68.1	0	0	0	111.3	F20 C32 C35 F39 M48 M49 H54 N55 I56 H57	F20-H52 AromaticContact CE2-CD2 3.96Å; F20-H52 HydrophobicContact CZ-CB 4.15Å; F20-H52 AromaticContact CZ-CD2 3.4Å; F20-H52 WeakPolarHBondContact CZ-CD2 3.4Å; F20-H52 AromaticContact CZ-CG 3.99Å; C32-H52 PolarHBondContact SG-NE2 3.18Å; C35-H52 PolarHBondContact SG-NE2 3.38Å; F39-H52 HydrophobicContact CZ-CB 4.39Å; F39-H52 AromaticContact CZ-CD2 3.99Å; F39-H52 AromaticContact CZ-CE1 3.75Å; F39-H52 AromaticContact CZ-CG 3.71Å; F39-H52 AromaticContact CZ-ND1 3.56Å; F39-H52 AromaticContact CZ-NE2 3.99Å; M48-H52 WeakPolarHBondContact O-CB 3.42Å; M48-H52 PolarHBondContact O-N 3.3Å; M49-H52 PolarHBondContact O-N 3.36Å; H52-H54 PolarHBondContact O-N 2.92Å; H52-N55 PolarHBondContact O-N 3.43Å; H52-I56 WeakPolarHBondContact ND1-CG1 3.45Å; H52-I56 WeakPolarHBondContact O-CB 3.4Å; H52-I56 PolarHBondContact O-N 2.96Å; H52-H57 AromaticContact CE1-NE2 3.99Å; H52-H57 AromaticContact NE2-CD2 3.65Å; H52-H57 AromaticContact NE2-NE2 3.62Å
53	L	88.3	Confident	84.7	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.026	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-44.9	179.5	-172.8	69.6	0	0	0	111.4	L34 M49 V50 K51 H57 A61 F68	L34-L53 HydrophobicContact CD1-CD1 3.7Å; M49-L53 WeakPolarHBondContact O-CB 3.43Å; M49-L53 PolarHBondContact O-N 3.48Å; V50-L53 PolarHBondContact O-N 3.3Å; K51-L53 VanDerWaalsContact C-N 3.33Å; K51-L53 PolarHBondContact O-N 3.22Å; L53-H57 HydrophobicContact CD1-CB 4.16Å; L53-H57 CarbonylContact O-C 3.55Å; L53-H57 VanDerWaalsContact O-CA 3.27Å; L53-H57 WeakPolarHBondContact O-CA 3.45Å; L53-H57 WeakPolarHBondContact O-CB 3.36Å; L53-H57 PolarHBondContact O-N 2.99Å; L53-A61 HydrophobicContact CG-CB 4.29Å; L53-F68 HydrophobicContact CD1-CE1 4.48Å; L53-F68 HydrophobicContact CD1-CZ 4.04Å; L53-F68 HydrophobicContact CD2-CZ 4.28Å
54	H	87.2	Confident	85.4	Confident	96 Å²	96	72 Å²	72	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-70.4	-37.1	178.6	-74.5	74	0	0	0	113.4	V50 K51 H52 P58	V50-H54 PolarHBondContact O-N 2.98Å; V50-H54 PolarHBondContact O-ND1 2.92Å; K51-H54 PolarHBondContact O-N 3.43Å; H52-H54 PolarHBondContact O-N 2.92Å; H54-P58 WeakPolarHBondContact O-CB 3.31Å
55	N	87.5	Confident	86.2	Confident	125 Å²	125	75.5 Å²	75.5	67%	0.668	39%	0.389	S	S	*	.	H	α-helix	trans	-85.5	-33.9	-173.5	-67.7	-2.1	0	0	0	113.4	K51 H52	K51-N55 VanDerWaalsContact O-CB 3.24Å; K51-N55 WeakPolarHBondContact O-CB 3.46Å; K51-N55 PolarHBondContact O-N 3.42Å; H52-N55 PolarHBondContact O-N 3.43Å
56	I	85.4	Confident	86.5	Confident	90 Å²	90	71.6 Å²	71.6	46%	0.462	39%	0.386	S	S	.	.	H	α-helix	trans	-104.5	-27.2	-174.4	-52.6	-58.8	0	0	0	111.6	H52 P58	H52-I56 WeakPolarHBondContact ND1-CG1 3.45Å; H52-I56 WeakPolarHBondContact O-CB 3.4Å; H52-I56 PolarHBondContact O-N 2.96Å; I56-P58 VanDerWaalsContact C-CD 3.44Å
57	H	87.6	Confident	86.9	Confident	27 Å²	27	71.7 Å²	71.7	13%	0.125	38%	0.379	C	S	.	.			trans	-132.1	53.4	-177.6	-56.7	-57.1	0	0	0	112.3	L34 C35 H52 L53 D59 K60 A61	L34-H57 HydrophobicContact CD1-CB 3.74Å; C35-H57 WeakPolarHBondContact CB-NE2 3.42Å; C35-H57 PolarHBondContact SG-NE2 3.49Å; C35-H57 VanDerWaalsContact SG-NE2 3.39Å; H52-H57 AromaticContact CE1-NE2 3.99Å; H52-H57 AromaticContact NE2-CD2 3.65Å; H52-H57 AromaticContact NE2-NE2 3.62Å; L53-H57 HydrophobicContact CD1-CB 4.16Å; L53-H57 CarbonylContact O-C 3.55Å; L53-H57 VanDerWaalsContact O-CA 3.27Å; L53-H57 WeakPolarHBondContact O-CA 3.45Å; L53-H57 WeakPolarHBondContact O-CB 3.36Å; L53-H57 PolarHBondContact O-N 2.99Å; H57-D59 PolarHBondContact O-N 2.81Å; H57-D59 VanDerWaalsContact O-N 3.16Å; H57-K60 HydrophobicContact CB-CB 4.36Å; H57-K60 CarbonylContact O-C 3.58Å; H57-K60 PolarHBondContact O-N 2.95Å; H57-A61 PolarHBondContact O-N 3.43Å; H57-A61 VanDerWaalsContact O-N 3.09Å
58	P	83	Confident	87.2	Confident	88 Å²	88	68.3 Å²	68.3	57%	0.571	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-57.8	-33.6	-173.9	23.7	-34.1	0	0	0	112.8	H54 I56 K60 A61	H54-P58 WeakPolarHBondContact O-CB 3.31Å; I56-P58 VanDerWaalsContact C-CD 3.44Å; P58-K60 PolarHBondContact O-N 3.42Å; P58-A61 WeakPolarHBondContact O-CB 3.22Å; P58-A61 PolarHBondContact O-N 2.83Å
59	D	83.7	Confident	87.4	Confident	104 Å²	104	68.6 Å²	68.6	56%	0.556	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-69.6	-17.7	178.1	68.1	-50.6	0	0	0	113.8	H57	H57-D59 PolarHBondContact O-N 2.81Å; H57-D59 VanDerWaalsContact O-N 3.16Å
60	K	87.6	Confident	87.5	Confident	60 Å²	60	71.6 Å²	71.6	26%	0.261	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-112.2	0.1	177.9	-57.3	-60.3	-173.8	-90.5	0	113	L34 H57 P58 N62 K63 Y67	L34-K60 HydrophobicContact CD1-CB 3.81Å; L34-K60 HydrophobicContact CD1-CG 4.26Å; L34-K60 HydrophobicContact CD2-CG 4.27Å; H57-K60 HydrophobicContact CB-CB 4.36Å; H57-K60 CarbonylContact O-C 3.58Å; H57-K60 PolarHBondContact O-N 2.95Å; P58-K60 PolarHBondContact O-N 3.42Å; K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 2.81Å; K60-K63 HydrophobicContact CB-CG 4.28Å; K60-K63 HydrophobicContact CD-CG 4.18Å; K60-K63 WeakPolarHBondContact O-CB 2.93Å; K60-K63 WeakPolarHBondContact O-CG 3.42Å; K60-K63 PolarHBondContact O-N 3.36Å; K60-Y67 HydrophobicContact CD-CE1 4.3Å; K60-Y67 WeakPolarHBondContact CD-OH 3.46Å; K60-Y67 WeakPolarHBondContact CE-OH 3.37Å
61	A	83.8	Confident	87.6	Confident	15 Å²	15	71 Å²	71	12%	0.124	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.7	-176.2	0	0	0	0	0	114	L53 H57 P58	L53-A61 HydrophobicContact CG-CB 4.29Å; H57-A61 PolarHBondContact O-N 3.43Å; H57-A61 VanDerWaalsContact O-N 3.09Å; P58-A61 WeakPolarHBondContact O-CB 3.22Å; P58-A61 PolarHBondContact O-N 2.83Å
62	N	86	Confident	87.5	Confident	154 Å²	154	67.8 Å²	67.8	82%	0.824	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	10.8	-179.5	-65.1	-19.2	0	0	0	113.9	K60	K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 2.81Å
63	K	89.2	Confident	87.3	Confident	95 Å²	95	72.4 Å²	72.4	41%	0.413	38%	0.381	S	S	.	.			trans	-77.3	144.2	179.6	-64.9	-66.4	-177.8	-175.4	0	111.2	K60 Y67 F68	K60-K63 HydrophobicContact CB-CG 4.28Å; K60-K63 HydrophobicContact CD-CG 4.18Å; K60-K63 WeakPolarHBondContact O-CB 2.93Å; K60-K63 WeakPolarHBondContact O-CG 3.42Å; K60-K63 PolarHBondContact O-N 3.36Å; K63-Y67 HydrophobicContact CB-CD1 3.45Å; K63-Y67 VanDerWaalsContact CB-CD1 3.45Å; K63-Y67 HydrophobicContact CB-CE1 4.11Å; K63-Y67 HydrophobicContact CB-CG 3.79Å; K63-Y67 HydrophobicContact CD-CD1 4.34Å; K63-Y67 HydrophobicContact CD-CD2 4.22Å; K63-Y67 HydrophobicContact CD-CG 4.1Å; K63-Y67 HydrophobicContact CG-CD1 3.72Å; K63-Y67 HydrophobicContact CG-CD2 4.45Å; K63-Y67 HydrophobicContact CG-CE1 3.95Å; K63-Y67 HydrophobicContact CG-CG 3.98Å; K63-F68 HydrophobicContact CB-CE2 4.14Å; K63-F68 HydrophobicContact CB-CZ 4.3Å
64	N	88.6	Confident	87.2	Confident	108 Å²	108	81.6 Å²	81.6	58%	0.578	42%	0.415	S	S	*	.			trans	-83.7	174	-179.1	69.2	4.2	0	0	0	112.3	A66 Y67 F68	N64-A66 VanDerWaalsContact C-N 3.28Å; N64-A66 PolarHBondContact O-N 3.11Å; N64-A66 PolarHBondContact OD1-N 2.91Å; N64-Y67 WeakPolarHBondContact O-CB 3.32Å; N64-Y67 PolarHBondContact O-N 2.77Å; N64-Y67 PolarHBondContact OD1-N 2.85Å; N64-Y67 VanDerWaalsContact OD1-N 3.13Å; N64-F68 WeakPolarHBondContact O-CD2 3.19Å
65	L	88.4	Confident	87	Confident	76 Å²	76	79.5 Å²	79.5	40%	0.398	41%	0.405	S	S	.	.	H	α-helix	trans	-57.1	-37.9	179.3	179.8	62.9	0	0	0	113.1	L16 K17 Y67 F68 Q69	L16-L65 HydrophobicContact CB-CD1 4.11Å; L16-L65 HydrophobicContact CD2-CD1 4.21Å; L16-L65 HydrophobicContact CG-CD1 3.97Å; K17-L65 HydrophobicContact CB-CD1 4.02Å; L65-Y67 VanDerWaalsContact C-N 3.3Å; L65-Y67 PolarHBondContact O-N 2.99Å; L65-F68 PolarHBondContact O-N 3.35Å; L65-F68 VanDerWaalsContact O-N 3.14Å; L65-Q69 HydrophobicContact CD1-CG 4.36Å; L65-Q69 HydrophobicContact CG-CG 4.25Å; L65-Q69 WeakPolarHBondContact O-CG 3.13Å; L65-Q69 PolarHBondContact O-N 2.96Å
66	A	88	Confident	86.6	Confident	54 Å²	54	79.2 Å²	79.2	45%	0.446	40%	0.403	S	S	.	.	H	α-helix	trans	-61	-38.5	-179.7	0	0	0	0	0	112.3	N64 Q69 S70	N64-A66 VanDerWaalsContact C-N 3.28Å; N64-A66 PolarHBondContact O-N 3.11Å; N64-A66 PolarHBondContact OD1-N 2.91Å; A66-Q69 PolarHBondContact O-N 2.81Å; A66-S70 PolarHBondContact O-N 3.26Å; A66-S70 PolarHBondContact O-OG 3.05Å
67	Y	90.9	Very high	86.2	Confident	60 Å²	60	84.6 Å²	84.6	24%	0.235	42%	0.417	C	S	.	.	H	α-helix	trans	-58	-50	172.9	173.5	-101.4	0	0	0	111.4	L34 K60 K63 N64 L65 Q69 S70 L71	L34-Y67 HydrophobicContact CD2-CE1 4.21Å; K60-Y67 HydrophobicContact CD-CE1 4.3Å; K60-Y67 WeakPolarHBondContact CD-OH 3.46Å; K60-Y67 WeakPolarHBondContact CE-OH 3.37Å; K63-Y67 HydrophobicContact CB-CD1 3.45Å; K63-Y67 VanDerWaalsContact CB-CD1 3.45Å; K63-Y67 HydrophobicContact CB-CE1 4.11Å; K63-Y67 HydrophobicContact CB-CG 3.79Å; K63-Y67 HydrophobicContact CD-CD1 4.34Å; K63-Y67 HydrophobicContact CD-CD2 4.22Å; K63-Y67 HydrophobicContact CD-CG 4.1Å; K63-Y67 HydrophobicContact CG-CD1 3.72Å; K63-Y67 HydrophobicContact CG-CD2 4.45Å; K63-Y67 HydrophobicContact CG-CE1 3.95Å; K63-Y67 HydrophobicContact CG-CG 3.98Å; N64-Y67 WeakPolarHBondContact O-CB 3.32Å; N64-Y67 PolarHBondContact O-N 2.77Å; N64-Y67 PolarHBondContact OD1-N 2.85Å; N64-Y67 VanDerWaalsContact OD1-N 3.13Å; L65-Y67 VanDerWaalsContact C-N 3.3Å; L65-Y67 PolarHBondContact O-N 2.99Å; Y67-Q69 PolarHBondContact O-N 3.36Å; Y67-S70 PolarHBondContact O-N 3.25Å; Y67-S70 PolarHBondContact O-OG 2.76Å; Y67-L71 HydrophobicContact CE1-CD2 4.48Å; Y67-L71 WeakPolarHBondContact O-CB 3.31Å; Y67-L71 PolarHBondContact O-N 2.98Å
68	F	90.6	Very high	85.4	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-70	-31.2	-179.4	-65.6	-66.3	0	0	0	113.5	L16 G19 L34 L53 K63 N64 L65 L71 H72	L16-F68 HydrophobicContact CD1-CB 4.13Å; L16-F68 HydrophobicContact CG-CB 4.32Å; L16-F68 WeakPolarHBondContact O-CB 3.21Å; L16-F68 WeakPolarHBondContact O-CG 3.34Å; G19-F68 VanDerWaalsContact CA-CE1 3.45Å; L34-F68 HydrophobicContact CD1-CE1 4.03Å; L34-F68 HydrophobicContact CG-CE1 4.3Å; L53-F68 HydrophobicContact CD1-CE1 4.48Å; L53-F68 HydrophobicContact CD1-CZ 4.04Å; L53-F68 HydrophobicContact CD2-CZ 4.28Å; K63-F68 HydrophobicContact CB-CE2 4.14Å; K63-F68 HydrophobicContact CB-CZ 4.3Å; N64-F68 WeakPolarHBondContact O-CD2 3.19Å; L65-F68 PolarHBondContact O-N 3.35Å; L65-F68 VanDerWaalsContact O-N 3.14Å; F68-L71 HydrophobicContact CD1-CD2 4.42Å; F68-L71 PolarHBondContact O-N 3.18Å; F68-H72 WeakPolarHBondContact O-CB 3.39Å; F68-H72 PolarHBondContact O-N 2.81Å
69	Q	89.2	Confident	84	Confident	91 Å²	91	92.2 Å²	92.2	43%	0.425	45%	0.449	S	S	.	.	H	α-helix	trans	-61.3	-50	171.2	-76.4	172.7	-30	0	0	111.3	L16 L65 A66 Y67 L71 H72 E73	L16-Q69 HydrophobicContact CD2-CG 3.68Å; L65-Q69 HydrophobicContact CD1-CG 4.36Å; L65-Q69 HydrophobicContact CG-CG 4.25Å; L65-Q69 WeakPolarHBondContact O-CG 3.13Å; L65-Q69 PolarHBondContact O-N 2.96Å; A66-Q69 PolarHBondContact O-N 2.81Å; Y67-Q69 PolarHBondContact O-N 3.36Å; Q69-L71 VanDerWaalsContact C-N 3.3Å; Q69-L71 PolarHBondContact O-N 3.25Å; Q69-H72 WeakPolarHBondContact O-CB 3.42Å; Q69-H72 PolarHBondContact O-N 3.44Å; Q69-E73 PolarHBondContact O-N 3.02Å
70	S	87.9	Confident	82.4	Confident	66 Å²	66	96.9 Å²	96.9	46%	0.462	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-37.9	177	71.5	0	0	0	0	112.7	A66 Y67 E73 R74	A66-S70 PolarHBondContact O-N 3.26Å; A66-S70 PolarHBondContact O-OG 3.05Å; Y67-S70 PolarHBondContact O-N 3.25Å; Y67-S70 PolarHBondContact O-OG 2.76Å; S70-E73 PolarHBondContact O-N 3.45Å; S70-R74 WeakPolarHBondContact O-CB 3.39Å; S70-R74 PolarHBondContact O-N 2.96Å
71	L	88.8	Confident	80.4	Confident	38 Å²	38	101.1 Å²	101.1	20%	0.199	49%	0.489	C	S	.	.	H	α-helix	trans	-65.2	-40.5	176.2	-174.1	65.3	0	0	0	111.5	L33 L34 Y67 F68 Q69 R74 F75	L33-L71 HydrophobicContact CB-CD2 3.63Å; L33-L71 HydrophobicContact CB-CG 4.13Å; L34-L71 HydrophobicContact CD2-CD2 3.58Å; L34-L71 HydrophobicContact CG-CD2 4.22Å; Y67-L71 HydrophobicContact CE1-CD2 4.48Å; Y67-L71 WeakPolarHBondContact O-CB 3.31Å; Y67-L71 PolarHBondContact O-N 2.98Å; F68-L71 HydrophobicContact CD1-CD2 4.42Å; F68-L71 PolarHBondContact O-N 3.18Å; Q69-L71 VanDerWaalsContact C-N 3.3Å; Q69-L71 PolarHBondContact O-N 3.25Å; L71-R74 PolarHBondContact O-N 3.47Å; L71-F75 WeakPolarHBondContact O-CB 3.43Å; L71-F75 PolarHBondContact O-N 2.85Å
72	H	86.9	Confident	78.3	Confident	56 Å²	56	107 Å²	107	26%	0.259	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-45	175.7	-174.8	-153.8	0	0	0	111.9	L16 L33 F68 Q69 R74 F75 L76	L16-H72 HydrophobicContact CD1-CB 4.21Å; L33-H72 HydrophobicContact CD1-CB 3.81Å; L33-H72 HydrophobicContact CD2-CB 4.48Å; F68-H72 WeakPolarHBondContact O-CB 3.39Å; F68-H72 PolarHBondContact O-N 2.81Å; Q69-H72 WeakPolarHBondContact O-CB 3.42Å; Q69-H72 PolarHBondContact O-N 3.44Å; H72-R74 VanDerWaalsContact C-N 3.33Å; H72-R74 PolarHBondContact O-N 3.45Å; H72-F75 WeakPolarHBondContact O-CB 3.48Å; H72-F75 PolarHBondContact O-N 3.09Å; H72-L76 WeakPolarHBondContact O-CG 3.43Å; H72-L76 PolarHBondContact O-N 3.43Å
73	E	85.4	Confident	76.2	Confident	112 Å²	112	110.2 Å²	110.2	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-42.5	175.2	-73.4	-176.5	-173.9	0	0	111.9	Q69 S70 F75 L76 R77	Q69-E73 PolarHBondContact O-N 3.02Å; S70-E73 PolarHBondContact O-N 3.45Å; E73-F75 VanDerWaalsContact C-N 3.31Å; E73-F75 PolarHBondContact O-N 3.21Å; E73-L76 PolarHBondContact O-N 3.29Å; E73-R77 WeakPolarHBondContact O-CG 3.33Å; E73-R77 PolarHBondContact O-N 3.22Å
74	R	85.1	Confident	73.7	Confident	198 Å²	198	109.8 Å²	109.8	75%	0.747	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-38.7	175.5	-168.8	178.3	-178.2	-177.6	1	111.9	S70 L71 H72 R77 R78	S70-R74 WeakPolarHBondContact O-CB 3.39Å; S70-R74 PolarHBondContact O-N 2.96Å; L71-R74 PolarHBondContact O-N 3.47Å; H72-R74 VanDerWaalsContact C-N 3.33Å; H72-R74 PolarHBondContact O-N 3.45Å; R74-R77 PolarHBondContact O-N 3.03Å; R74-R78 PolarHBondContact O-N 3.35Å
75	F	82.9	Confident	71.4	Confident	53 Å²	53	110.6 Å²	110.6	23%	0.232	53%	0.532	C	S	.	.	H	α-helix	trans	-62.3	-43.3	174.7	-179	-93.6	0	0	0	111.6	P24 M31 L33 E36 L71 H72 E73 R77 R78	P24-F75 HydrophobicContact CG-CE1 4.04Å; P24-F75 HydrophobicContact CG-CZ 4.13Å; M31-F75 HydrophobicContact CE-CE1 4.06Å; M31-F75 HydrophobicContact CE-CE2 3.82Å; M31-F75 HydrophobicContact CE-CZ 3.56Å; L33-F75 HydrophobicContact CD2-CB 4.19Å; L33-F75 HydrophobicContact CD2-CD1 4.48Å; L33-F75 HydrophobicContact CD2-CG 4.2Å; E36-F75 HydrophobicContact CG-CE2 4.38Å; L71-F75 WeakPolarHBondContact O-CB 3.43Å; L71-F75 PolarHBondContact O-N 2.85Å; H72-F75 WeakPolarHBondContact O-CB 3.48Å; H72-F75 PolarHBondContact O-N 3.09Å; E73-F75 VanDerWaalsContact C-N 3.31Å; E73-F75 PolarHBondContact O-N 3.21Å; F75-R77 VanDerWaalsContact C-N 3.33Å; F75-R77 PolarHBondContact O-N 3.23Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 3.1Å
76	L	79.6	Confident	69.1	Low	118 Å²	118	111.8 Å²	111.8	62%	0.618	54%	0.544	S	S	*	.	H	α-helix	trans	-66.1	-31.8	176.7	-68.6	172.8	0	0	0	113.3	H72 E73	H72-L76 WeakPolarHBondContact O-CG 3.43Å; H72-L76 PolarHBondContact O-N 3.43Å; E73-L76 PolarHBondContact O-N 3.29Å
77	R	76.9	Confident	66.7	Low	203 Å²	203	114 Å²	114	77%	0.766	56%	0.556	S	S	*	*	H	α-helix	trans	-81.6	-9.1	178.6	-70.2	-177.5	-172.3	-164.4	5	114.4	E73 R74 F75	E73-R77 WeakPolarHBondContact O-CG 3.33Å; E73-R77 PolarHBondContact O-N 3.22Å; R74-R77 PolarHBondContact O-N 3.03Å; F75-R77 VanDerWaalsContact C-N 3.33Å; F75-R77 PolarHBondContact O-N 3.23Å
78	R	70.8	Confident	64.3	Low	159 Å²	159	115 Å²	115	60%	0.6	57%	0.569	S	S	*	*	S	Bend	trans	-63.1	126.3	179.9	-162.9	173.5	-175.1	179.6	0.6	108.6	E36 R74 F75 K80	E36-R78 IonicContact OE1-NH1 2.76Å; E36-R78 PolarHBondContact OE1-NH1 3.13Å; R74-R78 PolarHBondContact O-N 3.35Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 3.1Å; R78-K80 PolarHBondContact O-N 2.99Å
79	P	54.5	Low	62.4	Low	117 Å²	117	119.7 Å²	119.7	76%	0.76	60%	0.601	S	S	*	*			trans	-55.4	119	173.2	-20.1	29.8	0	0	0	107.8	L81	P79-L81 PolarHBondContact O-N 3.09Å
80	K	49.2	Very low	60.4	Low	201 Å²	201	125.6 Å²	125.6	87%	0.874	62%	0.619	S	S	*	*			trans	-68.5	88.9	173.3	-68.5	179.9	-177.5	174.7	0	106.6	R78 D82	R78-K80 PolarHBondContact O-N 2.99Å; K80-D82 PolarHBondContact O-N 3.26Å; K80-D82 VanDerWaalsContact O-N 3.17Å
81	L	45.6	Very low	58.6	Low	149 Å²	149	125.1 Å²	125.1	78%	0.78	61%	0.614	S	S	*	*			trans	-56.3	120.6	154.1	-136.7	101	0	0	0	104.2	P79 R83	P79-L81 PolarHBondContact O-N 3.09Å; L81-R83 PolarHBondContact O-N 3.19Å
82	D	39.9	Very low	57	Low	139 Å²	139	127.5 Å²	127.5	74%	0.743	62%	0.624	S	S	*	*			trans	-62.3	82.8	-170.1	-159.8	6.8	0	0	0	110.5	K80 S84	K80-D82 PolarHBondContact O-N 3.26Å; K80-D82 VanDerWaalsContact O-N 3.17Å; D82-S84 PolarHBondContact OD1-OG 2.97Å
83	R	41.2	Very low	55.7	Low	222 Å²	222	132 Å²	132	84%	0.838	65%	0.645	S	S	*	*			trans	-95.4	32.9	175	-84.8	-169.4	173.1	-156.1	-1.2	109.9	L81 L85	L81-R83 PolarHBondContact O-N 3.19Å; R83-L85 PolarHBondContact O-N 2.67Å
84	S	37.2	Very low	55.4	Low	86 Å²	86	132.1 Å²	132.1	60%	0.601	65%	0.645	S	S	*	*			trans	-70.5	56.6	161.8	71.5	0	0	0	0	110.8	D82	D82-S84 PolarHBondContact OD1-OG 2.97Å
85	L	39.5	Very low	55.4	Low	125 Å²	125	126.4 Å²	126.4	65%	0.654	63%	0.63	S	S	*	*			trans	-104.8	101	152.4	-131.3	77	0	0	0	105.2	R83 S87	R83-L85 PolarHBondContact O-N 2.67Å; L85-S87 PolarHBondContact O-N 3.24Å
86	P	40.2	Very low	55.7	Low	101 Å²	101	124.2 Å²	124.2	66%	0.656	62%	0.622	S	S	*	*			trans	-57.7	109.3	172.6	-16.1	28.6	0	0	0	107.5	T88	P86-T88 PolarHBondContact O-N 2.91Å
87	S	37.5	Very low	56.3	Low	100 Å²	100	122.7 Å²	122.7	70%	0.699	61%	0.614	S	S	*	*			trans	-67.6	73.4	173.7	59.6	0	0	0	0	109.6	L85	L85-S87 PolarHBondContact O-N 3.24Å
88	T	42.3	Very low	57	Low	82 Å²	82	116.9 Å²	116.9	50%	0.503	60%	0.598	S	S	.	*			trans	-88.5	116.3	156.1	49.2	0	0	0	0	105.3	P86 R90 T91	P86-T88 PolarHBondContact O-N 2.91Å; T88-R90 PolarHBondContact O-N 3.46Å; T88-T91 PolarHBondContact O-N 3.01Å; T88-T91 PolarHBondContact O-OG1 3Å; T88-T91 WeakPolarHBondContact OG1-CG2 3.46Å
89	S	49.5	Very low	58	Low	97 Å²	97	110.9 Å²	110.9	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-46.7	-23.8	-176.2	47	0	0	0	0	115.3
90	R	46.7	Very low	59.9	Low	215 Å²	215	105.3 Å²	105.3	81%	0.811	55%	0.545	S	S	*	.	H	α-helix	trans	-69.8	-28.2	175.8	-61.6	-176.7	-157.7	-168.1	3.4	114.7	T88	T88-R90 PolarHBondContact O-N 3.46Å
91	T	51.7	Low	62.2	Low	56 Å²	56	98.7 Å²	98.7	34%	0.344	52%	0.515	S	S	.	.	H	α-helix	trans	-73.5	-36.9	179.9	48.8	0	0	0	0	111.6	T88 E93 H94 D95	T88-T91 PolarHBondContact O-N 3.01Å; T88-T91 PolarHBondContact O-OG1 3Å; T88-T91 WeakPolarHBondContact OG1-CG2 3.46Å; T91-E93 PolarHBondContact O-N 3.02Å; T91-H94 PolarHBondContact O-N 3.37Å; T91-D95 VanDerWaalsContact O-CG 3.25Å; T91-D95 PolarHBondContact O-N 2.98Å
92	Q	53.8	Low	64.6	Low	89 Å²	89	95.7 Å²	95.7	42%	0.416	50%	0.5	S	S	.	.	H	α-helix	trans	-72.1	-26.9	-176.9	-68.1	-171.2	-8.6	0	0	115.2
93	E	60.9	Low	67.2	Low	149 Å²	149	90.6 Å²	90.6	70%	0.696	47%	0.473	S	S	*	.	H	α-helix	trans	-76.2	-37.4	174	-76.2	-177.7	167.9	0	0	111.3	T91 D95 G96 L97	T91-E93 PolarHBondContact O-N 3.02Å; E93-D95 VanDerWaalsContact C-N 3.32Å; E93-D95 PolarHBondContact O-N 3.41Å; E93-G96 PolarHBondContact O-N 3.27Å; E93-L97 PolarHBondContact O-N 2.84Å
94	H	77.5	Confident	69.9	Low	116 Å²	116	80 Å²	80	54%	0.537	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-39.4	177.1	-170.2	-76.7	0	0	0	111.7	T91 G96 L97 L98	T91-H94 PolarHBondContact O-N 3.37Å; H94-G96 PolarHBondContact O-N 3.46Å; H94-L97 PolarHBondContact O-N 3.1Å; H94-L98 VanDerWaalsContact O-CB 3.23Å; H94-L98 WeakPolarHBondContact O-CB 3.44Å; H94-L98 PolarHBondContact O-N 3.26Å
95	D	86.2	Confident	72.7	Confident	78 Å²	78	79.1 Å²	79.1	42%	0.417	42%	0.421	S	S	.	.	H	α-helix	trans	-63.4	-41.6	-179.9	-65.6	-20	0	0	0	112.5	T91 E93 A99	T91-D95 VanDerWaalsContact O-CG 3.25Å; T91-D95 PolarHBondContact O-N 2.98Å; E93-D95 VanDerWaalsContact C-N 3.32Å; E93-D95 PolarHBondContact O-N 3.41Å; D95-A99 VanDerWaalsContact O-CB 3.25Å; D95-A99 WeakPolarHBondContact O-CB 3.42Å; D95-A99 PolarHBondContact O-N 3.1Å
96	G	88.7	Confident	75.5	Confident	6 Å²	6	78.6 Å²	78.6	6%	0.062	42%	0.418	C	S	.	.	H	α-helix	trans	-67.4	-42.1	177.5	0	0	0	0	0	112.5	E93 H94 A99 S100 K143	E93-G96 PolarHBondContact O-N 3.27Å; H94-G96 PolarHBondContact O-N 3.46Å; G96-A99 PolarHBondContact O-N 2.83Å; G96-S100 PolarHBondContact O-N 3.17Å; G96-K143 CarbonylContact C-O 3.6Å; G96-K143 WeakPolarHBondContact CA-O 3.46Å
97	L	91.5	Very high	78.1	Confident	87 Å²	87	74 Å²	74	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-48.9	175.3	-177.4	64.9	0	0	0	111.3	E93 H94 S100 Y101 R154	E93-L97 PolarHBondContact O-N 2.84Å; H94-L97 PolarHBondContact O-N 3.1Å; L97-S100 PolarHBondContact O-N 2.66Å; L97-Y101 HydrophobicContact CD1-CD2 4.22Å; L97-Y101 HydrophobicContact CD1-CE2 3.91Å; L97-Y101 HydrophobicContact CG-CD2 4.2Å; L97-Y101 HydrophobicContact CG-CE2 4.14Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; L97-Y101 PolarHBondContact O-N 3.26Å; L97-Y101 VanDerWaalsContact O-N 3.08Å; L97-R154 PolarHBondContact O-NH1 2.96Å
98	L	92.4	Very high	80.8	Confident	81 Å²	81	71.4 Å²	71.4	42%	0.424	37%	0.372	S	S	.	.	H	α-helix	trans	-59.7	-45.5	177.4	177.9	61.8	0	0	0	111.4	H94 S100 Y101 N102	H94-L98 VanDerWaalsContact O-CB 3.23Å; H94-L98 WeakPolarHBondContact O-CB 3.44Å; H94-L98 PolarHBondContact O-N 3.26Å; L98-S100 VanDerWaalsContact C-N 3.33Å; L98-S100 PolarHBondContact O-N 2.8Å; L98-Y101 PolarHBondContact O-N 2.95Å; L98-N102 PolarHBondContact O-N 2.75Å; L98-N102 PolarHBondContact O-ND2 3.45Å
99	A	92.4	Very high	83.3	Confident	32 Å²	32	74 Å²	74	26%	0.264	38%	0.377	S	S	.	.	H	α-helix	trans	-57.6	-45.6	176.4	0	0	0	0	0	111.4	D95 G96 Y101 N102 I103 V144	D95-A99 VanDerWaalsContact O-CB 3.25Å; D95-A99 WeakPolarHBondContact O-CB 3.42Å; D95-A99 PolarHBondContact O-N 3.1Å; G96-A99 PolarHBondContact O-N 2.83Å; A99-Y101 PolarHBondContact O-N 2.99Å; A99-N102 PolarHBondContact O-N 3.18Å; A99-I103 WeakPolarHBondContact O-CB 3.46Å; A99-I103 WeakPolarHBondContact O-CD1 3.31Å; A99-I103 WeakPolarHBondContact O-CG1 3.34Å; A99-I103 PolarHBondContact O-N 2.89Å; A99-V144 HydrophobicContact CB-CG1 4.4Å; A99-V144 HydrophobicContact CB-CG2 4.18Å
100	S	94.5	Very high	85.4	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-37.7	176.8	-91.3	0	0	0	0	113.4	G96 L97 L98 I103 S104 V144 S145 R154	G96-S100 PolarHBondContact O-N 3.17Å; L97-S100 PolarHBondContact O-N 2.66Å; L98-S100 VanDerWaalsContact C-N 3.33Å; L98-S100 PolarHBondContact O-N 2.8Å; S100-I103 PolarHBondContact O-N 2.83Å; S100-S104 WeakPolarHBondContact O-CB 3.28Å; S100-S104 PolarHBondContact O-N 2.91Å; S100-S104 PolarHBondContact O-OG 3.27Å; S100-V144 VanDerWaalsContact OG-C 3.27Å; S100-V144 WeakPolarHBondContact OG-CG1 3.41Å; S100-S145 VanDerWaalsContact OG-C 3.32Å; S100-S145 PolarHBondContact OG-N 3.36Å; S100-S145 VanDerWaalsContact OG-N 3.11Å; S100-S145 PolarHBondContact OG-O 3.48Å; S100-R154 PolarHBondContact OG-NH2 2.76Å
101	Y	96.3	Very high	87.5	Confident	62 Å²	62	65.7 Å²	65.7	24%	0.243	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-45.5	174.6	-90.6	-80.7	0	0	0	110.9	L97 L98 A99 I103 S104 L105 R154 D157 M158	L97-Y101 HydrophobicContact CD1-CD2 4.22Å; L97-Y101 HydrophobicContact CD1-CE2 3.91Å; L97-Y101 HydrophobicContact CG-CD2 4.2Å; L97-Y101 HydrophobicContact CG-CE2 4.14Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; L97-Y101 PolarHBondContact O-N 3.26Å; L97-Y101 VanDerWaalsContact O-N 3.08Å; L98-Y101 PolarHBondContact O-N 2.95Å; A99-Y101 PolarHBondContact O-N 2.99Å; Y101-I103 VanDerWaalsContact C-N 3.33Å; Y101-I103 PolarHBondContact O-N 3.07Å; Y101-S104 PolarHBondContact O-N 3.45Å; Y101-L105 PolarHBondContact O-N 3.34Å; Y101-R154 HydrophobicContact CD1-CB 3.85Å; Y101-R154 HydrophobicContact CD1-CG 4.04Å; Y101-R154 HydrophobicContact CD2-CG 4.49Å; Y101-R154 HydrophobicContact CE1-CB 3.72Å; Y101-R154 HydrophobicContact CE1-CG 3.76Å; Y101-R154 HydrophobicContact CE2-CG 4.23Å; Y101-R154 HydrophobicContact CG-CG 4.39Å; Y101-R154 VanDerWaalsContact N-NH1 3.14Å; Y101-D157 HydrophobicContact CE1-CB 4.13Å; Y101-D157 PolarHBondContact OH-OD2 3.31Å; Y101-M158 HydrophobicContact CD1-CE 4.4Å; Y101-M158 HydrophobicContact CD1-CG 3.8Å; Y101-M158 HydrophobicContact CD1-SD 3.93Å; Y101-M158 HydrophobicContact CE1-CG 4.12Å
102	N	96.3	Very high	89.4	Confident	86 Å²	86	68.9 Å²	68.9	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-41.3	177.4	-70.7	-22.2	0	0	0	112	L98 A99 L105 L106	L98-N102 PolarHBondContact O-N 2.75Å; L98-N102 PolarHBondContact O-ND2 3.45Å; A99-N102 PolarHBondContact O-N 3.18Å; N102-L105 PolarHBondContact O-N 3.36Å; N102-L106 WeakPolarHBondContact O-CG 3.38Å; N102-L106 PolarHBondContact O-N 2.98Å; N102-L106 VanDerWaalsContact O-N 3.11Å
103	I	95.7	Very high	91.3	Very high	33 Å²	33	67.9 Å²	67.9	17%	0.169	38%	0.379	C	S	.	.	H	α-helix	trans	-68.3	-43.6	176.6	-66.4	165.1	0	0	0	110.8	A99 S100 Y101 L105 L106 I107 L121 I125 V144 L146	A99-I103 WeakPolarHBondContact O-CB 3.46Å; A99-I103 WeakPolarHBondContact O-CD1 3.31Å; A99-I103 WeakPolarHBondContact O-CG1 3.34Å; A99-I103 PolarHBondContact O-N 2.89Å; S100-I103 PolarHBondContact O-N 2.83Å; Y101-I103 VanDerWaalsContact C-N 3.33Å; Y101-I103 PolarHBondContact O-N 3.07Å; I103-L105 VanDerWaalsContact C-N 3.27Å; I103-L105 PolarHBondContact O-N 3.44Å; I103-L106 WeakPolarHBondContact O-CA 3.23Å; I103-L106 WeakPolarHBondContact O-CB 3.29Å; I103-L106 PolarHBondContact O-N 3.44Å; I103-I107 HydrophobicContact CG2-CD1 4.16Å; I103-I107 HydrophobicContact CG2-CG1 4.46Å; I103-I107 WeakPolarHBondContact O-CG1 3.44Å; I103-I107 PolarHBondContact O-N 3.33Å; I103-L121 HydrophobicContact CG2-CD1 3.64Å; I103-I125 HydrophobicContact CD1-CD1 4.22Å; I103-V144 HydrophobicContact CD1-CG1 3.89Å; I103-L146 HydrophobicContact CB-CD2 3.88Å; I103-L146 HydrophobicContact CD1-CD1 4.01Å; I103-L146 HydrophobicContact CD1-CD2 4.42Å; I103-L146 HydrophobicContact CG2-CD1 3.89Å; I103-L146 HydrophobicContact CG2-CD2 3.63Å; I103-L146 HydrophobicContact CG2-CG 4.43Å
104	S	96.8	Very high	92.9	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-57.4	-40.3	174.4	-66.1	0	0	0	0	112	S100 Y101 L106 I107 A108 R154	S100-S104 WeakPolarHBondContact O-CB 3.28Å; S100-S104 PolarHBondContact O-N 2.91Å; S100-S104 PolarHBondContact O-OG 3.27Å; Y101-S104 PolarHBondContact O-N 3.45Å; S104-L106 VanDerWaalsContact C-N 3.34Å; S104-L106 PolarHBondContact O-N 2.91Å; S104-I107 PolarHBondContact O-N 3.23Å; S104-A108 PolarHBondContact O-N 3.43Å; S104-R154 WeakPolarHBondContact OG-CD 3.45Å
105	L	96.8	Very high	93.7	Very high	66 Å²	66	59.9 Å²	59.9	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-39.3	174.1	-179	62.1	0	0	0	112.2	Y101 N102 I103 A108 K109 M158	Y101-L105 PolarHBondContact O-N 3.34Å; N102-L105 PolarHBondContact O-N 3.36Å; I103-L105 VanDerWaalsContact C-N 3.27Å; I103-L105 PolarHBondContact O-N 3.44Å; L105-A108 PolarHBondContact O-N 3.04Å; L105-K109 HydrophobicContact CD1-CD 4.49Å; L105-K109 HydrophobicContact CD1-CG 4.48Å; L105-K109 HydrophobicContact CG-CD 4.32Å; L105-K109 WeakPolarHBondContact O-CB 3.49Å; L105-K109 WeakPolarHBondContact O-CG 3.48Å; L105-K109 PolarHBondContact O-N 3.31Å; L105-M158 HydrophobicContact CB-CE 3.99Å; L105-M158 HydrophobicContact CB-SD 4.09Å; L105-M158 HydrophobicContact CD1-SD 4.48Å
106	L	96.9	Very high	94.1	Very high	115 Å²	115	58 Å²	58	60%	0.602	33%	0.334	S	S	*	.	H	α-helix	trans	-65.6	-41.1	175	-68.5	171.6	0	0	0	111.8	N102 I103 S104 K109 S110	N102-L106 WeakPolarHBondContact O-CG 3.38Å; N102-L106 PolarHBondContact O-N 2.98Å; N102-L106 VanDerWaalsContact O-N 3.11Å; I103-L106 WeakPolarHBondContact O-CA 3.23Å; I103-L106 WeakPolarHBondContact O-CB 3.29Å; I103-L106 PolarHBondContact O-N 3.44Å; S104-L106 VanDerWaalsContact C-N 3.34Å; S104-L106 PolarHBondContact O-N 2.91Å; L106-K109 PolarHBondContact O-N 3.24Å; L106-S110 WeakPolarHBondContact O-CB 3.2Å; L106-S110 PolarHBondContact O-N 3.35Å; L106-S110 VanDerWaalsContact O-N 3.08Å; L106-S110 PolarHBondContact O-OG 3.28Å
107	I	95.7	Very high	94.3	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-51.1	175.1	-65.4	169.2	0	0	0	109.6	I103 S104 K109 S110 G111 I116 L121 V151	I103-I107 HydrophobicContact CG2-CD1 4.16Å; I103-I107 HydrophobicContact CG2-CG1 4.46Å; I103-I107 WeakPolarHBondContact O-CG1 3.44Å; I103-I107 PolarHBondContact O-N 3.33Å; S104-I107 PolarHBondContact O-N 3.23Å; I107-K109 PolarHBondContact O-N 3Å; I107-S110 PolarHBondContact O-N 3.46Å; I107-S110 VanDerWaalsContact O-N 3.08Å; I107-S110 PolarHBondContact O-OG 2.88Å; I107-G111 PolarHBondContact O-N 3.21Å; I107-I116 HydrophobicContact CB-CG2 4.49Å; I107-I116 HydrophobicContact CD1-CG2 3.95Å; I107-I116 HydrophobicContact CG1-CG2 3.84Å; I107-I116 HydrophobicContact CG2-CG2 3.88Å; I107-L121 HydrophobicContact CD1-CD1 3.91Å; I107-L121 HydrophobicContact CG1-CD1 3.96Å; I107-V151 HydrophobicContact CB-CG1 4.46Å; I107-V151 HydrophobicContact CD1-CG1 3.92Å; I107-V151 HydrophobicContact CD1-CG2 3.97Å; I107-V151 HydrophobicContact CG2-CG1 4.25Å
108	A	94.2	Very high	94.4	Very high	44 Å²	44	57.6 Å²	57.6	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-48.5	178.4	0	0	0	0	0	112.3	S104 L105 S110 G111 I155	S104-A108 PolarHBondContact O-N 3.43Å; L105-A108 PolarHBondContact O-N 3.04Å; A108-S110 PolarHBondContact O-N 3.4Å; A108-G111 PolarHBondContact O-N 3.3Å; A108-I155 HydrophobicContact CB-CD1 3.87Å; A108-I155 HydrophobicContact CB-CG1 4.06Å; A108-I155 HydrophobicContact CB-CG2 4.44Å
109	K	94.1	Very high	94.5	Very high	137 Å²	137	60.3 Å²	60.3	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-60.9	-26.4	177.7	-77.1	179.2	176.3	179.6	0	113.6	L105 L106 I107	L105-K109 HydrophobicContact CD1-CD 4.49Å; L105-K109 HydrophobicContact CD1-CG 4.48Å; L105-K109 HydrophobicContact CG-CD 4.32Å; L105-K109 WeakPolarHBondContact O-CB 3.49Å; L105-K109 WeakPolarHBondContact O-CG 3.48Å; L105-K109 PolarHBondContact O-N 3.31Å; L106-K109 PolarHBondContact O-N 3.24Å; I107-K109 PolarHBondContact O-N 3Å
110	S	94.1	Very high	94.6	Very high	66 Å²	66	63.1 Å²	63.1	46%	0.462	35%	0.349	S	S	.	.	H	α-helix	trans	-85.7	-9.8	178.4	73.7	0	0	0	0	114.1	L106 I107 A108 K112	L106-S110 WeakPolarHBondContact O-CB 3.2Å; L106-S110 PolarHBondContact O-N 3.35Å; L106-S110 VanDerWaalsContact O-N 3.08Å; L106-S110 PolarHBondContact O-OG 3.28Å; I107-S110 PolarHBondContact O-N 3.46Å; I107-S110 VanDerWaalsContact O-N 3.08Å; I107-S110 PolarHBondContact O-OG 2.88Å; A108-S110 PolarHBondContact O-N 3.4Å; S110-K112 PolarHBondContact O-N 3.1Å; S110-K112 WeakPolarHBondContact OG-CG 3.4Å
111	G	90.4	Very high	94.6	Very high	71 Å²	71	65.5 Å²	65.5	73%	0.732	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	25.2	-176.7	0	0	0	0	0	113.8	I107 A108	I107-G111 PolarHBondContact O-N 3.21Å; A108-G111 PolarHBondContact O-N 3.3Å
112	K	91.2	Very high	94.5	Very high	124 Å²	124	64.6 Å²	64.6	54%	0.539	36%	0.36	S	S	.	.			trans	-88.8	156.5	-179.9	-64.6	-65.6	-179.3	-177.4	0	111.2	S110 I116	S110-K112 PolarHBondContact O-N 3.1Å; S110-K112 WeakPolarHBondContact OG-CG 3.4Å; K112-I116 HydrophobicContact CB-CD1 4.08Å; K112-I116 HydrophobicContact CB-CG2 4.3Å; K112-I116 HydrophobicContact CG-CD1 4.09Å
113	A	94.3	Very high	94.3	Very high	68 Å²	68	63.5 Å²	63.5	56%	0.562	36%	0.358	S	S	*	.			trans	-57.5	140.6	171.5	0	0	0	0	0	110.5	T115 I116	A113-T115 PolarHBondContact O-N 3.17Å; A113-I116 WeakPolarHBondContact O-CB 3.43Å; A113-I116 WeakPolarHBondContact O-CG2 3.33Å; A113-I116 PolarHBondContact O-N 3.11Å; A113-I116 VanDerWaalsContact O-N 3.1Å
114	H	94.4	Very high	94.3	Very high	57 Å²	57	65.4 Å²	65.4	26%	0.264	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.2	-177.2	-60	167.2	0	0	0	112.7	I116 G117 N148 V151	H114-I116 PolarHBondContact O-N 2.81Å; H114-I116 VanDerWaalsContact O-N 3.1Å; H114-G117 PolarHBondContact O-N 3.3Å; H114-G117 VanDerWaalsContact O-N 3.16Å; H114-N148 WeakPolarHBondContact CB-OD1 3.45Å; H114-V151 HydrophobicContact CB-CB 4.17Å; H114-V151 HydrophobicContact CB-CG1 3.9Å
115	T	95.3	Very high	94	Very high	39 Å²	39	67.5 Å²	67.5	24%	0.239	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17	174.7	64.3	0	0	0	0	113.5	A113 G117 E118 E119 N148	A113-T115 PolarHBondContact O-N 3.17Å; T115-G117 PolarHBondContact O-N 3.16Å; T115-G117 VanDerWaalsContact O-N 3.08Å; T115-E118 VanDerWaalsContact O-CG 3.22Å; T115-E118 WeakPolarHBondContact O-CG 3.5Å; T115-E118 PolarHBondContact O-N 2.88Å; T115-E118 VanDerWaalsContact O-N 3.1Å; T115-E119 WeakPolarHBondContact CB-OE1 3.22Å; T115-E119 WeakPolarHBondContact O-CB 3.37Å; T115-E119 WeakPolarHBondContact O-CG 3.38Å; T115-E119 PolarHBondContact O-N 3.47Å; T115-E119 PolarHBondContact OG1-OE1 2.88Å; T115-N148 HydrophobicContact CG2-CB 4.24Å
116	I	95.1	Very high	93.8	Very high	39 Å²	39	66 Å²	66	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-57.5	-27.1	174.3	-160	170.6	0	0	0	112.6	I107 K112 A113 H114 L120 L121	I107-I116 HydrophobicContact CB-CG2 4.49Å; I107-I116 HydrophobicContact CD1-CG2 3.95Å; I107-I116 HydrophobicContact CG1-CG2 3.84Å; I107-I116 HydrophobicContact CG2-CG2 3.88Å; K112-I116 HydrophobicContact CB-CD1 4.08Å; K112-I116 HydrophobicContact CB-CG2 4.3Å; K112-I116 HydrophobicContact CG-CD1 4.09Å; A113-I116 WeakPolarHBondContact O-CB 3.43Å; A113-I116 WeakPolarHBondContact O-CG2 3.33Å; A113-I116 PolarHBondContact O-N 3.11Å; A113-I116 VanDerWaalsContact O-N 3.1Å; H114-I116 PolarHBondContact O-N 2.81Å; H114-I116 VanDerWaalsContact O-N 3.1Å; I116-L120 HydrophobicContact CD1-CD2 4.32Å; I116-L120 HydrophobicContact CG1-CB 4.03Å; I116-L120 HydrophobicContact CG1-CD2 4.2Å; I116-L120 PolarHBondContact O-N 3.38Å; I116-L120 VanDerWaalsContact O-N 3.09Å; I116-L121 PolarHBondContact O-N 2.95Å
117	G	92.4	Very high	93.7	Very high	0 Å²	0	66 Å²	66	0%	0	37%	0.373	C	S	.	.	I	π-helix	trans	-56.6	-50.3	175	0	0	0	0	0	112	H114 T115 L121 I122 L146	H114-G117 PolarHBondContact O-N 3.3Å; H114-G117 VanDerWaalsContact O-N 3.16Å; T115-G117 PolarHBondContact O-N 3.16Å; T115-G117 VanDerWaalsContact O-N 3.08Å; G117-L121 PolarHBondContact O-N 2.85Å; G117-I122 WeakPolarHBondContact O-CG1 3.25Å; G117-I122 PolarHBondContact O-N 3.45Å; G117-L146 CarbonylContact C-O 3.58Å
118	E	93.1	Very high	93.6	Very high	84 Å²	84	69 Å²	69	39%	0.393	39%	0.392	S	S	.	.	I	π-helix	trans	-85.2	-39.4	-179.9	60.1	-166.9	152.1	0	0	113.4	T115 P123 L146	T115-E118 VanDerWaalsContact O-CG 3.22Å; T115-E118 WeakPolarHBondContact O-CG 3.5Å; T115-E118 PolarHBondContact O-N 2.88Å; T115-E118 VanDerWaalsContact O-N 3.1Å; E118-P123 WeakPolarHBondContact O-CD 3.23Å; E118-L146 PolarHBondContact N-O 3.44Å
119	E	94.2	Very high	93.4	Very high	138 Å²	138	67.9 Å²	67.9	65%	0.645	38%	0.379	S	S	*	.	I	π-helix	trans	-71.3	-31.6	-175.4	-70	174.6	-164.6	0	0	113.2	T115	T115-E119 WeakPolarHBondContact CB-OE1 3.22Å; T115-E119 WeakPolarHBondContact O-CB 3.37Å; T115-E119 WeakPolarHBondContact O-CG 3.38Å; T115-E119 PolarHBondContact O-N 3.47Å; T115-E119 PolarHBondContact OG1-OE1 2.88Å
120	L	94.9	Very high	93.3	Very high	92 Å²	92	64.7 Å²	64.7	48%	0.482	37%	0.369	S	S	.	.	I	π-helix	trans	-131.8	-49.3	-172.2	-176.1	62.6	0	0	0	113.6	I116 P123 V124	I116-L120 HydrophobicContact CD1-CD2 4.32Å; I116-L120 HydrophobicContact CG1-CB 4.03Å; I116-L120 HydrophobicContact CG1-CD2 4.2Å; I116-L120 PolarHBondContact O-N 3.38Å; I116-L120 VanDerWaalsContact O-N 3.09Å; L120-P123 WeakPolarHBondContact O-CD 3.31Å; L120-V124 HydrophobicContact CD1-CG2 4.12Å; L120-V124 HydrophobicContact CG-CG2 4.4Å; L120-V124 WeakPolarHBondContact O-CB 3.24Å; L120-V124 VanDerWaalsContact O-CG2 3.24Å; L120-V124 WeakPolarHBondContact O-CG2 3.35Å; L120-V124 PolarHBondContact O-N 2.7Å
121	L	94.6	Very high	93.2	Very high	49 Å²	49	65.3 Å²	65.3	26%	0.257	37%	0.37	S	S	.	.	I	π-helix	trans	-70.1	-42.6	-170.6	-61.1	-179.1	0	0	0	112.5	I103 I107 I116 G117 V124 I125 L146	I103-L121 HydrophobicContact CG2-CD1 3.64Å; I107-L121 HydrophobicContact CD1-CD1 3.91Å; I107-L121 HydrophobicContact CG1-CD1 3.96Å; I116-L121 PolarHBondContact O-N 2.95Å; G117-L121 PolarHBondContact O-N 2.85Å; L121-V124 PolarHBondContact O-N 3.04Å; L121-I125 WeakPolarHBondContact O-CB 3.45Å; L121-I125 WeakPolarHBondContact O-CD1 3.36Å; L121-I125 WeakPolarHBondContact O-CG1 3.21Å; L121-I125 PolarHBondContact O-N 3.08Å; L121-L146 HydrophobicContact CB-CD1 4.32Å
122	I	93.1	Very high	93.2	Very high	43 Å²	43	66.8 Å²	66.8	22%	0.221	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-50.6	174.7	-73.7	176	0	0	0	111.6	G117 V124 I125 S126 I141 L146	G117-I122 WeakPolarHBondContact O-CG1 3.25Å; G117-I122 PolarHBondContact O-N 3.45Å; I122-V124 VanDerWaalsContact C-N 3.34Å; I122-V124 PolarHBondContact O-N 3.42Å; I122-I125 PolarHBondContact O-N 3.09Å; I122-S126 WeakPolarHBondContact O-CB 3.49Å; I122-S126 PolarHBondContact O-N 3.46Å; I122-I141 HydrophobicContact CG2-CD1 4.36Å; I122-I141 HydrophobicContact CG2-CG2 3.79Å; I122-L146 HydrophobicContact CD1-CB 4.16Å; I122-L146 HydrophobicContact CG1-CB 4.22Å; I122-L146 HydrophobicContact CG1-CD1 4.23Å
123	P	93.6	Very high	93	Very high	64 Å²	64	65.9 Å²	65.9	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-54.6	-44.9	173.6	-29.2	33.7	0	0	0	113.9	E118 L120 S126 E127	E118-P123 WeakPolarHBondContact O-CD 3.23Å; L120-P123 WeakPolarHBondContact O-CD 3.31Å; P123-S126 WeakPolarHBondContact O-CB 3.49Å; P123-S126 PolarHBondContact O-N 3Å; P123-E127 PolarHBondContact O-N 3.1Å
124	V	94.3	Very high	92.7	Very high	72 Å²	72	69.9 Å²	69.9	44%	0.436	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-45	178.3	168.6	0	0	0	0	111.4	L120 L121 I122 S126 E127 V128	L120-V124 HydrophobicContact CD1-CG2 4.12Å; L120-V124 HydrophobicContact CG-CG2 4.4Å; L120-V124 WeakPolarHBondContact O-CB 3.24Å; L120-V124 VanDerWaalsContact O-CG2 3.24Å; L120-V124 WeakPolarHBondContact O-CG2 3.35Å; L120-V124 PolarHBondContact O-N 2.7Å; L121-V124 PolarHBondContact O-N 3.04Å; I122-V124 VanDerWaalsContact C-N 3.34Å; I122-V124 PolarHBondContact O-N 3.42Å; V124-S126 VanDerWaalsContact C-N 3.29Å; V124-S126 PolarHBondContact O-N 3.27Å; V124-E127 PolarHBondContact O-N 3.44Å; V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.08Å; V124-V128 VanDerWaalsContact O-N 3.07Å
125	I	92.3	Very high	92.2	Very high	45 Å²	45	70.1 Å²	70.1	23%	0.231	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-41.9	176.6	-69.5	163.6	0	0	0	110.2	I103 L121 I122 V128 L129 I141 L146	I103-I125 HydrophobicContact CD1-CD1 4.22Å; L121-I125 WeakPolarHBondContact O-CB 3.45Å; L121-I125 WeakPolarHBondContact O-CD1 3.36Å; L121-I125 WeakPolarHBondContact O-CG1 3.21Å; L121-I125 PolarHBondContact O-N 3.08Å; I122-I125 PolarHBondContact O-N 3.09Å; I125-V128 PolarHBondContact O-N 3.16Å; I125-L129 HydrophobicContact CG2-CD1 3.59Å; I125-L129 HydrophobicContact CG2-CG 4.26Å; I125-L129 WeakPolarHBondContact O-CB 3.47Å; I125-L129 WeakPolarHBondContact O-CD1 3.49Å; I125-L129 WeakPolarHBondContact O-CG 3.45Å; I125-L129 PolarHBondContact O-N 2.91Å; I125-I141 HydrophobicContact CG2-CG1 4.47Å; I125-L146 HydrophobicContact CD1-CD1 4.15Å
126	S	92.6	Very high	91.7	Very high	35 Å²	35	72.5 Å²	72.5	25%	0.245	39%	0.393	C	S	.	.	H	α-helix	trans	-58.3	-48.6	176.6	-164	0	0	0	0	112.1	I122 P123 V124 L129 N130	I122-S126 WeakPolarHBondContact O-CB 3.49Å; I122-S126 PolarHBondContact O-N 3.46Å; P123-S126 WeakPolarHBondContact O-CB 3.49Å; P123-S126 PolarHBondContact O-N 3Å; V124-S126 VanDerWaalsContact C-N 3.29Å; V124-S126 PolarHBondContact O-N 3.27Å; S126-L129 PolarHBondContact O-N 2.88Å; S126-N130 WeakPolarHBondContact O-CB 3.32Å; S126-N130 VanDerWaalsContact O-CG 3.26Å; S126-N130 PolarHBondContact O-N 3.1Å; S126-N130 PolarHBondContact O-ND2 2.95Å; S126-N130 PolarHBondContact OG-ND2 3.31Å
127	E	94.7	Very high	91.1	Very high	114 Å²	114	70.9 Å²	70.9	53%	0.533	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-46.2	-179.6	-175.5	55.5	-143.3	0	0	111.6	P123 V124 L129 N130 T131	P123-E127 PolarHBondContact O-N 3.1Å; V124-E127 PolarHBondContact O-N 3.44Å; E127-L129 PolarHBondContact O-N 3.1Å; E127-N130 PolarHBondContact O-N 3.23Å; E127-T131 VanDerWaalsContact O-CB 3.23Å; E127-T131 WeakPolarHBondContact O-CB 3.21Å; E127-T131 PolarHBondContact O-N 3.42Å; E127-T131 PolarHBondContact O-OG1 2.87Å; E127-T131 PolarHBondContact OE1-OG1 3.01Å
128	V	92.4	Very high	90.7	Very high	69 Å²	69	74.4 Å²	74.4	42%	0.418	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-43	178.2	173.9	0	0	0	0	111.6	V124 I125 V132 L133	V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.08Å; V124-V128 VanDerWaalsContact O-N 3.07Å; I125-V128 PolarHBondContact O-N 3.16Å; V128-V132 HydrophobicContact CG1-CB 4.38Å; V128-V132 HydrophobicContact CG1-CG2 4.4Å; V128-V132 WeakPolarHBondContact O-CA 3.17Å; V128-V132 VanDerWaalsContact O-CB 3.29Å; V128-V132 WeakPolarHBondContact O-CB 3.35Å; V128-V132 PolarHBondContact O-N 3.22Å; V128-L133 PolarHBondContact O-N 3.07Å
129	L	90.7	Very high	90.1	Very high	19 Å²	19	75.8 Å²	75.8	10%	0.099	43%	0.425	C	S	.	.	H	α-helix	trans	-65.1	-43.9	-179.5	-73.3	167.8	0	0	0	112.3	I125 S126 E127 L133 H134 V135 A137 V140	I125-L129 HydrophobicContact CG2-CD1 3.59Å; I125-L129 HydrophobicContact CG2-CG 4.26Å; I125-L129 WeakPolarHBondContact O-CB 3.47Å; I125-L129 WeakPolarHBondContact O-CD1 3.49Å; I125-L129 WeakPolarHBondContact O-CG 3.45Å; I125-L129 PolarHBondContact O-N 2.91Å; S126-L129 PolarHBondContact O-N 2.88Å; E127-L129 PolarHBondContact O-N 3.1Å; L129-L133 HydrophobicContact CD2-CD1 3.94Å; L129-L133 CarbonylContact O-C 3.55Å; L129-L133 PolarHBondContact O-N 2.95Å; L129-H134 PolarHBondContact O-N 3.42Å; L129-V135 CarbonylContact C-O 3.58Å; L129-V135 PolarHBondContact O-N 3.34Å; L129-A137 HydrophobicContact CB-CB 3.97Å; L129-A137 HydrophobicContact CD1-CB 4.02Å; L129-V140 HydrophobicContact CD1-CB 3.64Å; L129-V140 HydrophobicContact CD1-CG1 3.69Å; L129-V140 HydrophobicContact CD1-CG2 4.16Å; L129-V140 HydrophobicContact CD2-CG1 4.31Å; L129-V140 HydrophobicContact CD2-CG2 4.26Å
130	N	92.1	Very high	89.5	Confident	71 Å²	71	71.5 Å²	71.5	38%	0.38	41%	0.408	S	S	.	.	H	α-helix	trans	-73.4	-43.8	-178.4	-66	-37	0	0	0	111.7	S126 E127 H134 V135 A137	S126-N130 WeakPolarHBondContact O-CB 3.32Å; S126-N130 VanDerWaalsContact O-CG 3.26Å; S126-N130 PolarHBondContact O-N 3.1Å; S126-N130 PolarHBondContact O-ND2 2.95Å; S126-N130 PolarHBondContact OG-ND2 3.31Å; E127-N130 PolarHBondContact O-N 3.23Å; N130-H134 WeakPolarHBondContact O-CA 3.37Å; N130-H134 PolarHBondContact O-ND1 3.4Å; N130-V135 PolarHBondContact OD1-O 2.96Å; N130-A137 WeakPolarHBondContact OD1-CB 3.34Å; N130-A137 PolarHBondContact OD1-N 3.27Å
131	T	90.8	Very high	89.1	Confident	78 Å²	78	69.1 Å²	69.1	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-89.8	-38.8	-169.4	-57.9	0	0	0	0	113.1	E127 H134	E127-T131 VanDerWaalsContact O-CB 3.23Å; E127-T131 WeakPolarHBondContact O-CB 3.21Å; E127-T131 PolarHBondContact O-N 3.42Å; E127-T131 PolarHBondContact O-OG1 2.87Å; E127-T131 PolarHBondContact OE1-OG1 3.01Å; T131-H134 PolarHBondContact O-CE1 2.88Å
132	V	90.6	Very high	88.6	Confident	102 Å²	102	75.3 Å²	75.3	62%	0.618	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-45.8	-176.7	-176.6	0	0	0	0	111.7	V128	V128-V132 HydrophobicContact CG1-CB 4.38Å; V128-V132 HydrophobicContact CG1-CG2 4.4Å; V128-V132 WeakPolarHBondContact O-CA 3.17Å; V128-V132 VanDerWaalsContact O-CB 3.29Å; V128-V132 WeakPolarHBondContact O-CB 3.35Å; V128-V132 PolarHBondContact O-N 3.22Å
133	L	88.3	Confident	88.2	Confident	106 Å²	106	77.5 Å²	77.5	56%	0.555	43%	0.428	S	S	*	.	S	Bend	trans	-94	-13	-174.7	-63.9	176.3	0	0	0	113.2	V128 L129 V135	V128-L133 PolarHBondContact O-N 3.07Å; L129-L133 HydrophobicContact CD2-CD1 3.94Å; L129-L133 CarbonylContact O-C 3.55Å; L129-L133 PolarHBondContact O-N 2.95Å; L133-V135 HydrophobicContact CB-CG2 4.08Å; L133-V135 WeakPolarHBondContact O-CG2 3.49Å; L133-V135 PolarHBondContact O-N 3.42Å
134	H	86.9	Confident	88	Confident	151 Å²	151	75.1 Å²	75.1	70%	0.699	41%	0.413	S	S	*	.			trans	50.5	36.4	-175.2	-54.4	-55.2	0	0	0	112.9	L129 N130 T131	L129-H134 PolarHBondContact O-N 3.42Å; N130-H134 WeakPolarHBondContact O-CA 3.37Å; N130-H134 PolarHBondContact O-ND1 3.4Å; T131-H134 PolarHBondContact O-CE1 2.88Å
135	V	85.1	Confident	87.8	Confident	63 Å²	63	74.3 Å²	74.3	38%	0.382	41%	0.41	S	S	.	.			trans	-106.5	134.8	176.9	-179.9	0	0	0	0	108.3	L129 N130 L133 A137 V140	L129-V135 CarbonylContact C-O 3.58Å; L129-V135 PolarHBondContact O-N 3.34Å; N130-V135 PolarHBondContact OD1-O 2.96Å; L133-V135 HydrophobicContact CB-CG2 4.08Å; L133-V135 WeakPolarHBondContact O-CG2 3.49Å; L133-V135 PolarHBondContact O-N 3.42Å; V135-A137 PolarHBondContact O-N 2.91Å; V135-V140 HydrophobicContact CG1-CG2 4.39Å
136	P	84.3	Confident	87.9	Confident	88 Å²	88	72.2 Å²	72.2	57%	0.571	40%	0.399	S	S	*	.			trans	-54.3	114.4	172.8	-24.8	33.8	0	0	0	111.1	A138	P136-A138 PolarHBondContact O-N 3.49Å
137	A	83	Confident	87.9	Confident	5 Å²	5	72.6 Å²	72.6	4%	0.041	40%	0.402	C	S	.	.	H	α-helix	trans	-65.5	-27.3	-174.1	0	0	0	0	0	113.7	L129 N130 V135 D139 V140 I141	L129-A137 HydrophobicContact CB-CB 3.97Å; L129-A137 HydrophobicContact CD1-CB 4.02Å; N130-A137 WeakPolarHBondContact OD1-CB 3.34Å; N130-A137 PolarHBondContact OD1-N 3.27Å; V135-A137 PolarHBondContact O-N 2.91Å; A137-D139 VanDerWaalsContact C-N 3.33Å; A137-D139 PolarHBondContact O-N 3.21Å; A137-V140 PolarHBondContact O-N 2.98Å; A137-V140 VanDerWaalsContact O-N 3.1Å; A137-I141 HydrophobicContact CB-CD1 3.69Å; A137-I141 HydrophobicContact CB-CG1 4.34Å; A137-I141 WeakPolarHBondContact O-CB 3.2Å; A137-I141 VanDerWaalsContact O-CG1 3.28Å; A137-I141 WeakPolarHBondContact O-CG1 3.45Å; A137-I141 PolarHBondContact O-N 3.01Å
138	A	84	Confident	87.9	Confident	74 Å²	74	69.5 Å²	69.5	61%	0.612	39%	0.389	S	S	*	.	H	α-helix	trans	-54.8	-43.6	-175.1	0	0	0	0	0	113.4	P136 V140 K142	P136-A138 PolarHBondContact O-N 3.49Å; A138-V140 VanDerWaalsContact C-N 3.33Å; A138-V140 PolarHBondContact O-N 2.86Å; A138-K142 VanDerWaalsContact O-CB 3.31Å; A138-K142 WeakPolarHBondContact O-CB 3.36Å; A138-K142 PolarHBondContact O-N 2.88Å; A138-K142 VanDerWaalsContact O-N 3.1Å
139	D	80.1	Confident	88.1	Confident	113 Å²	113	71.5 Å²	71.5	60%	0.604	40%	0.397	S	S	*	.	H	α-helix	trans	-70.8	-29.6	-178.2	-71.4	-27.4	0	0	0	112.6	A137 K143	A137-D139 VanDerWaalsContact C-N 3.33Å; A137-D139 PolarHBondContact O-N 3.21Å; D139-K143 WeakPolarHBondContact O-CD 3.44Å; D139-K143 WeakPolarHBondContact O-CG 3.4Å
140	V	82.1	Confident	88.2	Confident	49 Å²	49	71.6 Å²	71.6	30%	0.297	40%	0.399	S	S	.	.	H	α-helix	trans	-83.7	-46.4	179.6	-178.3	0	0	0	0	110.4	L129 V135 A137 A138 K142 K143 V144	L129-V140 HydrophobicContact CD1-CB 3.64Å; L129-V140 HydrophobicContact CD1-CG1 3.69Å; L129-V140 HydrophobicContact CD1-CG2 4.16Å; L129-V140 HydrophobicContact CD2-CG1 4.31Å; L129-V140 HydrophobicContact CD2-CG2 4.26Å; V135-V140 HydrophobicContact CG1-CG2 4.39Å; A137-V140 PolarHBondContact O-N 2.98Å; A137-V140 VanDerWaalsContact O-N 3.1Å; A138-V140 VanDerWaalsContact C-N 3.33Å; A138-V140 PolarHBondContact O-N 2.86Å; V140-K142 VanDerWaalsContact C-N 3.28Å; V140-K142 PolarHBondContact O-N 2.92Å; V140-K143 WeakPolarHBondContact O-CB 3.13Å; V140-K143 PolarHBondContact O-N 3.35Å; V140-V144 PolarHBondContact O-N 2.78Å
141	I	85.2	Confident	88.4	Confident	41 Å²	41	68.2 Å²	68.2	21%	0.21	38%	0.381	C	S	.	.	H	α-helix	trans	-59.3	-41.3	178.7	-68.7	168.9	0	0	0	110.5	I122 I125 A137 K143 V144	I122-I141 HydrophobicContact CG2-CD1 4.36Å; I122-I141 HydrophobicContact CG2-CG2 3.79Å; I125-I141 HydrophobicContact CG2-CG1 4.47Å; A137-I141 HydrophobicContact CB-CD1 3.69Å; A137-I141 HydrophobicContact CB-CG1 4.34Å; A137-I141 WeakPolarHBondContact O-CB 3.2Å; A137-I141 VanDerWaalsContact O-CG1 3.28Å; A137-I141 WeakPolarHBondContact O-CG1 3.45Å; A137-I141 PolarHBondContact O-N 3.01Å; I141-K143 PolarHBondContact O-N 2.99Å; I141-V144 CarbonylContact O-C 3.49Å; I141-V144 PolarHBondContact O-N 3Å; I141-V144 VanDerWaalsContact O-N 3.1Å
142	K	84.2	Confident	88.7	Confident	179 Å²	179	68.6 Å²	68.6	78%	0.778	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.6	176.9	-172.2	174.7	178.8	179.7	0	112.9	A138 V140	A138-K142 VanDerWaalsContact O-CB 3.31Å; A138-K142 WeakPolarHBondContact O-CB 3.36Å; A138-K142 PolarHBondContact O-N 2.88Å; A138-K142 VanDerWaalsContact O-N 3.1Å; V140-K142 VanDerWaalsContact C-N 3.28Å; V140-K142 PolarHBondContact O-N 2.92Å
143	K	84.8	Confident	89	Confident	90 Å²	90	70.4 Å²	70.4	39%	0.391	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-21.9	178.8	-66.1	174.6	-178.3	-176	0	113.3	G96 D139 V140 I141	G96-K143 CarbonylContact C-O 3.6Å; G96-K143 WeakPolarHBondContact CA-O 3.46Å; D139-K143 WeakPolarHBondContact O-CD 3.44Å; D139-K143 WeakPolarHBondContact O-CG 3.4Å; V140-K143 WeakPolarHBondContact O-CB 3.13Å; V140-K143 PolarHBondContact O-N 3.35Å; I141-K143 PolarHBondContact O-N 2.99Å
144	V	89.4	Confident	89.4	Confident	14 Å²	14	65.9 Å²	65.9	9%	0.085	35%	0.348	C	S	.	.	S	Bend	trans	-108.4	78.1	-178.8	-172.3	0	0	0	0	108.7	A99 S100 I103 V140 I141 L146	A99-V144 HydrophobicContact CB-CG1 4.4Å; A99-V144 HydrophobicContact CB-CG2 4.18Å; S100-V144 VanDerWaalsContact OG-C 3.27Å; S100-V144 WeakPolarHBondContact OG-CG1 3.41Å; I103-V144 HydrophobicContact CD1-CG1 3.89Å; V140-V144 PolarHBondContact O-N 2.78Å; I141-V144 CarbonylContact O-C 3.49Å; I141-V144 PolarHBondContact O-N 3Å; I141-V144 VanDerWaalsContact O-N 3.1Å; V144-L146 HydrophobicContact CG1-CD1 4.06Å; V144-L146 HydrophobicContact CG1-CD2 4.39Å; V144-L146 HydrophobicContact CG1-CG 4.03Å; V144-L146 PolarHBondContact O-N 3.19Å
145	S	90.2	Very high	89.8	Confident	55 Å²	55	60.1 Å²	60.1	39%	0.385	32%	0.322	S	S	.	.			trans	-72	115.9	179.5	-50.5	0	0	0	0	111.1	S100 T150	S100-S145 VanDerWaalsContact OG-C 3.32Å; S100-S145 PolarHBondContact OG-N 3.36Å; S100-S145 VanDerWaalsContact OG-N 3.11Å; S100-S145 PolarHBondContact OG-O 3.48Å; S145-T150 WeakPolarHBondContact O-CG2 3.36Å
146	L	94.1	Very high	90.3	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	33%	0.326	C	S	.	.			trans	-126.2	30.6	-179.2	-61.1	172.3	0	0	0	112.3	I103 G117 E118 L121 I122 I125 V144 V151	I103-L146 HydrophobicContact CB-CD2 3.88Å; I103-L146 HydrophobicContact CD1-CD1 4.01Å; I103-L146 HydrophobicContact CD1-CD2 4.42Å; I103-L146 HydrophobicContact CG2-CD1 3.89Å; I103-L146 HydrophobicContact CG2-CD2 3.63Å; I103-L146 HydrophobicContact CG2-CG 4.43Å; G117-L146 CarbonylContact C-O 3.58Å; E118-L146 PolarHBondContact N-O 3.44Å; L121-L146 HydrophobicContact CB-CD1 4.32Å; I122-L146 HydrophobicContact CD1-CB 4.16Å; I122-L146 HydrophobicContact CG1-CB 4.22Å; I122-L146 HydrophobicContact CG1-CD1 4.23Å; I125-L146 HydrophobicContact CD1-CD1 4.15Å; V144-L146 HydrophobicContact CG1-CD1 4.06Å; V144-L146 HydrophobicContact CG1-CD2 4.39Å; V144-L146 HydrophobicContact CG1-CG 4.03Å; V144-L146 PolarHBondContact O-N 3.19Å; L146-V151 HydrophobicContact CB-CG2 4.39Å; L146-V151 HydrophobicContact CD2-CG2 4.38Å
147	S	93.3	Very high	90.9	Very high	43 Å²	43	60.2 Å²	60.2	30%	0.301	32%	0.316	S	S	.	.			trans	-62.6	155.2	171.5	69.5	0	0	0	0	110.7	D149 T150 V151	S147-D149 VanDerWaalsContact C-N 3.28Å; S147-D149 PolarHBondContact O-N 2.82Å; S147-T150 WeakPolarHBondContact O-CB 3.18Å; S147-T150 PolarHBondContact O-N 3.36Å; S147-T150 VanDerWaalsContact OG-CB 3.31Å; S147-T150 WeakPolarHBondContact OG-CB 3.28Å; S147-T150 PolarHBondContact OG-N 3.48Å; S147-T150 PolarHBondContact OG-OG1 3.28Å; S147-V151 WeakPolarHBondContact O-CG2 3.34Å; S147-V151 PolarHBondContact O-N 3.11Å
148	N	94.5	Very high	91.6	Very high	49 Å²	49	62 Å²	62	26%	0.262	32%	0.324	S	S	.	.	H	α-helix	trans	-43.5	-53.7	176.3	177.9	68.4	0	0	0	112.8	H114 T115 T150 V151 Q152	H114-N148 WeakPolarHBondContact CB-OD1 3.45Å; T115-N148 HydrophobicContact CG2-CB 4.24Å; N148-T150 VanDerWaalsContact C-N 3.33Å; N148-T150 PolarHBondContact O-N 3.04Å; N148-V151 PolarHBondContact O-N 3.43Å; N148-Q152 PolarHBondContact O-N 2.69Å
149	D	95.8	Very high	92.1	Very high	110 Å²	110	61 Å²	61	59%	0.588	32%	0.316	S	S	*	.	H	α-helix	trans	-70.2	-31.9	-176.4	-49.4	-25.1	0	0	0	112.3	S147 R153	S147-D149 VanDerWaalsContact C-N 3.28Å; S147-D149 PolarHBondContact O-N 2.82Å; D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 PolarHBondContact O-N 3.39Å
150	T	94.6	Very high	92.8	Very high	22 Å²	22	58.3 Å²	58.3	14%	0.135	31%	0.309	C	S	.	.	H	α-helix	trans	-69.7	-42.4	176.3	-63.5	0	0	0	0	110.8	S145 S147 N148 R154	S145-T150 WeakPolarHBondContact O-CG2 3.36Å; S147-T150 WeakPolarHBondContact O-CB 3.18Å; S147-T150 PolarHBondContact O-N 3.36Å; S147-T150 VanDerWaalsContact OG-CB 3.31Å; S147-T150 WeakPolarHBondContact OG-CB 3.28Å; S147-T150 PolarHBondContact OG-N 3.48Å; S147-T150 PolarHBondContact OG-OG1 3.28Å; N148-T150 VanDerWaalsContact C-N 3.33Å; N148-T150 PolarHBondContact O-N 3.04Å; T150-R154 HydrophobicContact CG2-CG 4.5Å; T150-R154 WeakPolarHBondContact O-CB 3.49Å; T150-R154 VanDerWaalsContact O-CD 3.32Å; T150-R154 WeakPolarHBondContact O-CD 3.33Å; T150-R154 WeakPolarHBondContact O-CG 3.19Å; T150-R154 PolarHBondContact O-N 3.08Å
151	V	96.1	Very high	93.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-46.9	176.6	171.3	0	0	0	0	109.8	I107 H114 L146 S147 N148 R154 I155	I107-V151 HydrophobicContact CB-CG1 4.46Å; I107-V151 HydrophobicContact CD1-CG1 3.92Å; I107-V151 HydrophobicContact CD1-CG2 3.97Å; I107-V151 HydrophobicContact CG2-CG1 4.25Å; H114-V151 HydrophobicContact CB-CB 4.17Å; H114-V151 HydrophobicContact CB-CG1 3.9Å; L146-V151 HydrophobicContact CB-CG2 4.39Å; L146-V151 HydrophobicContact CD2-CG2 4.38Å; S147-V151 WeakPolarHBondContact O-CG2 3.34Å; S147-V151 PolarHBondContact O-N 3.11Å; N148-V151 PolarHBondContact O-N 3.43Å; V151-R154 PolarHBondContact O-N 3.43Å; V151-I155 HydrophobicContact CG1-CD1 3.7Å; V151-I155 HydrophobicContact CG1-CG1 4.47Å; V151-I155 VanDerWaalsContact O-CG1 3.27Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 3.28Å
152	Q	96.4	Very high	93.9	Very high	85 Å²	85	62.9 Å²	62.9	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-54.7	-58.3	175.2	-180	178.9	6.4	0	0	111.4	N148 R154 I155 D156	N148-Q152 PolarHBondContact O-N 2.69Å; Q152-R154 PolarHBondContact O-N 3.08Å; Q152-I155 WeakPolarHBondContact O-CA 3.45Å; Q152-I155 WeakPolarHBondContact O-CB 3.49Å; Q152-I155 PolarHBondContact O-N 3.04Å; Q152-D156 WeakPolarHBondContact CG-OD2 3.27Å; Q152-D156 VanDerWaalsContact O-CG 3.31Å; Q152-D156 PolarHBondContact O-N 3.44Å
153	R	97	Very high	94.5	Very high	141 Å²	141	57.7 Å²	57.7	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-56.1	-39.6	-178	-178.4	170.8	61.2	96.5	-2.1	112.5	D149 D156 D157	D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 PolarHBondContact O-N 3.39Å; R153-D156 PolarHBondContact O-N 2.97Å; R153-D157 WeakPolarHBondContact O-CB 3.28Å; R153-D157 PolarHBondContact O-N 3.48Å
154	R	96.2	Very high	95	Very high	10 Å²	10	58.9 Å²	58.9	4%	0.038	32%	0.321	C	S	.	.	H	α-helix	trans	-68.5	-37.5	177.8	-71.4	165.4	-175.5	-107.7	12.9	112.5	L97 S100 Y101 S104 T150 V151 Q152 D156 M158	L97-R154 PolarHBondContact O-NH1 2.96Å; S100-R154 PolarHBondContact OG-NH2 2.76Å; Y101-R154 HydrophobicContact CD1-CB 3.85Å; Y101-R154 HydrophobicContact CD1-CG 4.04Å; Y101-R154 HydrophobicContact CD2-CG 4.49Å; Y101-R154 HydrophobicContact CE1-CB 3.72Å; Y101-R154 HydrophobicContact CE1-CG 3.76Å; Y101-R154 HydrophobicContact CE2-CG 4.23Å; Y101-R154 HydrophobicContact CG-CG 4.39Å; Y101-R154 VanDerWaalsContact N-NH1 3.14Å; S104-R154 WeakPolarHBondContact OG-CD 3.45Å; T150-R154 HydrophobicContact CG2-CG 4.5Å; T150-R154 WeakPolarHBondContact O-CB 3.49Å; T150-R154 VanDerWaalsContact O-CD 3.32Å; T150-R154 WeakPolarHBondContact O-CD 3.33Å; T150-R154 WeakPolarHBondContact O-CG 3.19Å; T150-R154 PolarHBondContact O-N 3.08Å; V151-R154 PolarHBondContact O-N 3.43Å; Q152-R154 PolarHBondContact O-N 3.08Å; R154-D156 VanDerWaalsContact C-N 3.34Å; R154-M158 WeakPolarHBondContact O-CB 3.36Å; R154-M158 WeakPolarHBondContact O-CE 3.5Å; R154-M158 VanDerWaalsContact O-CG 3.28Å; R154-M158 WeakPolarHBondContact O-CG 3.4Å; R154-M158 PolarHBondContact O-N 3.49Å
155	I	95.8	Very high	95.4	Very high	30 Å²	30	61.6 Å²	61.6	15%	0.154	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-44.6	174	-68.7	166.3	0	0	0	109.4	A108 V151 Q152 M158 A159	A108-I155 HydrophobicContact CB-CD1 3.87Å; A108-I155 HydrophobicContact CB-CG1 4.06Å; A108-I155 HydrophobicContact CB-CG2 4.44Å; V151-I155 HydrophobicContact CG1-CD1 3.7Å; V151-I155 HydrophobicContact CG1-CG1 4.47Å; V151-I155 VanDerWaalsContact O-CG1 3.27Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 3.28Å; Q152-I155 WeakPolarHBondContact O-CA 3.45Å; Q152-I155 WeakPolarHBondContact O-CB 3.49Å; Q152-I155 PolarHBondContact O-N 3.04Å; I155-M158 HydrophobicContact CG1-CE 4.28Å; I155-M158 PolarHBondContact O-N 3.11Å; I155-A159 VanDerWaalsContact O-CB 3.31Å; I155-A159 WeakPolarHBondContact O-CB 3.39Å; I155-A159 PolarHBondContact O-N 3.24Å
156	D	95.8	Very high	95.7	Very high	86 Å²	86	59.7 Å²	59.7	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-63.1	-44.7	177.6	-62.3	-21.4	0	0	0	111.4	Q152 R153 R154 M158 A159 A160	Q152-D156 WeakPolarHBondContact CG-OD2 3.27Å; Q152-D156 VanDerWaalsContact O-CG 3.31Å; Q152-D156 PolarHBondContact O-N 3.44Å; R153-D156 PolarHBondContact O-N 2.97Å; R154-D156 VanDerWaalsContact C-N 3.34Å; D156-M158 PolarHBondContact O-N 3.3Å; D156-A159 PolarHBondContact O-N 2.83Å; D156-A160 WeakPolarHBondContact O-CB 3.43Å; D156-A160 PolarHBondContact O-N 2.84Å
157	D	97	Very high	95.9	Very high	67 Å²	67	59.9 Å²	59.9	36%	0.358	32%	0.324	S	S	.	.	H	α-helix	trans	-57.6	-47.2	174.9	-69.1	-18.4	0	0	0	111.1	Y101 R153 D161	Y101-D157 HydrophobicContact CE1-CB 4.13Å; Y101-D157 PolarHBondContact OH-OD2 3.31Å; R153-D157 WeakPolarHBondContact O-CB 3.28Å; R153-D157 PolarHBondContact O-N 3.48Å; D157-D161 PolarHBondContact O-N 3.45Å; D157-D161 VanDerWaalsContact O-N 3.11Å
158	M	96.7	Very high	96.1	Very high	43 Å²	43	62.8 Å²	62.8	21%	0.212	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-38.5	178	-73	-176.1	-64.7	0	0	112.1	Y101 L105 R154 I155 D156 D161 V162	Y101-M158 HydrophobicContact CD1-CE 4.4Å; Y101-M158 HydrophobicContact CD1-CG 3.8Å; Y101-M158 HydrophobicContact CD1-SD 3.93Å; Y101-M158 HydrophobicContact CE1-CG 4.12Å; L105-M158 HydrophobicContact CB-CE 3.99Å; L105-M158 HydrophobicContact CB-SD 4.09Å; L105-M158 HydrophobicContact CD1-SD 4.48Å; R154-M158 WeakPolarHBondContact O-CB 3.36Å; R154-M158 WeakPolarHBondContact O-CE 3.5Å; R154-M158 VanDerWaalsContact O-CG 3.28Å; R154-M158 WeakPolarHBondContact O-CG 3.4Å; R154-M158 PolarHBondContact O-N 3.49Å; I155-M158 HydrophobicContact CG1-CE 4.28Å; I155-M158 PolarHBondContact O-N 3.11Å; D156-M158 PolarHBondContact O-N 3.3Å; M158-D161 PolarHBondContact O-N 3.05Å; M158-V162 VanDerWaalsContact O-CG2 3.28Å; M158-V162 WeakPolarHBondContact O-CG2 3.31Å; M158-V162 PolarHBondContact O-N 2.88Å
159	A	94.4	Very high	96.2	Very high	53 Å²	53	63 Å²	63	44%	0.438	33%	0.332	S	S	.	.	H	α-helix	trans	-65.9	-43.2	178.2	0	0	0	0	0	111.2	I155 D156 V162 E163	I155-A159 VanDerWaalsContact O-CB 3.31Å; I155-A159 WeakPolarHBondContact O-CB 3.39Å; I155-A159 PolarHBondContact O-N 3.24Å; D156-A159 PolarHBondContact O-N 2.83Å; A159-V162 PolarHBondContact O-N 3.48Å; A159-E163 WeakPolarHBondContact O-CB 3.31Å; A159-E163 PolarHBondContact O-N 3.18Å
160	A	95.3	Very high	96.3	Very high	56 Å²	56	57.8 Å²	57.8	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-62.2	-41.7	176.3	0	0	0	0	0	112.2	D156 E163 Q164	D156-A160 WeakPolarHBondContact O-CB 3.43Å; D156-A160 PolarHBondContact O-N 2.84Å; A160-E163 PolarHBondContact O-N 3.48Å; A160-Q164 WeakPolarHBondContact O-CB 3.37Å; A160-Q164 PolarHBondContact O-N 3.5Å
161	D	96.6	Very high	96.4	Very high	101 Å²	101	60 Å²	60	54%	0.54	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-43	175.9	-177.7	77.2	0	0	0	112.3	D157 M158 Q164 T165	D157-D161 PolarHBondContact O-N 3.45Å; D157-D161 VanDerWaalsContact O-N 3.11Å; M158-D161 PolarHBondContact O-N 3.05Å; D161-Q164 PolarHBondContact O-N 2.93Å; D161-T165 VanDerWaalsContact O-CB 3.31Å; D161-T165 WeakPolarHBondContact O-CB 2.84Å; D161-T165 PolarHBondContact O-N 3.44Å; D161-T165 PolarHBondContact O-OG1 3.11Å
162	V	94.7	Very high	96.4	Very high	86 Å²	86	65.9 Å²	65.9	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-45.4	175.5	170.1	0	0	0	0	111.2	M158 A159 T165 L166	M158-V162 VanDerWaalsContact O-CG2 3.28Å; M158-V162 WeakPolarHBondContact O-CG2 3.31Å; M158-V162 PolarHBondContact O-N 2.88Å; A159-V162 PolarHBondContact O-N 3.48Å; V162-T165 PolarHBondContact O-N 2.76Å; V162-L166 VanDerWaalsContact O-CB 3.27Å; V162-L166 WeakPolarHBondContact O-CB 3.03Å; V162-L166 PolarHBondContact O-N 3.45Å
163	E	95.4	Very high	96.4	Very high	69 Å²	69	63.2 Å²	63.2	32%	0.322	34%	0.337	S	S	.	.	H	α-helix	trans	-59.9	-50.2	177	-177.8	-177.4	149.6	0	0	110.6	A159 A160 T165 L166 C167 K233	A159-E163 WeakPolarHBondContact O-CB 3.31Å; A159-E163 PolarHBondContact O-N 3.18Å; A160-E163 PolarHBondContact O-N 3.48Å; E163-T165 PolarHBondContact O-N 3.09Å; E163-L166 PolarHBondContact O-N 2.93Å; E163-C167 WeakPolarHBondContact O-CB 3.37Å; E163-C167 PolarHBondContact O-N 3.37Å; E163-C167 PolarHBondContact O-SG 2.88Å; E163-K233 WeakPolarHBondContact OE1-CE 3.33Å; E163-K233 IonicContact OE1-NZ 2.77Å; E163-K233 PolarHBondContact OE1-NZ 3.34Å
164	Q	96.5	Very high	96.3	Very high	115 Å²	115	61.4 Å²	61.4	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-49.9	178.8	-179.5	177.4	-10.8	0	0	111.3	A160 D161 L166 C167 E168	A160-Q164 WeakPolarHBondContact O-CB 3.37Å; A160-Q164 PolarHBondContact O-N 3.5Å; D161-Q164 PolarHBondContact O-N 2.93Å; Q164-L166 VanDerWaalsContact C-N 3.3Å; Q164-L166 PolarHBondContact O-N 3.3Å; Q164-C167 PolarHBondContact O-N 2.84Å; Q164-E168 HydrophobicContact CG-CG 4.38Å; Q164-E168 WeakPolarHBondContact CG-OE1 2.86Å; Q164-E168 PolarHBondContact NE2-OE1 2.88Å; Q164-E168 WeakPolarHBondContact O-CB 3.45Å; Q164-E168 WeakPolarHBondContact O-CG 3.44Å; Q164-E168 PolarHBondContact O-N 2.87Å
165	T	96.6	Very high	96.4	Very high	71 Å²	71	60.9 Å²	60.9	44%	0.436	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-42	179.5	-61.3	0	0	0	0	111.6	D161 V162 E163 F169	D161-T165 VanDerWaalsContact O-CB 3.31Å; D161-T165 WeakPolarHBondContact O-CB 2.84Å; D161-T165 PolarHBondContact O-N 3.44Å; D161-T165 PolarHBondContact O-OG1 3.11Å; V162-T165 PolarHBondContact O-N 2.76Å; E163-T165 PolarHBondContact O-N 3.09Å; T165-F169 WeakPolarHBondContact O-CB 3.34Å; T165-F169 PolarHBondContact O-N 3.26Å
166	L	97	Very high	96.3	Very high	15 Å²	15	59.8 Å²	59.8	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-50.1	177	177.6	60.1	0	0	0	110.9	V162 E163 Q164 E168 F169 L170 V195 F197 E206 L208	V162-L166 VanDerWaalsContact O-CB 3.27Å; V162-L166 WeakPolarHBondContact O-CB 3.03Å; V162-L166 PolarHBondContact O-N 3.45Å; E163-L166 PolarHBondContact O-N 2.93Å; Q164-L166 VanDerWaalsContact C-N 3.3Å; Q164-L166 PolarHBondContact O-N 3.3Å; L166-E168 PolarHBondContact O-N 3.37Å; L166-F169 WeakPolarHBondContact O-CB 3.27Å; L166-F169 PolarHBondContact O-N 2.83Å; L166-F169 VanDerWaalsContact O-N 3.13Å; L166-L170 HydrophobicContact CD1-CD1 4.07Å; L166-L170 HydrophobicContact CD1-CD2 4.37Å; L166-L170 HydrophobicContact CD1-CG 4.08Å; L166-L170 HydrophobicContact CG-CD1 3.95Å; L166-L170 HydrophobicContact CG-CG 4.37Å; L166-L170 VanDerWaalsContact O-CG 3.27Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.18Å; L166-V195 HydrophobicContact CD1-CG2 4.16Å; L166-V195 HydrophobicContact CD2-CG2 4.17Å; L166-F197 HydrophobicContact CD1-CE1 3.54Å; L166-F197 HydrophobicContact CD1-CZ 3.8Å; L166-E206 HydrophobicContact CD1-CB 4.2Å; L166-E206 HydrophobicContact CD1-CG 4.37Å; L166-E206 HydrophobicContact CD2-CB 3.8Å; L166-L208 HydrophobicContact CD2-CD1 4.07Å; L166-L208 HydrophobicContact CG-CD1 4.45Å
167	C	97.4	Very high	96.3	Very high	6 Å²	6	55.8 Å²	55.8	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-46.1	179.9	-72.9	0	0	0	0	111.7	E163 Q164 F169 L170 K171 K233 I235	E163-C167 WeakPolarHBondContact O-CB 3.37Å; E163-C167 PolarHBondContact O-N 3.37Å; E163-C167 PolarHBondContact O-SG 2.88Å; Q164-C167 PolarHBondContact O-N 2.84Å; C167-F169 VanDerWaalsContact C-N 3.29Å; C167-F169 PolarHBondContact O-N 3.11Å; C167-L170 PolarHBondContact O-N 2.96Å; C167-L170 VanDerWaalsContact O-N 3.14Å; C167-K171 WeakPolarHBondContact O-CG 3.43Å; C167-K171 PolarHBondContact O-N 3.13Å; C167-K171 VanDerWaalsContact O-N 3.11Å; C167-K233 HydrophobicContact CB-CB 4.32Å; C167-I235 HydrophobicContact CB-CD1 4.05Å
168	E	97.5	Very high	96.1	Very high	103 Å²	103	53.2 Å²	53.2	48%	0.481	29%	0.292	S	S	.	.	H	α-helix	trans	-56.9	-42.2	175.1	-74.8	177.4	-171.6	0	0	111.9	Q164 L166 K171	Q164-E168 HydrophobicContact CG-CG 4.38Å; Q164-E168 WeakPolarHBondContact CG-OE1 2.86Å; Q164-E168 PolarHBondContact NE2-OE1 2.88Å; Q164-E168 WeakPolarHBondContact O-CB 3.45Å; Q164-E168 WeakPolarHBondContact O-CG 3.44Å; Q164-E168 PolarHBondContact O-N 2.87Å; L166-E168 PolarHBondContact O-N 3.37Å; E168-K171 WeakPolarHBondContact O-CB 3.34Å; E168-K171 PolarHBondContact O-N 3.27Å
169	F	96.8	Very high	96	Very high	55 Å²	55	51.3 Å²	51.3	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-38.4	176.5	-177.1	-94.5	0	0	0	112.9	T165 L166 C167 K171 T172 T173 F197 K199	T165-F169 WeakPolarHBondContact O-CB 3.34Å; T165-F169 PolarHBondContact O-N 3.26Å; L166-F169 WeakPolarHBondContact O-CB 3.27Å; L166-F169 PolarHBondContact O-N 2.83Å; L166-F169 VanDerWaalsContact O-N 3.13Å; C167-F169 VanDerWaalsContact C-N 3.29Å; C167-F169 PolarHBondContact O-N 3.11Å; F169-K171 VanDerWaalsContact C-N 3.32Å; F169-K171 PolarHBondContact O-N 2.77Å; F169-T172 PolarHBondContact O-N 3.4Å; F169-T173 HydrophobicContact CE1-CG2 3.67Å; F169-T173 HydrophobicContact CZ-CG2 3.88Å; F169-T173 VanDerWaalsContact O-CB 3.26Å; F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 2.94Å; F169-T173 PolarHBondContact O-OG1 3.42Å; F169-F197 AromaticContact CD1-CD2 3.94Å; F169-F197 HydrophobicContact CD1-CD2 3.94Å; F169-F197 AromaticContact CD1-CE2 3.89Å; F169-F197 HydrophobicContact CD1-CE2 3.89Å; F169-F197 HydrophobicContact CD1-CG 4.29Å; F169-F197 HydrophobicContact CD1-CZ 4.25Å; F169-F197 HydrophobicContact CE1-CB 4.2Å; F169-F197 HydrophobicContact CE1-CD1 4.43Å; F169-F197 AromaticContact CE1-CD2 3.18Å; F169-F197 HydrophobicContact CE1-CD2 3.18Å; F169-F197 AromaticContact CE1-CE2 3.5Å; F169-F197 HydrophobicContact CE1-CE2 3.5Å; F169-F197 AromaticContact CE1-CG 3.69Å; F169-F197 HydrophobicContact CE1-CG 3.69Å; F169-F197 HydrophobicContact CE1-CZ 4.28Å; F169-F197 AromaticContact CZ-CD2 3.91Å; F169-F197 HydrophobicContact CZ-CD2 3.91Å; F169-F197 HydrophobicContact CZ-CE2 4.21Å; F169-K199 HydrophobicContact CE2-CD 4.46Å; F169-K199 HydrophobicContact CE2-CG 4.42Å; F169-K199 HydrophobicContact CZ-CB 4.21Å; F169-K199 HydrophobicContact CZ-CG 4.33Å
170	L	97.5	Very high	95.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-73.1	-20.3	-179.9	-63.8	174.2	0	0	0	113.3	L166 C167 T172 F175 V195 F197 L208 I235 N239	L166-L170 HydrophobicContact CD1-CD1 4.07Å; L166-L170 HydrophobicContact CD1-CD2 4.37Å; L166-L170 HydrophobicContact CD1-CG 4.08Å; L166-L170 HydrophobicContact CG-CD1 3.95Å; L166-L170 HydrophobicContact CG-CG 4.37Å; L166-L170 VanDerWaalsContact O-CG 3.27Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.18Å; C167-L170 PolarHBondContact O-N 2.96Å; C167-L170 VanDerWaalsContact O-N 3.14Å; L170-T172 PolarHBondContact O-N 3.19Å; L170-F175 HydrophobicContact CB-CD1 4.2Å; L170-F175 HydrophobicContact CB-CE1 3.82Å; L170-F175 HydrophobicContact CB-CZ 4.43Å; L170-F175 HydrophobicContact CD2-CB 4.06Å; L170-F175 HydrophobicContact CD2-CD1 3.5Å; L170-F175 HydrophobicContact CD2-CD2 4.34Å; L170-F175 HydrophobicContact CD2-CE1 3.92Å; L170-F175 HydrophobicContact CD2-CG 3.73Å; L170-F175 HydrophobicContact CD2-CZ 4.48Å; L170-F175 HydrophobicContact CG-CD1 4.35Å; L170-F175 HydrophobicContact CG-CE1 4.31Å; L170-V195 HydrophobicContact CD1-CG1 4.18Å; L170-V195 HydrophobicContact CD1-CG2 4.14Å; L170-V195 HydrophobicContact CD2-CB 4.42Å; L170-V195 HydrophobicContact CD2-CG2 4.32Å; L170-F197 HydrophobicContact CD2-CD1 3.86Å; L170-F197 HydrophobicContact CD2-CE1 4.27Å; L170-L208 HydrophobicContact CD1-CD1 3.55Å; L170-I235 HydrophobicContact CB-CD1 4.14Å; L170-I235 HydrophobicContact CB-CG2 4.21Å; L170-I235 HydrophobicContact CD1-CD1 4.28Å; L170-N239 PolarHBondContact O-ND2 3.36Å
171	K	97.8	Very high	95.5	Very high	68 Å²	68	51.4 Å²	51.4	30%	0.296	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-34.1	174.6	-70.1	-175.3	179.8	-170.4	0	112.6	C167 E168 F169 K233 E234 I235 N239	C167-K171 WeakPolarHBondContact O-CG 3.43Å; C167-K171 PolarHBondContact O-N 3.13Å; C167-K171 VanDerWaalsContact O-N 3.11Å; E168-K171 WeakPolarHBondContact O-CB 3.34Å; E168-K171 PolarHBondContact O-N 3.27Å; F169-K171 VanDerWaalsContact C-N 3.32Å; F169-K171 PolarHBondContact O-N 2.77Å; K171-K233 WeakPolarHBondContact CE-O 3.44Å; K171-K233 PolarHBondContact NZ-O 2.95Å; K171-E234 IonicContact NZ-OE2 3.29Å; K171-E234 PolarHBondContact NZ-OE2 3.3Å; K171-I235 HydrophobicContact CG-CG1 4.27Å; K171-N239 PolarHBondContact O-ND2 3.16Å
172	T	96.2	Very high	95.1	Very high	124 Å²	124	48.9 Å²	48.9	76%	0.761	26%	0.256	S	S	*	.	S	Bend	trans	-113.8	0.1	-174	60.5	0	0	0	0	114.1	F169 L170	F169-T172 PolarHBondContact O-N 3.4Å; L170-T172 PolarHBondContact O-N 3.19Å
173	T	96.2	Very high	94.6	Very high	28 Å²	28	50.2 Å²	50.2	17%	0.172	26%	0.259	C	S	.	.	S	Bend	trans	-121.5	140.6	-172.4	-50.3	0	0	0	0	110.1	F169 F175 F197	F169-T173 HydrophobicContact CE1-CG2 3.67Å; F169-T173 HydrophobicContact CZ-CG2 3.88Å; F169-T173 VanDerWaalsContact O-CB 3.26Å; F169-T173 WeakPolarHBondContact O-CB 3.33Å; F169-T173 PolarHBondContact O-N 2.94Å; F169-T173 PolarHBondContact O-OG1 3.42Å; T173-F175 VanDerWaalsContact O-CD1 3.29Å; T173-F175 WeakPolarHBondContact O-CD1 3.4Å; T173-F197 HydrophobicContact CG2-CB 4.36Å
174	Q	95.8	Very high	94.1	Very high	103 Å²	103	50.1 Å²	50.1	48%	0.481	26%	0.261	S	S	.	.			trans	-78.3	139.8	170.7	-76.1	-176.4	-10.6	0	0	111.1	N239 T241	Q174-N239 VanDerWaalsContact CA-O 3.32Å; Q174-N239 WeakPolarHBondContact CA-O 3.37Å; Q174-T241 HydrophobicContact CB-CG2 3.73Å; Q174-T241 HydrophobicContact CG-CG2 4.01Å
175	F	96.4	Very high	93.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	158.5	-176.4	59.4	-90	0	0	0	112	L170 T173 V195 R196 F197 F230 I235 N239 I240 T241	L170-F175 HydrophobicContact CB-CD1 4.2Å; L170-F175 HydrophobicContact CB-CE1 3.82Å; L170-F175 HydrophobicContact CB-CZ 4.43Å; L170-F175 HydrophobicContact CD2-CB 4.06Å; L170-F175 HydrophobicContact CD2-CD1 3.5Å; L170-F175 HydrophobicContact CD2-CD2 4.34Å; L170-F175 HydrophobicContact CD2-CE1 3.92Å; L170-F175 HydrophobicContact CD2-CG 3.73Å; L170-F175 HydrophobicContact CD2-CZ 4.48Å; L170-F175 HydrophobicContact CG-CD1 4.35Å; L170-F175 HydrophobicContact CG-CE1 4.31Å; T173-F175 VanDerWaalsContact O-CD1 3.29Å; T173-F175 WeakPolarHBondContact O-CD1 3.4Å; F175-V195 HydrophobicContact CD2-CB 4.15Å; F175-V195 HydrophobicContact CD2-CG1 3.66Å; F175-V195 HydrophobicContact CE2-CG1 3.78Å; F175-R196 CarbonylContact C-O 3.34Å; F175-R196 VanDerWaalsContact CA-O 3.25Å; F175-R196 WeakPolarHBondContact CA-O 3.31Å; F175-R196 VanDerWaalsContact CB-O 3.25Å; F175-R196 WeakPolarHBondContact CB-O 3.49Å; F175-F197 HydrophobicContact CB-CB 4.01Å; F175-F230 HydrophobicContact CE2-CE1 4.2Å; F175-F230 AromaticContact CE2-CZ 3.94Å; F175-F230 HydrophobicContact CE2-CZ 3.94Å; F175-F230 AromaticContact CZ-CE1 3.65Å; F175-F230 HydrophobicContact CZ-CE1 3.65Å; F175-F230 AromaticContact CZ-CZ 3.77Å; F175-F230 HydrophobicContact CZ-CZ 3.77Å; F175-I235 HydrophobicContact CE1-CG2 4.05Å; F175-I235 HydrophobicContact CZ-CG2 3.99Å; F175-N239 HydrophobicContact CD1-CB 4.17Å; F175-N239 HydrophobicContact CE1-CB 3.74Å; F175-N239 PolarHBondContact N-O 3.02Å; F175-I240 HydrophobicContact CE2-CG1 3.8Å; F175-I240 HydrophobicContact CZ-CG1 3.94Å; F175-I240 CarbonylContact O-C 3.58Å; F175-I240 WeakPolarHBondContact O-CA 3.24Å; F175-T241 PolarHBondContact O-N 2.76Å; F175-T241 PolarHBondContact O-OG1 3.03Å
176	S	94.9	Very high	92.7	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	142.9	167.5	65.6	0	0	0	0	110.4	V195 R196 A242	S176-V195 CarbonylContact O-C 3.48Å; S176-V195 WeakPolarHBondContact O-CA 3.35Å; S176-R196 PolarHBondContact N-O 3.43Å; S176-R196 PolarHBondContact O-N 3.02Å; S176-R196 WeakPolarHBondContact OG-CB 3.4Å; S176-A242 CarbonylContact C-O 3.5Å; S176-A242 WeakPolarHBondContact CA-O 3.5Å
177	L	95.7	Very high	92.1	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.1	178.6	-175.3	68	0	0	0	110.2	L179 A193 Y194 V195 L208 L226 I240 A242 V243 A244 F258	L177-L179 HydrophobicContact CD1-CD2 4.33Å; L177-L179 HydrophobicContact CD2-CD1 4.02Å; L177-L179 HydrophobicContact CD2-CD2 4.21Å; L177-L179 HydrophobicContact CD2-CG 3.98Å; L177-L179 HydrophobicContact CG-CD2 4.25Å; L177-L179 HydrophobicContact CG-CG 4.09Å; L177-A193 HydrophobicContact CD1-CB 4.34Å; L177-Y194 CarbonylContact C-O 3.51Å; L177-V195 HydrophobicContact CD1-CG1 4.08Å; L177-L208 HydrophobicContact CD1-CD2 4.46Å; L177-L226 HydrophobicContact CD1-CD1 4.46Å; L177-L226 HydrophobicContact CD2-CD1 3.86Å; L177-L226 HydrophobicContact CD2-CD2 3.6Å; L177-L226 HydrophobicContact CD2-CG 4.41Å; L177-I240 HydrophobicContact CB-CG2 4.09Å; L177-I240 HydrophobicContact CD2-CD1 4.4Å; L177-A242 PolarHBondContact N-O 3.43Å; L177-V243 HydrophobicContact CB-CG2 4.19Å; L177-V243 HydrophobicContact CD2-CG2 4.24Å; L177-V243 HydrophobicContact CG-CG2 4.35Å; L177-V243 CarbonylContact O-C 3.55Å; L177-V243 VanDerWaalsContact O-CA 3.23Å; L177-V243 WeakPolarHBondContact O-CA 3.29Å; L177-A244 PolarHBondContact O-N 3.37Å; L177-F258 HydrophobicContact CD2-CZ 4.37Å
178	Q	93.1	Very high	91.6	Very high	14 Å²	14	59.7 Å²	59.7	7%	0.065	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.2	166.5	178	-176.7	-2.1	0	0	108.4	A193 Y194 A244 C522 G525	Q178-A193 WeakPolarHBondContact O-CA 3.5Å; Q178-Y194 PolarHBondContact N-O 3.28Å; Q178-Y194 PolarHBondContact O-N 3.43Å; Q178-A244 WeakPolarHBondContact CA-O 3.27Å; Q178-A244 HydrophobicContact CB-CB 4.29Å; Q178-A244 HydrophobicContact CG-CB 4.25Å; Q178-C522 PolarHBondContact NE2-O 3.36Å; Q178-G525 VanDerWaalsContact OE1-CA 3.3Å
179	L	93.7	Very high	91.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.8	177.5	-65.9	176.7	0	0	0	110.2	L177 L191 L192 A193 I222 A244 M251 F258	L177-L179 HydrophobicContact CD1-CD2 4.33Å; L177-L179 HydrophobicContact CD2-CD1 4.02Å; L177-L179 HydrophobicContact CD2-CD2 4.21Å; L177-L179 HydrophobicContact CD2-CG 3.98Å; L177-L179 HydrophobicContact CG-CD2 4.25Å; L177-L179 HydrophobicContact CG-CG 4.09Å; L179-L191 HydrophobicContact CB-CD1 4.33Å; L179-L191 HydrophobicContact CD2-CD1 4.14Å; L179-L191 HydrophobicContact CD2-CG 4.33Å; L179-L192 WeakPolarHBondContact CA-O 3.26Å; L179-A193 HydrophobicContact CD2-CB 3.62Å; L179-I222 HydrophobicContact CD1-CG2 4.31Å; L179-A244 PolarHBondContact N-O 2.88Å; L179-M251 HydrophobicContact CB-CE 3.57Å; L179-M251 HydrophobicContact CD1-CE 3.93Å; L179-M251 HydrophobicContact CG-CE 4.42Å; L179-F258 HydrophobicContact CD1-CD1 4.04Å; L179-F258 HydrophobicContact CD1-CD2 4.13Å; L179-F258 HydrophobicContact CD1-CE1 3.52Å; L179-F258 HydrophobicContact CD1-CE2 3.56Å; L179-F258 HydrophobicContact CD1-CG 4.34Å; L179-F258 HydrophobicContact CD1-CZ 3.24Å
180	D	91.1	Very high	91.1	Very high	43 Å²	43	54.5 Å²	54.5	23%	0.23	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.8	172.2	-161.1	16.6	0	0	0	110	L192	D180-L192 PolarHBondContact N-O 2.78Å; D180-L192 PolarHBondContact O-N 2.78Å
181	E	88.4	Confident	90.9	Very high	68 Å²	68	54.6 Å²	54.6	32%	0.318	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.3	176.6	-171	-164.9	134.8	0	0	109.2	L190 L213 T217	E181-L190 WeakPolarHBondContact CA-O 3.42Å; E181-L213 HydrophobicContact CG-CD1 4.34Å; E181-T217 VanDerWaalsContact CD-CG2 3.45Å; E181-T217 HydrophobicContact CG-CG2 4.44Å; E181-T217 VanDerWaalsContact OE1-CG2 3.25Å; E181-T217 WeakPolarHBondContact OE1-CG2 3.28Å; E181-T217 VanDerWaalsContact OE2-CB 3.32Å; E181-T217 WeakPolarHBondContact OE2-CB 3.43Å; E181-T217 WeakPolarHBondContact OE2-CG2 3.44Å
182	S	87.6	Confident	90.8	Very high	49 Å²	49	52.8 Å²	52.8	34%	0.343	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.9	174.5	-155.4	0	0	0	0	110.9	L190	S182-L190 PolarHBondContact N-O 3.39Å; S182-L190 PolarHBondContact O-N 3Å
183	I	85.2	Confident	90.8	Very high	113 Å²	113	46.9 Å²	46.9	58%	0.579	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	121.5	176.8	-57.2	171.5	0	0	0	108.6
184	L	84.2	Confident	90.8	Very high	68 Å²	68	46.8 Å²	46.8	36%	0.356	26%	0.263	S	S	.	.			trans	-79.9	160.7	173.5	-64.8	-174.6	0	0	0	111.5	G186 N187 E188 L190	L184-G186 PolarHBondContact O-N 3.19Å; L184-G186 VanDerWaalsContact O-N 3.09Å; L184-N187 PolarHBondContact O-N 3.35Å; L184-E188 HydrophobicContact CB-CB 4.27Å; L184-E188 WeakPolarHBondContact CB-OE2 3.35Å; L184-E188 HydrophobicContact CD1-CB 4.27Å; L184-E188 PolarHBondContact N-O 3.15Å; L184-L190 HydrophobicContact CD1-CD1 3.77Å; L184-L190 HydrophobicContact CD1-CG 4.06Å; L184-L190 HydrophobicContact CD2-CD1 4.09Å; L184-L190 HydrophobicContact CG-CD1 3.98Å; L184-L190 HydrophobicContact CG-CG 4.19Å
185	P	79.2	Confident	90.8	Very high	137 Å²	137	41.9 Å²	41.9	89%	0.89	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-21.7	-179	-26.9	36	0	0	0	115.8	N187	P185-N187 VanDerWaalsContact C-N 3.28Å
186	G	85.1	Confident	90.6	Very high	51 Å²	51	43 Å²	43	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	10.9	175.8	0	0	0	0	0	114.3	L184 E188	L184-G186 PolarHBondContact O-N 3.19Å; L184-G186 VanDerWaalsContact O-N 3.09Å; G186-E188 WeakPolarHBondContact CA-OE2 3.27Å; G186-E188 PolarHBondContact N-OE2 3.46Å; G186-E188 VanDerWaalsContact N-OE2 3.11Å; G186-E188 PolarHBondContact O-N 2.89Å
187	N	83.4	Confident	90.5	Very high	143 Å²	143	43 Å²	43	77%	0.765	24%	0.244	S	C	*	.	S	Bend	trans	65.1	17	-170.4	-67	-27.4	0	0	0	114.4	L184 P185	L184-N187 PolarHBondContact O-N 3.35Å; P185-N187 VanDerWaalsContact C-N 3.28Å
188	E	87.5	Confident	90.3	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	26%	0.262	S	S	.	.			trans	-73.4	128.4	169.2	-49.9	88.6	169.5	0	0	109.7	L184 G186	L184-E188 HydrophobicContact CB-CB 4.27Å; L184-E188 WeakPolarHBondContact CB-OE2 3.35Å; L184-E188 HydrophobicContact CD1-CB 4.27Å; L184-E188 PolarHBondContact N-O 3.15Å; G186-E188 WeakPolarHBondContact CA-OE2 3.27Å; G186-E188 PolarHBondContact N-OE2 3.46Å; G186-E188 VanDerWaalsContact N-OE2 3.11Å; G186-E188 PolarHBondContact O-N 2.89Å
189	A	90.3	Very high	90.3	Very high	10 Å²	10	51.1 Å²	51.1	8%	0.083	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.5	175.7	0	0	0	0	0	109.6	E212 L213 T217	A189-E212 CarbonylContact O-C 3.47Å; A189-E212 WeakPolarHBondContact O-CA 3.17Å; A189-L213 HydrophobicContact CB-CB 4.07Å; A189-L213 HydrophobicContact CB-CD1 4.39Å; A189-L213 PolarHBondContact O-N 3.49Å; A189-T217 HydrophobicContact CB-CG2 3.79Å
190	L	92.7	Very high	90.1	Very high	40 Å²	40	55.3 Å²	55.3	21%	0.209	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.7	174.2	-67.7	-177.4	0	0	0	110.3	E181 S182 L184 L192 K211 E212	E181-L190 WeakPolarHBondContact CA-O 3.42Å; S182-L190 PolarHBondContact N-O 3.39Å; S182-L190 PolarHBondContact O-N 3Å; L184-L190 HydrophobicContact CD1-CD1 3.77Å; L184-L190 HydrophobicContact CD1-CG 4.06Å; L184-L190 HydrophobicContact CD2-CD1 4.09Å; L184-L190 HydrophobicContact CG-CD1 3.98Å; L184-L190 HydrophobicContact CG-CG 4.19Å; L190-L192 HydrophobicContact CB-CD2 4.46Å; L190-K211 CarbonylContact C-O 3.5Å; L190-K211 WeakPolarHBondContact CA-O 3.39Å; L190-E212 HydrophobicContact CD2-CB 4.17Å
191	L	95	Very high	90	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	116	164.4	-177.1	64.4	0	0	0	109.1	L179 F209 A210 K211 L213 I222 V225	L179-L191 HydrophobicContact CB-CD1 4.33Å; L179-L191 HydrophobicContact CD2-CD1 4.14Å; L179-L191 HydrophobicContact CD2-CG 4.33Å; L191-F209 HydrophobicContact CB-CE2 4.47Å; L191-F209 HydrophobicContact CD2-CE2 3.94Å; L191-F209 HydrophobicContact CD2-CZ 4.18Å; L191-F209 HydrophobicContact CG-CE2 4.07Å; L191-A210 WeakPolarHBondContact O-CA 3.44Å; L191-K211 PolarHBondContact N-O 2.86Å; L191-K211 PolarHBondContact O-N 2.83Å; L191-L213 HydrophobicContact CB-CD1 4.23Å; L191-L213 HydrophobicContact CB-CD2 4.2Å; L191-L213 HydrophobicContact CB-CG 4.07Å; L191-I222 HydrophobicContact CD1-CG2 3.73Å; L191-I222 HydrophobicContact CD2-CG2 3.78Å; L191-I222 HydrophobicContact CG-CG2 4.42Å; L191-V225 HydrophobicContact CD2-CB 4.33Å; L191-V225 HydrophobicContact CD2-CG1 4.04Å
192	L	95.1	Very high	90	Very high	31 Å²	31	65.9 Å²	65.9	16%	0.162	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.8	174.8	-56.6	179.5	0	0	0	109.2	L179 D180 L190 Y194 A210	L179-L192 WeakPolarHBondContact CA-O 3.26Å; D180-L192 PolarHBondContact N-O 2.78Å; D180-L192 PolarHBondContact O-N 2.78Å; L190-L192 HydrophobicContact CB-CD2 4.46Å; L192-Y194 HydrophobicContact CB-CE2 4.04Å; L192-A210 HydrophobicContact CD2-CB 3.57Å
193	A	96.2	Very high	90	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.3	175.7	0	0	0	0	0	110.8	L177 Q178 L179 L208 F209	L177-A193 HydrophobicContact CD1-CB 4.34Å; Q178-A193 WeakPolarHBondContact O-CA 3.5Å; L179-A193 HydrophobicContact CD2-CB 3.62Å; A193-L208 HydrophobicContact CB-CB 4.08Å; A193-L208 HydrophobicContact CB-CD2 4.45Å; A193-L208 PolarHBondContact O-N 2.91Å; A193-F209 HydrophobicContact CB-CD1 3.9Å; A193-F209 HydrophobicContact CB-CD2 3.95Å; A193-F209 HydrophobicContact CB-CE1 3.64Å; A193-F209 HydrophobicContact CB-CE2 3.69Å; A193-F209 HydrophobicContact CB-CG 4.04Å; A193-F209 HydrophobicContact CB-CZ 3.53Å; A193-F209 PolarHBondContact N-O 2.88Å; A193-F209 PolarHBondContact O-N 2.92Å
194	Y	95.5	Very high	90.3	Very high	26 Å²	26	63.7 Å²	63.7	10%	0.102	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.5	171.2	-61.9	-92.7	0	0	0	109.5	L177 Q178 L192 E206 M207	L177-Y194 CarbonylContact C-O 3.51Å; Q178-Y194 PolarHBondContact N-O 3.28Å; Q178-Y194 PolarHBondContact O-N 3.43Å; L192-Y194 HydrophobicContact CB-CE2 4.04Å; Y194-E206 CarbonylContact C-O 3.5Å; Y194-E206 VanDerWaalsContact CA-O 3.31Å; Y194-E206 WeakPolarHBondContact CA-O 3.39Å; Y194-M207 HydrophobicContact CD1-CB 3.91Å; Y194-M207 HydrophobicContact CD1-CG 4.19Å; Y194-M207 HydrophobicContact CE1-CB 3.77Å; Y194-M207 HydrophobicContact CE1-CG 3.87Å; Y194-M207 HydrophobicContact CE1-SD 4.4Å
195	V	95.6	Very high	90.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.2	175.8	-71.1	0	0	0	0	110	L166 L170 F175 S176 L177 F197 Q205 E206 L208	L166-V195 HydrophobicContact CD1-CG2 4.16Å; L166-V195 HydrophobicContact CD2-CG2 4.17Å; L170-V195 HydrophobicContact CD1-CG1 4.18Å; L170-V195 HydrophobicContact CD1-CG2 4.14Å; L170-V195 HydrophobicContact CD2-CB 4.42Å; L170-V195 HydrophobicContact CD2-CG2 4.32Å; F175-V195 HydrophobicContact CD2-CB 4.15Å; F175-V195 HydrophobicContact CD2-CG1 3.66Å; F175-V195 HydrophobicContact CE2-CG1 3.78Å; S176-V195 CarbonylContact O-C 3.48Å; S176-V195 WeakPolarHBondContact O-CA 3.35Å; L177-V195 HydrophobicContact CD1-CG1 4.08Å; V195-F197 HydrophobicContact CB-CD1 4.48Å; V195-F197 HydrophobicContact CG2-CD1 4.19Å; V195-F197 HydrophobicContact CG2-CE1 3.96Å; V195-Q205 WeakPolarHBondContact O-CA 3.33Å; V195-E206 HydrophobicContact CG2-CB 4.29Å; V195-E206 PolarHBondContact N-O 2.78Å; V195-E206 PolarHBondContact O-N 2.93Å; V195-L208 HydrophobicContact CG1-CB 4.08Å; V195-L208 HydrophobicContact CG1-CD1 4.41Å; V195-L208 HydrophobicContact CG1-CD2 3.88Å; V195-L208 HydrophobicContact CG1-CG 4.35Å; V195-L208 HydrophobicContact CG2-CB 4.44Å
196	R	92.6	Very high	91.3	Very high	23 Å²	23	60.8 Å²	60.8	9%	0.087	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.3	169.6	-60.9	175.1	167.6	-129.7	-4.1	111.1	F175 S176 V204 Q205 G525 K526	F175-R196 CarbonylContact C-O 3.34Å; F175-R196 VanDerWaalsContact CA-O 3.25Å; F175-R196 WeakPolarHBondContact CA-O 3.31Å; F175-R196 VanDerWaalsContact CB-O 3.25Å; F175-R196 WeakPolarHBondContact CB-O 3.49Å; S176-R196 PolarHBondContact N-O 3.43Å; S176-R196 PolarHBondContact O-N 3.02Å; S176-R196 WeakPolarHBondContact OG-CB 3.4Å; R196-V204 VanDerWaalsContact CA-O 3.23Å; R196-V204 WeakPolarHBondContact CA-O 3.49Å; R196-Q205 HydrophobicContact CG-CB 3.94Å; R196-Q205 HydrophobicContact CG-CG 3.97Å; R196-Q205 VanDerWaalsContact CZ-OE1 3.23Å; R196-G525 WeakPolarHBondContact CD-O 3.4Å; R196-G525 PolarHBondContact NE-O 2.96Å; R196-G525 VanDerWaalsContact NE-O 3.15Å; R196-K526 VanDerWaalsContact CZ-CA 3.45Å; R196-K526 VanDerWaalsContact NH1-CA 3.3Å; R196-K526 PolarHBondContact NH1-O 3.03Å
197	F	94.1	Very high	91.8	Very high	7 Å²	7	63.1 Å²	63.1	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	165.4	-176.2	50.3	-94.7	0	0	0	109.7	L166 F169 L170 T173 F175 V195 K199 V204 E206	L166-F197 HydrophobicContact CD1-CE1 3.54Å; L166-F197 HydrophobicContact CD1-CZ 3.8Å; F169-F197 AromaticContact CD1-CD2 3.94Å; F169-F197 HydrophobicContact CD1-CD2 3.94Å; F169-F197 AromaticContact CD1-CE2 3.89Å; F169-F197 HydrophobicContact CD1-CE2 3.89Å; F169-F197 HydrophobicContact CD1-CG 4.29Å; F169-F197 HydrophobicContact CD1-CZ 4.25Å; F169-F197 HydrophobicContact CE1-CB 4.2Å; F169-F197 HydrophobicContact CE1-CD1 4.43Å; F169-F197 AromaticContact CE1-CD2 3.18Å; F169-F197 HydrophobicContact CE1-CD2 3.18Å; F169-F197 AromaticContact CE1-CE2 3.5Å; F169-F197 HydrophobicContact CE1-CE2 3.5Å; F169-F197 AromaticContact CE1-CG 3.69Å; F169-F197 HydrophobicContact CE1-CG 3.69Å; F169-F197 HydrophobicContact CE1-CZ 4.28Å; F169-F197 AromaticContact CZ-CD2 3.91Å; F169-F197 HydrophobicContact CZ-CD2 3.91Å; F169-F197 HydrophobicContact CZ-CE2 4.21Å; L170-F197 HydrophobicContact CD2-CD1 3.86Å; L170-F197 HydrophobicContact CD2-CE1 4.27Å; T173-F197 HydrophobicContact CG2-CB 4.36Å; F175-F197 HydrophobicContact CB-CB 4.01Å; V195-F197 HydrophobicContact CB-CD1 4.48Å; V195-F197 HydrophobicContact CG2-CD1 4.19Å; V195-F197 HydrophobicContact CG2-CE1 3.96Å; F197-K199 HydrophobicContact CD2-CB 4.11Å; F197-K199 HydrophobicContact CE2-CB 4.03Å; F197-K199 HydrophobicContact CE2-CD 4.26Å; F197-V204 HydrophobicContact CD2-CB 4.15Å; F197-V204 HydrophobicContact CE2-CB 3.72Å; F197-V204 HydrophobicContact CE2-CG1 3.87Å; F197-V204 HydrophobicContact CE2-CG2 4.43Å; F197-V204 HydrophobicContact CZ-CB 4.09Å; F197-V204 HydrophobicContact CZ-CG1 3.79Å; F197-V204 PolarHBondContact N-O 3.33Å; F197-V204 VanDerWaalsContact N-O 3.11Å; F197-V204 PolarHBondContact O-N 3.5Å; F197-E206 HydrophobicContact CE1-CG 4.36Å; F197-E206 HydrophobicContact CZ-CG 4.17Å
198	I	91.7	Very high	92.4	Very high	74 Å²	74	56.7 Å²	56.7	38%	0.379	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.8	174.2	-61.8	174.3	0	0	0	108.4	Q202 F529	I198-Q202 WeakPolarHBondContact CA-O 3.45Å; I198-F529 HydrophobicContact CD1-CB 4.24Å; I198-F529 HydrophobicContact CD1-CD1 3.39Å; I198-F529 HydrophobicContact CD1-CD2 4.28Å; I198-F529 HydrophobicContact CD1-CE1 3.65Å; I198-F529 HydrophobicContact CD1-CG 3.73Å; I198-F529 HydrophobicContact CD1-CZ 4.21Å; I198-F529 HydrophobicContact CG1-CD1 4.21Å; I198-F529 HydrophobicContact CG1-CD2 4.22Å; I198-F529 HydrophobicContact CG1-CE1 4.39Å; I198-F529 HydrophobicContact CG1-CE2 4.41Å; I198-F529 HydrophobicContact CG1-CG 4.11Å; I198-F529 HydrophobicContact CG1-CZ 4.49Å
199	K	91.3	Very high	92.8	Very high	111 Å²	111	53.7 Å²	53.7	48%	0.483	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	123.5	172.6	-175.9	175.9	-179.7	176.9	0	108.5	F169 F197 E201 Q202 V204	F169-K199 HydrophobicContact CE2-CD 4.46Å; F169-K199 HydrophobicContact CE2-CG 4.42Å; F169-K199 HydrophobicContact CZ-CB 4.21Å; F169-K199 HydrophobicContact CZ-CG 4.33Å; F197-K199 HydrophobicContact CD2-CB 4.11Å; F197-K199 HydrophobicContact CE2-CB 4.03Å; F197-K199 HydrophobicContact CE2-CD 4.26Å; K199-E201 VanDerWaalsContact C-N 3.33Å; K199-E201 PolarHBondContact O-N 3.14Å; K199-Q202 PolarHBondContact N-O 3.47Å; K199-Q202 PolarHBondContact O-N 2.78Å; K199-Q202 VanDerWaalsContact O-N 3.07Å; K199-V204 HydrophobicContact CB-CG2 4Å
200	A	90.9	Very high	93	Very high	91 Å²	91	55.6 Å²	55.6	75%	0.752	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	51	-176.9	0	0	0	0	0	112.9	Q202	A200-Q202 PolarHBondContact O-N 3.36Å
201	E	87.9	Confident	93.1	Very high	194 Å²	194	57.1 Å²	57.1	91%	0.907	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	8.6	-179.9	-55.5	177.6	178.4	0	0	115.3	K199	K199-E201 VanDerWaalsContact C-N 3.33Å; K199-E201 PolarHBondContact O-N 3.14Å
202	Q	89	Confident	93	Very high	138 Å²	138	62 Å²	62	65%	0.645	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	141.4	176.7	-64.6	-175.7	-13.1	0	0	110.9	I198 K199 A200 V204	I198-Q202 WeakPolarHBondContact CA-O 3.45Å; K199-Q202 PolarHBondContact N-O 3.47Å; K199-Q202 PolarHBondContact O-N 2.78Å; K199-Q202 VanDerWaalsContact O-N 3.07Å; A200-Q202 PolarHBondContact O-N 3.36Å; Q202-V204 PolarHBondContact O-N 3.42Å
203	V	87.7	Confident	92.9	Very high	83 Å²	83	61 Å²	61	50%	0.503	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	115.3	170.3	-180	0	0	0	0	108
204	V	91.2	Very high	92.6	Very high	33 Å²	33	66.6 Å²	66.6	20%	0.2	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.7	178.2	178.9	0	0	0	0	108.9	R196 F197 K199 Q202 E206	R196-V204 VanDerWaalsContact CA-O 3.23Å; R196-V204 WeakPolarHBondContact CA-O 3.49Å; F197-V204 HydrophobicContact CD2-CB 4.15Å; F197-V204 HydrophobicContact CE2-CB 3.72Å; F197-V204 HydrophobicContact CE2-CG1 3.87Å; F197-V204 HydrophobicContact CE2-CG2 4.43Å; F197-V204 HydrophobicContact CZ-CB 4.09Å; F197-V204 HydrophobicContact CZ-CG1 3.79Å; F197-V204 PolarHBondContact N-O 3.33Å; F197-V204 VanDerWaalsContact N-O 3.11Å; F197-V204 PolarHBondContact O-N 3.5Å; K199-V204 HydrophobicContact CB-CG2 4Å; Q202-V204 PolarHBondContact O-N 3.42Å; V204-E206 HydrophobicContact CG1-CG 4.09Å
205	Q	91.5	Very high	92.2	Very high	57 Å²	57	71 Å²	71	27%	0.266	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.6	170.7	179.8	-176.3	-41.4	0	0	109.3	V195 R196	V195-Q205 WeakPolarHBondContact O-CA 3.33Å; R196-Q205 HydrophobicContact CG-CB 3.94Å; R196-Q205 HydrophobicContact CG-CG 3.97Å; R196-Q205 VanDerWaalsContact CZ-OE1 3.23Å
206	E	93.7	Very high	91.9	Very high	87 Å²	87	73 Å²	73	41%	0.407	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	154	173.9	-67.6	-63.7	171.6	0	0	111.2	L166 Y194 V195 F197 V204	L166-E206 HydrophobicContact CD1-CB 4.2Å; L166-E206 HydrophobicContact CD1-CG 4.37Å; L166-E206 HydrophobicContact CD2-CB 3.8Å; Y194-E206 CarbonylContact C-O 3.5Å; Y194-E206 VanDerWaalsContact CA-O 3.31Å; Y194-E206 WeakPolarHBondContact CA-O 3.39Å; V195-E206 HydrophobicContact CG2-CB 4.29Å; V195-E206 PolarHBondContact N-O 2.78Å; V195-E206 PolarHBondContact O-N 2.93Å; F197-E206 HydrophobicContact CE1-CG 4.36Å; F197-E206 HydrophobicContact CZ-CG 4.17Å; V204-E206 HydrophobicContact CG1-CG 4.09Å
207	M	94.5	Very high	91.8	Very high	100 Å²	100	74.5 Å²	74.5	49%	0.493	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.8	167.4	-169.7	174.3	84.5	0	0	108.1	Y194	Y194-M207 HydrophobicContact CD1-CB 3.91Å; Y194-M207 HydrophobicContact CD1-CG 4.19Å; Y194-M207 HydrophobicContact CE1-CB 3.77Å; Y194-M207 HydrophobicContact CE1-CG 3.87Å; Y194-M207 HydrophobicContact CE1-SD 4.4Å
208	L	96.4	Very high	91.8	Very high	9 Å²	9	80.7 Å²	80.7	5%	0.047	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-50.7	178.9	-174.8	64.3	0	0	0	110.9	L166 L170 L177 A193 V195 F229 F230	L166-L208 HydrophobicContact CD2-CD1 4.07Å; L166-L208 HydrophobicContact CG-CD1 4.45Å; L170-L208 HydrophobicContact CD1-CD1 3.55Å; L177-L208 HydrophobicContact CD1-CD2 4.46Å; A193-L208 HydrophobicContact CB-CB 4.08Å; A193-L208 HydrophobicContact CB-CD2 4.45Å; A193-L208 PolarHBondContact O-N 2.91Å; V195-L208 HydrophobicContact CG1-CB 4.08Å; V195-L208 HydrophobicContact CG1-CD1 4.41Å; V195-L208 HydrophobicContact CG1-CD2 3.88Å; V195-L208 HydrophobicContact CG1-CG 4.35Å; V195-L208 HydrophobicContact CG2-CB 4.44Å; L208-F229 HydrophobicContact CD1-CE1 3.8Å; L208-F229 HydrophobicContact CD1-CZ 4.16Å; L208-F229 HydrophobicContact CD2-CD1 4.27Å; L208-F229 HydrophobicContact CD2-CE1 3.83Å; L208-F229 HydrophobicContact CG-CD1 4.49Å; L208-F229 HydrophobicContact CG-CE1 3.65Å; L208-F229 HydrophobicContact CG-CZ 4.12Å; L208-F230 HydrophobicContact CD2-CE2 3.75Å; L208-F230 HydrophobicContact CD2-CZ 4.19Å
209	F	95.7	Very high	91.9	Very high	13 Å²	13	77.3 Å²	77.3	6%	0.057	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	164.6	174.7	62	-107.3	0	0	0	112	L191 A193 K211 V225 L226 F229	L191-F209 HydrophobicContact CB-CE2 4.47Å; L191-F209 HydrophobicContact CD2-CE2 3.94Å; L191-F209 HydrophobicContact CD2-CZ 4.18Å; L191-F209 HydrophobicContact CG-CE2 4.07Å; A193-F209 HydrophobicContact CB-CD1 3.9Å; A193-F209 HydrophobicContact CB-CD2 3.95Å; A193-F209 HydrophobicContact CB-CE1 3.64Å; A193-F209 HydrophobicContact CB-CE2 3.69Å; A193-F209 HydrophobicContact CB-CG 4.04Å; A193-F209 HydrophobicContact CB-CZ 3.53Å; A193-F209 PolarHBondContact N-O 2.88Å; A193-F209 PolarHBondContact O-N 2.92Å; F209-K211 HydrophobicContact CB-CG 4.39Å; F209-K211 HydrophobicContact CD2-CB 3.91Å; F209-K211 HydrophobicContact CD2-CD 4.19Å; F209-K211 HydrophobicContact CD2-CG 3.8Å; F209-K211 HydrophobicContact CE2-CB 4.18Å; F209-K211 HydrophobicContact CE2-CD 4.47Å; F209-K211 HydrophobicContact CE2-CG 4.39Å; F209-K211 HydrophobicContact CG-CD 4.43Å; F209-K211 HydrophobicContact CG-CG 4.24Å; F209-V225 HydrophobicContact CE2-CG1 4.47Å; F209-L226 HydrophobicContact CE1-CD1 3.92Å; F209-L226 HydrophobicContact CZ-CD1 3.96Å; F209-F229 HydrophobicContact CB-CE2 4.34Å; F209-F229 HydrophobicContact CD1-CB 4.41Å; F209-F229 AromaticContact CD1-CD1 3.63Å; F209-F229 HydrophobicContact CD1-CD1 3.63Å; F209-F229 AromaticContact CD1-CD2 4Å; F209-F229 HydrophobicContact CD1-CD2 4Å; F209-F229 AromaticContact CD1-CE1 3.79Å; F209-F229 HydrophobicContact CD1-CE1 3.79Å; F209-F229 HydrophobicContact CD1-CE2 4.1Å; F209-F229 AromaticContact CD1-CG 3.73Å; F209-F229 HydrophobicContact CD1-CG 3.73Å; F209-F229 AromaticContact CD1-CZ 3.99Å; F209-F229 HydrophobicContact CD1-CZ 3.99Å; F209-F229 HydrophobicContact CE1-CB 4.15Å; F209-F229 AromaticContact CE1-CD1 3.75Å; F209-F229 HydrophobicContact CE1-CD1 3.75Å; F209-F229 HydrophobicContact CE1-CE1 4.3Å; F209-F229 AromaticContact CE1-CG 3.89Å; F209-F229 HydrophobicContact CE1-CG 3.89Å
210	A	94.4	Very high	92	Very high	49 Å²	49	76.3 Å²	76.3	41%	0.405	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	107.9	161	0	0	0	0	0	107.5	L191 L192	L191-A210 WeakPolarHBondContact O-CA 3.44Å; L192-A210 HydrophobicContact CD2-CB 3.57Å
211	K	94.7	Very high	92.2	Very high	72 Å²	72	72.8 Å²	72.8	31%	0.313	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.6	-176.6	-78.9	-173.9	-178.2	-94	0	110.8	L190 L191 F209 V225	L190-K211 CarbonylContact C-O 3.5Å; L190-K211 WeakPolarHBondContact CA-O 3.39Å; L191-K211 PolarHBondContact N-O 2.86Å; L191-K211 PolarHBondContact O-N 2.83Å; F209-K211 HydrophobicContact CB-CG 4.39Å; F209-K211 HydrophobicContact CD2-CB 3.91Å; F209-K211 HydrophobicContact CD2-CD 4.19Å; F209-K211 HydrophobicContact CD2-CG 3.8Å; F209-K211 HydrophobicContact CE2-CB 4.18Å; F209-K211 HydrophobicContact CE2-CD 4.47Å; F209-K211 HydrophobicContact CE2-CG 4.39Å; F209-K211 HydrophobicContact CG-CD 4.43Å; F209-K211 HydrophobicContact CG-CG 4.24Å; K211-V225 HydrophobicContact CB-CG1 3.95Å; K211-V225 HydrophobicContact CD-CG1 3.92Å
212	E	93.6	Very high	92.6	Very high	103 Å²	103	63.5 Å²	63.5	48%	0.481	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134.8	177.4	-170.5	-179.4	174.4	0	0	111.8	A189 L190 V214	A189-E212 CarbonylContact O-C 3.47Å; A189-E212 WeakPolarHBondContact O-CA 3.17Å; L190-E212 HydrophobicContact CD2-CB 4.17Å; E212-V214 PolarHBondContact O-N 3Å
213	L	93.4	Very high	93	Very high	10 Å²	10	57.8 Å²	57.8	5%	0.052	30%	0.304	C	S	.	.			trans	-90	88.8	167.8	-65.4	172.2	0	0	0	108	E181 A189 L191 T215 T217 I222 V225	E181-L213 HydrophobicContact CG-CD1 4.34Å; A189-L213 HydrophobicContact CB-CB 4.07Å; A189-L213 HydrophobicContact CB-CD1 4.39Å; A189-L213 PolarHBondContact O-N 3.49Å; L191-L213 HydrophobicContact CB-CD1 4.23Å; L191-L213 HydrophobicContact CB-CD2 4.2Å; L191-L213 HydrophobicContact CB-CG 4.07Å; L213-T215 VanDerWaalsContact C-N 3.33Å; L213-T215 PolarHBondContact O-N 3.3Å; L213-T217 HydrophobicContact CD1-CG2 4.01Å; L213-I222 HydrophobicContact CD1-CD1 4.48Å; L213-I222 HydrophobicContact CD1-CG1 3.92Å; L213-I222 HydrophobicContact CD2-CG1 3.99Å; L213-V225 HydrophobicContact CD2-CG2 4Å
214	V	88.9	Confident	93.4	Very high	119 Å²	119	57.4 Å²	57.4	72%	0.721	30%	0.299	S	S	*	.	S	Bend	trans	-59.9	-37.5	-167.6	-179.3	0	0	0	0	113.7	E212	E212-V214 PolarHBondContact O-N 3Å
215	T	86.6	Confident	93.6	Very high	118 Å²	118	57.3 Å²	57.3	72%	0.724	30%	0.298	S	S	*	.	S	Bend	trans	-107.8	-53.8	-170.4	55.1	0	0	0	0	113.4	L213	L213-T215 VanDerWaalsContact C-N 3.33Å; L213-T215 PolarHBondContact O-N 3.3Å
216	D	90.4	Very high	93.9	Very high	42 Å²	42	54.6 Å²	54.6	23%	0.225	29%	0.286	C	S	.	.			trans	-156.7	170.2	-174.3	66.4	60.7	0	0	0	111.2	R218 S221	D216-R218 HydrophobicContact CB-CG 4.41Å; D216-R218 WeakPolarHBondContact OD1-CB 3.42Å; D216-R218 VanDerWaalsContact OD1-CG 3.3Å; D216-R218 WeakPolarHBondContact OD1-CG 3.16Å; D216-R218 PolarHBondContact OD1-N 3.28Å; D216-R218 IonicContact OD1-NE 3.39Å; D216-R218 PolarHBondContact OD1-NE 3.26Å; D216-R218 IonicContact OD2-CZ 3.57Å; D216-R218 IonicContact OD2-NE 3.12Å; D216-R218 PolarHBondContact OD2-NE 3.48Å; D216-R218 IonicContact OD2-NH2 2.69Å; D216-R218 PolarHBondContact OD2-NH2 3.05Å; D216-S221 WeakPolarHBondContact OD1-CB 3.43Å; D216-S221 PolarHBondContact OD1-OG 2.83Å
217	T	89.9	Confident	94	Very high	54 Å²	54	53.4 Å²	53.4	33%	0.331	28%	0.279	S	S	.	.			trans	-107.6	28.7	-177.5	58.4	0	0	0	0	111.9	E181 A189 L213 A250	E181-T217 VanDerWaalsContact CD-CG2 3.45Å; E181-T217 HydrophobicContact CG-CG2 4.44Å; E181-T217 VanDerWaalsContact OE1-CG2 3.25Å; E181-T217 WeakPolarHBondContact OE1-CG2 3.28Å; E181-T217 VanDerWaalsContact OE2-CB 3.32Å; E181-T217 WeakPolarHBondContact OE2-CB 3.43Å; E181-T217 WeakPolarHBondContact OE2-CG2 3.44Å; A189-T217 HydrophobicContact CB-CG2 3.79Å; L213-T217 HydrophobicContact CD1-CG2 4.01Å; T217-A250 VanDerWaalsContact O-CB 3.25Å; T217-A250 WeakPolarHBondContact O-CB 3.42Å
218	R	93.6	Very high	94.1	Very high	138 Å²	138	53 Å²	53	52%	0.521	28%	0.279	S	S	.	.			trans	-70.2	151.6	176.9	-64.1	-178.2	-68.6	153.8	-3.6	110.2	D216 E220 S221 I222	D216-R218 HydrophobicContact CB-CG 4.41Å; D216-R218 WeakPolarHBondContact OD1-CB 3.42Å; D216-R218 VanDerWaalsContact OD1-CG 3.3Å; D216-R218 WeakPolarHBondContact OD1-CG 3.16Å; D216-R218 PolarHBondContact OD1-N 3.28Å; D216-R218 IonicContact OD1-NE 3.39Å; D216-R218 PolarHBondContact OD1-NE 3.26Å; D216-R218 IonicContact OD2-CZ 3.57Å; D216-R218 IonicContact OD2-NE 3.12Å; D216-R218 PolarHBondContact OD2-NE 3.48Å; D216-R218 IonicContact OD2-NH2 2.69Å; D216-R218 PolarHBondContact OD2-NH2 3.05Å; R218-E220 IonicContact NH1-OE2 3.63Å; R218-E220 PolarHBondContact O-N 3.22Å; R218-S221 PolarHBondContact O-N 2.69Å; R218-I222 WeakPolarHBondContact O-CG1 3.5Å; R218-I222 PolarHBondContact O-N 2.84Å
219	G	93.9	Very high	94.2	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-56.9	-33.8	178.5	0	0	0	0	0	114.1	F223 A250 F258	G219-F223 VanDerWaalsContact O-CB 3.31Å; G219-F223 WeakPolarHBondContact O-CB 3.33Å; G219-F223 PolarHBondContact O-N 2.87Å; G219-A250 WeakPolarHBondContact CA-O 3.19Å; G219-F258 WeakPolarHBondContact O-CA 3.46Å
220	E	94.9	Very high	94.3	Very high	90 Å²	90	52.2 Å²	52.2	42%	0.421	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-49	173.8	-176.3	174.4	-155	0	0	112	R218 I222 F223 L224	R218-E220 IonicContact NH1-OE2 3.63Å; R218-E220 PolarHBondContact O-N 3.22Å; E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 3.41Å; E220-F223 WeakPolarHBondContact O-CB 3.32Å; E220-F223 PolarHBondContact O-N 2.88Å; E220-F223 VanDerWaalsContact O-N 3.15Å; E220-L224 HydrophobicContact CG-CD1 4.35Å; E220-L224 WeakPolarHBondContact O-CG 3.29Å; E220-L224 PolarHBondContact O-N 3.39Å
221	S	95	Very high	94.4	Very high	17 Å²	17	55.5 Å²	55.5	12%	0.119	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-41.9	179.2	-52.7	0	0	0	0	111.8	D216 R218 F223 L224 V225	D216-S221 WeakPolarHBondContact OD1-CB 3.43Å; D216-S221 PolarHBondContact OD1-OG 2.83Å; R218-S221 PolarHBondContact O-N 2.69Å; S221-F223 VanDerWaalsContact C-N 3.31Å; S221-F223 PolarHBondContact O-N 3.26Å; S221-L224 PolarHBondContact O-N 3.11Å; S221-V225 WeakPolarHBondContact O-CG2 3.25Å; S221-V225 PolarHBondContact O-N 2.78Å
222	I	95.7	Very high	94.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-41.6	175.1	-64.9	166.4	0	0	0	110.7	L179 L191 L213 R218 E220 L226 M251 F258	L179-I222 HydrophobicContact CD1-CG2 4.31Å; L191-I222 HydrophobicContact CD1-CG2 3.73Å; L191-I222 HydrophobicContact CD2-CG2 3.78Å; L191-I222 HydrophobicContact CG-CG2 4.42Å; L213-I222 HydrophobicContact CD1-CD1 4.48Å; L213-I222 HydrophobicContact CD1-CG1 3.92Å; L213-I222 HydrophobicContact CD2-CG1 3.99Å; R218-I222 WeakPolarHBondContact O-CG1 3.5Å; R218-I222 PolarHBondContact O-N 2.84Å; E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 3.41Å; I222-L226 PolarHBondContact O-N 3.01Å; I222-L226 VanDerWaalsContact O-N 3.14Å; I222-M251 HydrophobicContact CD1-SD 3.62Å; I222-M251 HydrophobicContact CG2-CE 4.27Å; I222-M251 HydrophobicContact CG2-SD 4.25Å; I222-F258 HydrophobicContact CB-CD2 4.37Å; I222-F258 HydrophobicContact CG2-CB 4.39Å; I222-F258 HydrophobicContact CG2-CD2 3.71Å; I222-F258 HydrophobicContact CG2-CE2 4.33Å; I222-F258 HydrophobicContact CG2-CG 4.17Å
223	F	96.5	Very high	94.7	Very high	17 Å²	17	55 Å²	55	8%	0.075	28%	0.28	C	S	.	.	H	α-helix	trans	-65.3	-42.5	177.1	171.5	-101.8	0	0	0	112.3	G219 E220 S221 L226 K227 F258 H261 L262 I265	G219-F223 VanDerWaalsContact O-CB 3.31Å; G219-F223 WeakPolarHBondContact O-CB 3.33Å; G219-F223 PolarHBondContact O-N 2.87Å; E220-F223 WeakPolarHBondContact O-CB 3.32Å; E220-F223 PolarHBondContact O-N 2.88Å; E220-F223 VanDerWaalsContact O-N 3.15Å; S221-F223 VanDerWaalsContact C-N 3.31Å; S221-F223 PolarHBondContact O-N 3.26Å; F223-L226 PolarHBondContact O-N 3.23Å; F223-K227 HydrophobicContact CE1-CD 4.03Å; F223-K227 HydrophobicContact CZ-CB 4.47Å; F223-K227 HydrophobicContact CZ-CD 4.16Å; F223-K227 VanDerWaalsContact O-CB 3.25Å; F223-K227 WeakPolarHBondContact O-CB 3.45Å; F223-K227 PolarHBondContact O-N 2.77Å; F223-F258 HydrophobicContact CB-CD2 3.82Å; F223-F258 HydrophobicContact CB-CE2 4.3Å; F223-F258 HydrophobicContact CD2-CD2 4.47Å; F223-F258 HydrophobicContact CD2-CE2 4.29Å; F223-H261 HydrophobicContact CB-CB 4Å; F223-H261 HydrophobicContact CD1-CB 3.78Å; F223-H261 HydrophobicContact CD2-CB 3.85Å; F223-H261 HydrophobicContact CE1-CB 4.2Å; F223-H261 HydrophobicContact CE2-CB 4.28Å; F223-H261 HydrophobicContact CG-CB 3.58Å; F223-H261 HydrophobicContact CZ-CB 4.42Å; F223-L262 HydrophobicContact CD2-CB 4.4Å; F223-L262 HydrophobicContact CE2-CB 4.42Å; F223-L262 HydrophobicContact CE2-CD1 4.35Å; F223-I265 HydrophobicContact CE2-CD1 4.29Å; F223-I265 HydrophobicContact CZ-CD1 3.6Å; F223-I265 HydrophobicContact CZ-CG1 4.37Å
224	L	96.2	Very high	94.9	Very high	75 Å²	75	61.2 Å²	61.2	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.7	-70.1	174.1	0	0	0	111.6	E220 S221 L226 K227 D228	E220-L224 HydrophobicContact CG-CD1 4.35Å; E220-L224 WeakPolarHBondContact O-CG 3.29Å; E220-L224 PolarHBondContact O-N 3.39Å; S221-L224 PolarHBondContact O-N 3.11Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 2.85Å; L224-K227 PolarHBondContact O-N 2.83Å; L224-K227 VanDerWaalsContact O-N 3.15Å; L224-D228 WeakPolarHBondContact O-CB 2.81Å; L224-D228 PolarHBondContact O-N 3.42Å
225	V	96.6	Very high	95.3	Very high	32 Å²	32	55.9 Å²	55.9	19%	0.194	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-42.1	176.5	170.9	0	0	0	0	112.1	L191 F209 K211 L213 S221 F229	L191-V225 HydrophobicContact CD2-CB 4.33Å; L191-V225 HydrophobicContact CD2-CG1 4.04Å; F209-V225 HydrophobicContact CE2-CG1 4.47Å; K211-V225 HydrophobicContact CB-CG1 3.95Å; K211-V225 HydrophobicContact CD-CG1 3.92Å; L213-V225 HydrophobicContact CD2-CG2 4Å; S221-V225 WeakPolarHBondContact O-CG2 3.25Å; S221-V225 PolarHBondContact O-N 2.78Å; V225-F229 WeakPolarHBondContact O-CB 3.33Å; V225-F229 PolarHBondContact O-N 2.98Å
226	L	96.7	Very high	95.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-47.7	175.2	-176.6	74.3	0	0	0	111.2	L177 F209 I222 F223 L224 F229 F230 F258	L177-L226 HydrophobicContact CD1-CD1 4.46Å; L177-L226 HydrophobicContact CD2-CD1 3.86Å; L177-L226 HydrophobicContact CD2-CD2 3.6Å; L177-L226 HydrophobicContact CD2-CG 4.41Å; F209-L226 HydrophobicContact CE1-CD1 3.92Å; F209-L226 HydrophobicContact CZ-CD1 3.96Å; I222-L226 PolarHBondContact O-N 3.01Å; I222-L226 VanDerWaalsContact O-N 3.14Å; F223-L226 PolarHBondContact O-N 3.23Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 2.85Å; L226-F229 PolarHBondContact O-N 3.34Å; L226-F230 HydrophobicContact CD1-CD2 3.89Å; L226-F230 HydrophobicContact CD1-CE2 3.39Å; L226-F230 HydrophobicContact CD1-CZ 4.15Å; L226-F230 HydrophobicContact CG-CD2 4.07Å; L226-F230 HydrophobicContact CG-CE2 3.98Å; L226-F230 WeakPolarHBondContact O-CD2 3.21Å; L226-F230 PolarHBondContact O-N 2.84Å; L226-F258 HydrophobicContact CB-CE2 4.33Å; L226-F258 HydrophobicContact CD2-CE2 3.57Å; L226-F258 HydrophobicContact CD2-CZ 3.56Å
227	K	96.8	Very high	96.2	Very high	62 Å²	62	51.8 Å²	51.8	27%	0.27	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-48.4	-178.3	-178.6	-176.7	168.2	-168.6	0	110.9	F223 L224 F229 F230 E231 L237	F223-K227 HydrophobicContact CE1-CD 4.03Å; F223-K227 HydrophobicContact CZ-CB 4.47Å; F223-K227 HydrophobicContact CZ-CD 4.16Å; F223-K227 VanDerWaalsContact O-CB 3.25Å; F223-K227 WeakPolarHBondContact O-CB 3.45Å; F223-K227 PolarHBondContact O-N 2.77Å; L224-K227 PolarHBondContact O-N 2.83Å; L224-K227 VanDerWaalsContact O-N 3.15Å; K227-F229 VanDerWaalsContact C-N 3.31Å; K227-F229 PolarHBondContact O-N 3.33Å; K227-F230 PolarHBondContact O-N 3.14Å; K227-F230 VanDerWaalsContact O-N 3.1Å; K227-E231 WeakPolarHBondContact CE-OE1 3.3Å; K227-E231 HydrophobicContact CG-CG 4.43Å; K227-E231 IonicContact NZ-OE1 2.82Å; K227-E231 WeakPolarHBondContact O-CG 3.25Å; K227-E231 PolarHBondContact O-N 3.1Å; K227-L237 HydrophobicContact CG-CD1 4.45Å
228	D	97.1	Very high	96.4	Very high	91 Å²	91	53 Å²	53	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-59.9	-41.9	179.3	-66.8	-10.2	0	0	0	110.9	L224 E231 E232	L224-D228 WeakPolarHBondContact O-CB 2.81Å; L224-D228 PolarHBondContact O-N 3.42Å; D228-E231 PolarHBondContact O-N 3.15Å; D228-E232 VanDerWaalsContact O-CB 3.27Å; D228-E232 WeakPolarHBondContact O-CB 3.38Å; D228-E232 PolarHBondContact O-N 3.1Å
229	F	97.4	Very high	96.6	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-43.3	174.3	179.6	-95.8	0	0	0	112.2	L208 F209 V225 L226 K227 E232 K233 I235	L208-F229 HydrophobicContact CD1-CE1 3.8Å; L208-F229 HydrophobicContact CD1-CZ 4.16Å; L208-F229 HydrophobicContact CD2-CD1 4.27Å; L208-F229 HydrophobicContact CD2-CE1 3.83Å; L208-F229 HydrophobicContact CG-CD1 4.49Å; L208-F229 HydrophobicContact CG-CE1 3.65Å; L208-F229 HydrophobicContact CG-CZ 4.12Å; F209-F229 HydrophobicContact CB-CE2 4.34Å; F209-F229 HydrophobicContact CD1-CB 4.41Å; F209-F229 AromaticContact CD1-CD1 3.63Å; F209-F229 HydrophobicContact CD1-CD1 3.63Å; F209-F229 AromaticContact CD1-CD2 4Å; F209-F229 HydrophobicContact CD1-CD2 4Å; F209-F229 AromaticContact CD1-CE1 3.79Å; F209-F229 HydrophobicContact CD1-CE1 3.79Å; F209-F229 HydrophobicContact CD1-CE2 4.1Å; F209-F229 AromaticContact CD1-CG 3.73Å; F209-F229 HydrophobicContact CD1-CG 3.73Å; F209-F229 AromaticContact CD1-CZ 3.99Å; F209-F229 HydrophobicContact CD1-CZ 3.99Å; F209-F229 HydrophobicContact CE1-CB 4.15Å; F209-F229 AromaticContact CE1-CD1 3.75Å; F209-F229 HydrophobicContact CE1-CD1 3.75Å; F209-F229 HydrophobicContact CE1-CE1 4.3Å; F209-F229 AromaticContact CE1-CG 3.89Å; F209-F229 HydrophobicContact CE1-CG 3.89Å; V225-F229 WeakPolarHBondContact O-CB 3.33Å; V225-F229 PolarHBondContact O-N 2.98Å; L226-F229 PolarHBondContact O-N 3.34Å; K227-F229 VanDerWaalsContact C-N 3.31Å; K227-F229 PolarHBondContact O-N 3.33Å; F229-E232 PolarHBondContact O-N 3.08Å; F229-K233 HydrophobicContact CD1-CG 4.39Å; F229-K233 HydrophobicContact CD2-CG 4.25Å; F229-K233 HydrophobicContact CE1-CG 4.03Å; F229-K233 HydrophobicContact CE2-CG 3.92Å; F229-K233 HydrophobicContact CZ-CG 3.81Å; F229-K233 WeakPolarHBondContact O-CB 3.39Å; F229-K233 WeakPolarHBondContact O-CG 3.35Å; F229-K233 PolarHBondContact O-N 3.03Å; F229-I235 HydrophobicContact CE1-CD1 4.49Å
230	F	97.7	Very high	96.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-36.9	179.8	-86.3	-126.9	0	0	0	111.8	F175 L208 L226 K227 E234 I235 L237 I240	F175-F230 HydrophobicContact CE2-CE1 4.2Å; F175-F230 AromaticContact CE2-CZ 3.94Å; F175-F230 HydrophobicContact CE2-CZ 3.94Å; F175-F230 AromaticContact CZ-CE1 3.65Å; F175-F230 HydrophobicContact CZ-CE1 3.65Å; F175-F230 AromaticContact CZ-CZ 3.77Å; F175-F230 HydrophobicContact CZ-CZ 3.77Å; L208-F230 HydrophobicContact CD2-CE2 3.75Å; L208-F230 HydrophobicContact CD2-CZ 4.19Å; L226-F230 HydrophobicContact CD1-CD2 3.89Å; L226-F230 HydrophobicContact CD1-CE2 3.39Å; L226-F230 HydrophobicContact CD1-CZ 4.15Å; L226-F230 HydrophobicContact CG-CD2 4.07Å; L226-F230 HydrophobicContact CG-CE2 3.98Å; L226-F230 WeakPolarHBondContact O-CD2 3.21Å; L226-F230 PolarHBondContact O-N 2.84Å; K227-F230 PolarHBondContact O-N 3.14Å; K227-F230 VanDerWaalsContact O-N 3.1Å; F230-E234 CarbonylContact O-C 3.48Å; F230-E234 WeakPolarHBondContact O-CA 3.23Å; F230-E234 PolarHBondContact O-N 3.02Å; F230-I235 HydrophobicContact CD1-CB 3.86Å; F230-I235 HydrophobicContact CD1-CG2 3.71Å; F230-I235 WeakPolarHBondContact CD1-O 3.47Å; F230-I235 HydrophobicContact CE1-CB 4.33Å; F230-I235 HydrophobicContact CE1-CG2 3.72Å; F230-I235 HydrophobicContact CG-CB 4.23Å; F230-I235 HydrophobicContact CZ-CG2 4.49Å; F230-I235 PolarHBondContact O-N 2.84Å; F230-L237 HydrophobicContact CB-CD2 4.14Å; F230-L237 HydrophobicContact CB-CG 4.41Å; F230-L237 HydrophobicContact CD1-CD2 3.48Å; F230-L237 VanDerWaalsContact CD1-CD2 3.48Å; F230-L237 HydrophobicContact CD1-CG 4.06Å; F230-L237 HydrophobicContact CE1-CD2 3.98Å; F230-L237 HydrophobicContact CG-CD2 3.86Å; F230-I240 HydrophobicContact CD1-CD1 4.49Å; F230-I240 HydrophobicContact CE1-CD1 3.65Å; F230-I240 HydrophobicContact CE1-CG1 3.9Å; F230-I240 HydrophobicContact CZ-CD1 3.98Å; F230-I240 HydrophobicContact CZ-CG1 4.34Å
231	E	97.3	Very high	96.7	Very high	118 Å²	118	45.4 Å²	45.4	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-67.5	-46.1	173.5	-72.4	-178.4	173.4	0	0	111.3	K227 D228 K233 E234	K227-E231 WeakPolarHBondContact CE-OE1 3.3Å; K227-E231 HydrophobicContact CG-CG 4.43Å; K227-E231 IonicContact NZ-OE1 2.82Å; K227-E231 WeakPolarHBondContact O-CG 3.25Å; K227-E231 PolarHBondContact O-N 3.1Å; D228-E231 PolarHBondContact O-N 3.15Å; E231-K233 VanDerWaalsContact C-N 3.29Å; E231-K233 PolarHBondContact O-N 3.44Å; E231-E234 PolarHBondContact O-N 2.79Å; E231-E234 VanDerWaalsContact O-N 3.16Å
232	E	97.5	Very high	96.7	Very high	117 Å²	117	44.8 Å²	44.8	55%	0.547	23%	0.233	S	C	.	.	H	α-helix	trans	-56.5	-43.3	175.8	-173.9	-158.3	136.4	0	0	111.6	D228 F229	D228-E232 VanDerWaalsContact O-CB 3.27Å; D228-E232 WeakPolarHBondContact O-CB 3.38Å; D228-E232 PolarHBondContact O-N 3.1Å; F229-E232 PolarHBondContact O-N 3.08Å
233	K	96.8	Very high	96.6	Very high	48 Å²	48	44.8 Å²	44.8	21%	0.209	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1.2	-178.6	-57.6	-51.1	-171.8	-168.3	0	113.9	E163 C167 K171 F229 E231 I235	E163-K233 WeakPolarHBondContact OE1-CE 3.33Å; E163-K233 IonicContact OE1-NZ 2.77Å; E163-K233 PolarHBondContact OE1-NZ 3.34Å; C167-K233 HydrophobicContact CB-CB 4.32Å; K171-K233 WeakPolarHBondContact CE-O 3.44Å; K171-K233 PolarHBondContact NZ-O 2.95Å; F229-K233 HydrophobicContact CD1-CG 4.39Å; F229-K233 HydrophobicContact CD2-CG 4.25Å; F229-K233 HydrophobicContact CE1-CG 4.03Å; F229-K233 HydrophobicContact CE2-CG 3.92Å; F229-K233 HydrophobicContact CZ-CG 3.81Å; F229-K233 WeakPolarHBondContact O-CB 3.39Å; F229-K233 WeakPolarHBondContact O-CG 3.35Å; F229-K233 PolarHBondContact O-N 3.03Å; E231-K233 VanDerWaalsContact C-N 3.29Å; E231-K233 PolarHBondContact O-N 3.44Å; K233-I235 HydrophobicContact CB-CD1 3.94Å; K233-I235 HydrophobicContact CB-CG1 3.98Å; K233-I235 PolarHBondContact O-N 2.8Å
234	E	97.7	Very high	96.4	Very high	139 Å²	139	44.2 Å²	44.2	65%	0.65	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	37.2	-176	-48.3	171.4	152.7	0	0	113.7	K171 F230 E231 P236	K171-E234 IonicContact NZ-OE2 3.29Å; K171-E234 PolarHBondContact NZ-OE2 3.3Å; F230-E234 CarbonylContact O-C 3.48Å; F230-E234 WeakPolarHBondContact O-CA 3.23Å; F230-E234 PolarHBondContact O-N 3.02Å; E231-E234 PolarHBondContact O-N 2.79Å; E231-E234 VanDerWaalsContact O-N 3.16Å; E234-P236 WeakPolarHBondContact O-CD 3.25Å
235	I	98	Very high	96.2	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.036	21%	0.213	C	C	.	.			trans	-90.6	119.8	176.2	-59.8	171.3	0	0	0	108.4	C167 L170 K171 F175 F229 F230 K233 L237	C167-I235 HydrophobicContact CB-CD1 4.05Å; L170-I235 HydrophobicContact CB-CD1 4.14Å; L170-I235 HydrophobicContact CB-CG2 4.21Å; L170-I235 HydrophobicContact CD1-CD1 4.28Å; K171-I235 HydrophobicContact CG-CG1 4.27Å; F175-I235 HydrophobicContact CE1-CG2 4.05Å; F175-I235 HydrophobicContact CZ-CG2 3.99Å; F229-I235 HydrophobicContact CE1-CD1 4.49Å; F230-I235 HydrophobicContact CD1-CB 3.86Å; F230-I235 HydrophobicContact CD1-CG2 3.71Å; F230-I235 WeakPolarHBondContact CD1-O 3.47Å; F230-I235 HydrophobicContact CE1-CB 4.33Å; F230-I235 HydrophobicContact CE1-CG2 3.72Å; F230-I235 HydrophobicContact CG-CB 4.23Å; F230-I235 HydrophobicContact CZ-CG2 4.49Å; F230-I235 PolarHBondContact O-N 2.84Å; K233-I235 HydrophobicContact CB-CD1 3.94Å; K233-I235 HydrophobicContact CB-CG1 3.98Å; K233-I235 PolarHBondContact O-N 2.8Å; I235-L237 PolarHBondContact O-N 3.32Å
236	P	97.5	Very high	95.6	Very high	52 Å²	52	41.1 Å²	41.1	34%	0.338	21%	0.214	S	C	.	.			trans	-63.8	124.4	176.9	-21.6	33.4	0	0	0	111.5	E234 S238 N239	E234-P236 WeakPolarHBondContact O-CD 3.25Å; P236-S238 WeakPolarHBondContact CB-OG 3.25Å; P236-S238 PolarHBondContact O-N 2.87Å; P236-S238 VanDerWaalsContact O-N 3.15Å; P236-N239 WeakPolarHBondContact O-CB 3.35Å; P236-N239 PolarHBondContact O-N 3.46Å
237	L	96.7	Very high	95.1	Very high	22 Å²	22	41.8 Å²	41.8	12%	0.115	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-58	-28.4	174.2	-74.2	168.7	0	0	0	112.2	K227 F230 I235 N239 I240 L262 I265 V266	K227-L237 HydrophobicContact CG-CD1 4.45Å; F230-L237 HydrophobicContact CB-CD2 4.14Å; F230-L237 HydrophobicContact CB-CG 4.41Å; F230-L237 HydrophobicContact CD1-CD2 3.48Å; F230-L237 VanDerWaalsContact CD1-CD2 3.48Å; F230-L237 HydrophobicContact CD1-CG 4.06Å; F230-L237 HydrophobicContact CE1-CD2 3.98Å; F230-L237 HydrophobicContact CG-CD2 3.86Å; I235-L237 PolarHBondContact O-N 3.32Å; L237-N239 PolarHBondContact O-N 2.59Å; L237-N239 VanDerWaalsContact O-N 3.14Å; L237-I240 HydrophobicContact CD2-CD1 3.8Å; L237-I240 WeakPolarHBondContact O-CB 3.23Å; L237-I240 WeakPolarHBondContact O-CG1 3.35Å; L237-I240 PolarHBondContact O-N 2.95Å; L237-L262 HydrophobicContact CD2-CD1 4.41Å; L237-I265 HydrophobicContact CB-CG2 4.19Å; L237-I265 HydrophobicContact CD1-CD1 3.85Å; L237-I265 HydrophobicContact CD1-CG2 4.08Å; L237-V266 HydrophobicContact CB-CG2 4.24Å; L237-V266 WeakPolarHBondContact O-CG2 3.41Å
238	S	96	Very high	94.7	Very high	81 Å²	81	40.2 Å²	40.2	57%	0.566	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-61	-16.9	175.2	55.8	0	0	0	0	114.4	P236 I240	P236-S238 WeakPolarHBondContact CB-OG 3.25Å; P236-S238 PolarHBondContact O-N 2.87Å; P236-S238 VanDerWaalsContact O-N 3.15Å; S238-I240 PolarHBondContact O-N 3.19Å
239	N	96.6	Very high	94.4	Very high	24 Å²	24	41.2 Å²	41.2	13%	0.128	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-76.8	-12.9	175.8	-69.6	-1	0	0	0	112.6	L170 K171 Q174 F175 P236 L237 T241	L170-N239 PolarHBondContact O-ND2 3.36Å; K171-N239 PolarHBondContact O-ND2 3.16Å; Q174-N239 VanDerWaalsContact CA-O 3.32Å; Q174-N239 WeakPolarHBondContact CA-O 3.37Å; F175-N239 HydrophobicContact CD1-CB 4.17Å; F175-N239 HydrophobicContact CE1-CB 3.74Å; F175-N239 PolarHBondContact N-O 3.02Å; P236-N239 WeakPolarHBondContact O-CB 3.35Å; P236-N239 PolarHBondContact O-N 3.46Å; L237-N239 PolarHBondContact O-N 2.59Å; L237-N239 VanDerWaalsContact O-N 3.14Å; N239-T241 PolarHBondContact O-N 2.8Å
240	I	97	Very high	94.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	115.3	175.7	-53.4	170.3	0	0	0	109	F175 L177 F230 L237 S238 A242 L262 I269	F175-I240 HydrophobicContact CE2-CG1 3.8Å; F175-I240 HydrophobicContact CZ-CG1 3.94Å; F175-I240 CarbonylContact O-C 3.58Å; F175-I240 WeakPolarHBondContact O-CA 3.24Å; L177-I240 HydrophobicContact CB-CG2 4.09Å; L177-I240 HydrophobicContact CD2-CD1 4.4Å; F230-I240 HydrophobicContact CD1-CD1 4.49Å; F230-I240 HydrophobicContact CE1-CD1 3.65Å; F230-I240 HydrophobicContact CE1-CG1 3.9Å; F230-I240 HydrophobicContact CZ-CD1 3.98Å; F230-I240 HydrophobicContact CZ-CG1 4.34Å; L237-I240 HydrophobicContact CD2-CD1 3.8Å; L237-I240 WeakPolarHBondContact O-CB 3.23Å; L237-I240 WeakPolarHBondContact O-CG1 3.35Å; L237-I240 PolarHBondContact O-N 2.95Å; S238-I240 PolarHBondContact O-N 3.19Å; I240-A242 WeakPolarHBondContact CG2-O 3.37Å; I240-L262 HydrophobicContact CD1-CD1 4.34Å; I240-I269 HydrophobicContact CB-CD1 4.35Å; I240-I269 HydrophobicContact CG2-CD1 3.57Å; I240-I269 HydrophobicContact CG2-CG1 4.35Å
241	T	94.9	Very high	93.9	Very high	44 Å²	44	42.8 Å²	42.8	27%	0.27	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-32	179.8	56.4	0	0	0	0	113	Q174 F175 N239 V270	Q174-T241 HydrophobicContact CB-CG2 3.73Å; Q174-T241 HydrophobicContact CG-CG2 4.01Å; F175-T241 PolarHBondContact O-N 2.76Å; F175-T241 PolarHBondContact O-OG1 3.03Å; N239-T241 PolarHBondContact O-N 2.8Å; T241-V270 PolarHBondContact O-N 3.14Å; T241-V270 VanDerWaalsContact O-N 3.08Å
242	A	93.8	Very high	93.6	Very high	3 Å²	3	40 Å²	40	3%	0.025	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	154.7	-179.4	0	0	0	0	0	110.9	S176 L177 I240 V270 F528	S176-A242 CarbonylContact C-O 3.5Å; S176-A242 WeakPolarHBondContact CA-O 3.5Å; L177-A242 PolarHBondContact N-O 3.43Å; I240-A242 WeakPolarHBondContact CG2-O 3.37Å; A242-V270 CarbonylContact C-O 3.24Å; A242-V270 WeakPolarHBondContact CA-O 3.39Å; A242-V270 HydrophobicContact CB-CB 3.99Å; A242-V270 WeakPolarHBondContact CB-O 3.39Å; A242-F528 HydrophobicContact CB-CD1 4.12Å; A242-F528 HydrophobicContact CB-CD2 4.38Å; A242-F528 HydrophobicContact CB-CE1 4.32Å; A242-F528 HydrophobicContact CB-CG 4.19Å
243	V	94.6	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.3	172.7	65.9	0	0	0	0	112.2	L177 T245 F258 I259 L262 I269 V270 V272	L177-V243 HydrophobicContact CB-CG2 4.19Å; L177-V243 HydrophobicContact CD2-CG2 4.24Å; L177-V243 HydrophobicContact CG-CG2 4.35Å; L177-V243 CarbonylContact O-C 3.55Å; L177-V243 VanDerWaalsContact O-CA 3.23Å; L177-V243 WeakPolarHBondContact O-CA 3.29Å; V243-T245 HydrophobicContact CG2-CG2 4.1Å; V243-F258 HydrophobicContact CG2-CE1 3.81Å; V243-I259 HydrophobicContact CG1-CD1 4.34Å; V243-I259 HydrophobicContact CG1-CG1 4.08Å; V243-L262 HydrophobicContact CG1-CD2 4.36Å; V243-I269 HydrophobicContact CB-CD1 3.96Å; V243-I269 HydrophobicContact CG1-CD1 3.78Å; V243-I269 HydrophobicContact CG1-CG1 4.33Å; V243-V270 PolarHBondContact N-O 3.07Å; V243-V272 PolarHBondContact O-N 3.37Å
244	A	91.7	Very high	93	Very high	6 Å²	6	44.4 Å²	44.4	5%	0.05	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.2	175.4	0	0	0	0	0	110.7	L177 Q178 L179 V272	L177-A244 PolarHBondContact O-N 3.37Å; Q178-A244 WeakPolarHBondContact CA-O 3.27Å; Q178-A244 HydrophobicContact CB-CB 4.29Å; Q178-A244 HydrophobicContact CG-CB 4.25Å; L179-A244 PolarHBondContact N-O 2.88Å; A244-V272 WeakPolarHBondContact CA-O 3.48Å
245	T	91.6	Very high	92.6	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	161.3	179.6	67.8	0	0	0	0	111.2	V243 G247 M251 I259 V272 C274	V243-T245 HydrophobicContact CG2-CG2 4.1Å; T245-G247 PolarHBondContact O-N 3.41Å; T245-M251 HydrophobicContact CG2-CB 4.08Å; T245-M251 HydrophobicContact CG2-CE 3.55Å; T245-M251 HydrophobicContact CG2-CG 4.48Å; T245-I259 HydrophobicContact CG2-CD1 4.15Å; T245-I259 HydrophobicContact CG2-CG1 4.41Å; T245-V272 PolarHBondContact N-O 3.5Å; T245-C274 WeakPolarHBondContact O-CB 3.34Å; T245-C274 PolarHBondContact O-N 3.09Å
246	D	84.3	Confident	92.3	Very high	40 Å²	40	55 Å²	55	21%	0.214	29%	0.291	C	S	.	.			trans	-66.7	-12.8	177.5	78.8	-28.1	0	0	0	113.9	A248 H273 H277	D246-A248 WeakPolarHBondContact OD1-CB 3.32Å; D246-A248 PolarHBondContact OD1-N 2.92Å; D246-H273 VanDerWaalsContact C-CD2 3.41Å; D246-H273 PolarHBondContact O-CD2 2.88Å; D246-H273 PolarHBondContact O-NE2 2.9Å; D246-H277 PolarHBondContact O-CD2 3.05Å; D246-H277 PolarHBondContact O-ND1 3.48Å
247	G	85.5	Confident	92.1	Very high	14 Å²	14	52.5 Å²	52.5	14%	0.144	28%	0.275	C	S	.	.			trans	86.4	8.8	179.6	0	0	0	0	0	115.7	T245 T252 H273	T245-G247 PolarHBondContact O-N 3.41Å; G247-T252 PolarHBondContact O-OG1 3.26Å; G247-T252 VanDerWaalsContact O-OG1 3.11Å; G247-H273 WeakPolarHBondContact CA-CD2 3.44Å; G247-H273 WeakPolarHBondContact CA-NE2 3.43Å; G247-H273 PolarHBondContact N-CD2 3.16Å
248	A	88.4	Confident	92.1	Very high	28 Å²	28	51.4 Å²	51.4	23%	0.231	27%	0.27	C	S	.	.			trans	-53.2	150	174	0	0	0	0	0	110.8	D246 A250 M251 T252	D246-A248 WeakPolarHBondContact OD1-CB 3.32Å; D246-A248 PolarHBondContact OD1-N 2.92Å; A248-A250 PolarHBondContact O-N 2.73Å; A248-A250 VanDerWaalsContact O-N 3.13Å; A248-M251 HydrophobicContact CB-CG 4.33Å; A248-M251 WeakPolarHBondContact O-CA 2.77Å; A248-M251 WeakPolarHBondContact O-CB 3.35Å; A248-M251 PolarHBondContact O-N 2.87Å; A248-T252 PolarHBondContact O-N 3.15Å; A248-T252 PolarHBondContact O-OG1 3.11Å
249	P	90.4	Very high	92.1	Very high	113 Å²	113	48.2 Å²	48.2	73%	0.734	25%	0.246	S	C	*	.	H	α-helix	trans	-55.4	-31.3	177.7	-27.7	35.5	0	0	0	113.7	M251 G253	P249-M251 VanDerWaalsContact C-N 3.25Å; P249-M251 PolarHBondContact O-N 3.03Å; P249-G253 VanDerWaalsContact O-CA 3.24Å; P249-G253 WeakPolarHBondContact O-CA 3.2Å; P249-G253 PolarHBondContact O-N 2.93Å
250	A	92.1	Very high	92	Very high	28 Å²	28	47.9 Å²	47.9	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-29.1	173	0	0	0	0	0	112.8	T217 G219 A248 G257 F258	T217-A250 VanDerWaalsContact O-CB 3.25Å; T217-A250 WeakPolarHBondContact O-CB 3.42Å; G219-A250 WeakPolarHBondContact CA-O 3.19Å; A248-A250 PolarHBondContact O-N 2.73Å; A248-A250 VanDerWaalsContact O-N 3.13Å; A250-G257 CarbonylContact O-C 3.4Å; A250-G257 VanDerWaalsContact O-CA 3.22Å; A250-G257 WeakPolarHBondContact O-CA 3.38Å; A250-F258 PolarHBondContact O-N 3.13Å
251	M	93.6	Very high	92	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-88.7	-49.9	179.7	-58	-54.1	-79.8	0	0	112	L179 I222 T245 A248 P249 F258 I259	L179-M251 HydrophobicContact CB-CE 3.57Å; L179-M251 HydrophobicContact CD1-CE 3.93Å; L179-M251 HydrophobicContact CG-CE 4.42Å; I222-M251 HydrophobicContact CD1-SD 3.62Å; I222-M251 HydrophobicContact CG2-CE 4.27Å; I222-M251 HydrophobicContact CG2-SD 4.25Å; T245-M251 HydrophobicContact CG2-CB 4.08Å; T245-M251 HydrophobicContact CG2-CE 3.55Å; T245-M251 HydrophobicContact CG2-CG 4.48Å; A248-M251 HydrophobicContact CB-CG 4.33Å; A248-M251 WeakPolarHBondContact O-CA 2.77Å; A248-M251 WeakPolarHBondContact O-CB 3.35Å; A248-M251 PolarHBondContact O-N 2.87Å; P249-M251 VanDerWaalsContact C-N 3.25Å; P249-M251 PolarHBondContact O-N 3.03Å; M251-F258 HydrophobicContact CE-CB 4.33Å; M251-F258 HydrophobicContact CE-CD1 4.04Å; M251-F258 HydrophobicContact CE-CG 4.18Å; M251-F258 PolarHBondContact O-N 2.79Å; M251-F258 HydrophobicContact SD-CB 4.12Å; M251-I259 WeakPolarHBondContact O-CB 3.33Å; M251-I259 VanDerWaalsContact O-CG1 3.28Å; M251-I259 WeakPolarHBondContact O-CG1 3.37Å; M251-I259 PolarHBondContact O-N 2.84Å
252	T	90.9	Very high	92.1	Very high	59 Å²	59	47.1 Å²	47.1	36%	0.362	24%	0.24	S	C	.	.	H	α-helix	trans	-103	0	-169.7	59.6	0	0	0	0	114.6	G247 A248 R254 I259	G247-T252 PolarHBondContact O-OG1 3.26Å; G247-T252 VanDerWaalsContact O-OG1 3.11Å; A248-T252 PolarHBondContact O-N 3.15Å; A248-T252 PolarHBondContact O-OG1 3.11Å; T252-R254 PolarHBondContact O-N 3.46Å; T252-I259 HydrophobicContact CG2-CD1 3.87Å
253	G	91	Very high	92.2	Very high	21 Å²	21	51.4 Å²	51.4	22%	0.216	26%	0.258	C	S	.	.			trans	-53.2	130.5	-179.6	0	0	0	0	0	112.8	P249 Q255 G257 A260	P249-G253 VanDerWaalsContact O-CA 3.24Å; P249-G253 WeakPolarHBondContact O-CA 3.2Å; P249-G253 PolarHBondContact O-N 2.93Å; G253-Q255 VanDerWaalsContact C-N 3.26Å; G253-Q255 PolarHBondContact O-N 3.02Å; G253-Q255 VanDerWaalsContact O-N 3.13Å; G253-G257 VanDerWaalsContact O-CA 3.23Å; G253-G257 WeakPolarHBondContact O-CA 3.48Å; G253-G257 PolarHBondContact O-N 3.42Å; G253-A260 WeakPolarHBondContact O-CB 3.36Å
254	R	89.9	Confident	92.3	Very high	238 Å²	238	58.3 Å²	58.3	90%	0.898	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.3	-170.5	-172.5	175.1	-178.8	174	1.7	115.1	T252 A260	T252-R254 PolarHBondContact O-N 3.46Å; R254-A260 WeakPolarHBondContact O-CB 3.1Å
255	Q	89.5	Confident	92.4	Very high	155 Å²	155	62 Å²	62	72%	0.724	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	-34.7	-176.5	-67.6	-178.7	-5.8	0	0	113.7	G253	G253-Q255 VanDerWaalsContact C-N 3.26Å; G253-Q255 PolarHBondContact O-N 3.02Å; G253-Q255 VanDerWaalsContact O-N 3.13Å
256	R	92.4	Very high	92.6	Very high	212 Å²	212	62.6 Å²	62.6	80%	0.8	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	6.7	-175.1	-61.4	-175.5	178.8	-176.1	-2.1	113.2
257	G	93.9	Very high	93.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-80	151.5	176.8	0	0	0	0	0	110.9	A250 G253 I259 A260 H261	A250-G257 CarbonylContact O-C 3.4Å; A250-G257 VanDerWaalsContact O-CA 3.22Å; A250-G257 WeakPolarHBondContact O-CA 3.38Å; G253-G257 VanDerWaalsContact O-CA 3.23Å; G253-G257 WeakPolarHBondContact O-CA 3.48Å; G253-G257 PolarHBondContact O-N 3.42Å; G257-I259 PolarHBondContact O-N 2.81Å; G257-A260 WeakPolarHBondContact O-CB 3.12Å; G257-A260 PolarHBondContact O-N 3.15Å; G257-H261 PolarHBondContact O-CD2 3.04Å; G257-H261 VanDerWaalsContact O-CD2 3.29Å; G257-H261 PolarHBondContact O-N 2.95Å
258	F	95.9	Very high	93.5	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-47.3	-46.3	174	163.7	-93.6	0	0	0	112.2	L177 L179 G219 I222 F223 L226 V243 A250 M251 A260 H261 L262	L177-F258 HydrophobicContact CD2-CZ 4.37Å; L179-F258 HydrophobicContact CD1-CD1 4.04Å; L179-F258 HydrophobicContact CD1-CD2 4.13Å; L179-F258 HydrophobicContact CD1-CE1 3.52Å; L179-F258 HydrophobicContact CD1-CE2 3.56Å; L179-F258 HydrophobicContact CD1-CG 4.34Å; L179-F258 HydrophobicContact CD1-CZ 3.24Å; G219-F258 WeakPolarHBondContact O-CA 3.46Å; I222-F258 HydrophobicContact CB-CD2 4.37Å; I222-F258 HydrophobicContact CG2-CB 4.39Å; I222-F258 HydrophobicContact CG2-CD2 3.71Å; I222-F258 HydrophobicContact CG2-CE2 4.33Å; I222-F258 HydrophobicContact CG2-CG 4.17Å; F223-F258 HydrophobicContact CB-CD2 3.82Å; F223-F258 HydrophobicContact CB-CE2 4.3Å; F223-F258 HydrophobicContact CD2-CD2 4.47Å; F223-F258 HydrophobicContact CD2-CE2 4.29Å; L226-F258 HydrophobicContact CB-CE2 4.33Å; L226-F258 HydrophobicContact CD2-CE2 3.57Å; L226-F258 HydrophobicContact CD2-CZ 3.56Å; V243-F258 HydrophobicContact CG2-CE1 3.81Å; A250-F258 PolarHBondContact O-N 3.13Å; M251-F258 HydrophobicContact CE-CB 4.33Å; M251-F258 HydrophobicContact CE-CD1 4.04Å; M251-F258 HydrophobicContact CE-CG 4.18Å; M251-F258 PolarHBondContact O-N 2.79Å; M251-F258 HydrophobicContact SD-CB 4.12Å; F258-A260 VanDerWaalsContact C-N 3.29Å; F258-A260 PolarHBondContact O-N 2.85Å; F258-H261 PolarHBondContact O-N 3.04Å; F258-L262 HydrophobicContact CE1-CB 4.49Å; F258-L262 HydrophobicContact CE1-CD2 3.8Å; F258-L262 HydrophobicContact CZ-CB 4.41Å; F258-L262 HydrophobicContact CZ-CD2 3.65Å; F258-L262 PolarHBondContact O-N 2.78Å
259	I	95.4	Very high	93.7	Very high	14 Å²	14	70.7 Å²	70.7	7%	0.072	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-34.7	-179.7	-64.7	177.2	0	0	0	111.5	V243 T245 M251 T252 G257 L262 K263 A271	V243-I259 HydrophobicContact CG1-CD1 4.34Å; V243-I259 HydrophobicContact CG1-CG1 4.08Å; T245-I259 HydrophobicContact CG2-CD1 4.15Å; T245-I259 HydrophobicContact CG2-CG1 4.41Å; M251-I259 WeakPolarHBondContact O-CB 3.33Å; M251-I259 VanDerWaalsContact O-CG1 3.28Å; M251-I259 WeakPolarHBondContact O-CG1 3.37Å; M251-I259 PolarHBondContact O-N 2.84Å; T252-I259 HydrophobicContact CG2-CD1 3.87Å; G257-I259 PolarHBondContact O-N 2.81Å; I259-L262 PolarHBondContact O-N 2.97Å; I259-K263 HydrophobicContact CG2-CD 4.18Å; I259-K263 HydrophobicContact CG2-CG 4.36Å; I259-K263 WeakPolarHBondContact O-CB 3.39Å; I259-K263 WeakPolarHBondContact O-CG 3.17Å; I259-K263 PolarHBondContact O-N 3.23Å; I259-A271 HydrophobicContact CD1-CB 3.87Å; I259-A271 HydrophobicContact CG2-CB 3.62Å
260	A	96.1	Very high	93.8	Very high	16 Å²	16	68.2 Å²	68.2	13%	0.132	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-40.8	177.6	0	0	0	0	0	111.4	G253 R254 G257 F258 Q264	G253-A260 WeakPolarHBondContact O-CB 3.36Å; R254-A260 WeakPolarHBondContact O-CB 3.1Å; G257-A260 WeakPolarHBondContact O-CB 3.12Å; G257-A260 PolarHBondContact O-N 3.15Å; F258-A260 VanDerWaalsContact C-N 3.29Å; F258-A260 PolarHBondContact O-N 2.85Å; A260-Q264 WeakPolarHBondContact O-CG 3.49Å; A260-Q264 PolarHBondContact O-N 3.14Å
261	H	96.7	Very high	93.7	Very high	30 Å²	30	68.7 Å²	68.7	14%	0.139	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-44.8	173.7	-69.1	-72.1	0	0	0	111.8	F223 G257 F258 K263 Q264	F223-H261 HydrophobicContact CB-CB 4Å; F223-H261 HydrophobicContact CD1-CB 3.78Å; F223-H261 HydrophobicContact CD2-CB 3.85Å; F223-H261 HydrophobicContact CE1-CB 4.2Å; F223-H261 HydrophobicContact CE2-CB 4.28Å; F223-H261 HydrophobicContact CG-CB 3.58Å; F223-H261 HydrophobicContact CZ-CB 4.42Å; G257-H261 PolarHBondContact O-CD2 3.04Å; G257-H261 VanDerWaalsContact O-CD2 3.29Å; G257-H261 PolarHBondContact O-N 2.95Å; F258-H261 PolarHBondContact O-N 3.04Å; H261-K263 VanDerWaalsContact C-N 3.32Å; H261-K263 PolarHBondContact O-N 2.99Å; H261-Q264 WeakPolarHBondContact O-CB 3.32Å; H261-Q264 PolarHBondContact O-N 2.87Å; H261-Q264 VanDerWaalsContact O-N 3.1Å
262	L	96.5	Very high	93.4	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-38.9	178.5	-175.1	54.2	0	0	0	112.3	F223 L237 I240 V243 F258 I259 Q264 I265 V266 I269	F223-L262 HydrophobicContact CD2-CB 4.4Å; F223-L262 HydrophobicContact CE2-CB 4.42Å; F223-L262 HydrophobicContact CE2-CD1 4.35Å; L237-L262 HydrophobicContact CD2-CD1 4.41Å; I240-L262 HydrophobicContact CD1-CD1 4.34Å; V243-L262 HydrophobicContact CG1-CD2 4.36Å; F258-L262 HydrophobicContact CE1-CB 4.49Å; F258-L262 HydrophobicContact CE1-CD2 3.8Å; F258-L262 HydrophobicContact CZ-CB 4.41Å; F258-L262 HydrophobicContact CZ-CD2 3.65Å; F258-L262 PolarHBondContact O-N 2.78Å; I259-L262 PolarHBondContact O-N 2.97Å; L262-Q264 PolarHBondContact O-N 3.3Å; L262-I265 PolarHBondContact O-N 3.42Å; L262-V266 HydrophobicContact CD1-CG2 4.24Å; L262-V266 PolarHBondContact O-N 3.39Å; L262-I269 HydrophobicContact CD2-CD1 3.26Å; L262-I269 HydrophobicContact CG-CD1 3.76Å
263	K	96.1	Very high	93.2	Very high	94 Å²	94	67.7 Å²	67.7	41%	0.409	33%	0.331	S	S	.	.	H	α-helix	trans	-63.2	-21.7	175.3	-82.7	-175.8	174.6	-163.9	0	114.5	I259 H261 I265 P267 I269	I259-K263 HydrophobicContact CG2-CD 4.18Å; I259-K263 HydrophobicContact CG2-CG 4.36Å; I259-K263 WeakPolarHBondContact O-CB 3.39Å; I259-K263 WeakPolarHBondContact O-CG 3.17Å; I259-K263 PolarHBondContact O-N 3.23Å; H261-K263 VanDerWaalsContact C-N 3.32Å; H261-K263 PolarHBondContact O-N 2.99Å; K263-I265 PolarHBondContact O-N 2.77Å; K263-P267 VanDerWaalsContact O-CA 3.29Å; K263-P267 WeakPolarHBondContact O-CA 3.48Å; K263-I269 HydrophobicContact CG-CG2 3.54Å
264	Q	95.7	Very high	93	Very high	144 Å²	144	66.8 Å²	66.8	67%	0.673	32%	0.322	S	S	*	.	H	α-helix	trans	-69.4	-27.9	173.9	-67.1	171	1.2	0	0	111.7	A260 H261 L262	A260-Q264 WeakPolarHBondContact O-CG 3.49Å; A260-Q264 PolarHBondContact O-N 3.14Å; H261-Q264 WeakPolarHBondContact O-CB 3.32Å; H261-Q264 PolarHBondContact O-N 2.87Å; H261-Q264 VanDerWaalsContact O-N 3.1Å; L262-Q264 PolarHBondContact O-N 3.3Å
265	I	95	Very high	92.9	Very high	84 Å²	84	55.5 Å²	55.5	43%	0.431	28%	0.279	S	S	.	.	H	α-helix	trans	-98.2	-38.7	179.1	-56.8	-170.1	0	0	0	111.4	F223 L237 L262 K263 P267	F223-I265 HydrophobicContact CE2-CD1 4.29Å; F223-I265 HydrophobicContact CZ-CD1 3.6Å; F223-I265 HydrophobicContact CZ-CG1 4.37Å; L237-I265 HydrophobicContact CB-CG2 4.19Å; L237-I265 HydrophobicContact CD1-CD1 3.85Å; L237-I265 HydrophobicContact CD1-CG2 4.08Å; L262-I265 PolarHBondContact O-N 3.42Å; K263-I265 PolarHBondContact O-N 2.77Å; I265-P267 WeakPolarHBondContact O-CD 3.46Å
266	V	95.5	Very high	92.6	Very high	15 Å²	15	48.2 Å²	48.2	9%	0.091	25%	0.245	C	C	.	.			trans	-123.6	81.4	-179.5	-168.6	0	0	0	0	109.1	L237 L262 D268 I269	L237-V266 HydrophobicContact CB-CG2 4.24Å; L237-V266 WeakPolarHBondContact O-CG2 3.41Å; L262-V266 HydrophobicContact CD1-CG2 4.24Å; L262-V266 PolarHBondContact O-N 3.39Å; V266-D268 VanDerWaalsContact C-N 3.27Å; V266-D268 PolarHBondContact O-N 2.91Å; V266-I269 HydrophobicContact CB-CB 4.28Å; V266-I269 HydrophobicContact CG1-CB 3.98Å; V266-I269 WeakPolarHBondContact O-CB 3.31Å; V266-I269 WeakPolarHBondContact O-CG2 3.44Å; V266-I269 PolarHBondContact O-N 3.01Å
267	P	94.8	Very high	92.1	Very high	92 Å²	92	40.3 Å²	40.3	60%	0.597	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-35.1	-173.7	-26.3	35.7	0	0	0	114.2	K263 I265 I269	K263-P267 VanDerWaalsContact O-CA 3.29Å; K263-P267 WeakPolarHBondContact O-CA 3.48Å; I265-P267 WeakPolarHBondContact O-CD 3.46Å; P267-I269 VanDerWaalsContact C-N 3.25Å; P267-I269 PolarHBondContact O-N 3.01Å
268	D	93	Very high	91.8	Very high	153 Å²	153	41.3 Å²	41.3	82%	0.818	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	4.8	-175.5	-61.3	-34.7	0	0	0	113.7	V266 V270	V266-D268 VanDerWaalsContact C-N 3.27Å; V266-D268 PolarHBondContact O-N 2.91Å; D268-V270 PolarHBondContact O-N 3.15Å
269	I	93.9	Very high	91.4	Very high	6 Å²	6	41.5 Å²	41.5	3%	0.031	22%	0.222	C	C	.	.			trans	-63.5	130.1	-177.2	-165.8	173.9	0	0	0	112	I240 V243 L262 K263 V266 P267 A271	I240-I269 HydrophobicContact CB-CD1 4.35Å; I240-I269 HydrophobicContact CG2-CD1 3.57Å; I240-I269 HydrophobicContact CG2-CG1 4.35Å; V243-I269 HydrophobicContact CB-CD1 3.96Å; V243-I269 HydrophobicContact CG1-CD1 3.78Å; V243-I269 HydrophobicContact CG1-CG1 4.33Å; L262-I269 HydrophobicContact CD2-CD1 3.26Å; L262-I269 HydrophobicContact CG-CD1 3.76Å; K263-I269 HydrophobicContact CG-CG2 3.54Å; V266-I269 HydrophobicContact CB-CB 4.28Å; V266-I269 HydrophobicContact CG1-CB 3.98Å; V266-I269 WeakPolarHBondContact O-CB 3.31Å; V266-I269 WeakPolarHBondContact O-CG2 3.44Å; V266-I269 PolarHBondContact O-N 3.01Å; P267-I269 VanDerWaalsContact C-N 3.25Å; P267-I269 PolarHBondContact O-N 3.01Å; I269-A271 PolarHBondContact O-N 3.26Å
270	V	91.6	Very high	90.7	Very high	61 Å²	61	42.5 Å²	42.5	37%	0.37	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	107.2	175.6	-178.9	0	0	0	0	109.5	T241 A242 V243 D268 V272 F528	T241-V270 PolarHBondContact O-N 3.14Å; T241-V270 VanDerWaalsContact O-N 3.08Å; A242-V270 CarbonylContact C-O 3.24Å; A242-V270 WeakPolarHBondContact CA-O 3.39Å; A242-V270 HydrophobicContact CB-CB 3.99Å; A242-V270 WeakPolarHBondContact CB-O 3.39Å; V243-V270 PolarHBondContact N-O 3.07Å; D268-V270 PolarHBondContact O-N 3.15Å; V270-V272 HydrophobicContact CG1-CG2 4.15Å; V270-F528 HydrophobicContact CG1-CE1 4.08Å; V270-F528 HydrophobicContact CG1-CZ 4.18Å
271	A	91.3	Very high	90.2	Very high	38 Å²	38	44.3 Å²	44.3	31%	0.314	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.9	177	0	0	0	0	0	111.1	I259 I269	I259-A271 HydrophobicContact CD1-CB 3.87Å; I259-A271 HydrophobicContact CG2-CB 3.62Å; I269-A271 PolarHBondContact O-N 3.26Å
272	V	87.1	Confident	89.8	Confident	12 Å²	12	42.9 Å²	42.9	7%	0.073	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.9	-179.2	174.9	0	0	0	0	110.8	V243 A244 T245 V270 L527 F528	V243-V272 PolarHBondContact O-N 3.37Å; A244-V272 WeakPolarHBondContact CA-O 3.48Å; T245-V272 PolarHBondContact N-O 3.5Å; V270-V272 HydrophobicContact CG1-CG2 4.15Å; V272-L527 HydrophobicContact CG1-CD1 3.51Å; V272-F528 HydrophobicContact CB-CE2 3.92Å; V272-F528 HydrophobicContact CB-CZ 4.25Å; V272-F528 HydrophobicContact CG1-CE2 4.11Å; V272-F528 HydrophobicContact CG2-CE1 4.32Å; V272-F528 HydrophobicContact CG2-CE2 3.26Å; V272-F528 HydrophobicContact CG2-CZ 3.11Å
273	H	86.7	Confident	89.3	Confident	36 Å²	36	43.2 Å²	43.2	17%	0.167	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.6	173.2	165.7	-154.5	0	0	0	109.4	D246 G247 V275 H277 R278	D246-H273 VanDerWaalsContact C-CD2 3.41Å; D246-H273 PolarHBondContact O-CD2 2.88Å; D246-H273 PolarHBondContact O-NE2 2.9Å; G247-H273 WeakPolarHBondContact CA-CD2 3.44Å; G247-H273 WeakPolarHBondContact CA-NE2 3.43Å; G247-H273 PolarHBondContact N-CD2 3.16Å; H273-V275 PolarHBondContact O-N 3.28Å; H273-V275 VanDerWaalsContact O-N 3.16Å; H273-H277 AromaticContact NE2-CD2 3.48Å; H273-H277 PolarHBondContact NE2-CD2 2.88Å; H273-R278 WeakPolarHBondContact CE1-CG 3.3Å; H273-R278 VanDerWaalsContact CG-NE 3.33Å; H273-R278 WeakPolarHBondContact ND1-CG 3.25Å; H273-R278 PolarHBondContact ND1-NE 2.89Å
274	C	86.5	Confident	88.7	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.014	23%	0.234	C	C	.	.			trans	-42.9	115.3	178	172.1	0	0	0	0	113.3	T245 I276 H277 R278 C522 C524	T245-C274 WeakPolarHBondContact O-CB 3.34Å; T245-C274 PolarHBondContact O-N 3.09Å; C274-I276 PolarHBondContact O-N 3.13Å; C274-H277 HydrophobicContact CB-CB 3.71Å; C274-H277 PolarHBondContact O-N 3.35Å; C274-H277 WeakPolarHBondContact SG-CB 3.3Å; C274-H277 PolarHBondContact SG-N 3.4Å; C274-R278 WeakPolarHBondContact O-CG 2.96Å; C274-R278 PolarHBondContact O-N 3.12Å; C274-C522 PolarHBondContact SG-SG 2.97Å; C274-C524 HydrophobicContact CB-CB 3.64Å; C274-C524 WeakPolarHBondContact SG-CB 3.39Å
275	V	87	Confident	88.2	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-49.1	178.4	-176.6	0	0	0	0	110	H273 H277 R278 E279 L395 T405 V409 Y466 I469 L527	H273-V275 PolarHBondContact O-N 3.28Å; H273-V275 VanDerWaalsContact O-N 3.16Å; V275-H277 PolarHBondContact O-N 3.17Å; V275-R278 WeakPolarHBondContact O-CA 3.35Å; V275-R278 WeakPolarHBondContact O-CB 3.4Å; V275-R278 PolarHBondContact O-N 3.49Å; V275-E279 PolarHBondContact O-N 3.34Å; V275-L395 HydrophobicContact CG1-CD1 3.68Å; V275-L395 HydrophobicContact CG1-CD2 3.84Å; V275-L395 HydrophobicContact CG1-CG 4.34Å; V275-T405 HydrophobicContact CB-CG2 4.3Å; V275-T405 HydrophobicContact CG1-CG2 3.75Å; V275-T405 HydrophobicContact CG2-CG2 3.67Å; V275-V409 HydrophobicContact CG1-CG2 4.09Å; V275-Y466 HydrophobicContact CB-CE1 4.31Å; V275-Y466 HydrophobicContact CG1-CE1 3.58Å; V275-Y466 WeakPolarHBondContact CG1-OH 3.48Å; V275-Y466 PolarHBondContact O-OH 2.93Å; V275-I469 HydrophobicContact CG1-CD1 4.49Å; V275-I469 HydrophobicContact CG2-CD1 3.77Å; V275-L527 HydrophobicContact CG2-CD1 3.72Å; V275-L527 HydrophobicContact CG2-CD2 4.28Å
276	I	83.1	Confident	87.9	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-32.8	-176.1	-33.3	-177.9	0	0	0	111.3	C274 H280 W336 L337 N392 L395 Q396	C274-I276 PolarHBondContact O-N 3.13Å; I276-H280 WeakPolarHBondContact O-CB 3.32Å; I276-H280 PolarHBondContact O-N 3.5Å; I276-H280 VanDerWaalsContact O-N 3.07Å; I276-W336 HydrophobicContact CB-CH2 3.72Å; I276-W336 HydrophobicContact CB-CZ3 4.36Å; I276-W336 HydrophobicContact CG2-CH2 3.2Å; I276-W336 HydrophobicContact CG2-CZ2 4.48Å; I276-W336 HydrophobicContact CG2-CZ3 3.35Å; I276-W336 WeakPolarHBondContact O-CH2 3.37Å; I276-L337 HydrophobicContact CD1-CD2 4.4Å; I276-L337 HydrophobicContact CG2-CD2 4.45Å; I276-N392 WeakPolarHBondContact CG2-ND2 3.46Å; I276-L395 HydrophobicContact CG1-CB 4.17Å; I276-Q396 HydrophobicContact CD1-CG 3.76Å
277	H	82.8	Confident	87.6	Confident	47 Å²	47	40.4 Å²	40.4	22%	0.218	21%	0.213	C	C	.	.	H	α-helix	trans	-67.7	-41.8	173.5	-173.6	103.9	0	0	0	111.1	D246 H273 C274 V275 H280 L281	D246-H277 PolarHBondContact O-CD2 3.05Å; D246-H277 PolarHBondContact O-ND1 3.48Å; H273-H277 AromaticContact NE2-CD2 3.48Å; H273-H277 PolarHBondContact NE2-CD2 2.88Å; C274-H277 HydrophobicContact CB-CB 3.71Å; C274-H277 PolarHBondContact O-N 3.35Å; C274-H277 WeakPolarHBondContact SG-CB 3.3Å; C274-H277 PolarHBondContact SG-N 3.4Å; V275-H277 PolarHBondContact O-N 3.17Å; H277-H280 WeakPolarHBondContact O-CB 3.35Å; H277-H280 PolarHBondContact O-N 2.86Å; H277-L281 VanDerWaalsContact CD2-CD1 3.48Å; H277-L281 WeakPolarHBondContact CD2-CD1 3.13Å; H277-L281 WeakPolarHBondContact O-CG 3.07Å; H277-L281 PolarHBondContact O-N 3.06Å
278	R	87.6	Confident	87.5	Confident	21 Å²	21	43 Å²	43	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-44.5	175.3	-68.3	171.2	177.5	-173.6	11.5	112.2	H273 C274 V275 H280 L281 A282 R465 Y466 D468	H273-R278 WeakPolarHBondContact CE1-CG 3.3Å; H273-R278 VanDerWaalsContact CG-NE 3.33Å; H273-R278 WeakPolarHBondContact ND1-CG 3.25Å; H273-R278 PolarHBondContact ND1-NE 2.89Å; C274-R278 WeakPolarHBondContact O-CG 2.96Å; C274-R278 PolarHBondContact O-N 3.12Å; V275-R278 WeakPolarHBondContact O-CA 3.35Å; V275-R278 WeakPolarHBondContact O-CB 3.4Å; V275-R278 PolarHBondContact O-N 3.49Å; R278-H280 VanDerWaalsContact C-N 3.31Å; R278-H280 PolarHBondContact O-N 3.3Å; R278-L281 PolarHBondContact O-N 3.19Å; R278-A282 PolarHBondContact O-N 3.45Å; R278-R465 HydrophobicContact CB-CB 4.46Å; R278-R465 WeakPolarHBondContact CD-O 3.34Å; R278-R465 PolarHBondContact NH1-O 3.34Å; R278-Y466 HydrophobicContact CB-CE1 3.83Å; R278-Y466 HydrophobicContact CG-CE1 4.49Å; R278-D468 IonicContact CZ-OD1 3.53Å; R278-D468 IonicContact CZ-OD2 2.68Å; R278-D468 VanDerWaalsContact NH1-CG 3.28Å; R278-D468 IonicContact NH1-OD1 3.22Å; R278-D468 PolarHBondContact NH1-OD1 3.01Å; R278-D468 IonicContact NH1-OD2 2.73Å; R278-D468 PolarHBondContact NH1-OD2 3.25Å; R278-D468 VanDerWaalsContact NH1-OD2 3.08Å; R278-D468 IonicContact NH2-OD1 3.13Å; R278-D468 IonicContact NH2-OD2 2.89Å; R278-D468 PolarHBondContact NH2-OD2 2.9Å
279	E	86.5	Confident	87.5	Confident	3 Å²	3	39 Å²	39	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-52.7	-52.1	171.8	168.1	-170.5	-157.9	0	0	110.4	V275 L281 A282 A283 F388 M391 N392 Y466	V275-E279 PolarHBondContact O-N 3.34Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.37Å; E279-A282 WeakPolarHBondContact O-CA 3.42Å; E279-A282 WeakPolarHBondContact O-CB 3.4Å; E279-A282 PolarHBondContact O-N 2.69Å; E279-A282 VanDerWaalsContact O-N 3.08Å; E279-A283 PolarHBondContact O-N 3.45Å; E279-F388 HydrophobicContact CG-CD1 3.95Å; E279-F388 HydrophobicContact CG-CE1 4.4Å; E279-M391 HydrophobicContact CB-CE 3.83Å; E279-M391 HydrophobicContact CG-CE 3.3Å; E279-M391 VanDerWaalsContact OE1-CE 3.24Å; E279-M391 WeakPolarHBondContact OE1-CE 3.08Å; E279-N392 PolarHBondContact OE2-ND2 3.41Å; E279-Y466 WeakPolarHBondContact CB-OH 3.22Å; E279-Y466 PolarHBondContact N-OH 3.36Å; E279-Y466 VanDerWaalsContact N-OH 3.11Å
280	H	81.7	Confident	87.3	Confident	35 Å²	35	38.7 Å²	38.7	16%	0.162	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-41.8	-177.5	175.2	61.2	0	0	0	112.7	I276 H277 R278 A282 A283 K284 W336	I276-H280 WeakPolarHBondContact O-CB 3.32Å; I276-H280 PolarHBondContact O-N 3.5Å; I276-H280 VanDerWaalsContact O-N 3.07Å; H277-H280 WeakPolarHBondContact O-CB 3.35Å; H277-H280 PolarHBondContact O-N 2.86Å; R278-H280 VanDerWaalsContact C-N 3.31Å; R278-H280 PolarHBondContact O-N 3.3Å; H280-A282 VanDerWaalsContact C-N 3.28Å; H280-A282 PolarHBondContact O-N 3.04Å; H280-A283 PolarHBondContact O-N 3.44Å; H280-K284 WeakPolarHBondContact CE1-CE 3.37Å; H280-K284 WeakPolarHBondContact NE2-CE 3.23Å; H280-K284 PolarHBondContact NE2-NZ 3.15Å; H280-K284 WeakPolarHBondContact O-CB 3.32Å; H280-K284 WeakPolarHBondContact O-CG 3.33Å; H280-K284 PolarHBondContact O-N 3.01Å; H280-W336 HydrophobicContact CB-CH2 4.33Å; H280-W336 HydrophobicContact CB-CZ2 4.38Å
281	L	85.8	Confident	87.1	Confident	55 Å²	55	38.2 Å²	38.2	29%	0.288	19%	0.19	S	C	.	.	H	α-helix	trans	-60.7	-39.5	174.8	-70.1	178.9	0	0	0	111.6	H277 R278 E279 R285	H277-L281 VanDerWaalsContact CD2-CD1 3.48Å; H277-L281 WeakPolarHBondContact CD2-CD1 3.13Å; H277-L281 WeakPolarHBondContact O-CG 3.07Å; H277-L281 PolarHBondContact O-N 3.06Å; R278-L281 PolarHBondContact O-N 3.19Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.37Å; L281-R285 PolarHBondContact O-N 3.04Å
282	A	88.3	Confident	87.1	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-44.9	175	0	0	0	0	0	112.3	R278 E279 H280 K284 R285 L458 D461 L462	R278-A282 PolarHBondContact O-N 3.45Å; E279-A282 WeakPolarHBondContact O-CA 3.42Å; E279-A282 WeakPolarHBondContact O-CB 3.4Å; E279-A282 PolarHBondContact O-N 2.69Å; E279-A282 VanDerWaalsContact O-N 3.08Å; H280-A282 VanDerWaalsContact C-N 3.28Å; H280-A282 PolarHBondContact O-N 3.04Å; A282-K284 PolarHBondContact O-N 3.24Å; A282-R285 VanDerWaalsContact O-CB 3.27Å; A282-R285 WeakPolarHBondContact O-CB 3.26Å; A282-R285 PolarHBondContact O-N 3.5Å; A282-L458 VanDerWaalsContact O-CD2 3.25Å; A282-L458 WeakPolarHBondContact O-CD2 3.41Å; A282-D461 WeakPolarHBondContact CA-OD2 3.15Å; A282-L462 HydrophobicContact CB-CD2 3.43Å; A282-L462 VanDerWaalsContact CB-CD2 3.43Å; A282-L462 HydrophobicContact CB-CG 3.75Å
283	A	85.7	Confident	87.1	Confident	7 Å²	7	38.4 Å²	38.4	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-24.4	178.5	0	0	0	0	0	113.3	E279 H280 R285 Y385 F388	E279-A283 PolarHBondContact O-N 3.45Å; H280-A283 PolarHBondContact O-N 3.44Å; A283-R285 VanDerWaalsContact C-N 3.34Å; A283-Y385 HydrophobicContact CB-CE1 4.31Å; A283-Y385 PolarHBondContact O-OH 2.74Å; A283-F388 HydrophobicContact CB-CD1 4.04Å; A283-F388 HydrophobicContact CB-CD2 4.1Å; A283-F388 HydrophobicContact CB-CE1 3.94Å; A283-F388 HydrophobicContact CB-CE2 4Å; A283-F388 HydrophobicContact CB-CG 4.13Å; A283-F388 HydrophobicContact CB-CZ 3.92Å
284	K	83.1	Confident	86.9	Confident	117 Å²	117	38.2 Å²	38.2	51%	0.509	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.9	172.4	-83.1	176.9	163.8	172.9	0	113.9	H280 A282 L286	H280-K284 WeakPolarHBondContact CE1-CE 3.37Å; H280-K284 WeakPolarHBondContact NE2-CE 3.23Å; H280-K284 PolarHBondContact NE2-NZ 3.15Å; H280-K284 WeakPolarHBondContact O-CB 3.32Å; H280-K284 WeakPolarHBondContact O-CG 3.33Å; H280-K284 PolarHBondContact O-N 3.01Å; A282-K284 PolarHBondContact O-N 3.24Å; K284-L286 PolarHBondContact O-N 3.15Å
285	R	85.5	Confident	86.9	Confident	105 Å²	105	46.4 Å²	46.4	40%	0.396	22%	0.22	S	C	.	.			trans	-76.9	93.4	-179.4	-165.6	178	174.7	169	-3.8	108.8	L281 A282 A283 H454 M457 D461	L281-R285 PolarHBondContact O-N 3.04Å; A282-R285 VanDerWaalsContact O-CB 3.27Å; A282-R285 WeakPolarHBondContact O-CB 3.26Å; A282-R285 PolarHBondContact O-N 3.5Å; A283-R285 VanDerWaalsContact C-N 3.34Å; R285-H454 PolarHBondContact O-NE2 3.35Å; R285-M457 HydrophobicContact CG-CE 3.97Å; R285-M457 HydrophobicContact CG-CG 4.41Å; R285-M457 HydrophobicContact CG-SD 3.8Å; R285-M457 PolarHBondContact NE-SD 3.19Å; R285-M457 WeakPolarHBondContact O-CE 3.18Å; R285-D461 VanDerWaalsContact CD-CG 3.48Å; R285-D461 IonicContact CZ-OD1 3.61Å; R285-D461 IonicContact NH1-OD1 3.81Å; R285-D461 PolarHBondContact NH1-OD1 3.27Å
286	L	87.8	Confident	86.8	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.099	23%	0.227	C	C	.	.			trans	-113.5	148.2	-179.9	-62.6	179.9	0	0	0	110.5	K284 L290 N291 L294 L381 H454	K284-L286 PolarHBondContact O-N 3.15Å; L286-L290 HydrophobicContact CB-CB 4.09Å; L286-L290 HydrophobicContact CD2-CB 4.28Å; L286-N291 HydrophobicContact CB-CB 4.14Å; L286-L294 HydrophobicContact CD1-CB 4.2Å; L286-L294 HydrophobicContact CD1-CD2 3.84Å; L286-L381 HydrophobicContact CD2-CD2 4.16Å; L286-H454 VanDerWaalsContact CD2-CE1 3.49Å; L286-H454 WeakPolarHBondContact CD2-CE1 3.49Å
287	S	90.4	Very high	86.8	Confident	37 Å²	37	47.9 Å²	47.9	26%	0.259	23%	0.228	S	C	.	.			trans	-62.5	160.3	166.8	67.2	0	0	0	0	110.6	R289 L290 N291	S287-R289 PolarHBondContact O-N 3.29Å; S287-L290 PolarHBondContact O-N 3.04Å; S287-L290 VanDerWaalsContact O-N 3.09Å; S287-L290 WeakPolarHBondContact OG-CG 3.26Å; S287-L290 PolarHBondContact OG-N 2.84Å; S287-N291 WeakPolarHBondContact O-CB 3.16Å; S287-N291 PolarHBondContact O-N 2.77Å
288	N	91.8	Very high	86.7	Confident	147 Å²	147	48 Å²	48	79%	0.786	23%	0.229	S	C	*	.	H	α-helix	trans	-54.6	-39.2	177.5	-71.7	-20.5	0	0	0	112	S292	N288-S292 WeakPolarHBondContact O-CB 3.37Å; N288-S292 PolarHBondContact O-N 3.09Å; N288-S292 PolarHBondContact O-OG 3.24Å
289	R	92.5	Very high	86.5	Confident	67 Å²	67	50.4 Å²	50.4	25%	0.253	24%	0.243	S	C	.	.	H	α-helix	trans	-56.2	-56.2	173.7	178.6	179.2	172.3	153.2	9.1	111.2	S287 S292 L293 R374 D377 D446 D447	S287-R289 PolarHBondContact O-N 3.29Å; R289-S292 PolarHBondContact O-N 2.95Å; R289-S292 PolarHBondContact O-OG 3.31Å; R289-L293 PolarHBondContact O-N 3.33Å; R289-R374 VanDerWaalsContact CG-NH2 3.26Å; R289-R374 PolarHBondContact O-NH2 3.26Å; R289-D377 IonicContact CZ-OD1 2.63Å; R289-D377 VanDerWaalsContact CZ-OD1 3.27Å; R289-D377 IonicContact CZ-OD2 3.8Å; R289-D377 IonicContact NE-OD1 3.18Å; R289-D377 PolarHBondContact NE-OD1 2.94Å; R289-D377 IonicContact NE-OD2 2.71Å; R289-D377 PolarHBondContact NE-OD2 2.99Å; R289-D377 VanDerWaalsContact NH2-CG 3.33Å; R289-D377 IonicContact NH2-OD1 2.86Å; R289-D377 PolarHBondContact NH2-OD1 2.88Å; R289-D377 IonicContact NH2-OD2 2.74Å; R289-D377 PolarHBondContact NH2-OD2 3.23Å; R289-D446 PolarHBondContact NH1-O 3.24Å; R289-D447 IonicContact CZ-OD1 3.13Å; R289-D447 IonicContact NH1-OD1 3.89Å; R289-D447 PolarHBondContact NH1-OD1 2.84Å; R289-D447 IonicContact NH2-OD1 2.59Å; R289-D447 PolarHBondContact NH2-OD1 3.4Å; R289-D447 IonicContact NH2-OD2 2.65Å
290	L	89.8	Confident	86.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-72.5	-31.8	-176.4	-63.5	175	0	0	0	112.9	L286 S287 L293 L294 D377 Y380 L381 Y451 H454	L286-L290 HydrophobicContact CB-CB 4.09Å; L286-L290 HydrophobicContact CD2-CB 4.28Å; S287-L290 PolarHBondContact O-N 3.04Å; S287-L290 VanDerWaalsContact O-N 3.09Å; S287-L290 WeakPolarHBondContact OG-CG 3.26Å; S287-L290 PolarHBondContact OG-N 2.84Å; L290-L293 WeakPolarHBondContact O-CB 3.46Å; L290-L293 PolarHBondContact O-N 3.3Å; L290-L294 PolarHBondContact O-N 2.87Å; L290-D377 HydrophobicContact CD2-CB 4.21Å; L290-Y380 HydrophobicContact CD1-CD1 4.44Å; L290-Y380 HydrophobicContact CD1-CE1 3.84Å; L290-Y380 HydrophobicContact CD2-CD1 4.26Å; L290-Y380 HydrophobicContact CD2-CE1 4.47Å; L290-L381 HydrophobicContact CB-CD1 4.39Å; L290-L381 HydrophobicContact CB-CD2 4.5Å; L290-L381 HydrophobicContact CD1-CD2 4.18Å; L290-L381 HydrophobicContact CD2-CD1 4.24Å; L290-L381 HydrophobicContact CD2-CD2 4.26Å; L290-L381 HydrophobicContact CD2-CG 4.09Å; L290-Y451 HydrophobicContact CD2-CE1 4.4Å; L290-H454 HydrophobicContact CD1-CB 3.94Å; L290-H454 WeakPolarHBondContact CD1-ND1 3.41Å
291	N	88.3	Confident	86.4	Confident	52 Å²	52	48.8 Å²	48.8	28%	0.278	24%	0.236	S	C	.	.	H	α-helix	trans	-66.1	-41.6	173.6	-165.4	-40.2	0	0	0	111.3	L286 S287 L293 L294 R295	L286-N291 HydrophobicContact CB-CB 4.14Å; S287-N291 WeakPolarHBondContact O-CB 3.16Å; S287-N291 PolarHBondContact O-N 2.77Å; N291-L293 PolarHBondContact O-N 3Å; N291-L294 PolarHBondContact O-N 3.36Å; N291-R295 WeakPolarHBondContact O-CG 3.09Å; N291-R295 PolarHBondContact O-N 2.97Å; N291-R295 PolarHBondContact OD1-NE 3.38Å
292	S	90.6	Very high	86.2	Confident	53 Å²	53	48.8 Å²	48.8	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-37.5	173.2	76.1	0	0	0	0	111.8	N288 R289 R295 L296 R374	N288-S292 WeakPolarHBondContact O-CB 3.37Å; N288-S292 PolarHBondContact O-N 3.09Å; N288-S292 PolarHBondContact O-OG 3.24Å; R289-S292 PolarHBondContact O-N 2.95Å; R289-S292 PolarHBondContact O-OG 3.31Å; S292-R295 PolarHBondContact O-N 3.26Å; S292-L296 PolarHBondContact O-N 2.82Å; S292-R374 PolarHBondContact OG-NH1 3.4Å
293	L	86.8	Confident	86.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-48	174.5	174.6	64.8	0	0	0	111.6	R289 L290 N291 R295 L296 V297 R374 D377 I378 L381	R289-L293 PolarHBondContact O-N 3.33Å; L290-L293 WeakPolarHBondContact O-CB 3.46Å; L290-L293 PolarHBondContact O-N 3.3Å; N291-L293 PolarHBondContact O-N 3Å; L293-R295 PolarHBondContact O-N 2.83Å; L293-L296 HydrophobicContact CD1-CD2 4.27Å; L293-L296 WeakPolarHBondContact O-CA 3.35Å; L293-L296 VanDerWaalsContact O-CB 3.31Å; L293-L296 WeakPolarHBondContact O-CB 3.1Å; L293-L296 PolarHBondContact O-N 3.22Å; L293-V297 HydrophobicContact CD1-CG2 4.03Å; L293-V297 HydrophobicContact CG-CG2 4.3Å; L293-V297 PolarHBondContact O-N 2.9Å; L293-R374 HydrophobicContact CD1-CB 3.96Å; L293-D377 HydrophobicContact CD2-CB 3.38Å; L293-D377 WeakPolarHBondContact CD2-O 3.35Å; L293-D377 HydrophobicContact CG-CB 4.49Å; L293-I378 HydrophobicContact CD1-CD1 4.05Å; L293-I378 HydrophobicContact CD1-CG1 3.57Å; L293-I378 HydrophobicContact CD2-CB 4.42Å; L293-I378 HydrophobicContact CD2-CG1 3.71Å; L293-I378 HydrophobicContact CG-CG1 4.13Å; L293-L381 HydrophobicContact CD2-CD1 3.69Å; L293-L381 HydrophobicContact CD2-CG 4.42Å; L293-L381 HydrophobicContact CG-CD1 4.38Å
294	L	83.9	Confident	86	Confident	33 Å²	33	51.1 Å²	51.1	17%	0.173	25%	0.25	C	C	.	.	H	α-helix	trans	-53.6	-42.4	177.2	171.6	64.5	0	0	0	110.9	L286 L290 N291 I298 F346	L286-L294 HydrophobicContact CD1-CB 4.2Å; L286-L294 HydrophobicContact CD1-CD2 3.84Å; L290-L294 PolarHBondContact O-N 2.87Å; N291-L294 PolarHBondContact O-N 3.36Å; L294-I298 HydrophobicContact CD1-CD1 3.73Å; L294-I298 HydrophobicContact CD1-CG1 4.17Å; L294-I298 HydrophobicContact CG-CD1 3.84Å; L294-I298 WeakPolarHBondContact O-CB 3.38Å; L294-I298 WeakPolarHBondContact O-CD1 3.23Å; L294-I298 WeakPolarHBondContact O-CG1 3.36Å; L294-I298 PolarHBondContact O-N 2.87Å; L294-F346 HydrophobicContact CB-CZ 4.43Å; L294-F346 HydrophobicContact CD1-CE2 3.53Å; L294-F346 HydrophobicContact CD1-CZ 3.34Å; L294-F346 HydrophobicContact CG-CZ 4.47Å
295	R	85.1	Confident	85.9	Confident	174 Å²	174	47.7 Å²	47.7	66%	0.657	24%	0.235	S	C	*	.	H	α-helix	trans	-64.9	-40.5	175.2	-66.6	177.7	-174.4	-143.6	1.4	112.9	N291 S292 L293 I298 N299	N291-R295 WeakPolarHBondContact O-CG 3.09Å; N291-R295 PolarHBondContact O-N 2.97Å; N291-R295 PolarHBondContact OD1-NE 3.38Å; S292-R295 PolarHBondContact O-N 3.26Å; L293-R295 PolarHBondContact O-N 2.83Å; R295-I298 PolarHBondContact O-N 3.3Å; R295-N299 WeakPolarHBondContact O-CB 3.48Å; R295-N299 PolarHBondContact O-N 3.27Å
296	L	85.7	Confident	85.9	Confident	32 Å²	32	46.9 Å²	46.9	17%	0.168	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-48.2	176.6	-174.7	70.3	0	0	0	111.2	S292 L293 N299 A300 L367 N370 L371	S292-L296 PolarHBondContact O-N 2.82Å; L293-L296 HydrophobicContact CD1-CD2 4.27Å; L293-L296 WeakPolarHBondContact O-CA 3.35Å; L293-L296 VanDerWaalsContact O-CB 3.31Å; L293-L296 WeakPolarHBondContact O-CB 3.1Å; L293-L296 PolarHBondContact O-N 3.22Å; L296-N299 WeakPolarHBondContact O-CB 3.4Å; L296-N299 PolarHBondContact O-N 3.14Å; L296-A300 PolarHBondContact O-N 2.84Å; L296-L367 HydrophobicContact CD1-CD1 3.39Å; L296-L367 HydrophobicContact CG-CD1 4.06Å; L296-N370 HydrophobicContact CD1-CB 4.07Å; L296-N370 HydrophobicContact CD2-CB 4.02Å; L296-L371 HydrophobicContact CD2-CD2 3.93Å; L296-L371 HydrophobicContact CD2-CG 4.36Å; L296-L371 HydrophobicContact CG-CD2 4.01Å
297	V	82.9	Confident	85.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-45.9	177.1	163.9	0	0	0	0	111.5	L293 N299 A300 I301 F346 L349 I378	L293-V297 HydrophobicContact CD1-CG2 4.03Å; L293-V297 HydrophobicContact CG-CG2 4.3Å; L293-V297 PolarHBondContact O-N 2.9Å; V297-N299 VanDerWaalsContact C-N 3.27Å; V297-N299 PolarHBondContact O-N 3.38Å; V297-A300 WeakPolarHBondContact O-CB 3.17Å; V297-A300 PolarHBondContact O-N 3.36Å; V297-I301 HydrophobicContact CG1-CD1 3.81Å; V297-I301 HydrophobicContact CG1-CG1 4.48Å; V297-I301 WeakPolarHBondContact O-CG1 3.37Å; V297-I301 PolarHBondContact O-N 3.1Å; V297-F346 HydrophobicContact CB-CE1 4.12Å; V297-F346 HydrophobicContact CB-CZ 4.45Å; V297-F346 HydrophobicContact CG1-CD1 4.44Å; V297-F346 HydrophobicContact CG1-CE1 3.85Å; V297-F346 HydrophobicContact CG1-CZ 4.15Å; V297-F346 HydrophobicContact CG2-CE1 4.02Å; V297-L349 HydrophobicContact CB-CD2 4.06Å; V297-L349 HydrophobicContact CG1-CD2 3.34Å; V297-L349 HydrophobicContact CG2-CD2 3.62Å; V297-I378 HydrophobicContact CG2-CD1 4.42Å; V297-I378 HydrophobicContact CG2-CG1 4.34Å
298	I	80.5	Confident	85.7	Confident	49 Å²	49	50.8 Å²	50.8	25%	0.251	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-40.6	176.7	-71.1	167.3	0	0	0	110.7	L294 R295 S302 H331	L294-I298 HydrophobicContact CD1-CD1 3.73Å; L294-I298 HydrophobicContact CD1-CG1 4.17Å; L294-I298 HydrophobicContact CG-CD1 3.84Å; L294-I298 WeakPolarHBondContact O-CB 3.38Å; L294-I298 WeakPolarHBondContact O-CD1 3.23Å; L294-I298 WeakPolarHBondContact O-CG1 3.36Å; L294-I298 PolarHBondContact O-N 2.87Å; R295-I298 PolarHBondContact O-N 3.3Å; I298-S302 WeakPolarHBondContact O-CB 3.37Å; I298-S302 PolarHBondContact O-N 3Å; I298-H331 HydrophobicContact CG1-CB 4.04Å; I298-H331 HydrophobicContact CG2-CB 4.3Å
299	N	84.4	Confident	85.6	Confident	71 Å²	71	48.4 Å²	48.4	38%	0.38	25%	0.254	S	S	.	.	H	α-helix	trans	-63	-44.3	176.3	-174.4	25.5	0	0	0	111.5	R295 L296 V297 S302 K303	R295-N299 WeakPolarHBondContact O-CB 3.48Å; R295-N299 PolarHBondContact O-N 3.27Å; L296-N299 WeakPolarHBondContact O-CB 3.4Å; L296-N299 PolarHBondContact O-N 3.14Å; V297-N299 VanDerWaalsContact C-N 3.27Å; V297-N299 PolarHBondContact O-N 3.38Å; N299-S302 PolarHBondContact O-N 2.07Å; N299-K303 WeakPolarHBondContact O-CG 3.2Å; N299-K303 PolarHBondContact O-N 3.11Å
300	A	84	Confident	85.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-51.9	175.9	0	0	0	0	0	112	L296 V297 S302 K303 I304 F360 L367 L371	L296-A300 PolarHBondContact O-N 2.84Å; V297-A300 WeakPolarHBondContact O-CB 3.17Å; V297-A300 PolarHBondContact O-N 3.36Å; A300-S302 VanDerWaalsContact C-N 3.29Å; A300-S302 PolarHBondContact O-N 2.93Å; A300-K303 PolarHBondContact O-N 2.83Å; A300-I304 PolarHBondContact O-N 2.84Å; A300-I304 VanDerWaalsContact O-N 3.13Å; A300-F360 HydrophobicContact CB-CE2 3.73Å; A300-F360 HydrophobicContact CB-CZ 4.13Å; A300-F360 WeakPolarHBondContact O-CZ 3.39Å; A300-L367 HydrophobicContact CB-CD2 4.05Å; A300-L371 HydrophobicContact CB-CD1 4.12Å
301	I	80.7	Confident	85.1	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-42.4	177	-65	169.6	0	0	0	110.7	V297 K303 I304 K305 L328 L329 L349	V297-I301 HydrophobicContact CG1-CD1 3.81Å; V297-I301 HydrophobicContact CG1-CG1 4.48Å; V297-I301 WeakPolarHBondContact O-CG1 3.37Å; V297-I301 PolarHBondContact O-N 3.1Å; I301-K303 PolarHBondContact O-N 2.79Å; I301-I304 PolarHBondContact O-N 3.49Å; I301-K305 HydrophobicContact CG2-CG 4.23Å; I301-K305 VanDerWaalsContact O-CB 3.29Å; I301-K305 WeakPolarHBondContact O-CB 3.39Å; I301-K305 WeakPolarHBondContact O-CG 3.22Å; I301-K305 PolarHBondContact O-N 2.89Å; I301-L328 HydrophobicContact CG1-CD1 4.45Å; I301-L329 WeakPolarHBondContact CG2-O 3.4Å; I301-L349 HydrophobicContact CD1-CD1 4.45Å; I301-L349 HydrophobicContact CG1-CD1 4.23Å
302	S	82	Confident	85.2	Confident	55 Å²	55	52.2 Å²	52.2	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-62.6	-40.5	177.9	-171.5	0	0	0	0	112.1	I298 N299 A300 I304 K305 S306	I298-S302 WeakPolarHBondContact O-CB 3.37Å; I298-S302 PolarHBondContact O-N 3Å; N299-S302 PolarHBondContact O-N 2.07Å; A300-S302 VanDerWaalsContact C-N 3.29Å; A300-S302 PolarHBondContact O-N 2.93Å; S302-I304 PolarHBondContact O-N 3.05Å; S302-K305 PolarHBondContact O-N 3.15Å; S302-S306 WeakPolarHBondContact O-CB 3.2Å; S302-S306 PolarHBondContact O-N 3.32Å; S302-S306 PolarHBondContact O-OG 3.4Å
303	K	86.2	Confident	85.1	Confident	55 Å²	55	53.6 Å²	53.6	24%	0.239	27%	0.27	C	S	.	.	H	α-helix	trans	-66.3	-35.6	177.4	-79.7	-178.4	176.9	-179.2	0	113.2	N299 A300 I301 N310 F360 D364 L367	N299-K303 WeakPolarHBondContact O-CG 3.2Å; N299-K303 PolarHBondContact O-N 3.11Å; A300-K303 PolarHBondContact O-N 2.83Å; I301-K303 PolarHBondContact O-N 2.79Å; K303-N310 PolarHBondContact O-ND2 3.48Å; K303-N310 VanDerWaalsContact O-ND2 3.08Å; K303-F360 HydrophobicContact CB-CE1 3.97Å; K303-F360 HydrophobicContact CB-CZ 3.95Å; K303-F360 HydrophobicContact CD-CE1 4.24Å; K303-D364 IonicContact NZ-OD2 3.08Å; K303-D364 PolarHBondContact NZ-OD2 3.04Å; K303-L367 HydrophobicContact CD-CD2 3.79Å
304	I	83.6	Confident	85	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.5	-46.2	173.5	-66.6	165.1	0	0	0	109.9	A300 I301 S302 N310 D311 F314 L328 V356 F359 F360	A300-I304 PolarHBondContact O-N 2.84Å; A300-I304 VanDerWaalsContact O-N 3.13Å; I301-I304 PolarHBondContact O-N 3.49Å; S302-I304 PolarHBondContact O-N 3.05Å; I304-N310 VanDerWaalsContact O-CB 3.32Å; I304-N310 WeakPolarHBondContact O-CB 3.35Å; I304-D311 PolarHBondContact O-N 2.92Å; I304-F314 HydrophobicContact CD1-CD2 3.81Å; I304-F314 HydrophobicContact CD1-CE2 3.94Å; I304-F314 HydrophobicContact CD1-CG 4.26Å; I304-F314 HydrophobicContact CD1-CZ 4.48Å; I304-F314 HydrophobicContact CG1-CD2 4.45Å; I304-F314 HydrophobicContact CG2-CB 3.7Å; I304-F314 HydrophobicContact CG2-CD1 4.06Å; I304-F314 HydrophobicContact CG2-CD2 4.38Å; I304-F314 HydrophobicContact CG2-CG 3.76Å; I304-L328 HydrophobicContact CB-CD1 4.39Å; I304-L328 HydrophobicContact CD1-CD1 3.47Å; I304-L328 VanDerWaalsContact CD1-CD1 3.47Å; I304-L328 HydrophobicContact CG2-CD1 4.26Å; I304-V356 HydrophobicContact CD1-CG2 4.42Å; I304-F359 HydrophobicContact CD1-CD1 4.34Å; I304-F359 HydrophobicContact CG1-CD1 3.93Å; I304-F359 HydrophobicContact CG1-CE1 3.83Å; I304-F360 HydrophobicContact CD1-CE2 3.7Å; I304-F360 HydrophobicContact CD1-CZ 3.99Å; I304-F360 HydrophobicContact CG1-CE2 3.98Å; I304-F360 HydrophobicContact CG1-CZ 3.72Å
305	K	81.5	Confident	85.1	Confident	46 Å²	46	53.9 Å²	53.9	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-82.2	-25.2	-171.2	-73	-68	-168.2	-179.6	0	116.2	I301 S302 N307 D311 L328 L330	I301-K305 HydrophobicContact CG2-CG 4.23Å; I301-K305 VanDerWaalsContact O-CB 3.29Å; I301-K305 WeakPolarHBondContact O-CB 3.39Å; I301-K305 WeakPolarHBondContact O-CG 3.22Å; I301-K305 PolarHBondContact O-N 2.89Å; S302-K305 PolarHBondContact O-N 3.15Å; K305-N307 VanDerWaalsContact C-N 3.26Å; K305-N307 PolarHBondContact O-N 2.81Å; K305-D311 WeakPolarHBondContact CD-OD1 3.46Å; K305-D311 WeakPolarHBondContact CE-OD1 3.48Å; K305-D311 IonicContact NZ-OD1 3.37Å; K305-D311 PolarHBondContact NZ-OD1 3.2Å; K305-L328 VanDerWaalsContact CE-C 3.45Å; K305-L328 WeakPolarHBondContact CE-O 3.27Å; K305-L328 PolarHBondContact NZ-O 3.46Å; K305-L330 HydrophobicContact CB-CD1 4.37Å; K305-L330 HydrophobicContact CB-CD2 3.38Å; K305-L330 HydrophobicContact CB-CG 3.72Å; K305-L330 HydrophobicContact CD-CG 4.28Å; K305-L330 HydrophobicContact CG-CD2 3.86Å; K305-L330 HydrophobicContact CG-CG 3.83Å
306	S	84.7	Confident	85.1	Confident	87 Å²	87	50.4 Å²	50.4	61%	0.608	26%	0.26	S	S	*	.	S	Bend	trans	-70.1	-23.7	-178.5	51.6	0	0	0	0	112.8	S302	S302-S306 WeakPolarHBondContact O-CB 3.2Å; S302-S306 PolarHBondContact O-N 3.32Å; S302-S306 PolarHBondContact O-OG 3.4Å
307	N	85.7	Confident	85	Confident	57 Å²	57	50 Å²	50	31%	0.305	26%	0.258	S	S	.	.	S	Bend	trans	-112.4	118	177.6	-176.3	-13.6	0	0	0	110.2	K305 L309 N310 D311	K305-N307 VanDerWaalsContact C-N 3.26Å; K305-N307 PolarHBondContact O-N 2.81Å; N307-L309 PolarHBondContact O-N 3.39Å; N307-L309 VanDerWaalsContact O-N 3.15Å; N307-L309 VanDerWaalsContact OD1-CB 3.28Å; N307-L309 WeakPolarHBondContact OD1-CB 3.31Å; N307-L309 PolarHBondContact OD1-N 3.24Å; N307-N310 HydrophobicContact CB-CB 3.95Å; N307-N310 WeakPolarHBondContact O-CB 3.28Å; N307-N310 PolarHBondContact O-N 3.04Å; N307-D311 PolarHBondContact O-N 3.13Å
308	P	88.7	Confident	85	Confident	82 Å²	82	49.9 Å²	49.9	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-55.8	-29.1	175.9	-26.3	34.8	0	0	0	114.4	R312	P308-R312 VanDerWaalsContact O-CG 3.24Å; P308-R312 WeakPolarHBondContact O-CG 3.45Å; P308-R312 PolarHBondContact O-N 3.02Å
309	L	90.7	Very high	85.1	Confident	96 Å²	96	53 Å²	53	50%	0.503	27%	0.271	S	S	.	.	H	α-helix	trans	-67.3	-48.8	173.6	179	64.5	0	0	0	110.7	N307 D311 R312 L313	N307-L309 PolarHBondContact O-N 3.39Å; N307-L309 VanDerWaalsContact O-N 3.15Å; N307-L309 VanDerWaalsContact OD1-CB 3.28Å; N307-L309 WeakPolarHBondContact OD1-CB 3.31Å; N307-L309 PolarHBondContact OD1-N 3.24Å; L309-D311 VanDerWaalsContact C-N 3.32Å; L309-D311 PolarHBondContact O-N 3.13Å; L309-R312 PolarHBondContact O-N 3.4Å; L309-R312 VanDerWaalsContact O-N 3.11Å; L309-L313 HydrophobicContact CD1-CD1 4.19Å; L309-L313 HydrophobicContact CD1-CG 4.22Å; L309-L313 HydrophobicContact CG-CD1 3.94Å; L309-L313 HydrophobicContact CG-CG 4.36Å; L309-L313 WeakPolarHBondContact O-CG 3.17Å; L309-L313 PolarHBondContact O-N 2.83Å
310	N	87	Confident	85.1	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.027	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-41.8	178.8	-66.9	-0.4	0	0	0	111.1	K303 I304 N307 R312 L313 F314 F359 Y363	K303-N310 PolarHBondContact O-ND2 3.48Å; K303-N310 VanDerWaalsContact O-ND2 3.08Å; I304-N310 VanDerWaalsContact O-CB 3.32Å; I304-N310 WeakPolarHBondContact O-CB 3.35Å; N307-N310 HydrophobicContact CB-CB 3.95Å; N307-N310 WeakPolarHBondContact O-CB 3.28Å; N307-N310 PolarHBondContact O-N 3.04Å; N310-R312 VanDerWaalsContact C-N 3.29Å; N310-R312 PolarHBondContact O-N 2.91Å; N310-L313 PolarHBondContact O-N 3.38Å; N310-F314 WeakPolarHBondContact O-CB 3.46Å; N310-F314 PolarHBondContact O-N 2.92Å; N310-F359 HydrophobicContact CB-CE1 4.47Å; N310-F359 HydrophobicContact CB-CZ 3.71Å; N310-Y363 VanDerWaalsContact ND2-CZ 3.29Å; N310-Y363 PolarHBondContact ND2-OH 3.32Å; N310-Y363 VanDerWaalsContact ND2-OH 3.1Å
311	D	85	Confident	84.7	Confident	29 Å²	29	58.7 Å²	58.7	16%	0.155	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-30.7	176.2	-179.5	79.1	0	0	0	112.7	I304 K305 N307 L309 R315	I304-D311 PolarHBondContact O-N 2.92Å; K305-D311 WeakPolarHBondContact CD-OD1 3.46Å; K305-D311 WeakPolarHBondContact CE-OD1 3.48Å; K305-D311 IonicContact NZ-OD1 3.37Å; K305-D311 PolarHBondContact NZ-OD1 3.2Å; N307-D311 PolarHBondContact O-N 3.13Å; L309-D311 VanDerWaalsContact C-N 3.32Å; L309-D311 PolarHBondContact O-N 3.13Å; D311-R315 WeakPolarHBondContact O-CB 3.42Å; D311-R315 PolarHBondContact O-N 3.25Å; D311-R315 IonicContact OD1-NH2 3.61Å; D311-R315 IonicContact OD2-CZ 2.77Å; D311-R315 IonicContact OD2-NH1 2.76Å; D311-R315 IonicContact OD2-NH2 3.68Å; D311-R315 PolarHBondContact OD2-NH2 3.32Å
312	R	90	Very high	84.3	Confident	166 Å²	166	65.9 Å²	65.9	63%	0.626	34%	0.341	S	S	*	.	H	α-helix	trans	-75.1	-47.3	173.5	-71	171.2	-158.9	180	4.6	112.1	P308 L309 N310 F314 R315 Q316	P308-R312 VanDerWaalsContact O-CG 3.24Å; P308-R312 WeakPolarHBondContact O-CG 3.45Å; P308-R312 PolarHBondContact O-N 3.02Å; L309-R312 PolarHBondContact O-N 3.4Å; L309-R312 VanDerWaalsContact O-N 3.11Å; N310-R312 VanDerWaalsContact C-N 3.29Å; N310-R312 PolarHBondContact O-N 2.91Å; R312-F314 VanDerWaalsContact C-N 3.34Å; R312-R315 WeakPolarHBondContact O-CB 3.49Å; R312-R315 PolarHBondContact O-N 3.05Å; R312-Q316 PolarHBondContact O-N 3.32Å
313	L	87.5	Confident	83.6	Confident	81 Å²	81	64.8 Å²	64.8	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-61.9	-44.1	178.5	-71.2	174.7	0	0	0	111.2	L309 N310 R315 Q316 L317 F359	L309-L313 HydrophobicContact CD1-CD1 4.19Å; L309-L313 HydrophobicContact CD1-CG 4.22Å; L309-L313 HydrophobicContact CG-CD1 3.94Å; L309-L313 HydrophobicContact CG-CG 4.36Å; L309-L313 WeakPolarHBondContact O-CG 3.17Å; L309-L313 PolarHBondContact O-N 2.83Å; N310-L313 PolarHBondContact O-N 3.38Å; L313-R315 VanDerWaalsContact C-N 3.35Å; L313-R315 PolarHBondContact O-N 3.3Å; L313-Q316 PolarHBondContact O-N 2.83Å; L313-L317 PolarHBondContact O-N 2.96Å; L313-F359 HydrophobicContact CB-CE2 3.99Å
314	F	85.8	Confident	82.6	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.009	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-41.1	176	-177.3	-95.3	0	0	0	111.9	I304 N310 R312 Q316 L317 C318 L328 L352 A355 V356 F359	I304-F314 HydrophobicContact CD1-CD2 3.81Å; I304-F314 HydrophobicContact CD1-CE2 3.94Å; I304-F314 HydrophobicContact CD1-CG 4.26Å; I304-F314 HydrophobicContact CD1-CZ 4.48Å; I304-F314 HydrophobicContact CG1-CD2 4.45Å; I304-F314 HydrophobicContact CG2-CB 3.7Å; I304-F314 HydrophobicContact CG2-CD1 4.06Å; I304-F314 HydrophobicContact CG2-CD2 4.38Å; I304-F314 HydrophobicContact CG2-CG 3.76Å; N310-F314 WeakPolarHBondContact O-CB 3.46Å; N310-F314 PolarHBondContact O-N 2.92Å; R312-F314 VanDerWaalsContact C-N 3.34Å; F314-Q316 VanDerWaalsContact C-N 3.35Å; F314-Q316 PolarHBondContact O-N 2.93Å; F314-L317 WeakPolarHBondContact O-CB 3.22Å; F314-L317 PolarHBondContact O-N 3.37Å; F314-C318 WeakPolarHBondContact CE1-SG 3.36Å; F314-C318 VanDerWaalsContact CZ-SG 3.55Å; F314-C318 PolarHBondContact O-N 3.24Å; F314-C318 PolarHBondContact O-SG 3.46Å; F314-L328 HydrophobicContact CD1-CD1 4.17Å; F314-L328 HydrophobicContact CD1-CG 4.33Å; F314-L328 HydrophobicContact CE1-CD1 3.6Å; F314-L328 HydrophobicContact CE1-CD2 4.44Å; F314-L328 HydrophobicContact CE1-CG 3.53Å; F314-L328 HydrophobicContact CE2-CD1 4.31Å; F314-L328 HydrophobicContact CZ-CD1 3.67Å; F314-L328 HydrophobicContact CZ-CD2 4.45Å; F314-L328 HydrophobicContact CZ-CG 3.88Å; F314-L352 HydrophobicContact CE1-CD1 4.2Å; F314-L352 HydrophobicContact CZ-CB 4.3Å; F314-L352 HydrophobicContact CZ-CD1 4.2Å; F314-A355 HydrophobicContact CE2-CB 4.34Å; F314-V356 HydrophobicContact CE2-CB 4.37Å; F314-V356 HydrophobicContact CE2-CG2 3.56Å; F314-V356 HydrophobicContact CZ-CG2 3.68Å; F314-F359 HydrophobicContact CB-CD2 4.09Å; F314-F359 HydrophobicContact CB-CE2 4.17Å; F314-F359 HydrophobicContact CD2-CB 4.05Å; F314-F359 HydrophobicContact CD2-CD2 4.17Å; F314-F359 HydrophobicContact CD2-CG 4.02Å
315	R	84.8	Confident	81.7	Confident	38 Å²	38	73.7 Å²	73.7	14%	0.143	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-45.1	175.2	177.6	180	-55.1	104.6	9.6	111.9	D311 R312 L313 L317 C318 E319 S326 R327	D311-R315 WeakPolarHBondContact O-CB 3.42Å; D311-R315 PolarHBondContact O-N 3.25Å; D311-R315 IonicContact OD1-NH2 3.61Å; D311-R315 IonicContact OD2-CZ 2.77Å; D311-R315 IonicContact OD2-NH1 2.76Å; D311-R315 IonicContact OD2-NH2 3.68Å; D311-R315 PolarHBondContact OD2-NH2 3.32Å; R312-R315 WeakPolarHBondContact O-CB 3.49Å; R312-R315 PolarHBondContact O-N 3.05Å; L313-R315 VanDerWaalsContact C-N 3.35Å; L313-R315 PolarHBondContact O-N 3.3Å; R315-L317 VanDerWaalsContact C-N 3.32Å; R315-C318 PolarHBondContact O-N 3.48Å; R315-E319 WeakPolarHBondContact CG-OE1 3.24Å; R315-E319 WeakPolarHBondContact O-CG 3.37Å; R315-E319 PolarHBondContact O-N 2.95Å; R315-S326 WeakPolarHBondContact CG-O 3.43Å; R315-R327 VanDerWaalsContact NE-NE 3.17Å
316	Q	86.1	Confident	80.9	Confident	101 Å²	101	73.6 Å²	73.6	47%	0.472	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177.6	-175	-177	-21.4	0	0	110.8	R312 L313 F314 C318 E319 E320	R312-Q316 PolarHBondContact O-N 3.32Å; L313-Q316 PolarHBondContact O-N 2.83Å; F314-Q316 VanDerWaalsContact C-N 3.35Å; F314-Q316 PolarHBondContact O-N 2.93Å; Q316-C318 VanDerWaalsContact C-N 3.34Å; Q316-C318 PolarHBondContact O-N 3.2Å; Q316-E319 PolarHBondContact O-N 2.8Å; Q316-E319 VanDerWaalsContact O-N 3.15Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.4Å; Q316-E320 PolarHBondContact NE2-OE1 2.92Å; Q316-E320 WeakPolarHBondContact O-CG 3.23Å; Q316-E320 PolarHBondContact O-N 3.25Å
317	L	84.3	Confident	79.9	Confident	22 Å²	22	76.8 Å²	76.8	12%	0.115	38%	0.378	C	S	.	.	H	α-helix	trans	-58.5	-44.8	175.6	-174.3	66.5	0	0	0	112	L313 F314 R315 E319 E320 S321 A355 E358 F359	L313-L317 PolarHBondContact O-N 2.96Å; F314-L317 WeakPolarHBondContact O-CB 3.22Å; F314-L317 PolarHBondContact O-N 3.37Å; R315-L317 VanDerWaalsContact C-N 3.32Å; L317-E319 VanDerWaalsContact C-N 3.32Å; L317-E319 PolarHBondContact O-N 3.42Å; L317-E320 PolarHBondContact O-N 3.13Å; L317-S321 PolarHBondContact O-N 3.21Å; L317-S321 PolarHBondContact O-OG 2.86Å; L317-S321 VanDerWaalsContact O-OG 3.04Å; L317-A355 HydrophobicContact CD2-CB 4.12Å; L317-A355 WeakPolarHBondContact CD2-O 2.98Å; L317-A355 HydrophobicContact CG-CB 4.26Å; L317-E358 HydrophobicContact CD1-CG 4.28Å; L317-E358 HydrophobicContact CD2-CB 4.21Å; L317-E358 HydrophobicContact CD2-CG 4.24Å; L317-F359 HydrophobicContact CD2-CB 3.94Å
318	C	81.3	Confident	78.8	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63	-36.7	175.9	-63	0	0	0	0	113.3	F314 R315 Q316 A323 L352	F314-C318 WeakPolarHBondContact CE1-SG 3.36Å; F314-C318 VanDerWaalsContact CZ-SG 3.55Å; F314-C318 PolarHBondContact O-N 3.24Å; F314-C318 PolarHBondContact O-SG 3.46Å; R315-C318 PolarHBondContact O-N 3.48Å; Q316-C318 VanDerWaalsContact C-N 3.34Å; Q316-C318 PolarHBondContact O-N 3.2Å; C318-A323 HydrophobicContact CB-CB 4.2Å; C318-A323 WeakPolarHBondContact O-CB 3.36Å; C318-A323 PolarHBondContact O-N 2.95Å; C318-L352 HydrophobicContact CB-CD2 4.49Å
319	E	83.4	Confident	77.4	Confident	114 Å²	114	74 Å²	74	53%	0.533	36%	0.358	S	S	.	.	H	α-helix	trans	-69.4	-34.7	176.7	-72.4	169	-171.2	0	0	111.7	R315 Q316 L317	R315-E319 WeakPolarHBondContact CG-OE1 3.24Å; R315-E319 WeakPolarHBondContact O-CG 3.37Å; R315-E319 PolarHBondContact O-N 2.95Å; Q316-E319 PolarHBondContact O-N 2.8Å; Q316-E319 VanDerWaalsContact O-N 3.15Å; L317-E319 VanDerWaalsContact C-N 3.32Å; L317-E319 PolarHBondContact O-N 3.42Å
320	E	83.4	Confident	75.5	Confident	129 Å²	129	73.9 Å²	73.9	60%	0.603	36%	0.358	S	S	*	.	H	α-helix	trans	-73.1	-30.5	176	-72.1	172.4	-169.6	0	0	112.9	Q316 L317 D322	Q316-E320 WeakPolarHBondContact CG-OE1 3.4Å; Q316-E320 PolarHBondContact NE2-OE1 2.92Å; Q316-E320 WeakPolarHBondContact O-CG 3.23Å; Q316-E320 PolarHBondContact O-N 3.25Å; L317-E320 PolarHBondContact O-N 3.13Å; E320-D322 VanDerWaalsContact C-N 3.29Å; E320-D322 PolarHBondContact O-N 2.96Å
321	S	76.1	Confident	73.7	Confident	63 Å²	63	76.6 Å²	76.6	44%	0.441	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	8.9	176.4	-49.8	0	0	0	0	114.5	L317 A323	L317-S321 PolarHBondContact O-N 3.21Å; L317-S321 PolarHBondContact O-OG 2.86Å; L317-S321 VanDerWaalsContact O-OG 3.04Å; S321-A323 PolarHBondContact O-N 3.23Å; S321-A323 VanDerWaalsContact O-N 3.15Å
322	D	72.3	Confident	71.7	Confident	156 Å²	156	78.2 Å²	78.2	83%	0.834	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	33.2	-173.2	-76.8	-36.4	0	0	0	113.5	E320	E320-D322 VanDerWaalsContact C-N 3.29Å; E320-D322 PolarHBondContact O-N 2.96Å
323	A	67.6	Low	69.5	Low	32 Å²	32	79.1 Å²	79.1	26%	0.264	39%	0.389	S	S	.	.			trans	-69.8	140.6	-177.8	0	0	0	0	0	111.6	C318 S321 Y325 L352	C318-A323 HydrophobicContact CB-CB 4.2Å; C318-A323 WeakPolarHBondContact O-CB 3.36Å; C318-A323 PolarHBondContact O-N 2.95Å; S321-A323 PolarHBondContact O-N 3.23Å; S321-A323 VanDerWaalsContact O-N 3.15Å; A323-Y325 PolarHBondContact O-N 2.93Å; A323-Y325 VanDerWaalsContact O-N 3.13Å; A323-L352 HydrophobicContact CB-CD2 3.48Å; A323-L352 VanDerWaalsContact CB-CD2 3.48Å
324	E	65.8	Low	67.2	Low	154 Å²	154	81.3 Å²	81.3	72%	0.72	41%	0.406	S	S	*	.	S	Bend	trans	-59.3	-28.8	179	-171.4	176.1	167.6	0	0	112.5
325	Y	65.2	Low	65.2	Low	88 Å²	88	91 Å²	91	35%	0.345	44%	0.443	S	S	.	.			trans	-121.4	127.7	178.7	-62.6	-81.6	0	0	0	112	A323 E351 L352	A323-Y325 PolarHBondContact O-N 2.93Å; A323-Y325 VanDerWaalsContact O-N 3.13Å; Y325-E351 WeakPolarHBondContact CD2-OE2 3.32Å; Y325-E351 WeakPolarHBondContact CE2-OE2 3.16Å; Y325-L352 VanDerWaalsContact O-CD2 3.23Å; Y325-L352 WeakPolarHBondContact O-CD2 3.41Å
326	S	62.7	Low	63.6	Low	44 Å²	44	91.7 Å²	91.7	31%	0.308	45%	0.445	S	S	.	.	S	Bend	trans	-97.1	4.3	178.2	66.5	0	0	0	0	114.5	R315	R315-S326 WeakPolarHBondContact CG-O 3.43Å
327	R	64.8	Low	61.4	Low	153 Å²	153	88.3 Å²	88.3	58%	0.577	43%	0.43	S	S	*	.			trans	-145.6	124.8	-174.7	-63.7	-174.5	-176.6	-164.3	-3	112.4	R315	R315-R327 VanDerWaalsContact NE-NE 3.17Å
328	L	63.5	Low	59.3	Low	6 Å²	6	89.9 Å²	89.9	3%	0.031	44%	0.443	C	S	.	.			trans	-68.3	158.8	163.1	-67.7	169.2	0	0	0	110.9	I301 I304 K305 F314 L349 L352 V356	I301-L328 HydrophobicContact CG1-CD1 4.45Å; I304-L328 HydrophobicContact CB-CD1 4.39Å; I304-L328 HydrophobicContact CD1-CD1 3.47Å; I304-L328 VanDerWaalsContact CD1-CD1 3.47Å; I304-L328 HydrophobicContact CG2-CD1 4.26Å; K305-L328 VanDerWaalsContact CE-C 3.45Å; K305-L328 WeakPolarHBondContact CE-O 3.27Å; K305-L328 PolarHBondContact NZ-O 3.46Å; F314-L328 HydrophobicContact CD1-CD1 4.17Å; F314-L328 HydrophobicContact CD1-CG 4.33Å; F314-L328 HydrophobicContact CE1-CD1 3.6Å; F314-L328 HydrophobicContact CE1-CD2 4.44Å; F314-L328 HydrophobicContact CE1-CG 3.53Å; F314-L328 HydrophobicContact CE2-CD1 4.31Å; F314-L328 HydrophobicContact CZ-CD1 3.67Å; F314-L328 HydrophobicContact CZ-CD2 4.45Å; F314-L328 HydrophobicContact CZ-CG 3.88Å; L328-L349 HydrophobicContact CD2-CD1 4.2Å; L328-L352 HydrophobicContact CD2-CD1 3.89Å; L328-L352 HydrophobicContact CG-CD1 4.37Å; L328-V356 HydrophobicContact CD1-CG2 4.39Å
329	L	59.3	Low	57.3	Low	75 Å²	75	97.6 Å²	97.6	39%	0.393	48%	0.476	S	S	.	.			trans	-109.4	133.3	173.6	-64.8	165.2	0	0	0	109.5	I301 H331 T341 R345	I301-L329 WeakPolarHBondContact CG2-O 3.4Å; L329-H331 PolarHBondContact O-N 3.35Å; L329-T341 HydrophobicContact CD1-CG2 3.48Å; L329-T341 VanDerWaalsContact CD1-CG2 3.48Å; L329-R345 HydrophobicContact CB-CG 3.99Å; L329-R345 HydrophobicContact CD1-CG 4.26Å
330	L	50.2	Low	55.4	Low	94 Å²	94	92.3 Å²	92.3	49%	0.492	45%	0.453	S	S	.	.			trans	-61.4	136.5	175.7	-90.8	169.6	0	0	0	111	K305 T332 R345	K305-L330 HydrophobicContact CB-CD1 4.37Å; K305-L330 HydrophobicContact CB-CD2 3.38Å; K305-L330 HydrophobicContact CB-CG 3.72Å; K305-L330 HydrophobicContact CD-CG 4.28Å; K305-L330 HydrophobicContact CG-CD2 3.86Å; K305-L330 HydrophobicContact CG-CG 3.83Å; L330-T332 PolarHBondContact O-N 3.22Å; L330-T332 VanDerWaalsContact O-N 3.09Å; L330-R345 PolarHBondContact O-NE 2.98Å; L330-R345 PolarHBondContact O-NH2 3.2Å
331	H	48.5	Very low	53.5	Low	62 Å²	62	88.2 Å²	88.2	29%	0.287	44%	0.436	S	S	.	.			trans	-70.4	103.7	172.2	179.1	-76.4	0	0	0	111.1	I298 L329	I298-H331 HydrophobicContact CG1-CB 4.04Å; I298-H331 HydrophobicContact CG2-CB 4.3Å; L329-H331 PolarHBondContact O-N 3.35Å
332	T	43.2	Very low	52	Low	62 Å²	62	86.3 Å²	86.3	38%	0.38	42%	0.423	S	S	.	.			trans	-93.4	120.8	170.5	48.4	0	0	0	0	110.5	L330 V334 R335 R345	L330-T332 PolarHBondContact O-N 3.22Å; L330-T332 VanDerWaalsContact O-N 3.09Å; T332-V334 PolarHBondContact O-N 2.95Å; T332-R335 PolarHBondContact OG1-O 3.29Å; T332-R345 PolarHBondContact OG1-NH2 3.26Å; T332-R345 VanDerWaalsContact OG1-NH2 3.12Å
333	K	43.7	Very low	50.8	Low	185 Å²	185	80.2 Å²	80.2	80%	0.804	39%	0.39	S	S	*	.	S	Bend	trans	-64.6	-22.1	176.5	-74	-179.5	179	177.1	0	113.7
334	V	40.1	Very low	50.1	Low	127 Å²	127	80.7 Å²	80.7	77%	0.77	39%	0.39	S	S	*	.	S	Bend	trans	-113.4	-16.5	-159	-167.1	0	0	0	0	114.3	T332	T332-V334 PolarHBondContact O-N 2.95Å
335	R	43.1	Very low	49.7	Very low	207 Å²	207	74.5 Å²	74.5	78%	0.781	36%	0.36	S	S	*	.			trans	-133.8	94.3	-173	-65.8	-177.5	-177.4	173.4	0.1	110.9	T332	T332-R335 PolarHBondContact OG1-O 3.29Å
336	W	51.7	Low	49.2	Very low	51 Å²	51	71 Å²	71	19%	0.193	35%	0.346	C	S	.	.			trans	-115	-15.8	-174.2	61.3	-84.5	0	0	0	114.1	I276 H280 S338 C342 N392	I276-W336 HydrophobicContact CB-CH2 3.72Å; I276-W336 HydrophobicContact CB-CZ3 4.36Å; I276-W336 HydrophobicContact CG2-CH2 3.2Å; I276-W336 HydrophobicContact CG2-CZ2 4.48Å; I276-W336 HydrophobicContact CG2-CZ3 3.35Å; I276-W336 WeakPolarHBondContact O-CH2 3.37Å; H280-W336 HydrophobicContact CB-CH2 4.33Å; H280-W336 HydrophobicContact CB-CZ2 4.38Å; W336-S338 PolarHBondContact O-N 3.1Å; W336-S338 VanDerWaalsContact O-N 3.14Å; W336-C342 HydrophobicContact CB-CB 4.23Å; W336-N392 WeakPolarHBondContact CZ3-ND2 3.39Å
337	L	40.2	Very low	48.9	Very low	31 Å²	31	72 Å²	72	16%	0.162	34%	0.344	C	S	.	.			trans	-71.7	1.1	-176.4	-76.1	169.3	0	0	0	115.3	I276 K339 V520 C522	I276-L337 HydrophobicContact CD1-CD2 4.4Å; I276-L337 HydrophobicContact CG2-CD2 4.45Å; L337-K339 PolarHBondContact O-N 3.37Å; L337-V520 HydrophobicContact CB-CG1 3.24Å; L337-V520 HydrophobicContact CD1-CG1 4.45Å; L337-V520 HydrophobicContact CG-CG1 4.47Å; L337-V520 WeakPolarHBondContact O-CG1 3.48Å; L337-C522 HydrophobicContact CD1-CB 4.05Å
338	S	40.2	Very low	48.8	Very low	54 Å²	54	65.2 Å²	65.2	38%	0.378	32%	0.32	S	S	.	.	S	Bend	trans	-73.7	95.5	168.4	65.2	0	0	0	0	108.3	W336 G340 T341	W336-S338 PolarHBondContact O-N 3.1Å; W336-S338 VanDerWaalsContact O-N 3.14Å; S338-G340 VanDerWaalsContact C-N 3.33Å; S338-G340 PolarHBondContact O-N 2.54Å; S338-T341 WeakPolarHBondContact O-CB 3.28Å; S338-T341 PolarHBondContact O-N 2.97Å; S338-T341 PolarHBondContact O-OG1 3.11Å; S338-T341 WeakPolarHBondContact OG-CB 3.18Å; S338-T341 PolarHBondContact OG-OG1 3.23Å
339	K	39.5	Very low	48.8	Very low	163 Å²	163	65 Å²	65	71%	0.709	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	20.3	63.8	166.5	-70.9	-169.7	175	-169.2	0	115.7	L337 T341 L393	L337-K339 PolarHBondContact O-N 3.37Å; K339-T341 VanDerWaalsContact C-N 3.34Å; K339-T341 PolarHBondContact O-N 2.92Å; K339-L393 HydrophobicContact CB-CD2 3.81Å; K339-L393 HydrophobicContact CG-CD2 4.05Å
340	G	41.8	Very low	49.1	Very low	3 Å²	3	62.8 Å²	62.8	3%	0.031	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	2.3	174.9	0	0	0	0	0	118.1	S338 C342 L343 T344 N389	S338-G340 VanDerWaalsContact C-N 3.33Å; S338-G340 PolarHBondContact O-N 2.54Å; G340-C342 PolarHBondContact O-N 2.96Å; G340-L343 PolarHBondContact O-N 3.42Å; G340-L343 VanDerWaalsContact O-N 3.1Å; G340-T344 WeakPolarHBondContact O-CB 3.12Å; G340-T344 PolarHBondContact O-N 2.7Å; G340-T344 PolarHBondContact O-OG1 3.48Å; G340-N389 WeakPolarHBondContact CA-OD1 2.86Å; G340-N389 PolarHBondContact O-ND2 3.5Å; G340-N389 PolarHBondContact O-OD1 3.3Å
341	T	43.5	Very low	49.9	Very low	43 Å²	43	61.2 Å²	61.2	26%	0.264	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.3	-173.5	-49.9	0	0	0	0	114.3	L329 S338 K339 R345	L329-T341 HydrophobicContact CD1-CG2 3.48Å; L329-T341 VanDerWaalsContact CD1-CG2 3.48Å; S338-T341 WeakPolarHBondContact O-CB 3.28Å; S338-T341 PolarHBondContact O-N 2.97Å; S338-T341 PolarHBondContact O-OG1 3.11Å; S338-T341 WeakPolarHBondContact OG-CB 3.18Å; S338-T341 PolarHBondContact OG-OG1 3.23Å; K339-T341 VanDerWaalsContact C-N 3.34Å; K339-T341 PolarHBondContact O-N 2.92Å; T341-R345 WeakPolarHBondContact O-CG 3.46Å
342	C	44.6	Very low	50.9	Low	23 Å²	23	58.4 Å²	58.4	16%	0.155	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-37.8	177.9	-170.8	0	0	0	0	113.3	W336 G340 R345	W336-C342 HydrophobicContact CB-CB 4.23Å; G340-C342 PolarHBondContact O-N 2.96Å; C342-R345 WeakPolarHBondContact O-CB 3.14Å; C342-R345 VanDerWaalsContact O-CG 3.26Å; C342-R345 WeakPolarHBondContact O-CG 3.38Å; C342-R345 PolarHBondContact SG-NH1 3.36Å
343	L	47.3	Very low	52.8	Low	28 Å²	28	55.9 Å²	55.9	15%	0.147	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-24.1	-178.7	-29.2	175.4	0	0	0	111.1	G340 R345 F346 Y385 F388 N389	G340-L343 PolarHBondContact O-N 3.42Å; G340-L343 VanDerWaalsContact O-N 3.1Å; L343-R345 PolarHBondContact O-N 3.21Å; L343-R345 VanDerWaalsContact O-N 3.14Å; L343-F346 PolarHBondContact O-N 3.19Å; L343-Y385 HydrophobicContact CB-CD1 3.89Å; L343-Y385 HydrophobicContact CB-CG 4.15Å; L343-Y385 HydrophobicContact CD1-CD1 4.06Å; L343-Y385 HydrophobicContact CD2-CD1 3.57Å; L343-Y385 HydrophobicContact CD2-CE1 3.84Å; L343-Y385 HydrophobicContact CD2-CG 4.49Å; L343-Y385 HydrophobicContact CG-CD1 4.05Å; L343-F388 HydrophobicContact CD1-CB 3.57Å; L343-N389 VanDerWaalsContact CB-CG 3.46Å; L343-N389 WeakPolarHBondContact CB-OD1 3.5Å; L343-N389 HydrophobicContact CD1-CB 4.49Å; L343-N389 WeakPolarHBondContact CD1-OD1 3.43Å; L343-N389 WeakPolarHBondContact CG-OD1 3.42Å
344	T	52.3	Low	54.6	Low	42 Å²	42	54.9 Å²	54.9	26%	0.258	27%	0.265	S	S	.	.	H	α-helix	trans	-59.8	-22.9	167.8	-56.2	0	0	0	0	111	G340 F346 Y347 C348 N389	G340-T344 WeakPolarHBondContact O-CB 3.12Å; G340-T344 PolarHBondContact O-N 2.7Å; G340-T344 PolarHBondContact O-OG1 3.48Å; T344-F346 VanDerWaalsContact C-N 3.32Å; T344-F346 PolarHBondContact O-N 3.19Å; T344-Y347 PolarHBondContact O-N 3.16Å; T344-C348 WeakPolarHBondContact O-CB 3.31Å; T344-C348 PolarHBondContact O-N 3.4Å; T344-C348 PolarHBondContact O-SG 3.12Å; T344-N389 PolarHBondContact N-ND2 3.03Å; T344-N389 PolarHBondContact OG1-ND2 3.48Å
345	R	58.1	Low	56.7	Low	23 Å²	23	49 Å²	49	9%	0.087	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-37.6	176.5	-55.8	-173.2	-180	135.7	-4.9	113.2	L329 L330 T332 T341 C342 L343 L349	L329-R345 HydrophobicContact CB-CG 3.99Å; L329-R345 HydrophobicContact CD1-CG 4.26Å; L330-R345 PolarHBondContact O-NE 2.98Å; L330-R345 PolarHBondContact O-NH2 3.2Å; T332-R345 PolarHBondContact OG1-NH2 3.26Å; T332-R345 VanDerWaalsContact OG1-NH2 3.12Å; T341-R345 WeakPolarHBondContact O-CG 3.46Å; C342-R345 WeakPolarHBondContact O-CB 3.14Å; C342-R345 VanDerWaalsContact O-CG 3.26Å; C342-R345 WeakPolarHBondContact O-CG 3.38Å; C342-R345 PolarHBondContact SG-NH1 3.36Å; L343-R345 PolarHBondContact O-N 3.21Å; L343-R345 VanDerWaalsContact O-N 3.14Å; R345-L349 WeakPolarHBondContact O-CB 3.27Å; R345-L349 PolarHBondContact O-N 2.99Å
346	F	55.2	Low	58.6	Low	14 Å²	14	39.2 Å²	39.2	6%	0.061	19%	0.193	C	C	.	.	H	α-helix	trans	-73.7	-41.6	179.6	-89.2	-80.2	0	0	0	111.5	L294 V297 L343 T344 L349 F350 L381 A382 Y385	L294-F346 HydrophobicContact CB-CZ 4.43Å; L294-F346 HydrophobicContact CD1-CE2 3.53Å; L294-F346 HydrophobicContact CD1-CZ 3.34Å; L294-F346 HydrophobicContact CG-CZ 4.47Å; V297-F346 HydrophobicContact CB-CE1 4.12Å; V297-F346 HydrophobicContact CB-CZ 4.45Å; V297-F346 HydrophobicContact CG1-CD1 4.44Å; V297-F346 HydrophobicContact CG1-CE1 3.85Å; V297-F346 HydrophobicContact CG1-CZ 4.15Å; V297-F346 HydrophobicContact CG2-CE1 4.02Å; L343-F346 PolarHBondContact O-N 3.19Å; T344-F346 VanDerWaalsContact C-N 3.32Å; T344-F346 PolarHBondContact O-N 3.19Å; F346-L349 WeakPolarHBondContact O-CB 3.29Å; F346-L349 PolarHBondContact O-N 2.91Å; F346-F350 PolarHBondContact O-N 2.94Å; F346-L381 HydrophobicContact CD1-CB 4.43Å; F346-L381 HydrophobicContact CE1-CD1 4.36Å; F346-A382 HydrophobicContact CB-CB 4.36Å; F346-Y385 HydrophobicContact CB-CD2 4.32Å; F346-Y385 AromaticContact CD2-CD2 3.64Å; F346-Y385 HydrophobicContact CD2-CD2 3.64Å; F346-Y385 AromaticContact CD2-CE2 3.91Å; F346-Y385 HydrophobicContact CD2-CE2 3.91Å; F346-Y385 HydrophobicContact CD2-CG 4.33Å; F346-Y385 HydrophobicContact CE2-CD2 4.07Å; F346-Y385 AromaticContact CE2-CE2 3.83Å; F346-Y385 HydrophobicContact CE2-CE2 3.83Å; F346-Y385 AromaticContact CG-CD2 3.98Å; F346-Y385 HydrophobicContact CG-CD2 3.98Å; F346-Y385 HydrophobicContact CZ-CE2 4.37Å
347	Y	55.9	Low	60.3	Low	65 Å²	65	37.9 Å²	37.9	26%	0.255	19%	0.19	S	C	.	.	H	α-helix	trans	-59.8	-53	173.6	178.5	-99.6	0	0	0	111.1	T344 L349 F350 E351 F386	T344-Y347 PolarHBondContact O-N 3.16Å; Y347-L349 VanDerWaalsContact C-N 3.28Å; Y347-L349 PolarHBondContact O-N 3.19Å; Y347-F350 PolarHBondContact O-N 3.44Å; Y347-E351 HydrophobicContact CE1-CG 4.19Å; Y347-E351 WeakPolarHBondContact CE1-OE1 3.35Å; Y347-E351 PolarHBondContact O-N 2.75Å; Y347-E351 PolarHBondContact OH-OE1 3.16Å; Y347-F386 HydrophobicContact CD2-CD2 4.34Å
348	C	62.9	Low	62.6	Low	11 Å²	11	41.7 Å²	41.7	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-33.5	173.8	-65.2	0	0	0	0	112.9	T344 F350 L352	T344-C348 WeakPolarHBondContact O-CB 3.31Å; T344-C348 PolarHBondContact O-N 3.4Å; T344-C348 PolarHBondContact O-SG 3.12Å; C348-F350 VanDerWaalsContact C-N 3.32Å; C348-L352 VanDerWaalsContact O-CB 3.26Å; C348-L352 WeakPolarHBondContact O-CB 3.43Å; C348-L352 WeakPolarHBondContact O-CG 3.47Å; C348-L352 PolarHBondContact O-N 2.9Å
349	L	64	Low	64.9	Low	2 Å²	2	40 Å²	40	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-39.7	174.8	-177.8	80.7	0	0	0	111	V297 I301 L328 R345 F346 Y347 L352 F353 V356 I378	V297-L349 HydrophobicContact CB-CD2 4.06Å; V297-L349 HydrophobicContact CG1-CD2 3.34Å; V297-L349 HydrophobicContact CG2-CD2 3.62Å; I301-L349 HydrophobicContact CD1-CD1 4.45Å; I301-L349 HydrophobicContact CG1-CD1 4.23Å; L328-L349 HydrophobicContact CD2-CD1 4.2Å; R345-L349 WeakPolarHBondContact O-CB 3.27Å; R345-L349 PolarHBondContact O-N 2.99Å; F346-L349 WeakPolarHBondContact O-CB 3.29Å; F346-L349 PolarHBondContact O-N 2.91Å; Y347-L349 VanDerWaalsContact C-N 3.28Å; Y347-L349 PolarHBondContact O-N 3.19Å; L349-L352 CarbonylContact O-C 3.34Å; L349-L352 VanDerWaalsContact O-C 3.24Å; L349-L352 PolarHBondContact O-N 3.37Å; L349-F353 VanDerWaalsContact O-CA 3.23Å; L349-F353 WeakPolarHBondContact O-CA 2.97Å; L349-F353 PolarHBondContact O-N 3.01Å; L349-V356 HydrophobicContact CD1-CG1 4.49Å; L349-V356 HydrophobicContact CD1-CG2 3.94Å; L349-I378 HydrophobicContact CD2-CG2 4.19Å
350	F	64.9	Low	67.3	Low	29 Å²	29	32.2 Å²	32.2	13%	0.127	16%	0.16	C	C	.	.	H	α-helix	trans	-68.5	-42.6	177.6	-169	-95.8	0	0	0	111.2	F346 Y347 C348 L352 F353 E375 I378 A379 A382 N433	F346-F350 PolarHBondContact O-N 2.94Å; Y347-F350 PolarHBondContact O-N 3.44Å; C348-F350 VanDerWaalsContact C-N 3.32Å; F350-L352 PolarHBondContact O-N 2.96Å; F350-F353 WeakPolarHBondContact O-CB 3.24Å; F350-F353 PolarHBondContact O-N 2.99Å; F350-E375 HydrophobicContact CE2-CG 4.39Å; F350-I378 HydrophobicContact CB-CG2 4.49Å; F350-I378 HydrophobicContact CD2-CG2 4.02Å; F350-A379 HydrophobicContact CD2-CB 3.98Å; F350-A379 HydrophobicContact CE2-CB 3.44Å; F350-A379 VanDerWaalsContact CE2-CB 3.44Å; F350-A379 HydrophobicContact CZ-CB 3.82Å; F350-A382 HydrophobicContact CB-CB 4.02Å; F350-N433 HydrophobicContact CD1-CB 3.66Å; F350-N433 VanDerWaalsContact CD1-CG 3.48Å; F350-N433 WeakPolarHBondContact CD1-OD1 3.32Å; F350-N433 HydrophobicContact CE1-CB 3.55Å; F350-N433 WeakPolarHBondContact CE1-OD1 3.44Å; F350-N433 HydrophobicContact CG-CB 4.27Å; F350-N433 HydrophobicContact CZ-CB 4.11Å
351	E	67.6	Low	69.6	Low	61 Å²	61	34.3 Å²	34.3	29%	0.285	18%	0.177	S	C	.	.	H	α-helix	trans	-58.9	-35.3	171.6	-69	177.4	148.9	0	0	112.5	Y325 Y347 F353	Y325-E351 WeakPolarHBondContact CD2-OE2 3.32Å; Y325-E351 WeakPolarHBondContact CE2-OE2 3.16Å; Y347-E351 HydrophobicContact CE1-CG 4.19Å; Y347-E351 WeakPolarHBondContact CE1-OE1 3.35Å; Y347-E351 PolarHBondContact O-N 2.75Å; Y347-E351 PolarHBondContact OH-OE1 3.16Å; E351-F353 VanDerWaalsContact C-N 3.35Å
352	L	69.9	Low	71.6	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	14.1	176.4	-58.3	176.7	0	0	0	112.7	F314 C318 A323 Y325 L328 C348 L349 F350 E354 A355 V356	F314-L352 HydrophobicContact CE1-CD1 4.2Å; F314-L352 HydrophobicContact CZ-CB 4.3Å; F314-L352 HydrophobicContact CZ-CD1 4.2Å; C318-L352 HydrophobicContact CB-CD2 4.49Å; A323-L352 HydrophobicContact CB-CD2 3.48Å; A323-L352 VanDerWaalsContact CB-CD2 3.48Å; Y325-L352 VanDerWaalsContact O-CD2 3.23Å; Y325-L352 WeakPolarHBondContact O-CD2 3.41Å; L328-L352 HydrophobicContact CD2-CD1 3.89Å; L328-L352 HydrophobicContact CG-CD1 4.37Å; C348-L352 VanDerWaalsContact O-CB 3.26Å; C348-L352 WeakPolarHBondContact O-CB 3.43Å; C348-L352 WeakPolarHBondContact O-CG 3.47Å; C348-L352 PolarHBondContact O-N 2.9Å; L349-L352 CarbonylContact O-C 3.34Å; L349-L352 VanDerWaalsContact O-C 3.24Å; L349-L352 PolarHBondContact O-N 3.37Å; F350-L352 PolarHBondContact O-N 2.96Å; L352-E354 VanDerWaalsContact C-N 3.33Å; L352-E354 PolarHBondContact O-N 3.34Å; L352-A355 PolarHBondContact O-N 3.13Å; L352-V356 HydrophobicContact CB-CG2 4.4Å; L352-V356 WeakPolarHBondContact O-CB 3.08Å; L352-V356 VanDerWaalsContact O-CG2 3.23Å; L352-V356 WeakPolarHBondContact O-CG2 3.23Å; L352-V356 PolarHBondContact O-N 3.18Å
353	F	81.5	Confident	73.5	Confident	10 Å²	10	42.1 Å²	42.1	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-43.5	-169.6	-176.8	-104.2	0	0	0	111	L349 F350 E351 V356 V357 L371 E375 I378	L349-F353 VanDerWaalsContact O-CA 3.23Å; L349-F353 WeakPolarHBondContact O-CA 2.97Å; L349-F353 PolarHBondContact O-N 3.01Å; F350-F353 WeakPolarHBondContact O-CB 3.24Å; F350-F353 PolarHBondContact O-N 2.99Å; E351-F353 VanDerWaalsContact C-N 3.35Å; F353-V356 PolarHBondContact O-N 2.91Å; F353-V357 HydrophobicContact CD1-CG2 4Å; F353-V357 HydrophobicContact CD2-CG2 4.41Å; F353-V357 HydrophobicContact CE1-CG2 3.62Å; F353-V357 HydrophobicContact CE2-CG2 4.05Å; F353-V357 HydrophobicContact CG-CG2 4.38Å; F353-V357 HydrophobicContact CZ-CG2 3.66Å; F353-V357 WeakPolarHBondContact O-CB 3.5Å; F353-V357 VanDerWaalsContact O-CG2 3.26Å; F353-V357 WeakPolarHBondContact O-CG2 3.39Å; F353-V357 PolarHBondContact O-N 3.29Å; F353-L371 HydrophobicContact CE2-CB 4.2Å; F353-L371 HydrophobicContact CZ-CB 4.47Å; F353-E375 HydrophobicContact CD1-CG 4.09Å; F353-E375 HydrophobicContact CE1-CB 4Å; F353-E375 HydrophobicContact CE1-CG 3.48Å; F353-E375 VanDerWaalsContact CE1-CG 3.48Å; F353-E375 WeakPolarHBondContact CE1-OE1 3.29Å; F353-E375 HydrophobicContact CZ-CB 3.8Å; F353-E375 HydrophobicContact CZ-CG 3.74Å; F353-I378 HydrophobicContact CD2-CD1 4.12Å; F353-I378 HydrophobicContact CE2-CD1 3.49Å; F353-I378 VanDerWaalsContact CE2-CD1 3.49Å; F353-I378 HydrophobicContact CZ-CD1 4.39Å
354	E	82.5	Confident	75.5	Confident	163 Å²	163	42.6 Å²	42.6	76%	0.762	22%	0.219	S	C	*	.	H	α-helix	trans	-59.9	-48.9	176.6	-63.3	-173.6	167.3	0	0	111.3	L352 V356 V357 E358	L352-E354 VanDerWaalsContact C-N 3.33Å; L352-E354 PolarHBondContact O-N 3.34Å; E354-V356 VanDerWaalsContact C-N 3.33Å; E354-V356 PolarHBondContact O-N 3.38Å; E354-V357 PolarHBondContact O-N 2.78Å; E354-E358 WeakPolarHBondContact O-CB 3.44Å; E354-E358 PolarHBondContact O-N 3.31Å
355	A	83.3	Confident	77.4	Confident	5 Å²	5	45 Å²	45	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-38	176.3	0	0	0	0	0	112.4	F314 L317 L352 F359	F314-A355 HydrophobicContact CE2-CB 4.34Å; L317-A355 HydrophobicContact CD2-CB 4.12Å; L317-A355 WeakPolarHBondContact CD2-O 2.98Å; L317-A355 HydrophobicContact CG-CB 4.26Å; L352-A355 PolarHBondContact O-N 3.13Å; A355-F359 WeakPolarHBondContact O-CB 3.26Å; A355-F359 PolarHBondContact O-N 3.06Å
356	V	84.6	Confident	79	Confident	1 Å²	1	47 Å²	47	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-43.8	175.7	169.8	0	0	0	0	110.6	I304 F314 L328 L349 L352 F353 E354 F360 L371	I304-V356 HydrophobicContact CD1-CG2 4.42Å; F314-V356 HydrophobicContact CE2-CB 4.37Å; F314-V356 HydrophobicContact CE2-CG2 3.56Å; F314-V356 HydrophobicContact CZ-CG2 3.68Å; L328-V356 HydrophobicContact CD1-CG2 4.39Å; L349-V356 HydrophobicContact CD1-CG1 4.49Å; L349-V356 HydrophobicContact CD1-CG2 3.94Å; L352-V356 HydrophobicContact CB-CG2 4.4Å; L352-V356 WeakPolarHBondContact O-CB 3.08Å; L352-V356 VanDerWaalsContact O-CG2 3.23Å; L352-V356 WeakPolarHBondContact O-CG2 3.23Å; L352-V356 PolarHBondContact O-N 3.18Å; F353-V356 PolarHBondContact O-N 2.91Å; E354-V356 VanDerWaalsContact C-N 3.33Å; E354-V356 PolarHBondContact O-N 3.38Å; V356-F360 HydrophobicContact CG1-CD2 3.75Å; V356-F360 HydrophobicContact CG1-CE2 3.9Å; V356-F360 WeakPolarHBondContact O-CD2 3.48Å; V356-F360 PolarHBondContact O-N 2.95Å; V356-L371 HydrophobicContact CG1-CD1 3.95Å
357	V	86.9	Confident	80.7	Confident	22 Å²	22	46.6 Å²	46.6	13%	0.133	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-46.9	177.6	163.9	0	0	0	0	110.6	F353 E354 F360 A361 C368 K372	F353-V357 HydrophobicContact CD1-CG2 4Å; F353-V357 HydrophobicContact CD2-CG2 4.41Å; F353-V357 HydrophobicContact CE1-CG2 3.62Å; F353-V357 HydrophobicContact CE2-CG2 4.05Å; F353-V357 HydrophobicContact CG-CG2 4.38Å; F353-V357 HydrophobicContact CZ-CG2 3.66Å; F353-V357 WeakPolarHBondContact O-CB 3.5Å; F353-V357 VanDerWaalsContact O-CG2 3.26Å; F353-V357 WeakPolarHBondContact O-CG2 3.39Å; F353-V357 PolarHBondContact O-N 3.29Å; E354-V357 PolarHBondContact O-N 2.78Å; V357-F360 PolarHBondContact O-N 3.14Å; V357-A361 WeakPolarHBondContact O-CB 3.38Å; V357-A361 PolarHBondContact O-N 3.01Å; V357-C368 PolarHBondContact O-SG 2.86Å; V357-K372 HydrophobicContact CG1-CD 4.25Å; V357-K372 HydrophobicContact CG1-CG 4.05Å; V357-K372 HydrophobicContact CG2-CG 4.15Å
358	E	87.5	Confident	82.3	Confident	111 Å²	111	43.5 Å²	43.5	52%	0.519	24%	0.237	S	C	.	.	H	α-helix	trans	-61.3	-47.5	176.9	-179.7	172.8	-176.2	0	0	111.4	L317 E354 F360 A361	L317-E358 HydrophobicContact CD1-CG 4.28Å; L317-E358 HydrophobicContact CD2-CB 4.21Å; L317-E358 HydrophobicContact CD2-CG 4.24Å; E354-E358 WeakPolarHBondContact O-CB 3.44Å; E354-E358 PolarHBondContact O-N 3.31Å; E358-F360 VanDerWaalsContact C-N 3.31Å; E358-F360 PolarHBondContact O-N 3.34Å; E358-A361 WeakPolarHBondContact O-CB 3.49Å; E358-A361 PolarHBondContact O-N 2.97Å; E358-A361 VanDerWaalsContact O-N 3.15Å
359	F	88.8	Confident	83.8	Confident	19 Å²	19	47.4 Å²	47.4	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-56.3	-45.2	176.5	-177.8	-91.4	0	0	0	112.1	I304 N310 L313 F314 L317 A355 S362 Y363	I304-F359 HydrophobicContact CD1-CD1 4.34Å; I304-F359 HydrophobicContact CG1-CD1 3.93Å; I304-F359 HydrophobicContact CG1-CE1 3.83Å; N310-F359 HydrophobicContact CB-CE1 4.47Å; N310-F359 HydrophobicContact CB-CZ 3.71Å; L313-F359 HydrophobicContact CB-CE2 3.99Å; F314-F359 HydrophobicContact CB-CD2 4.09Å; F314-F359 HydrophobicContact CB-CE2 4.17Å; F314-F359 HydrophobicContact CD2-CB 4.05Å; F314-F359 HydrophobicContact CD2-CD2 4.17Å; F314-F359 HydrophobicContact CD2-CG 4.02Å; L317-F359 HydrophobicContact CD2-CB 3.94Å; A355-F359 WeakPolarHBondContact O-CB 3.26Å; A355-F359 PolarHBondContact O-N 3.06Å; F359-S362 PolarHBondContact O-OG 3.26Å; F359-Y363 HydrophobicContact CE1-CD1 4.23Å; F359-Y363 HydrophobicContact CE1-CG 4.27Å; F359-Y363 WeakPolarHBondContact O-CB 3.44Å; F359-Y363 PolarHBondContact O-N 3.28Å
360	F	90.3	Very high	85.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-79.2	-17.7	-179.7	-76.7	-61	0	0	0	114	A300 K303 I304 V356 V357 E358 S362 Y363 D364 N365 L367 C368 L371	A300-F360 HydrophobicContact CB-CE2 3.73Å; A300-F360 HydrophobicContact CB-CZ 4.13Å; A300-F360 WeakPolarHBondContact O-CZ 3.39Å; K303-F360 HydrophobicContact CB-CE1 3.97Å; K303-F360 HydrophobicContact CB-CZ 3.95Å; K303-F360 HydrophobicContact CD-CE1 4.24Å; I304-F360 HydrophobicContact CD1-CE2 3.7Å; I304-F360 HydrophobicContact CD1-CZ 3.99Å; I304-F360 HydrophobicContact CG1-CE2 3.98Å; I304-F360 HydrophobicContact CG1-CZ 3.72Å; V356-F360 HydrophobicContact CG1-CD2 3.75Å; V356-F360 HydrophobicContact CG1-CE2 3.9Å; V356-F360 WeakPolarHBondContact O-CD2 3.48Å; V356-F360 PolarHBondContact O-N 2.95Å; V357-F360 PolarHBondContact O-N 3.14Å; E358-F360 VanDerWaalsContact C-N 3.31Å; E358-F360 PolarHBondContact O-N 3.34Å; F360-S362 VanDerWaalsContact C-N 3.27Å; F360-S362 PolarHBondContact O-N 2.82Å; F360-Y363 AromaticContact CD1-CD1 3.86Å; F360-Y363 HydrophobicContact CD1-CD1 3.86Å; F360-Y363 AromaticContact CE1-CD1 3.79Å; F360-Y363 HydrophobicContact CE1-CD1 3.79Å; F360-Y363 HydrophobicContact CE1-CE1 4.28Å; F360-Y363 PolarHBondContact O-N 3.07Å; F360-D364 HydrophobicContact CD1-CB 3.89Å; F360-D364 CarbonylContact O-C 3.59Å; F360-D364 WeakPolarHBondContact O-CA 3.33Å; F360-D364 PolarHBondContact O-N 2.93Å; F360-D364 VanDerWaalsContact O-O 3.07Å; F360-N365 PolarHBondContact O-N 3.18Å; F360-L367 HydrophobicContact CD1-CD2 3.89Å; F360-L367 HydrophobicContact CD2-CD2 4.32Å; F360-L367 HydrophobicContact CE1-CD2 3.64Å; F360-L367 HydrophobicContact CE2-CD2 4.12Å; F360-L367 HydrophobicContact CG-CD2 4.23Å; F360-L367 HydrophobicContact CG-CG 4.48Å; F360-L367 HydrophobicContact CZ-CD2 3.77Å; F360-C368 HydrophobicContact CB-CB 3.85Å; F360-L371 HydrophobicContact CD2-CD1 4.13Å
361	A	89.4	Confident	86.2	Confident	47 Å²	47	50 Å²	50	39%	0.388	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-40.8	178.4	0	0	0	0	0	111.6	V357 E358	V357-A361 WeakPolarHBondContact O-CB 3.38Å; V357-A361 PolarHBondContact O-N 3.01Å; E358-A361 WeakPolarHBondContact O-CB 3.49Å; E358-A361 PolarHBondContact O-N 2.97Å; E358-A361 VanDerWaalsContact O-N 3.15Å
362	S	85.4	Confident	87.3	Confident	113 Å²	113	51.1 Å²	51.1	79%	0.79	27%	0.274	S	S	*	.	H	α-helix	trans	-87.9	-28.4	175.4	55.3	0	0	0	0	114.2	F359 F360	F359-S362 PolarHBondContact O-OG 3.26Å; F360-S362 VanDerWaalsContact C-N 3.27Å; F360-S362 PolarHBondContact O-N 2.82Å
363	Y	85.4	Confident	88.3	Confident	117 Å²	117	58.9 Å²	58.9	46%	0.459	31%	0.308	S	S	.	.	H	α-helix	trans	-93	-40.9	-171.2	-176.6	-101.3	0	0	0	113.8	N310 F359 F360	N310-Y363 VanDerWaalsContact ND2-CZ 3.29Å; N310-Y363 PolarHBondContact ND2-OH 3.32Å; N310-Y363 VanDerWaalsContact ND2-OH 3.1Å; F359-Y363 HydrophobicContact CE1-CD1 4.23Å; F359-Y363 HydrophobicContact CE1-CG 4.27Å; F359-Y363 WeakPolarHBondContact O-CB 3.44Å; F359-Y363 PolarHBondContact O-N 3.28Å; F360-Y363 AromaticContact CD1-CD1 3.86Å; F360-Y363 HydrophobicContact CD1-CD1 3.86Å; F360-Y363 AromaticContact CE1-CD1 3.79Å; F360-Y363 HydrophobicContact CE1-CD1 3.79Å; F360-Y363 HydrophobicContact CE1-CE1 4.28Å; F360-Y363 PolarHBondContact O-N 3.07Å
364	D	89.5	Confident	88.7	Confident	38 Å²	38	60.7 Å²	60.7	20%	0.203	31%	0.314	C	S	.	.			trans	-153.9	82.1	-179.5	-172.4	-21	0	0	0	110	K303 F360 A366 L367 C368	K303-D364 IonicContact NZ-OD2 3.08Å; K303-D364 PolarHBondContact NZ-OD2 3.04Å; F360-D364 HydrophobicContact CD1-CB 3.89Å; F360-D364 CarbonylContact O-C 3.59Å; F360-D364 WeakPolarHBondContact O-CA 3.33Å; F360-D364 PolarHBondContact O-N 2.93Å; F360-D364 VanDerWaalsContact O-O 3.07Å; D364-A366 PolarHBondContact O-N 2.77Å; D364-A366 PolarHBondContact OD1-N 3.47Å; D364-L367 HydrophobicContact CB-CB 4Å; D364-L367 VanDerWaalsContact CG-CB 3.43Å; D364-L367 PolarHBondContact O-N 2.93Å; D364-L367 VanDerWaalsContact O-N 3.11Å; D364-L367 PolarHBondContact OD1-N 3.16Å; D364-C368 PolarHBondContact O-N 3.03Å
365	N	91	Very high	89	Confident	93 Å²	93	55.2 Å²	55.2	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-31.6	-175.9	-168.4	47.6	0	0	0	112.4	F360 C368 E369	F360-N365 PolarHBondContact O-N 3.18Å; N365-C368 WeakPolarHBondContact O-CB 3.48Å; N365-C368 PolarHBondContact O-N 2.83Å; N365-E369 WeakPolarHBondContact O-CG 3.48Å; N365-E369 PolarHBondContact O-N 2.96Å
366	A	93.1	Very high	89.4	Confident	63 Å²	63	55.6 Å²	55.6	52%	0.521	29%	0.291	S	S	.	.	H	α-helix	trans	-66.9	-41	176.9	0	0	0	0	0	111.7	D364 N370	D364-A366 PolarHBondContact O-N 2.77Å; D364-A366 PolarHBondContact OD1-N 3.47Å; A366-N370 WeakPolarHBondContact O-CB 3.49Å; A366-N370 PolarHBondContact O-N 3.28Å; A366-N370 VanDerWaalsContact O-N 3.17Å; A366-N370 PolarHBondContact O-ND2 3.08Å
367	L	90.5	Very high	89.7	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-42	173.2	179.5	58.1	0	0	0	111.5	L296 A300 K303 F360 D364 N370 L371	L296-L367 HydrophobicContact CD1-CD1 3.39Å; L296-L367 HydrophobicContact CG-CD1 4.06Å; A300-L367 HydrophobicContact CB-CD2 4.05Å; K303-L367 HydrophobicContact CD-CD2 3.79Å; F360-L367 HydrophobicContact CD1-CD2 3.89Å; F360-L367 HydrophobicContact CD2-CD2 4.32Å; F360-L367 HydrophobicContact CE1-CD2 3.64Å; F360-L367 HydrophobicContact CE2-CD2 4.12Å; F360-L367 HydrophobicContact CG-CD2 4.23Å; F360-L367 HydrophobicContact CG-CG 4.48Å; F360-L367 HydrophobicContact CZ-CD2 3.77Å; D364-L367 HydrophobicContact CB-CB 4Å; D364-L367 VanDerWaalsContact CG-CB 3.43Å; D364-L367 PolarHBondContact O-N 2.93Å; D364-L367 VanDerWaalsContact O-N 3.11Å; D364-L367 PolarHBondContact OD1-N 3.16Å; L367-N370 PolarHBondContact O-N 3.35Å; L367-L371 HydrophobicContact CD1-CD1 4.38Å; L367-L371 HydrophobicContact CD1-CG 4.31Å; L367-L371 HydrophobicContact CG-CD1 4.16Å; L367-L371 WeakPolarHBondContact O-CG 3.36Å; L367-L371 PolarHBondContact O-N 3.34Å
368	C	90.2	Very high	89.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-53.8	-54.2	175.4	-174.8	0	0	0	0	111.6	V357 F360 D364 N365 N370 L371 K372	V357-C368 PolarHBondContact O-SG 2.86Å; F360-C368 HydrophobicContact CB-CB 3.85Å; D364-C368 PolarHBondContact O-N 3.03Å; N365-C368 WeakPolarHBondContact O-CB 3.48Å; N365-C368 PolarHBondContact O-N 2.83Å; C368-N370 VanDerWaalsContact C-N 3.31Å; C368-N370 PolarHBondContact O-N 3.24Å; C368-L371 WeakPolarHBondContact O-CB 3.38Å; C368-L371 PolarHBondContact O-N 3.27Å; C368-L371 VanDerWaalsContact O-N 3.11Å; C368-K372 PolarHBondContact O-N 3.18Å; C368-K372 VanDerWaalsContact SG-CE 3.54Å
369	E	92.8	Very high	89.9	Confident	94 Å²	94	49.2 Å²	49.2	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-35.1	-179.8	-69.7	-57.6	120.1	0	0	112.6	N365 K372 K373	N365-E369 WeakPolarHBondContact O-CG 3.48Å; N365-E369 PolarHBondContact O-N 2.96Å; E369-K372 IonicContact OE1-NZ 3.2Å; E369-K372 PolarHBondContact OE1-NZ 3.34Å; E369-K373 VanDerWaalsContact O-CB 3.29Å; E369-K373 WeakPolarHBondContact O-CB 3.36Å; E369-K373 PolarHBondContact O-N 3.2Å
370	N	91.7	Very high	90.1	Very high	84 Å²	84	48.3 Å²	48.3	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-66.6	-36.1	174	-80.3	-51.9	0	0	0	112.7	L296 A366 L367 C368 R374	L296-N370 HydrophobicContact CD1-CB 4.07Å; L296-N370 HydrophobicContact CD2-CB 4.02Å; A366-N370 WeakPolarHBondContact O-CB 3.49Å; A366-N370 PolarHBondContact O-N 3.28Å; A366-N370 VanDerWaalsContact O-N 3.17Å; A366-N370 PolarHBondContact O-ND2 3.08Å; L367-N370 PolarHBondContact O-N 3.35Å; C368-N370 VanDerWaalsContact C-N 3.31Å; C368-N370 PolarHBondContact O-N 3.24Å; N370-R374 WeakPolarHBondContact O-CG 3.43Å; N370-R374 PolarHBondContact O-N 3Å
371	L	89.4	Confident	90	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-50.1	175.5	-72.4	168.6	0	0	0	110.5	L296 A300 F353 V356 F360 L367 C368 K373 R374 E375 I378	L296-L371 HydrophobicContact CD2-CD2 3.93Å; L296-L371 HydrophobicContact CD2-CG 4.36Å; L296-L371 HydrophobicContact CG-CD2 4.01Å; A300-L371 HydrophobicContact CB-CD1 4.12Å; F353-L371 HydrophobicContact CE2-CB 4.2Å; F353-L371 HydrophobicContact CZ-CB 4.47Å; V356-L371 HydrophobicContact CG1-CD1 3.95Å; F360-L371 HydrophobicContact CD2-CD1 4.13Å; L367-L371 HydrophobicContact CD1-CD1 4.38Å; L367-L371 HydrophobicContact CD1-CG 4.31Å; L367-L371 HydrophobicContact CG-CD1 4.16Å; L367-L371 WeakPolarHBondContact O-CG 3.36Å; L367-L371 PolarHBondContact O-N 3.34Å; C368-L371 WeakPolarHBondContact O-CB 3.38Å; C368-L371 PolarHBondContact O-N 3.27Å; C368-L371 VanDerWaalsContact O-N 3.11Å; L371-K373 VanDerWaalsContact C-N 3.33Å; L371-K373 PolarHBondContact O-N 2.81Å; L371-R374 CarbonylContact O-C 3.57Å; L371-R374 PolarHBondContact O-N 3.32Å; L371-E375 PolarHBondContact O-N 3.45Å; L371-E375 VanDerWaalsContact O-N 3.13Å; L371-I378 HydrophobicContact CD2-CD1 4.1Å
372	K	89.9	Confident	89.9	Confident	84 Å²	84	46 Å²	46	37%	0.365	24%	0.237	S	C	.	.	H	α-helix	trans	-55	-46.1	175.9	-69.1	179.6	-170.1	163.1	0	112.1	V357 C368 E369 R374 E375	V357-K372 HydrophobicContact CG1-CD 4.25Å; V357-K372 HydrophobicContact CG1-CG 4.05Å; V357-K372 HydrophobicContact CG2-CG 4.15Å; C368-K372 PolarHBondContact O-N 3.18Å; C368-K372 VanDerWaalsContact SG-CE 3.54Å; E369-K372 IonicContact OE1-NZ 3.2Å; E369-K372 PolarHBondContact OE1-NZ 3.34Å; K372-R374 PolarHBondContact O-N 2.88Å; K372-E375 WeakPolarHBondContact O-CB 3.18Å; K372-E375 PolarHBondContact O-N 3.48Å
373	K	91	Very high	90.1	Very high	165 Å²	165	40.8 Å²	40.8	72%	0.717	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.1	179	-176.2	173.9	179	179.6	0	113.5	E369 L371	E369-K373 VanDerWaalsContact O-CB 3.29Å; E369-K373 WeakPolarHBondContact O-CB 3.36Å; E369-K373 PolarHBondContact O-N 3.2Å; L371-K373 VanDerWaalsContact C-N 3.33Å; L371-K373 PolarHBondContact O-N 2.81Å
374	R	89.6	Confident	90.3	Very high	47 Å²	47	35.3 Å²	35.3	18%	0.177	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	18.9	-175.1	-57.2	-67.4	-64.7	-77.1	-6.6	112.2	R289 S292 L293 N370 L371 K372 S376 D377 I378	R289-R374 VanDerWaalsContact CG-NH2 3.26Å; R289-R374 PolarHBondContact O-NH2 3.26Å; S292-R374 PolarHBondContact OG-NH1 3.4Å; L293-R374 HydrophobicContact CD1-CB 3.96Å; N370-R374 WeakPolarHBondContact O-CG 3.43Å; N370-R374 PolarHBondContact O-N 3Å; L371-R374 CarbonylContact O-C 3.57Å; L371-R374 PolarHBondContact O-N 3.32Å; K372-R374 PolarHBondContact O-N 2.88Å; R374-S376 VanDerWaalsContact C-N 3.33Å; R374-S376 PolarHBondContact O-N 3.43Å; R374-D377 IonicContact CZ-OD2 3.7Å; R374-D377 IonicContact NE-OD2 3.27Å; R374-D377 PolarHBondContact NE-OD2 3.11Å; R374-D377 IonicContact NH2-OD2 3.19Å; R374-D377 PolarHBondContact NH2-OD2 2.93Å; R374-D377 WeakPolarHBondContact O-CB 3.39Å; R374-D377 PolarHBondContact O-N 2.96Å; R374-D377 VanDerWaalsContact O-N 3.09Å; R374-I378 WeakPolarHBondContact O-CG1 3.21Å; R374-I378 PolarHBondContact O-N 3.34Å; R374-I378 VanDerWaalsContact O-N 3.12Å
375	E	89.4	Confident	90.1	Very high	48 Å²	48	34.1 Å²	34.1	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-57	-42.2	-178.1	-176.2	174.9	-171.2	0	0	112.7	F350 F353 L371 K372 D377 I378 A379 L437	F350-E375 HydrophobicContact CE2-CG 4.39Å; F353-E375 HydrophobicContact CD1-CG 4.09Å; F353-E375 HydrophobicContact CE1-CB 4Å; F353-E375 HydrophobicContact CE1-CG 3.48Å; F353-E375 VanDerWaalsContact CE1-CG 3.48Å; F353-E375 WeakPolarHBondContact CE1-OE1 3.29Å; F353-E375 HydrophobicContact CZ-CB 3.8Å; F353-E375 HydrophobicContact CZ-CG 3.74Å; L371-E375 PolarHBondContact O-N 3.45Å; L371-E375 VanDerWaalsContact O-N 3.13Å; K372-E375 WeakPolarHBondContact O-CB 3.18Å; K372-E375 PolarHBondContact O-N 3.48Å; E375-D377 VanDerWaalsContact C-N 3.31Å; E375-D377 PolarHBondContact O-N 3Å; E375-I378 WeakPolarHBondContact O-CB 3.33Å; E375-I378 PolarHBondContact O-N 3.49Å; E375-I378 VanDerWaalsContact O-N 3.09Å; E375-A379 PolarHBondContact O-N 2.98Å; E375-L437 VanDerWaalsContact CD-CD1 3.47Å; E375-L437 HydrophobicContact CG-CD1 3.87Å; E375-L437 HydrophobicContact CG-CD2 3.98Å; E375-L437 WeakPolarHBondContact OE1-CD1 3.47Å
376	S	91.3	Very high	89.8	Confident	13 Å²	13	33.8 Å²	33.8	9%	0.091	17%	0.166	C	C	.	.	H	α-helix	trans	-57.5	-42.6	174.8	54.3	0	0	0	0	112.5	R374 I378 A379 Y380 D447 Y451	R374-S376 VanDerWaalsContact C-N 3.33Å; R374-S376 PolarHBondContact O-N 3.43Å; S376-I378 VanDerWaalsContact C-N 3.31Å; S376-I378 PolarHBondContact O-N 3.36Å; S376-A379 PolarHBondContact O-N 2.93Å; S376-Y380 WeakPolarHBondContact O-CB 3.46Å; S376-Y380 PolarHBondContact O-N 3.03Å; S376-D447 PolarHBondContact OG-OD2 3.36Å; S376-Y451 WeakPolarHBondContact CB-OH 3.41Å; S376-Y451 PolarHBondContact O-OH 2.71Å; S376-Y451 PolarHBondContact OG-OH 3.11Å
377	D	91.5	Very high	89.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.6	-33.8	178.3	-69.4	-7.2	0	0	0	111.6	R289 L290 L293 R374 E375 L381 Y451	R289-D377 IonicContact CZ-OD1 2.63Å; R289-D377 VanDerWaalsContact CZ-OD1 3.27Å; R289-D377 IonicContact CZ-OD2 3.8Å; R289-D377 IonicContact NE-OD1 3.18Å; R289-D377 PolarHBondContact NE-OD1 2.94Å; R289-D377 IonicContact NE-OD2 2.71Å; R289-D377 PolarHBondContact NE-OD2 2.99Å; R289-D377 VanDerWaalsContact NH2-CG 3.33Å; R289-D377 IonicContact NH2-OD1 2.86Å; R289-D377 PolarHBondContact NH2-OD1 2.88Å; R289-D377 IonicContact NH2-OD2 2.74Å; R289-D377 PolarHBondContact NH2-OD2 3.23Å; L290-D377 HydrophobicContact CD2-CB 4.21Å; L293-D377 HydrophobicContact CD2-CB 3.38Å; L293-D377 WeakPolarHBondContact CD2-O 3.35Å; L293-D377 HydrophobicContact CG-CB 4.49Å; R374-D377 IonicContact CZ-OD2 3.7Å; R374-D377 IonicContact NE-OD2 3.27Å; R374-D377 PolarHBondContact NE-OD2 3.11Å; R374-D377 IonicContact NH2-OD2 3.19Å; R374-D377 PolarHBondContact NH2-OD2 2.93Å; R374-D377 WeakPolarHBondContact O-CB 3.39Å; R374-D377 PolarHBondContact O-N 2.96Å; R374-D377 VanDerWaalsContact O-N 3.09Å; E375-D377 VanDerWaalsContact C-N 3.31Å; E375-D377 PolarHBondContact O-N 3Å; D377-L381 WeakPolarHBondContact O-CB 3.41Å; D377-L381 WeakPolarHBondContact O-CG 3.31Å; D377-L381 PolarHBondContact O-N 3.28Å; D377-Y451 WeakPolarHBondContact CA-OH 3.47Å; D377-Y451 PolarHBondContact N-OH 2.78Å; D377-Y451 WeakPolarHBondContact OD1-CE1 3.16Å; D377-Y451 VanDerWaalsContact OD1-CZ 3.29Å; D377-Y451 PolarHBondContact OD1-OH 3.33Å
378	I	88.6	Confident	89.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.4	-47.5	176.5	-63.3	168.1	0	0	0	109.6	L293 V297 L349 F350 F353 L371 R374 E375 S376 Y380 L381 A382	L293-I378 HydrophobicContact CD1-CD1 4.05Å; L293-I378 HydrophobicContact CD1-CG1 3.57Å; L293-I378 HydrophobicContact CD2-CB 4.42Å; L293-I378 HydrophobicContact CD2-CG1 3.71Å; L293-I378 HydrophobicContact CG-CG1 4.13Å; V297-I378 HydrophobicContact CG2-CD1 4.42Å; V297-I378 HydrophobicContact CG2-CG1 4.34Å; L349-I378 HydrophobicContact CD2-CG2 4.19Å; F350-I378 HydrophobicContact CB-CG2 4.49Å; F350-I378 HydrophobicContact CD2-CG2 4.02Å; F353-I378 HydrophobicContact CD2-CD1 4.12Å; F353-I378 HydrophobicContact CE2-CD1 3.49Å; F353-I378 VanDerWaalsContact CE2-CD1 3.49Å; F353-I378 HydrophobicContact CZ-CD1 4.39Å; L371-I378 HydrophobicContact CD2-CD1 4.1Å; R374-I378 WeakPolarHBondContact O-CG1 3.21Å; R374-I378 PolarHBondContact O-N 3.34Å; R374-I378 VanDerWaalsContact O-N 3.12Å; E375-I378 WeakPolarHBondContact O-CB 3.33Å; E375-I378 PolarHBondContact O-N 3.49Å; E375-I378 VanDerWaalsContact O-N 3.09Å; S376-I378 VanDerWaalsContact C-N 3.31Å; S376-I378 PolarHBondContact O-N 3.36Å; I378-Y380 PolarHBondContact O-N 3.32Å; I378-L381 PolarHBondContact O-N 3.45Å; I378-A382 VanDerWaalsContact O-CB 3.31Å; I378-A382 WeakPolarHBondContact O-CB 3.34Å; I378-A382 PolarHBondContact O-N 3.4Å
379	A	89.7	Confident	88.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.8	-49.2	176.9	0	0	0	0	0	111.5	F350 E375 S376 L381 A382 D383 N433 L434 L437	F350-A379 HydrophobicContact CD2-CB 3.98Å; F350-A379 HydrophobicContact CE2-CB 3.44Å; F350-A379 VanDerWaalsContact CE2-CB 3.44Å; F350-A379 HydrophobicContact CZ-CB 3.82Å; E375-A379 PolarHBondContact O-N 2.98Å; S376-A379 PolarHBondContact O-N 2.93Å; A379-L381 PolarHBondContact O-N 3.36Å; A379-A382 PolarHBondContact O-N 3.17Å; A379-D383 PolarHBondContact O-N 2.79Å; A379-N433 HydrophobicContact CB-CB 4.12Å; A379-L434 HydrophobicContact CB-CB 4.32Å; A379-L434 HydrophobicContact CB-CD1 4Å; A379-L437 HydrophobicContact CB-CD2 4.21Å
380	Y	92	Very high	88.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-48.6	177.1	165.7	-102.5	0	0	0	112.5	L290 S376 I378 A382 D383 L384 L423 F431 Y451 H454	L290-Y380 HydrophobicContact CD1-CD1 4.44Å; L290-Y380 HydrophobicContact CD1-CE1 3.84Å; L290-Y380 HydrophobicContact CD2-CD1 4.26Å; L290-Y380 HydrophobicContact CD2-CE1 4.47Å; S376-Y380 WeakPolarHBondContact O-CB 3.46Å; S376-Y380 PolarHBondContact O-N 3.03Å; I378-Y380 PolarHBondContact O-N 3.32Å; Y380-A382 VanDerWaalsContact C-N 3.34Å; Y380-A382 PolarHBondContact O-N 3.13Å; Y380-D383 PolarHBondContact O-N 3.36Å; Y380-L384 HydrophobicContact CE1-CD2 4.27Å; Y380-L384 WeakPolarHBondContact O-CB 3.45Å; Y380-L384 PolarHBondContact O-N 3.12Å; Y380-L423 HydrophobicContact CE2-CD2 4.39Å; Y380-F431 HydrophobicContact CD2-CD1 4.24Å; Y380-F431 AromaticContact CD2-CE1 3.94Å; Y380-F431 HydrophobicContact CD2-CE1 3.94Å; Y380-F431 AromaticContact CE2-CE1 3.89Å; Y380-F431 HydrophobicContact CE2-CE1 3.89Å; Y380-F431 HydrophobicContact CE2-CZ 4.43Å; Y380-Y451 AromaticContact CD1-CD1 3.42Å; Y380-Y451 HydrophobicContact CD1-CD1 3.42Å; Y380-Y451 VanDerWaalsContact CD1-CD1 3.42Å; Y380-Y451 AromaticContact CD1-CE1 3.79Å; Y380-Y451 HydrophobicContact CD1-CE1 3.79Å; Y380-Y451 AromaticContact CD1-CG 3.96Å; Y380-Y451 HydrophobicContact CD1-CG 3.96Å; Y380-Y451 HydrophobicContact CD2-CD1 4.06Å; Y380-Y451 AromaticContact CD2-CD2 3.99Å; Y380-Y451 HydrophobicContact CD2-CD2 3.99Å; Y380-Y451 AromaticContact CD2-CG 3.7Å; Y380-Y451 HydrophobicContact CD2-CG 3.7Å; Y380-Y451 AromaticContact CE1-CD1 3.79Å; Y380-Y451 HydrophobicContact CE1-CD1 3.79Å; Y380-Y451 HydrophobicContact CE1-CG 4.25Å; Y380-Y451 HydrophobicContact CE2-CD1 4.38Å; Y380-Y451 HydrophobicContact CE2-CG 4.01Å; Y380-Y451 AromaticContact CG-CD1 3.56Å; Y380-Y451 HydrophobicContact CG-CD1 3.56Å; Y380-Y451 AromaticContact CG-CD2 3.99Å; Y380-Y451 HydrophobicContact CG-CD2 3.99Å; Y380-Y451 AromaticContact CG-CE1 3.89Å; Y380-Y451 HydrophobicContact CG-CE1 3.89Å; Y380-Y451 HydrophobicContact CG-CE2 4.27Å; Y380-Y451 AromaticContact CG-CG 3.66Å; Y380-Y451 HydrophobicContact CG-CG 3.66Å; Y380-H454 AromaticContact CE1-ND1 3.33Å; Y380-H454 VanDerWaalsContact CE1-ND1 3.33Å; Y380-H454 WeakPolarHBondContact CE1-ND1 3.4Å; Y380-H454 AromaticContact CZ-ND1 3.52Å; Y380-H454 PolarHBondContact OH-ND1 3.06Å
381	L	89.5	Confident	88.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-39.2	178.7	-77.3	-175.2	0	0	0	111.5	L286 L290 L293 F346 D377 I378 A379 L384 Y385	L286-L381 HydrophobicContact CD2-CD2 4.16Å; L290-L381 HydrophobicContact CB-CD1 4.39Å; L290-L381 HydrophobicContact CB-CD2 4.5Å; L290-L381 HydrophobicContact CD1-CD2 4.18Å; L290-L381 HydrophobicContact CD2-CD1 4.24Å; L290-L381 HydrophobicContact CD2-CD2 4.26Å; L290-L381 HydrophobicContact CD2-CG 4.09Å; L293-L381 HydrophobicContact CD2-CD1 3.69Å; L293-L381 HydrophobicContact CD2-CG 4.42Å; L293-L381 HydrophobicContact CG-CD1 4.38Å; F346-L381 HydrophobicContact CD1-CB 4.43Å; F346-L381 HydrophobicContact CE1-CD1 4.36Å; D377-L381 WeakPolarHBondContact O-CB 3.41Å; D377-L381 WeakPolarHBondContact O-CG 3.31Å; D377-L381 PolarHBondContact O-N 3.28Å; I378-L381 PolarHBondContact O-N 3.45Å; A379-L381 PolarHBondContact O-N 3.36Å; L381-L384 PolarHBondContact O-N 2.94Å; L381-Y385 HydrophobicContact CB-CD2 4.07Å; L381-Y385 HydrophobicContact CB-CE2 4.23Å; L381-Y385 HydrophobicContact CD1-CE2 4.48Å; L381-Y385 HydrophobicContact CD2-CE2 4.06Å; L381-Y385 WeakPolarHBondContact O-CB 3.44Å; L381-Y385 WeakPolarHBondContact O-CD2 3.4Å; L381-Y385 PolarHBondContact O-N 3.39Å
382	A	85.9	Confident	87.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-48.9	176.1	0	0	0	0	0	111.7	F346 F350 I378 A379 Y380 L384 Y385 F386	F346-A382 HydrophobicContact CB-CB 4.36Å; F350-A382 HydrophobicContact CB-CB 4.02Å; I378-A382 VanDerWaalsContact O-CB 3.31Å; I378-A382 WeakPolarHBondContact O-CB 3.34Å; I378-A382 PolarHBondContact O-N 3.4Å; A379-A382 PolarHBondContact O-N 3.17Å; Y380-A382 VanDerWaalsContact C-N 3.34Å; Y380-A382 PolarHBondContact O-N 3.13Å; A382-L384 PolarHBondContact O-N 3.42Å; A382-Y385 PolarHBondContact O-N 2.92Å; A382-F386 WeakPolarHBondContact O-CB 3.4Å; A382-F386 PolarHBondContact O-N 3.11Å
383	D	89.6	Confident	87.5	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-42.8	177	-74.8	-32.1	0	0	0	112.7	A379 Y380 F386 K387 F431 P432 N433 L434	A379-D383 PolarHBondContact O-N 2.79Å; Y380-D383 PolarHBondContact O-N 3.36Å; D383-F386 WeakPolarHBondContact O-CB 3.4Å; D383-K387 WeakPolarHBondContact O-CG 3.49Å; D383-K387 PolarHBondContact O-N 3.44Å; D383-F431 HydrophobicContact CB-CB 4.28Å; D383-F431 HydrophobicContact CB-CD1 3.65Å; D383-F431 HydrophobicContact CB-CG 4.42Å; D383-F431 WeakPolarHBondContact OD2-CA 3.28Å; D383-F431 VanDerWaalsContact OD2-CB 3.28Å; D383-F431 WeakPolarHBondContact OD2-CB 3.4Å; D383-P432 VanDerWaalsContact OD1-CD 3.22Å; D383-P432 WeakPolarHBondContact OD1-CD 3.45Å; D383-P432 WeakPolarHBondContact OD1-CG 3.35Å; D383-N433 WeakPolarHBondContact OD1-CB 3.44Å; D383-N433 PolarHBondContact OD1-N 3.26Å; D383-N433 VanDerWaalsContact OD1-N 3.11Å; D383-N433 PolarHBondContact OD1-ND2 3Å; D383-N433 PolarHBondContact OD2-N 2.88Å; D383-N433 VanDerWaalsContact OD2-N 3.15Å; D383-L434 PolarHBondContact OD2-N 3.03Å
384	L	89.4	Confident	87.1	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-67	-44.4	178.8	178.1	64.3	0	0	0	111.7	Y380 L381 A382 F386 K387 F388 H454 L455 L458	Y380-L384 HydrophobicContact CE1-CD2 4.27Å; Y380-L384 WeakPolarHBondContact O-CB 3.45Å; Y380-L384 PolarHBondContact O-N 3.12Å; L381-L384 PolarHBondContact O-N 2.94Å; A382-L384 PolarHBondContact O-N 3.42Å; L384-F386 VanDerWaalsContact C-N 3.3Å; L384-F386 PolarHBondContact O-N 3.31Å; L384-K387 WeakPolarHBondContact O-CB 3.48Å; L384-K387 PolarHBondContact O-N 3.48Å; L384-K387 VanDerWaalsContact O-N 3.12Å; L384-F388 HydrophobicContact CD1-CD2 4.23Å; L384-F388 HydrophobicContact CD1-CE2 3.85Å; L384-F388 HydrophobicContact CD2-CE2 4.12Å; L384-F388 HydrophobicContact CG-CD2 3.98Å; L384-F388 HydrophobicContact CG-CE2 3.75Å; L384-F388 WeakPolarHBondContact O-CD2 3.39Å; L384-F388 PolarHBondContact O-N 3.44Å; L384-H454 VanDerWaalsContact CD2-CE1 3.41Å; L384-H454 WeakPolarHBondContact CD2-CE1 3.14Å; L384-L455 HydrophobicContact CD1-CD2 4.25Å; L384-L458 HydrophobicContact CD1-CD1 4.18Å; L384-L458 HydrophobicContact CD2-CD1 3.75Å
385	Y	85.4	Confident	86.9	Confident	13 Å²	13	25 Å²	25	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-67.5	-30.8	179.3	-87.1	-53.9	0	0	0	112.6	A283 L343 F346 L381 A382 K387 F388 N389	A283-Y385 HydrophobicContact CB-CE1 4.31Å; A283-Y385 PolarHBondContact O-OH 2.74Å; L343-Y385 HydrophobicContact CB-CD1 3.89Å; L343-Y385 HydrophobicContact CB-CG 4.15Å; L343-Y385 HydrophobicContact CD1-CD1 4.06Å; L343-Y385 HydrophobicContact CD2-CD1 3.57Å; L343-Y385 HydrophobicContact CD2-CE1 3.84Å; L343-Y385 HydrophobicContact CD2-CG 4.49Å; L343-Y385 HydrophobicContact CG-CD1 4.05Å; F346-Y385 HydrophobicContact CB-CD2 4.32Å; F346-Y385 AromaticContact CD2-CD2 3.64Å; F346-Y385 HydrophobicContact CD2-CD2 3.64Å; F346-Y385 AromaticContact CD2-CE2 3.91Å; F346-Y385 HydrophobicContact CD2-CE2 3.91Å; F346-Y385 HydrophobicContact CD2-CG 4.33Å; F346-Y385 HydrophobicContact CE2-CD2 4.07Å; F346-Y385 AromaticContact CE2-CE2 3.83Å; F346-Y385 HydrophobicContact CE2-CE2 3.83Å; F346-Y385 AromaticContact CG-CD2 3.98Å; F346-Y385 HydrophobicContact CG-CD2 3.98Å; F346-Y385 HydrophobicContact CZ-CE2 4.37Å; L381-Y385 HydrophobicContact CB-CD2 4.07Å; L381-Y385 HydrophobicContact CB-CE2 4.23Å; L381-Y385 HydrophobicContact CD1-CE2 4.48Å; L381-Y385 HydrophobicContact CD2-CE2 4.06Å; L381-Y385 WeakPolarHBondContact O-CB 3.44Å; L381-Y385 WeakPolarHBondContact O-CD2 3.4Å; L381-Y385 PolarHBondContact O-N 3.39Å; A382-Y385 PolarHBondContact O-N 2.92Å; Y385-K387 VanDerWaalsContact C-N 3.35Å; Y385-F388 HydrophobicContact CD1-CD2 4.33Å; Y385-F388 PolarHBondContact O-N 3.09Å; Y385-N389 WeakPolarHBondContact O-CB 3.22Å; Y385-N389 PolarHBondContact O-N 3.14Å
386	F	84.7	Confident	86.3	Confident	86 Å²	86	23.9 Å²	23.9	38%	0.377	12%	0.117	S	C	.	.	H	α-helix	trans	-59	-46.1	168	-178.3	-90	0	0	0	111.4	Y347 A382 D383 L384 F388 N389 E390	Y347-F386 HydrophobicContact CD2-CD2 4.34Å; A382-F386 WeakPolarHBondContact O-CB 3.4Å; A382-F386 PolarHBondContact O-N 3.11Å; D383-F386 WeakPolarHBondContact O-CB 3.4Å; L384-F386 VanDerWaalsContact C-N 3.3Å; L384-F386 PolarHBondContact O-N 3.31Å; F386-F388 PolarHBondContact O-N 3.12Å; F386-N389 VanDerWaalsContact O-CB 3.27Å; F386-N389 WeakPolarHBondContact O-CB 3.38Å; F386-N389 PolarHBondContact O-N 3.34Å; F386-N389 VanDerWaalsContact O-N 3.13Å; F386-E390 HydrophobicContact CD1-CG 4.19Å; F386-E390 HydrophobicContact CE1-CG 3.8Å; F386-E390 HydrophobicContact CZ-CG 4.25Å; F386-E390 PolarHBondContact O-N 2.93Å
387	K	88	Confident	85.3	Confident	38 Å²	38	24.7 Å²	24.7	17%	0.165	13%	0.127	C	C	.	.	H	α-helix	trans	-65.9	-39.3	178.5	-61.5	179.1	-162.5	-42	0	112.6	D383 L384 Y385 N389 E390 M391 F412 L419 Q430	D383-K387 WeakPolarHBondContact O-CG 3.49Å; D383-K387 PolarHBondContact O-N 3.44Å; L384-K387 WeakPolarHBondContact O-CB 3.48Å; L384-K387 PolarHBondContact O-N 3.48Å; L384-K387 VanDerWaalsContact O-N 3.12Å; Y385-K387 VanDerWaalsContact C-N 3.35Å; K387-N389 VanDerWaalsContact C-N 3.33Å; K387-E390 PolarHBondContact O-N 3.46Å; K387-M391 PolarHBondContact O-N 3.03Å; K387-M391 VanDerWaalsContact O-N 3.09Å; K387-F412 HydrophobicContact CB-CE2 3.87Å; K387-F412 HydrophobicContact CB-CZ 4.48Å; K387-F412 WeakPolarHBondContact O-CE2 3.13Å; K387-L419 HydrophobicContact CD-CD1 4.12Å; K387-Q430 WeakPolarHBondContact CE-O 3.24Å; K387-Q430 PolarHBondContact NZ-O 3.45Å
388	F	86.4	Confident	84	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-59.4	-46.1	170.8	-82.5	-66.7	0	0	0	110.5	E279 A283 L343 L384 Y385 F386 E390 M391 N392 F412 L458 L462	E279-F388 HydrophobicContact CG-CD1 3.95Å; E279-F388 HydrophobicContact CG-CE1 4.4Å; A283-F388 HydrophobicContact CB-CD1 4.04Å; A283-F388 HydrophobicContact CB-CD2 4.1Å; A283-F388 HydrophobicContact CB-CE1 3.94Å; A283-F388 HydrophobicContact CB-CE2 4Å; A283-F388 HydrophobicContact CB-CG 4.13Å; A283-F388 HydrophobicContact CB-CZ 3.92Å; L343-F388 HydrophobicContact CD1-CB 3.57Å; L384-F388 HydrophobicContact CD1-CD2 4.23Å; L384-F388 HydrophobicContact CD1-CE2 3.85Å; L384-F388 HydrophobicContact CD2-CE2 4.12Å; L384-F388 HydrophobicContact CG-CD2 3.98Å; L384-F388 HydrophobicContact CG-CE2 3.75Å; L384-F388 WeakPolarHBondContact O-CD2 3.39Å; L384-F388 PolarHBondContact O-N 3.44Å; Y385-F388 HydrophobicContact CD1-CD2 4.33Å; Y385-F388 PolarHBondContact O-N 3.09Å; F386-F388 PolarHBondContact O-N 3.12Å; F388-E390 VanDerWaalsContact C-N 3.33Å; F388-E390 PolarHBondContact O-N 3.43Å; F388-M391 HydrophobicContact CD1-CE 4.14Å; F388-M391 HydrophobicContact CE1-CE 4.48Å; F388-M391 PolarHBondContact O-N 2.91Å; F388-M391 VanDerWaalsContact O-N 3.14Å; F388-N392 VanDerWaalsContact O-CB 3.29Å; F388-N392 WeakPolarHBondContact O-CB 3.44Å; F388-N392 PolarHBondContact O-N 3.36Å; F388-F412 HydrophobicContact CD1-CE1 4.24Å; F388-F412 AromaticContact CD1-CZ 3.87Å; F388-F412 HydrophobicContact CD1-CZ 3.87Å; F388-F412 AromaticContact CE1-CE1 3.84Å; F388-F412 HydrophobicContact CE1-CE1 3.84Å; F388-F412 AromaticContact CE1-CZ 3.86Å; F388-F412 HydrophobicContact CE1-CZ 3.86Å; F388-F412 HydrophobicContact CG-CZ 4.24Å; F388-F412 HydrophobicContact CZ-CE1 4.26Å; F388-F412 HydrophobicContact CZ-CZ 4.23Å; F388-L458 HydrophobicContact CE2-CD1 4.24Å; F388-L458 HydrophobicContact CZ-CD1 4.2Å; F388-L458 HydrophobicContact CZ-CD2 4.13Å; F388-L462 HydrophobicContact CE1-CD1 4.5Å
389	N	81.4	Confident	83.1	Confident	11 Å²	11	39.9 Å²	39.9	6%	0.059	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-43.1	175.8	-95.1	-7.8	0	0	0	113.5	G340 L343 T344 Y385 F386 K387 N392 L393	G340-N389 WeakPolarHBondContact CA-OD1 2.86Å; G340-N389 PolarHBondContact O-ND2 3.5Å; G340-N389 PolarHBondContact O-OD1 3.3Å; L343-N389 VanDerWaalsContact CB-CG 3.46Å; L343-N389 WeakPolarHBondContact CB-OD1 3.5Å; L343-N389 HydrophobicContact CD1-CB 4.49Å; L343-N389 WeakPolarHBondContact CD1-OD1 3.43Å; L343-N389 WeakPolarHBondContact CG-OD1 3.42Å; T344-N389 PolarHBondContact N-ND2 3.03Å; T344-N389 PolarHBondContact OG1-ND2 3.48Å; Y385-N389 WeakPolarHBondContact O-CB 3.22Å; Y385-N389 PolarHBondContact O-N 3.14Å; F386-N389 VanDerWaalsContact O-CB 3.27Å; F386-N389 WeakPolarHBondContact O-CB 3.38Å; F386-N389 PolarHBondContact O-N 3.34Å; F386-N389 VanDerWaalsContact O-N 3.13Å; K387-N389 VanDerWaalsContact C-N 3.33Å; N389-N392 WeakPolarHBondContact O-CB 3.34Å; N389-N392 PolarHBondContact O-N 2.99Å; N389-L393 VanDerWaalsContact O-CG 3.3Å; N389-L393 WeakPolarHBondContact O-CG 3.48Å; N389-L393 PolarHBondContact O-N 3.48Å
390	E	85	Confident	82.3	Confident	100 Å²	100	40.6 Å²	40.6	47%	0.467	21%	0.206	S	C	.	.	H	α-helix	trans	-60.2	-46.5	175.8	-69.4	-172.9	114.1	0	0	111.3	F386 K387 F388 N392 L393 L394	F386-E390 HydrophobicContact CD1-CG 4.19Å; F386-E390 HydrophobicContact CE1-CG 3.8Å; F386-E390 HydrophobicContact CZ-CG 4.25Å; F386-E390 PolarHBondContact O-N 2.93Å; K387-E390 PolarHBondContact O-N 3.46Å; F388-E390 VanDerWaalsContact C-N 3.33Å; F388-E390 PolarHBondContact O-N 3.43Å; E390-N392 VanDerWaalsContact C-N 3.34Å; E390-N392 PolarHBondContact O-N 2.83Å; E390-L393 PolarHBondContact O-N 3.49Å; E390-L394 WeakPolarHBondContact O-CG 3.31Å; E390-L394 PolarHBondContact O-N 3.08Å
391	M	84.9	Confident	81.6	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.034	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.4	-172.7	178.2	68.7	0	0	111.2	E279 K387 F388 L393 L394 L395 F412	E279-M391 HydrophobicContact CB-CE 3.83Å; E279-M391 HydrophobicContact CG-CE 3.3Å; E279-M391 VanDerWaalsContact OE1-CE 3.24Å; E279-M391 WeakPolarHBondContact OE1-CE 3.08Å; K387-M391 PolarHBondContact O-N 3.03Å; K387-M391 VanDerWaalsContact O-N 3.09Å; F388-M391 HydrophobicContact CD1-CE 4.14Å; F388-M391 HydrophobicContact CE1-CE 4.48Å; F388-M391 PolarHBondContact O-N 2.91Å; F388-M391 VanDerWaalsContact O-N 3.14Å; M391-L393 VanDerWaalsContact C-N 3.33Å; M391-L393 PolarHBondContact O-N 2.84Å; M391-L394 WeakPolarHBondContact O-CB 3.49Å; M391-L394 PolarHBondContact O-N 2.77Å; M391-L394 VanDerWaalsContact O-N 3.16Å; M391-L395 HydrophobicContact CE-CD1 4.47Å; M391-L395 HydrophobicContact CG-CD1 4.03Å; M391-L395 HydrophobicContact CG-CG 4.38Å; M391-L395 VanDerWaalsContact O-CG 3.31Å; M391-L395 WeakPolarHBondContact O-CG 3.49Å; M391-L395 PolarHBondContact O-N 2.94Å; M391-F412 HydrophobicContact CB-CD2 3.97Å; M391-F412 HydrophobicContact CB-CE2 4.31Å; M391-F412 HydrophobicContact CE-CD1 4.25Å; M391-F412 HydrophobicContact CE-CE1 4.43Å; M391-F412 HydrophobicContact CE-CG 4.38Å; M391-F412 HydrophobicContact CG-CB 4.38Å; M391-F412 HydrophobicContact CG-CD2 4.34Å; M391-F412 HydrophobicContact CG-CG 4.4Å; M391-F412 HydrophobicContact SD-CB 3.44Å; M391-F412 WeakPolarHBondContact SD-CB 3.48Å; M391-F412 HydrophobicContact SD-CD1 3.72Å; M391-F412 HydrophobicContact SD-CD2 3.83Å; M391-F412 HydrophobicContact SD-CE1 4.41Å; M391-F412 HydrophobicContact SD-CE2 4.49Å; M391-F412 HydrophobicContact SD-CG 3.38Å; M391-F412 WeakPolarHBondContact SD-CG 3.38Å
392	N	82.6	Confident	81	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-57.1	-44.1	179	-169.3	-105.3	0	0	0	112.8	I276 E279 W336 F388 N389 E390 L395 Q396	I276-N392 WeakPolarHBondContact CG2-ND2 3.46Å; E279-N392 PolarHBondContact OE2-ND2 3.41Å; W336-N392 WeakPolarHBondContact CZ3-ND2 3.39Å; F388-N392 VanDerWaalsContact O-CB 3.29Å; F388-N392 WeakPolarHBondContact O-CB 3.44Å; F388-N392 PolarHBondContact O-N 3.36Å; N389-N392 WeakPolarHBondContact O-CB 3.34Å; N389-N392 PolarHBondContact O-N 2.99Å; E390-N392 VanDerWaalsContact C-N 3.34Å; E390-N392 PolarHBondContact O-N 2.83Å; N392-L395 CarbonylContact O-C 3.42Å; N392-L395 PolarHBondContact O-N 3.36Å; N392-Q396 WeakPolarHBondContact O-CG 3.42Å; N392-Q396 PolarHBondContact O-N 3.09Å; N392-Q396 VanDerWaalsContact O-N 3.09Å; N392-Q396 PolarHBondContact OD1-NE2 3.13Å
393	L	81.9	Confident	80.8	Confident	84 Å²	84	47.6 Å²	47.6	44%	0.44	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-39.3	177.5	-71.6	172.1	0	0	0	111.9	K339 N389 E390 M391 L395 Q396	K339-L393 HydrophobicContact CB-CD2 3.81Å; K339-L393 HydrophobicContact CG-CD2 4.05Å; N389-L393 VanDerWaalsContact O-CG 3.3Å; N389-L393 WeakPolarHBondContact O-CG 3.48Å; N389-L393 PolarHBondContact O-N 3.48Å; E390-L393 PolarHBondContact O-N 3.49Å; M391-L393 VanDerWaalsContact C-N 3.33Å; M391-L393 PolarHBondContact O-N 2.84Å; L393-L395 VanDerWaalsContact C-N 3.3Å; L393-L395 PolarHBondContact O-N 2.92Å; L393-Q396 PolarHBondContact O-N 3.11Å
394	L	83.4	Confident	80.5	Confident	115 Å²	115	50.4 Å²	50.4	60%	0.602	26%	0.255	S	S	*	.	H	α-helix	trans	-61.8	-40.8	173.3	-66	171.9	0	0	0	111.1	E390 M391 Q396 G397 A408	E390-L394 WeakPolarHBondContact O-CG 3.31Å; E390-L394 PolarHBondContact O-N 3.08Å; M391-L394 WeakPolarHBondContact O-CB 3.49Å; M391-L394 PolarHBondContact O-N 2.77Å; M391-L394 VanDerWaalsContact O-N 3.16Å; L394-Q396 VanDerWaalsContact C-N 3.26Å; L394-Q396 PolarHBondContact O-N 2.68Å; L394-G397 PolarHBondContact O-N 3.22Å; L394-A408 HydrophobicContact CB-CB 4.5Å
395	L	84	Confident	80.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-6.6	179.1	-64.2	176.9	0	0	0	114.4	V275 I276 M391 N392 L393 L400 T405 A408 V409	V275-L395 HydrophobicContact CG1-CD1 3.68Å; V275-L395 HydrophobicContact CG1-CD2 3.84Å; V275-L395 HydrophobicContact CG1-CG 4.34Å; I276-L395 HydrophobicContact CG1-CB 4.17Å; M391-L395 HydrophobicContact CE-CD1 4.47Å; M391-L395 HydrophobicContact CG-CD1 4.03Å; M391-L395 HydrophobicContact CG-CG 4.38Å; M391-L395 VanDerWaalsContact O-CG 3.31Å; M391-L395 WeakPolarHBondContact O-CG 3.49Å; M391-L395 PolarHBondContact O-N 2.94Å; N392-L395 CarbonylContact O-C 3.42Å; N392-L395 PolarHBondContact O-N 3.36Å; L393-L395 VanDerWaalsContact C-N 3.3Å; L393-L395 PolarHBondContact O-N 2.92Å; L395-L400 HydrophobicContact CD2-CD1 4.36Å; L395-L400 WeakPolarHBondContact O-CD2 3.33Å; L395-T405 HydrophobicContact CD2-CG2 4.01Å; L395-A408 HydrophobicContact CD2-CB 4.28Å; L395-V409 HydrophobicContact CD2-CG2 4.46Å
396	Q	76.9	Confident	80.6	Confident	25 Å²	25	51.9 Å²	51.9	12%	0.117	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-3	175.7	-74.2	173	3.5	0	0	113.3	I276 N392 L393 L394 K526	I276-Q396 HydrophobicContact CD1-CG 3.76Å; N392-Q396 WeakPolarHBondContact O-CG 3.42Å; N392-Q396 PolarHBondContact O-N 3.09Å; N392-Q396 VanDerWaalsContact O-N 3.09Å; N392-Q396 PolarHBondContact OD1-NE2 3.13Å; L393-Q396 PolarHBondContact O-N 3.11Å; L394-Q396 VanDerWaalsContact C-N 3.26Å; L394-Q396 PolarHBondContact O-N 2.68Å; Q396-K526 PolarHBondContact O-NZ 2.78Å; Q396-K526 VanDerWaalsContact O-NZ 3.16Å
397	G	69.8	Low	80.8	Confident	30 Å²	30	51 Å²	51	31%	0.309	27%	0.271	S	S	.	.			trans	-55.8	150.6	-177.8	0	0	0	0	0	113.5	L394 E399 L400 K526	L394-G397 PolarHBondContact O-N 3.22Å; G397-E399 VanDerWaalsContact C-N 3.29Å; G397-E399 PolarHBondContact O-N 3.09Å; G397-L400 PolarHBondContact O-N 3.39Å; G397-K526 WeakPolarHBondContact O-CD 3.1Å; G397-K526 WeakPolarHBondContact O-CE 3.17Å; G397-K526 PolarHBondContact O-NZ 3.3Å
398	N	65.5	Low	80.9	Confident	140 Å²	140	50.2 Å²	50.2	75%	0.749	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.8	-178.2	-74.9	-15.1	0	0	0	114.6	K526	N398-K526 VanDerWaalsContact CA-NZ 3.32Å; N398-K526 PolarHBondContact OD1-NZ 3.37Å
399	E	68.9	Low	81.2	Confident	178 Å²	178	50.1 Å²	50.1	83%	0.832	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	19.5	-176.2	-59.7	-179.5	173.4	0	0	112.6	G397 N401	G397-E399 VanDerWaalsContact C-N 3.29Å; G397-E399 PolarHBondContact O-N 3.09Å; E399-N401 PolarHBondContact O-N 3.12Å
400	L	73.4	Confident	81.7	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.079	27%	0.272	C	S	.	.			trans	-59.8	138.4	176.4	-167.5	80.1	0	0	0	109.3	L395 G397 T405 K526	L395-L400 HydrophobicContact CD2-CD1 4.36Å; L395-L400 WeakPolarHBondContact O-CD2 3.33Å; G397-L400 PolarHBondContact O-N 3.39Å; L400-T405 VanDerWaalsContact CD2-OG1 3.32Å; L400-T405 WeakPolarHBondContact CD2-OG1 3.43Å; L400-T405 VanDerWaalsContact CG-OG1 3.27Å; L400-T405 WeakPolarHBondContact CG-OG1 3.31Å; L400-K526 HydrophobicContact CB-CB 3.85Å; L400-K526 HydrophobicContact CB-CD 4.25Å; L400-K526 HydrophobicContact CD2-CB 4.39Å; L400-K526 CarbonylContact O-C 2.97Å; L400-K526 WeakPolarHBondContact O-CB 3.34Å
401	N	77.6	Confident	82	Confident	45 Å²	45	46.8 Å²	46.8	24%	0.241	26%	0.264	C	S	.	.			trans	-138.6	177.4	169.8	63.6	38.7	0	0	0	108.3	E399 I403 T404 T405	E399-N401 PolarHBondContact O-N 3.12Å; N401-I403 PolarHBondContact O-N 3.32Å; N401-I403 WeakPolarHBondContact OD1-CA 3.12Å; N401-I403 WeakPolarHBondContact OD1-CB 3.39Å; N401-I403 PolarHBondContact OD1-N 3.23Å; N401-T404 PolarHBondContact N-OG1 3.37Å; N401-T404 PolarHBondContact O-N 3.44Å; N401-T404 PolarHBondContact O-OG1 3.05Å; N401-T404 PolarHBondContact OD1-N 2.84Å; N401-T404 PolarHBondContact OD1-OG1 2.82Å; N401-T405 VanDerWaalsContact O-CB 3.28Å; N401-T405 WeakPolarHBondContact O-CB 3.19Å; N401-T405 PolarHBondContact O-N 3.03Å; N401-T405 PolarHBondContact O-OG1 3.15Å
402	R	75.4	Confident	82.5	Confident	75 Å²	75	47.5 Å²	47.5	28%	0.283	27%	0.267	S	S	.	.	H	α-helix	trans	-59.5	-30.6	-177.6	-155.8	175.3	166.5	-168.4	-8.9	113.3	K406 D468 M472 L527	R402-K406 WeakPolarHBondContact O-CB 3.47Å; R402-K406 PolarHBondContact O-N 3.36Å; R402-D468 PolarHBondContact NH2-O 2.96Å; R402-M472 HydrophobicContact CB-CE 4.33Å; R402-M472 HydrophobicContact CB-SD 4.18Å; R402-M472 WeakPolarHBondContact CD-SD 3.4Å; R402-M472 HydrophobicContact CG-CE 3.78Å; R402-M472 HydrophobicContact CG-SD 3.49Å; R402-M472 WeakPolarHBondContact CG-SD 3.38Å; R402-M472 VanDerWaalsContact CZ-SD 3.56Å; R402-M472 PolarHBondContact NE-SD 2.86Å; R402-M472 WeakPolarHBondContact O-CE 3.45Å; R402-L527 HydrophobicContact CB-CD2 4.12Å; R402-L527 WeakPolarHBondContact CB-O 3.5Å; R402-L527 HydrophobicContact CG-CD2 4.21Å; R402-L527 PolarHBondContact N-O 3.25Å; R402-L527 VanDerWaalsContact N-O 3.12Å
403	I	82.3	Confident	83.1	Confident	27 Å²	27	47.7 Å²	47.7	14%	0.138	27%	0.268	C	S	.	.	H	α-helix	trans	-75.6	-49.6	-178.2	-56.4	178.2	0	0	0	111	N401 T405 K406 A407 V474 V478 I479 I530	N401-I403 PolarHBondContact O-N 3.32Å; N401-I403 WeakPolarHBondContact OD1-CA 3.12Å; N401-I403 WeakPolarHBondContact OD1-CB 3.39Å; N401-I403 PolarHBondContact OD1-N 3.23Å; I403-T405 VanDerWaalsContact C-N 3.27Å; I403-T405 PolarHBondContact O-N 2.96Å; I403-K406 WeakPolarHBondContact O-CB 3.43Å; I403-K406 PolarHBondContact O-N 3.06Å; I403-K406 VanDerWaalsContact O-N 3.12Å; I403-A407 PolarHBondContact O-N 3.08Å; I403-V474 HydrophobicContact CD1-CG1 3.76Å; I403-V474 HydrophobicContact CG1-CG1 4.02Å; I403-V474 HydrophobicContact CG1-CG2 4.18Å; I403-V474 HydrophobicContact CG2-CG1 4.08Å; I403-V474 HydrophobicContact CG2-CG2 4.47Å; I403-V478 HydrophobicContact CD1-CB 4.33Å; I403-V478 HydrophobicContact CD1-CG1 3.21Å; I403-I479 HydrophobicContact CG2-CD1 4.46Å; I403-I479 HydrophobicContact CG2-CG1 4.12Å; I403-I530 HydrophobicContact CD1-CB 4.3Å; I403-I530 HydrophobicContact CD1-CD1 3.85Å
404	T	83.9	Confident	83.7	Confident	62 Å²	62	52.5 Å²	52.5	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-65.5	-34.7	177.1	52.8	0	0	0	0	111.2	N401 A407 A408	N401-T404 PolarHBondContact N-OG1 3.37Å; N401-T404 PolarHBondContact O-N 3.44Å; N401-T404 PolarHBondContact O-OG1 3.05Å; N401-T404 PolarHBondContact OD1-N 2.84Å; N401-T404 PolarHBondContact OD1-OG1 2.82Å; T404-A407 PolarHBondContact O-N 2.77Å; T404-A408 PolarHBondContact O-N 3Å
405	T	87.2	Confident	84.3	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.2	-50	168.8	-59.8	0	0	0	0	111.4	V275 L395 L400 N401 I403 A407 A408 V409 I469 L527	V275-T405 HydrophobicContact CB-CG2 4.3Å; V275-T405 HydrophobicContact CG1-CG2 3.75Å; V275-T405 HydrophobicContact CG2-CG2 3.67Å; L395-T405 HydrophobicContact CD2-CG2 4.01Å; L400-T405 VanDerWaalsContact CD2-OG1 3.32Å; L400-T405 WeakPolarHBondContact CD2-OG1 3.43Å; L400-T405 VanDerWaalsContact CG-OG1 3.27Å; L400-T405 WeakPolarHBondContact CG-OG1 3.31Å; N401-T405 VanDerWaalsContact O-CB 3.28Å; N401-T405 WeakPolarHBondContact O-CB 3.19Å; N401-T405 PolarHBondContact O-N 3.03Å; N401-T405 PolarHBondContact O-OG1 3.15Å; I403-T405 VanDerWaalsContact C-N 3.27Å; I403-T405 PolarHBondContact O-N 2.96Å; T405-A407 VanDerWaalsContact C-N 3.31Å; T405-A407 PolarHBondContact O-N 3.25Å; T405-A408 PolarHBondContact O-N 3.5Å; T405-V409 HydrophobicContact CG2-CG2 4.18Å; T405-V409 WeakPolarHBondContact O-CB 3.47Å; T405-V409 WeakPolarHBondContact O-CG2 3.24Å; T405-V409 PolarHBondContact O-N 3.08Å; T405-I469 HydrophobicContact CG2-CD1 4Å; T405-I469 HydrophobicContact CG2-CG2 4.47Å; T405-L527 HydrophobicContact CG2-CD2 3.94Å; T405-L527 WeakPolarHBondContact OG1-CD2 3.43Å
406	K	89.7	Confident	84.9	Confident	45 Å²	45	53 Å²	53	20%	0.196	28%	0.278	C	S	.	.	H	α-helix	trans	-57.1	-46.9	177.9	179	178.2	-178.8	177.4	0	110.8	R402 I403 A408 V409 C410 I469 L470 M472 V474	R402-K406 WeakPolarHBondContact O-CB 3.47Å; R402-K406 PolarHBondContact O-N 3.36Å; I403-K406 WeakPolarHBondContact O-CB 3.43Å; I403-K406 PolarHBondContact O-N 3.06Å; I403-K406 VanDerWaalsContact O-N 3.12Å; K406-A408 PolarHBondContact O-N 3.12Å; K406-V409 PolarHBondContact O-N 3.01Å; K406-C410 WeakPolarHBondContact O-CB 3.44Å; K406-C410 PolarHBondContact O-N 3.48Å; K406-C410 PolarHBondContact O-SG 2.93Å; K406-I469 HydrophobicContact CB-CG2 3.89Å; K406-I469 WeakPolarHBondContact CD-O 3.27Å; K406-I469 HydrophobicContact CG-CG2 4.27Å; K406-I469 WeakPolarHBondContact CG-O 3.25Å; K406-L470 WeakPolarHBondContact CE-O 3.5Å; K406-L470 PolarHBondContact NZ-O 3.24Å; K406-M472 HydrophobicContact CB-CE 3.62Å; K406-M472 HydrophobicContact CD-CB 4.46Å; K406-M472 HydrophobicContact CD-CE 3.65Å; K406-M472 HydrophobicContact CG-CE 4.16Å; K406-M472 PolarHBondContact NZ-O 2.82Å; K406-V474 HydrophobicContact CD-CG2 4.11Å
407	A	89.3	Confident	85.9	Confident	68 Å²	68	54.3 Å²	54.3	56%	0.562	29%	0.288	S	S	*	.	H	α-helix	trans	-58.3	-47	178.9	0	0	0	0	0	112	I403 T404 T405 G411	I403-A407 PolarHBondContact O-N 3.08Å; T404-A407 PolarHBondContact O-N 2.77Å; T405-A407 VanDerWaalsContact C-N 3.31Å; T405-A407 PolarHBondContact O-N 3.25Å; A407-G411 PolarHBondContact O-N 3.25Å
408	A	89.5	Confident	87.1	Confident	21 Å²	21	57.3 Å²	57.3	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-49.5	178.4	0	0	0	0	0	112.2	L394 L395 T404 T405 K406 G411 F412	L394-A408 HydrophobicContact CB-CB 4.5Å; L395-A408 HydrophobicContact CD2-CB 4.28Å; T404-A408 PolarHBondContact O-N 3Å; T405-A408 PolarHBondContact O-N 3.5Å; K406-A408 PolarHBondContact O-N 3.12Å; A408-G411 PolarHBondContact O-N 3.38Å; A408-F412 PolarHBondContact O-N 2.64Å
409	V	92.1	Very high	88.6	Confident	1 Å²	1	51 Å²	51	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-48.4	-179.7	173.2	0	0	0	0	111.1	V275 L395 T405 K406 G411 F412 V413 Y466 L470	V275-V409 HydrophobicContact CG1-CG2 4.09Å; L395-V409 HydrophobicContact CD2-CG2 4.46Å; T405-V409 HydrophobicContact CG2-CG2 4.18Å; T405-V409 WeakPolarHBondContact O-CB 3.47Å; T405-V409 WeakPolarHBondContact O-CG2 3.24Å; T405-V409 PolarHBondContact O-N 3.08Å; K406-V409 PolarHBondContact O-N 3.01Å; V409-G411 VanDerWaalsContact C-N 3.29Å; V409-G411 PolarHBondContact O-N 3.18Å; V409-F412 PolarHBondContact O-N 3.37Å; V409-V413 HydrophobicContact CG1-CG2 4.17Å; V409-V413 WeakPolarHBondContact O-CB 3.32Å; V409-V413 VanDerWaalsContact O-CG2 3.32Å; V409-V413 WeakPolarHBondContact O-CG2 3.41Å; V409-V413 PolarHBondContact O-N 3.03Å; V409-Y466 HydrophobicContact CG1-CD1 4.09Å; V409-Y466 HydrophobicContact CG1-CD2 3.57Å; V409-Y466 HydrophobicContact CG1-CE2 4.03Å; V409-Y466 HydrophobicContact CG1-CG 3.57Å; V409-Y466 HydrophobicContact CG2-CD1 4.45Å; V409-Y466 HydrophobicContact CG2-CE1 4.24Å; V409-Y466 HydrophobicContact CG2-CE2 4.47Å; V409-L470 HydrophobicContact CG1-CD2 4.12Å
410	C	92.3	Very high	90	Very high	11 Å²	11	47.2 Å²	47.2	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-43.7	176.2	-74.6	0	0	0	0	111.3	K406 R414 L470	K406-C410 WeakPolarHBondContact O-CB 3.44Å; K406-C410 PolarHBondContact O-N 3.48Å; K406-C410 PolarHBondContact O-SG 2.93Å; C410-R414 VanDerWaalsContact O-CB 3.27Å; C410-R414 WeakPolarHBondContact O-CB 3.34Å; C410-R414 VanDerWaalsContact O-CG 3.22Å; C410-R414 WeakPolarHBondContact O-CG 3.42Å; C410-R414 PolarHBondContact O-N 2.9Å; C410-L470 HydrophobicContact CB-CD2 4.33Å; C410-L470 WeakPolarHBondContact SG-CD2 3.35Å
411	G	92.5	Very high	91.1	Very high	29 Å²	29	53 Å²	53	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-60.6	-44.4	177.9	0	0	0	0	0	112.3	A407 A408 V409 K415	A407-G411 PolarHBondContact O-N 3.25Å; A408-G411 PolarHBondContact O-N 3.38Å; V409-G411 VanDerWaalsContact C-N 3.29Å; V409-G411 PolarHBondContact O-N 3.18Å; G411-K415 WeakPolarHBondContact O-CD 3.42Å; G411-K415 VanDerWaalsContact O-CG 3.23Å; G411-K415 WeakPolarHBondContact O-CG 3.34Å; G411-K415 PolarHBondContact O-N 3.47Å
412	F	94	Very high	92	Very high	22 Å²	22	52.6 Å²	52.6	10%	0.096	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-49.8	178.1	-169.5	-91.6	0	0	0	112.4	K387 F388 M391 A408 V409 R414 K415 L416 L462	K387-F412 HydrophobicContact CB-CE2 3.87Å; K387-F412 HydrophobicContact CB-CZ 4.48Å; K387-F412 WeakPolarHBondContact O-CE2 3.13Å; F388-F412 HydrophobicContact CD1-CE1 4.24Å; F388-F412 AromaticContact CD1-CZ 3.87Å; F388-F412 HydrophobicContact CD1-CZ 3.87Å; F388-F412 AromaticContact CE1-CE1 3.84Å; F388-F412 HydrophobicContact CE1-CE1 3.84Å; F388-F412 AromaticContact CE1-CZ 3.86Å; F388-F412 HydrophobicContact CE1-CZ 3.86Å; F388-F412 HydrophobicContact CG-CZ 4.24Å; F388-F412 HydrophobicContact CZ-CE1 4.26Å; F388-F412 HydrophobicContact CZ-CZ 4.23Å; M391-F412 HydrophobicContact CB-CD2 3.97Å; M391-F412 HydrophobicContact CB-CE2 4.31Å; M391-F412 HydrophobicContact CE-CD1 4.25Å; M391-F412 HydrophobicContact CE-CE1 4.43Å; M391-F412 HydrophobicContact CE-CG 4.38Å; M391-F412 HydrophobicContact CG-CB 4.38Å; M391-F412 HydrophobicContact CG-CD2 4.34Å; M391-F412 HydrophobicContact CG-CG 4.4Å; M391-F412 HydrophobicContact SD-CB 3.44Å; M391-F412 WeakPolarHBondContact SD-CB 3.48Å; M391-F412 HydrophobicContact SD-CD1 3.72Å; M391-F412 HydrophobicContact SD-CD2 3.83Å; M391-F412 HydrophobicContact SD-CE1 4.41Å; M391-F412 HydrophobicContact SD-CE2 4.49Å; M391-F412 HydrophobicContact SD-CG 3.38Å; M391-F412 WeakPolarHBondContact SD-CG 3.38Å; A408-F412 PolarHBondContact O-N 2.64Å; V409-F412 PolarHBondContact O-N 3.37Å; F412-R414 VanDerWaalsContact C-N 3.32Å; F412-R414 PolarHBondContact O-N 2.94Å; F412-K415 WeakPolarHBondContact O-CB 3.39Å; F412-K415 PolarHBondContact O-N 3.38Å; F412-L416 HydrophobicContact CD1-CD1 4.42Å; F412-L416 HydrophobicContact CE1-CD1 4.28Å; F412-L416 HydrophobicContact CE1-CD2 4.16Å; F412-L416 HydrophobicContact CE1-CG 4.42Å; F412-L416 PolarHBondContact O-N 2.9Å; F412-L462 HydrophobicContact CD1-CD1 4.05Å; F412-L462 HydrophobicContact CE1-CD1 3.81Å
413	V	95.4	Very high	92.9	Very high	8 Å²	8	49 Å²	49	5%	0.048	25%	0.246	C	C	.	.	H	α-helix	trans	-58.8	-43.9	-179.6	173.1	0	0	0	0	110.9	V409 K415 L416 P417 H459 L462 L470	V409-V413 HydrophobicContact CG1-CG2 4.17Å; V409-V413 WeakPolarHBondContact O-CB 3.32Å; V409-V413 VanDerWaalsContact O-CG2 3.32Å; V409-V413 WeakPolarHBondContact O-CG2 3.41Å; V409-V413 PolarHBondContact O-N 3.03Å; V413-K415 VanDerWaalsContact C-N 3.27Å; V413-K415 PolarHBondContact O-N 2.98Å; V413-L416 PolarHBondContact O-N 3.06Å; V413-P417 VanDerWaalsContact O-CD 3.3Å; V413-P417 WeakPolarHBondContact O-CD 3.29Å; V413-H459 PolarHBondContact O-CD2 3.21Å; V413-L462 HydrophobicContact CG2-CB 3.91Å; V413-L470 HydrophobicContact CG1-CD1 4.49Å
414	R	94.6	Very high	93.5	Very high	186 Å²	186	50.6 Å²	50.6	70%	0.702	26%	0.263	S	S	*	.	H	α-helix	trans	-67	-23.9	178	-73.1	175.9	176.4	155.8	-1.3	114	C410 F412	C410-R414 VanDerWaalsContact O-CB 3.27Å; C410-R414 WeakPolarHBondContact O-CB 3.34Å; C410-R414 VanDerWaalsContact O-CG 3.22Å; C410-R414 WeakPolarHBondContact O-CG 3.42Å; C410-R414 PolarHBondContact O-N 2.9Å; F412-R414 VanDerWaalsContact C-N 3.32Å; F412-R414 PolarHBondContact O-N 2.94Å
415	K	95.8	Very high	94.1	Very high	125 Å²	125	54.1 Å²	54.1	54%	0.543	27%	0.269	S	S	.	.	H	α-helix	trans	-73.6	-26.5	175.4	-76.3	170	-178	-177.5	0	112.3	G411 F412 V413 L418 L419	G411-K415 WeakPolarHBondContact O-CD 3.42Å; G411-K415 VanDerWaalsContact O-CG 3.23Å; G411-K415 WeakPolarHBondContact O-CG 3.34Å; G411-K415 PolarHBondContact O-N 3.47Å; F412-K415 WeakPolarHBondContact O-CB 3.39Å; F412-K415 PolarHBondContact O-N 3.38Å; V413-K415 VanDerWaalsContact C-N 3.27Å; V413-K415 PolarHBondContact O-N 2.98Å; K415-L418 WeakPolarHBondContact O-CB 3.39Å; K415-L418 PolarHBondContact O-N 2.69Å; K415-L418 VanDerWaalsContact O-N 3.16Å; K415-L419 HydrophobicContact CB-CD1 4.47Å; K415-L419 VanDerWaalsContact O-CG 3.31Å; K415-L419 WeakPolarHBondContact O-CG 3.2Å; K415-L419 PolarHBondContact O-N 3.38Å
416	L	96.7	Very high	94.3	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-46.2	-174.3	-64	168.8	0	0	0	113.8	F412 V413 L418 L419 R420 L455 L458 H459 L462	F412-L416 HydrophobicContact CD1-CD1 4.42Å; F412-L416 HydrophobicContact CE1-CD1 4.28Å; F412-L416 HydrophobicContact CE1-CD2 4.16Å; F412-L416 HydrophobicContact CE1-CG 4.42Å; F412-L416 PolarHBondContact O-N 2.9Å; V413-L416 PolarHBondContact O-N 3.06Å; L416-L418 VanDerWaalsContact C-N 3.27Å; L416-L418 PolarHBondContact O-N 3.25Å; L416-L419 HydrophobicContact CD2-CD1 4.27Å; L416-L419 PolarHBondContact O-N 3.37Å; L416-R420 WeakPolarHBondContact O-CB 3.49Å; L416-R420 PolarHBondContact O-N 3.04Å; L416-L455 HydrophobicContact CD2-CD2 4.05Å; L416-L458 HydrophobicContact CD1-CB 4.37Å; L416-H459 HydrophobicContact CB-CB 4Å; L416-H459 HydrophobicContact CD1-CB 4.13Å; L416-L462 HydrophobicContact CD1-CD1 3.52Å
417	P	97.1	Very high	94.5	Very high	52 Å²	52	60.3 Å²	60.3	34%	0.338	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-32.9	174.5	-24	35.6	0	0	0	113.2	V413 R421	V413-P417 VanDerWaalsContact O-CD 3.3Å; V413-P417 WeakPolarHBondContact O-CD 3.29Å; P417-R421 WeakPolarHBondContact O-CB 3.33Å; P417-R421 PolarHBondContact O-N 3.25Å
418	L	96.4	Very high	94.6	Very high	92 Å²	92	57.5 Å²	57.5	48%	0.482	27%	0.271	S	S	.	.	H	α-helix	trans	-67.7	-47.3	175.8	-61.5	175.7	0	0	0	110.9	K415 L416 R420 R421 N422	K415-L418 WeakPolarHBondContact O-CB 3.39Å; K415-L418 PolarHBondContact O-N 2.69Å; K415-L418 VanDerWaalsContact O-N 3.16Å; L416-L418 VanDerWaalsContact C-N 3.27Å; L416-L418 PolarHBondContact O-N 3.25Å; L418-R420 VanDerWaalsContact C-N 3.3Å; L418-R420 PolarHBondContact O-N 3.11Å; L418-R421 PolarHBondContact O-N 2.93Å; L418-N422 WeakPolarHBondContact O-CB 3.49Å; L418-N422 VanDerWaalsContact O-CG 3.27Å; L418-N422 PolarHBondContact O-N 2.8Å
419	L	96.9	Very high	94.7	Very high	7 Å²	7	59.9 Å²	59.9	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-56.8	-46	174.6	-70.9	167.2	0	0	0	110.7	K387 K415 L416 N422 L423 Q430 F431 L455	K387-L419 HydrophobicContact CD-CD1 4.12Å; K415-L419 HydrophobicContact CB-CD1 4.47Å; K415-L419 VanDerWaalsContact O-CG 3.31Å; K415-L419 WeakPolarHBondContact O-CG 3.2Å; K415-L419 PolarHBondContact O-N 3.38Å; L416-L419 HydrophobicContact CD2-CD1 4.27Å; L416-L419 PolarHBondContact O-N 3.37Å; L419-N422 PolarHBondContact O-N 3.42Å; L419-L423 WeakPolarHBondContact O-CB 3.39Å; L419-L423 PolarHBondContact O-N 3.01Å; L419-Q430 HydrophobicContact CD2-CB 3.49Å; L419-Q430 VanDerWaalsContact CD2-CB 3.49Å; L419-Q430 HydrophobicContact CD2-CG 4.11Å; L419-F431 HydrophobicContact CB-CE2 4.22Å; L419-F431 HydrophobicContact CB-CZ 4.13Å; L419-F431 HydrophobicContact CD2-CE2 3.78Å; L419-F431 HydrophobicContact CD2-CZ 3.94Å; L419-F431 HydrophobicContact CG-CZ 4.49Å; L419-L455 HydrophobicContact CB-CD1 4.1Å
420	R	97	Very high	94.7	Very high	100 Å²	100	63.1 Å²	63.1	38%	0.377	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-44.5	177.9	179.8	-108.4	162.8	109.7	6.9	112	L416 L418 A424 C452 L455 D456	L416-R420 WeakPolarHBondContact O-CB 3.49Å; L416-R420 PolarHBondContact O-N 3.04Å; L418-R420 VanDerWaalsContact C-N 3.3Å; L418-R420 PolarHBondContact O-N 3.11Å; R420-A424 WeakPolarHBondContact O-CB 3.26Å; R420-A424 PolarHBondContact O-N 3.37Å; R420-C452 HydrophobicContact CG-CB 4.13Å; R420-L455 HydrophobicContact CB-CB 3.97Å; R420-L455 HydrophobicContact CB-CD1 4.03Å; R420-L455 HydrophobicContact CG-CB 4.43Å; R420-D456 WeakPolarHBondContact CD-OD1 3.45Å; R420-D456 IonicContact CZ-OD1 2.77Å; R420-D456 IonicContact CZ-OD2 3.55Å; R420-D456 IonicContact NE-OD1 2.68Å; R420-D456 IonicContact NE-OD2 2.66Å; R420-D456 IonicContact NH1-OD1 3.61Å; R420-D456 PolarHBondContact NH1-OD1 3.4Å; R420-D456 IonicContact NH1-OD2 3.45Å; R420-D456 PolarHBondContact NH1-OD2 2.58Å; R420-D456 IonicContact NH2-OD2 3.72Å
421	R	97.4	Very high	94.8	Very high	137 Å²	137	62.6 Å²	62.6	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-45	177.8	179.3	-179.4	176.5	173.2	0.8	112.2	P417 L418 A424 R425	P417-R421 WeakPolarHBondContact O-CB 3.33Å; P417-R421 PolarHBondContact O-N 3.25Å; L418-R421 PolarHBondContact O-N 2.93Å; R421-A424 PolarHBondContact O-N 2.91Å; R421-R425 WeakPolarHBondContact O-CG 3.23Å; R421-R425 PolarHBondContact O-N 3.45Å
422	N	96.2	Very high	94.7	Very high	36 Å²	36	64.9 Å²	64.9	19%	0.193	32%	0.319	C	S	.	.	H	α-helix	trans	-68.5	-42.2	-179.2	-67.5	-6	0	0	0	110.6	L418 L419 A424 R425 R426 E427 Q430	L418-N422 WeakPolarHBondContact O-CB 3.49Å; L418-N422 VanDerWaalsContact O-CG 3.27Å; L418-N422 PolarHBondContact O-N 2.8Å; L419-N422 PolarHBondContact O-N 3.42Å; N422-A424 PolarHBondContact O-N 3.43Å; N422-R425 CarbonylContact O-C 3.57Å; N422-R425 WeakPolarHBondContact O-CA 3.16Å; N422-R425 WeakPolarHBondContact O-CB 3.41Å; N422-R425 PolarHBondContact O-N 3.33Å; N422-R426 PolarHBondContact O-N 3.46Å; N422-E427 HydrophobicContact CB-CB 4.1Å; N422-E427 WeakPolarHBondContact O-CB 3.39Å; N422-E427 PolarHBondContact O-N 3.15Å; N422-Q430 PolarHBondContact ND2-OE1 3.06Å
423	L	95.1	Very high	94.4	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-43.2	175.3	-171.9	59.6	0	0	0	112.2	Y380 L419 R425 R426 L428 F431 L434 V448 Y451 L455	Y380-L423 HydrophobicContact CE2-CD2 4.39Å; L419-L423 WeakPolarHBondContact O-CB 3.39Å; L419-L423 PolarHBondContact O-N 3.01Å; L423-R425 PolarHBondContact O-N 3.46Å; L423-R426 WeakPolarHBondContact O-CA 3.46Å; L423-R426 PolarHBondContact O-N 3.43Å; L423-L428 HydrophobicContact CD1-CD2 3.35Å; L423-F431 HydrophobicContact CB-CE2 4.38Å; L423-F431 HydrophobicContact CD1-CD2 4.43Å; L423-F431 HydrophobicContact CD1-CE2 4.45Å; L423-F431 HydrophobicContact CD2-CE2 4.48Å; L423-F431 HydrophobicContact CD2-CZ 4.44Å; L423-L434 HydrophobicContact CD1-CD2 3.97Å; L423-V448 HydrophobicContact CG-CG1 4.41Å; L423-V448 WeakPolarHBondContact O-CG1 3.48Å; L423-Y451 VanDerWaalsContact CD2-CB 3.42Å; L423-Y451 HydrophobicContact CD2-CD2 4.38Å; L423-Y451 HydrophobicContact CD2-CG 4.4Å; L423-L455 HydrophobicContact CD2-CD1 3.82Å
424	A	95.3	Very high	94.2	Very high	60 Å²	60	64.3 Å²	64.3	50%	0.496	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-25.9	174.9	0	0	0	0	0	113.4	R420 R421 N422 R426	R420-A424 WeakPolarHBondContact O-CB 3.26Å; R420-A424 PolarHBondContact O-N 3.37Å; R421-A424 PolarHBondContact O-N 2.91Å; N422-A424 PolarHBondContact O-N 3.43Å; A424-R426 VanDerWaalsContact C-N 3.31Å
425	R	95	Very high	94.1	Very high	136 Å²	136	57.9 Å²	57.9	51%	0.513	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	2.2	173.7	-68	172.5	172.8	-154.8	-11.5	113.2	R421 N422 L423 E427	R421-R425 WeakPolarHBondContact O-CG 3.23Å; R421-R425 PolarHBondContact O-N 3.45Å; N422-R425 CarbonylContact O-C 3.57Å; N422-R425 WeakPolarHBondContact O-CA 3.16Å; N422-R425 WeakPolarHBondContact O-CB 3.41Å; N422-R425 PolarHBondContact O-N 3.33Å; L423-R425 PolarHBondContact O-N 3.46Å; R425-E427 HydrophobicContact CB-CG 4.02Å; R425-E427 WeakPolarHBondContact CD-OE1 3.47Å; R425-E427 IonicContact NH1-OE1 3.99Å; R425-E427 PolarHBondContact O-N 3.25Å
426	R	92.5	Very high	93.7	Very high	79 Å²	79	54.7 Å²	54.7	30%	0.298	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	24.3	-172	-58.4	176.5	163.7	-90.4	3.4	113.1	N422 L423 A424 L428 I443 D445	N422-R426 PolarHBondContact O-N 3.46Å; L423-R426 WeakPolarHBondContact O-CA 3.46Å; L423-R426 PolarHBondContact O-N 3.43Å; A424-R426 VanDerWaalsContact C-N 3.31Å; R426-L428 PolarHBondContact O-N 3.06Å; R426-I443 PolarHBondContact NH1-O 2.8Å; R426-I443 PolarHBondContact NH2-O 2.86Å; R426-D445 IonicContact CZ-OD1 2.54Å; R426-D445 IonicContact NE-OD1 3.4Å; R426-D445 IonicContact NH2-OD1 3.08Å; R426-D445 PolarHBondContact NH2-OD1 3.34Å
427	E	93.5	Very high	93.3	Very high	96 Å²	96	55.1 Å²	55.1	45%	0.449	30%	0.299	S	S	.	.			trans	-85.1	83.8	172	-67.2	172.8	-155.8	0	0	108.9	N422 R425 G429	N422-E427 HydrophobicContact CB-CB 4.1Å; N422-E427 WeakPolarHBondContact O-CB 3.39Å; N422-E427 PolarHBondContact O-N 3.15Å; R425-E427 HydrophobicContact CB-CG 4.02Å; R425-E427 WeakPolarHBondContact CD-OE1 3.47Å; R425-E427 IonicContact NH1-OE1 3.99Å; R425-E427 PolarHBondContact O-N 3.25Å; E427-G429 VanDerWaalsContact C-N 3.29Å; E427-G429 PolarHBondContact O-N 2.78Å
428	L	91.8	Very high	92.8	Very high	8 Å²	8	56 Å²	56	4%	0.042	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-84	8.7	-171.6	-54.7	-167.3	0	0	0	114.9	L423 R426 Q430 F431 L434 C435 Q438 I443	L423-L428 HydrophobicContact CD1-CD2 3.35Å; R426-L428 PolarHBondContact O-N 3.06Å; L428-Q430 PolarHBondContact O-N 2.72Å; L428-F431 CarbonylContact O-C 3.08Å; L428-F431 WeakPolarHBondContact O-CA 3.16Å; L428-F431 PolarHBondContact O-N 3.35Å; L428-F431 VanDerWaalsContact O-O 3.1Å; L428-L434 HydrophobicContact CD1-CB 4.35Å; L428-L434 HydrophobicContact CD1-CD2 4.07Å; L428-L434 HydrophobicContact CD1-CG 3.85Å; L428-L434 HydrophobicContact CD2-CD2 4.11Å; L428-C435 HydrophobicContact CB-CB 3.79Å; L428-Q438 HydrophobicContact CD1-CB 4.06Å; L428-Q438 HydrophobicContact CD1-CG 4.41Å; L428-I443 HydrophobicContact CD1-CD1 3.44Å; L428-I443 VanDerWaalsContact CD1-CD1 3.44Å
429	G	91.5	Very high	92.3	Very high	72 Å²	72	57.4 Å²	57.4	74%	0.742	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-58.9	-19.4	-175	0	0	0	0	0	114.9	E427	E427-G429 VanDerWaalsContact C-N 3.29Å; E427-G429 PolarHBondContact O-N 2.78Å
430	Q	92.4	Very high	91.6	Very high	68 Å²	68	63.9 Å²	63.9	32%	0.318	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-89.7	-3.6	174.8	-60.2	178.9	-67.5	0	0	113.7	K387 L419 N422 L428	K387-Q430 WeakPolarHBondContact CE-O 3.24Å; K387-Q430 PolarHBondContact NZ-O 3.45Å; L419-Q430 HydrophobicContact CD2-CB 3.49Å; L419-Q430 VanDerWaalsContact CD2-CB 3.49Å; L419-Q430 HydrophobicContact CD2-CG 4.11Å; N422-Q430 PolarHBondContact ND2-OE1 3.06Å; L428-Q430 PolarHBondContact O-N 2.72Å
431	F	92.9	Very high	90.9	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.345	C	S	.	.			trans	-125.9	76	-178.9	-65.8	-87.9	0	0	0	108.4	Y380 D383 L419 L423 L428 N433 L434 C435 L455	Y380-F431 HydrophobicContact CD2-CD1 4.24Å; Y380-F431 AromaticContact CD2-CE1 3.94Å; Y380-F431 HydrophobicContact CD2-CE1 3.94Å; Y380-F431 AromaticContact CE2-CE1 3.89Å; Y380-F431 HydrophobicContact CE2-CE1 3.89Å; Y380-F431 HydrophobicContact CE2-CZ 4.43Å; D383-F431 HydrophobicContact CB-CB 4.28Å; D383-F431 HydrophobicContact CB-CD1 3.65Å; D383-F431 HydrophobicContact CB-CG 4.42Å; D383-F431 WeakPolarHBondContact OD2-CA 3.28Å; D383-F431 VanDerWaalsContact OD2-CB 3.28Å; D383-F431 WeakPolarHBondContact OD2-CB 3.4Å; L419-F431 HydrophobicContact CB-CE2 4.22Å; L419-F431 HydrophobicContact CB-CZ 4.13Å; L419-F431 HydrophobicContact CD2-CE2 3.78Å; L419-F431 HydrophobicContact CD2-CZ 3.94Å; L419-F431 HydrophobicContact CG-CZ 4.49Å; L423-F431 HydrophobicContact CB-CE2 4.38Å; L423-F431 HydrophobicContact CD1-CD2 4.43Å; L423-F431 HydrophobicContact CD1-CE2 4.45Å; L423-F431 HydrophobicContact CD2-CE2 4.48Å; L423-F431 HydrophobicContact CD2-CZ 4.44Å; L428-F431 CarbonylContact O-C 3.08Å; L428-F431 WeakPolarHBondContact O-CA 3.16Å; L428-F431 PolarHBondContact O-N 3.35Å; L428-F431 VanDerWaalsContact O-O 3.1Å; F431-N433 VanDerWaalsContact C-N 3.33Å; F431-N433 PolarHBondContact O-N 3.24Å; F431-L434 HydrophobicContact CB-CB 3.89Å; F431-L434 HydrophobicContact CB-CD2 4.5Å; F431-L434 PolarHBondContact O-N 3.3Å; F431-C435 VanDerWaalsContact O-CB 3.24Å; F431-C435 WeakPolarHBondContact O-CB 3.15Å; F431-C435 PolarHBondContact O-N 2.79Å; F431-L455 HydrophobicContact CZ-CD1 4.14Å
432	P	90.7	Very high	90.4	Very high	77 Å²	77	63.6 Å²	63.6	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-38.6	-170.7	22.2	-33.5	0	0	0	113.5	D383 C435 A436	D383-P432 VanDerWaalsContact OD1-CD 3.22Å; D383-P432 WeakPolarHBondContact OD1-CD 3.45Å; D383-P432 WeakPolarHBondContact OD1-CG 3.35Å; P432-C435 PolarHBondContact O-N 2.83Å; P432-A436 WeakPolarHBondContact O-CB 3.46Å; P432-A436 PolarHBondContact O-N 2.98Å
433	N	88.4	Confident	90.2	Very high	18 Å²	18	62.1 Å²	62.1	10%	0.096	35%	0.35	C	S	.	.	H	α-helix	trans	-67.5	-45.6	178.1	-66.5	-55.5	0	0	0	110.9	F350 A379 D383 F431 C435 A436 L437	F350-N433 HydrophobicContact CD1-CB 3.66Å; F350-N433 VanDerWaalsContact CD1-CG 3.48Å; F350-N433 WeakPolarHBondContact CD1-OD1 3.32Å; F350-N433 HydrophobicContact CE1-CB 3.55Å; F350-N433 WeakPolarHBondContact CE1-OD1 3.44Å; F350-N433 HydrophobicContact CG-CB 4.27Å; F350-N433 HydrophobicContact CZ-CB 4.11Å; A379-N433 HydrophobicContact CB-CB 4.12Å; D383-N433 WeakPolarHBondContact OD1-CB 3.44Å; D383-N433 PolarHBondContact OD1-N 3.26Å; D383-N433 VanDerWaalsContact OD1-N 3.11Å; D383-N433 PolarHBondContact OD1-ND2 3Å; D383-N433 PolarHBondContact OD2-N 2.88Å; D383-N433 VanDerWaalsContact OD2-N 3.15Å; F431-N433 VanDerWaalsContact C-N 3.33Å; F431-N433 PolarHBondContact O-N 3.24Å; N433-C435 VanDerWaalsContact C-N 3.31Å; N433-C435 PolarHBondContact O-N 3.02Å; N433-A436 PolarHBondContact O-N 3.47Å; N433-L437 WeakPolarHBondContact O-CB 3.46Å; N433-L437 PolarHBondContact O-N 2.91Å
434	L	90.8	Very high	90.1	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-66.2	-35.1	177.5	-164.8	67.4	0	0	0	111.8	A379 D383 L423 L428 F431 L437 Q438 I443 Y451	A379-L434 HydrophobicContact CB-CB 4.32Å; A379-L434 HydrophobicContact CB-CD1 4Å; D383-L434 PolarHBondContact OD2-N 3.03Å; L423-L434 HydrophobicContact CD1-CD2 3.97Å; L428-L434 HydrophobicContact CD1-CB 4.35Å; L428-L434 HydrophobicContact CD1-CD2 4.07Å; L428-L434 HydrophobicContact CD1-CG 3.85Å; L428-L434 HydrophobicContact CD2-CD2 4.11Å; F431-L434 HydrophobicContact CB-CB 3.89Å; F431-L434 HydrophobicContact CB-CD2 4.5Å; F431-L434 PolarHBondContact O-N 3.3Å; L434-L437 PolarHBondContact O-N 3.15Å; L434-Q438 PolarHBondContact O-N 3.35Å; L434-I443 HydrophobicContact CD1-CD1 3.69Å; L434-I443 HydrophobicContact CD1-CG1 4.27Å; L434-I443 HydrophobicContact CD2-CD1 4.28Å; L434-I443 HydrophobicContact CG-CD1 3.61Å; L434-Y451 HydrophobicContact CD1-CE2 4.26Å; L434-Y451 HydrophobicContact CD2-CD2 4.21Å; L434-Y451 HydrophobicContact CD2-CE2 4.14Å
435	C	91.8	Very high	90	Very high	51 Å²	51	71 Å²	71	35%	0.345	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-43.3	175.5	-168.8	0	0	0	0	112	L428 F431 P432 N433 L437 Q438	L428-C435 HydrophobicContact CB-CB 3.79Å; F431-C435 VanDerWaalsContact O-CB 3.24Å; F431-C435 WeakPolarHBondContact O-CB 3.15Å; F431-C435 PolarHBondContact O-N 2.79Å; P432-C435 PolarHBondContact O-N 2.83Å; N433-C435 VanDerWaalsContact C-N 3.31Å; N433-C435 PolarHBondContact O-N 3.02Å; C435-L437 VanDerWaalsContact C-N 3.32Å; C435-Q438 PolarHBondContact O-N 3.01Å
436	A	88.3	Confident	89.9	Confident	58 Å²	58	70.1 Å²	70.1	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-41.3	175.7	0	0	0	0	0	111	P432 N433 Q438 V439	P432-A436 WeakPolarHBondContact O-CB 3.46Å; P432-A436 PolarHBondContact O-N 2.98Å; N433-A436 PolarHBondContact O-N 3.47Å; A436-Q438 VanDerWaalsContact C-N 3.35Å; A436-Q438 PolarHBondContact O-N 3.12Å; A436-V439 WeakPolarHBondContact O-CB 3.41Å; A436-V439 PolarHBondContact O-N 3.49Å
437	L	87.5	Confident	90	Very high	9 Å²	9	67.1 Å²	67.1	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-39.2	176.4	-174.4	65.1	0	0	0	112.4	E375 A379 N433 L434 C435 V439 N440 V441	E375-L437 VanDerWaalsContact CD-CD1 3.47Å; E375-L437 HydrophobicContact CG-CD1 3.87Å; E375-L437 HydrophobicContact CG-CD2 3.98Å; E375-L437 WeakPolarHBondContact OE1-CD1 3.47Å; A379-L437 HydrophobicContact CB-CD2 4.21Å; N433-L437 WeakPolarHBondContact O-CB 3.46Å; N433-L437 PolarHBondContact O-N 2.91Å; L434-L437 PolarHBondContact O-N 3.15Å; C435-L437 VanDerWaalsContact C-N 3.32Å; L437-V439 PolarHBondContact O-N 3.47Å; L437-V439 VanDerWaalsContact O-N 3.09Å; L437-N440 PolarHBondContact O-N 2.99Å; L437-V441 HydrophobicContact CD1-CB 3.99Å; L437-V441 HydrophobicContact CD1-CG2 3.77Å; L437-V441 HydrophobicContact CG-CB 4.11Å; L437-V441 HydrophobicContact CG-CG2 4.45Å; L437-V441 PolarHBondContact O-N 3.34Å
438	Q	87.1	Confident	90.1	Very high	72 Å²	72	63.1 Å²	63.1	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-57.8	-25.5	-179.6	-167.9	-180	0.4	0	0	113.4	L428 L434 C435 A436 N440 V441 I443	L428-Q438 HydrophobicContact CD1-CB 4.06Å; L428-Q438 HydrophobicContact CD1-CG 4.41Å; L434-Q438 PolarHBondContact O-N 3.35Å; C435-Q438 PolarHBondContact O-N 3.01Å; A436-Q438 VanDerWaalsContact C-N 3.35Å; A436-Q438 PolarHBondContact O-N 3.12Å; Q438-N440 VanDerWaalsContact C-N 3.31Å; Q438-V441 WeakPolarHBondContact CA-O 3.36Å; Q438-I443 HydrophobicContact CB-CD1 3.85Å; Q438-I443 HydrophobicContact CG-CD1 4.14Å
439	V	85.8	Confident	90.3	Very high	120 Å²	120	68 Å²	68	73%	0.727	38%	0.383	S	S	*	.	H	α-helix	trans	-65.8	-36.4	177.7	-179.9	0	0	0	0	111.5	A436 L437	A436-V439 WeakPolarHBondContact O-CB 3.41Å; A436-V439 PolarHBondContact O-N 3.49Å; L437-V439 PolarHBondContact O-N 3.47Å; L437-V439 VanDerWaalsContact O-N 3.09Å
440	N	82.9	Confident	90.5	Very high	143 Å²	143	65.3 Å²	65.3	77%	0.765	35%	0.354	S	S	*	.	H	α-helix	trans	-105.4	-26.6	-174.4	-63.8	-25.7	0	0	0	112.9	L437 Q438	L437-N440 PolarHBondContact O-N 2.99Å; Q438-N440 VanDerWaalsContact C-N 3.31Å
441	V	82.9	Confident	90.6	Very high	63 Å²	63	62 Å²	62	38%	0.382	34%	0.338	S	S	.	.	S	Bend	trans	-133.6	124.9	-172.2	-177.3	0	0	0	0	109.9	L437 Q438 I443	L437-V441 HydrophobicContact CD1-CB 3.99Å; L437-V441 HydrophobicContact CD1-CG2 3.77Å; L437-V441 HydrophobicContact CG-CB 4.11Å; L437-V441 HydrophobicContact CG-CG2 4.45Å; L437-V441 PolarHBondContact O-N 3.34Å; Q438-V441 WeakPolarHBondContact CA-O 3.36Å; V441-I443 PolarHBondContact O-N 3.39Å
442	E	87	Confident	90.8	Very high	169 Å²	169	62.5 Å²	62.5	79%	0.79	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-68.7	120.3	174	-173.5	178.3	-173.5	0	0	110.8	K444	E442-K444 PolarHBondContact O-N 3.43Å
443	I	90.5	Very high	91.1	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.021	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-78.9	120	175	-58.7	160.5	0	0	0	108.7	R426 L428 L434 Q438 V441 D447 V448	R426-I443 PolarHBondContact NH1-O 2.8Å; R426-I443 PolarHBondContact NH2-O 2.86Å; L428-I443 HydrophobicContact CD1-CD1 3.44Å; L428-I443 VanDerWaalsContact CD1-CD1 3.44Å; L434-I443 HydrophobicContact CD1-CD1 3.69Å; L434-I443 HydrophobicContact CD1-CG1 4.27Å; L434-I443 HydrophobicContact CD2-CD1 4.28Å; L434-I443 HydrophobicContact CG-CD1 3.61Å; Q438-I443 HydrophobicContact CB-CD1 3.85Å; Q438-I443 HydrophobicContact CG-CD1 4.14Å; V441-I443 PolarHBondContact O-N 3.39Å; I443-D447 HydrophobicContact CG2-CB 3.95Å; I443-V448 HydrophobicContact CG2-CG2 3.81Å
444	K	92.5	Very high	91.5	Very high	134 Å²	134	63.5 Å²	63.5	58%	0.583	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-65	148.9	-177.3	-61.5	176.8	-179	176	0	111.7	E442 D446 D447 V448	E442-K444 PolarHBondContact O-N 3.43Å; K444-D446 VanDerWaalsContact C-N 3.28Å; K444-D446 PolarHBondContact O-N 3.23Å; K444-D447 HydrophobicContact CB-CB 4.42Å; K444-D447 WeakPolarHBondContact O-CB 3.32Å; K444-D447 PolarHBondContact O-N 3.05Å; K444-V448 PolarHBondContact O-N 2.96Å; K444-V448 VanDerWaalsContact O-N 3.17Å
445	D	93.2	Very high	91.8	Very high	114 Å²	114	63.5 Å²	63.5	61%	0.61	34%	0.339	S	S	*	.	H	α-helix	trans	-57.7	-41.8	175.8	-71.7	-35.9	0	0	0	111.9	R426 D447 V448 E449	R426-D445 IonicContact CZ-OD1 2.54Å; R426-D445 IonicContact NE-OD1 3.4Å; R426-D445 IonicContact NH2-OD1 3.08Å; R426-D445 PolarHBondContact NH2-OD1 3.34Å; D445-D447 PolarHBondContact O-N 2.84Å; D445-V448 PolarHBondContact O-N 3.4Å; D445-E449 WeakPolarHBondContact O-CB 3.28Å; D445-E449 PolarHBondContact O-N 2.91Å
446	D	94	Very high	92	Very high	116 Å²	116	63.6 Å²	63.6	62%	0.62	34%	0.336	S	S	*	.	H	α-helix	trans	-58.6	-29.3	175.5	-65.7	-9.6	0	0	0	113.1	R289 K444 A450	R289-D446 PolarHBondContact NH1-O 3.24Å; K444-D446 VanDerWaalsContact C-N 3.28Å; K444-D446 PolarHBondContact O-N 3.23Å; D446-A450 VanDerWaalsContact O-CB 3.31Å; D446-A450 WeakPolarHBondContact O-CB 3.27Å; D446-A450 PolarHBondContact O-N 2.61Å; D446-A450 VanDerWaalsContact O-N 3.15Å
447	D	94.3	Very high	92.4	Very high	16 Å²	16	63.1 Å²	63.1	9%	0.086	32%	0.324	C	S	.	.	H	α-helix	trans	-75.7	-49.2	178.1	-64.1	-2	0	0	0	109.8	R289 S376 I443 K444 D445 E449 A450 Y451	R289-D447 IonicContact CZ-OD1 3.13Å; R289-D447 IonicContact NH1-OD1 3.89Å; R289-D447 PolarHBondContact NH1-OD1 2.84Å; R289-D447 IonicContact NH2-OD1 2.59Å; R289-D447 PolarHBondContact NH2-OD1 3.4Å; R289-D447 IonicContact NH2-OD2 2.65Å; S376-D447 PolarHBondContact OG-OD2 3.36Å; I443-D447 HydrophobicContact CG2-CB 3.95Å; K444-D447 HydrophobicContact CB-CB 4.42Å; K444-D447 WeakPolarHBondContact O-CB 3.32Å; K444-D447 PolarHBondContact O-N 3.05Å; D445-D447 PolarHBondContact O-N 2.84Å; D447-E449 VanDerWaalsContact C-N 3.29Å; D447-E449 PolarHBondContact O-N 3.2Å; D447-A450 PolarHBondContact O-N 3.34Å; D447-Y451 HydrophobicContact CB-CE2 4Å; D447-Y451 WeakPolarHBondContact O-CD1 3.41Å; D447-Y451 VanDerWaalsContact O-CD2 3.22Å; D447-Y451 WeakPolarHBondContact O-CD2 3.32Å; D447-Y451 PolarHBondContact O-N 3.45Å
448	V	95	Very high	92.8	Very high	13 Å²	13	62.7 Å²	62.7	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-57.7	-44.3	176.2	178.4	0	0	0	0	110.8	L423 I443 K444 D445 Y451 C452	L423-V448 HydrophobicContact CG-CG1 4.41Å; L423-V448 WeakPolarHBondContact O-CG1 3.48Å; I443-V448 HydrophobicContact CG2-CG2 3.81Å; K444-V448 PolarHBondContact O-N 2.96Å; K444-V448 VanDerWaalsContact O-N 3.17Å; D445-V448 PolarHBondContact O-N 3.4Å; V448-Y451 PolarHBondContact O-N 2.68Å; V448-C452 PolarHBondContact O-N 3.09Å; V448-C452 PolarHBondContact O-SG 2.74Å
449	E	95.9	Very high	93.2	Very high	110 Å²	110	62.1 Å²	62.1	51%	0.514	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-47.6	177	-169.7	-177	169.8	0	0	111.2	D445 D447 Y451 C452 Q453	D445-E449 WeakPolarHBondContact O-CB 3.28Å; D445-E449 PolarHBondContact O-N 2.91Å; D447-E449 VanDerWaalsContact C-N 3.29Å; D447-E449 PolarHBondContact O-N 3.2Å; E449-Y451 VanDerWaalsContact C-N 3.28Å; E449-Y451 PolarHBondContact O-N 2.73Å; E449-C452 PolarHBondContact O-N 3.46Å; E449-Q453 HydrophobicContact CG-CG 4.5Å; E449-Q453 WeakPolarHBondContact O-CG 3.35Å; E449-Q453 PolarHBondContact O-N 3.19Å; E449-Q453 PolarHBondContact OE1-NE2 3.4Å
450	A	95.9	Very high	93.7	Very high	15 Å²	15	62.7 Å²	62.7	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-37.3	178.7	0	0	0	0	0	112.7	D446 D447 H454	D446-A450 VanDerWaalsContact O-CB 3.31Å; D446-A450 WeakPolarHBondContact O-CB 3.27Å; D446-A450 PolarHBondContact O-N 2.61Å; D446-A450 VanDerWaalsContact O-N 3.15Å; D447-A450 PolarHBondContact O-N 3.34Å; A450-H454 PolarHBondContact O-N 2.93Å; A450-H454 VanDerWaalsContact O-N 3.07Å
451	Y	96.3	Very high	94.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-71.9	-40.9	176.5	-55.2	-25	0	0	0	112.1	L290 S376 D377 Y380 L423 L434 D447 V448 E449 Q453 H454 L455	L290-Y451 HydrophobicContact CD2-CE1 4.4Å; S376-Y451 WeakPolarHBondContact CB-OH 3.41Å; S376-Y451 PolarHBondContact O-OH 2.71Å; S376-Y451 PolarHBondContact OG-OH 3.11Å; D377-Y451 WeakPolarHBondContact CA-OH 3.47Å; D377-Y451 PolarHBondContact N-OH 2.78Å; D377-Y451 WeakPolarHBondContact OD1-CE1 3.16Å; D377-Y451 VanDerWaalsContact OD1-CZ 3.29Å; D377-Y451 PolarHBondContact OD1-OH 3.33Å; Y380-Y451 AromaticContact CD1-CD1 3.42Å; Y380-Y451 HydrophobicContact CD1-CD1 3.42Å; Y380-Y451 VanDerWaalsContact CD1-CD1 3.42Å; Y380-Y451 AromaticContact CD1-CE1 3.79Å; Y380-Y451 HydrophobicContact CD1-CE1 3.79Å; Y380-Y451 AromaticContact CD1-CG 3.96Å; Y380-Y451 HydrophobicContact CD1-CG 3.96Å; Y380-Y451 HydrophobicContact CD2-CD1 4.06Å; Y380-Y451 AromaticContact CD2-CD2 3.99Å; Y380-Y451 HydrophobicContact CD2-CD2 3.99Å; Y380-Y451 AromaticContact CD2-CG 3.7Å; Y380-Y451 HydrophobicContact CD2-CG 3.7Å; Y380-Y451 AromaticContact CE1-CD1 3.79Å; Y380-Y451 HydrophobicContact CE1-CD1 3.79Å; Y380-Y451 HydrophobicContact CE1-CG 4.25Å; Y380-Y451 HydrophobicContact CE2-CD1 4.38Å; Y380-Y451 HydrophobicContact CE2-CG 4.01Å; Y380-Y451 AromaticContact CG-CD1 3.56Å; Y380-Y451 HydrophobicContact CG-CD1 3.56Å; Y380-Y451 AromaticContact CG-CD2 3.99Å; Y380-Y451 HydrophobicContact CG-CD2 3.99Å; Y380-Y451 AromaticContact CG-CE1 3.89Å; Y380-Y451 HydrophobicContact CG-CE1 3.89Å; Y380-Y451 HydrophobicContact CG-CE2 4.27Å; Y380-Y451 AromaticContact CG-CG 3.66Å; Y380-Y451 HydrophobicContact CG-CG 3.66Å; L423-Y451 VanDerWaalsContact CD2-CB 3.42Å; L423-Y451 HydrophobicContact CD2-CD2 4.38Å; L423-Y451 HydrophobicContact CD2-CG 4.4Å; L434-Y451 HydrophobicContact CD1-CE2 4.26Å; L434-Y451 HydrophobicContact CD2-CD2 4.21Å; L434-Y451 HydrophobicContact CD2-CE2 4.14Å; D447-Y451 HydrophobicContact CB-CE2 4Å; D447-Y451 WeakPolarHBondContact O-CD1 3.41Å; D447-Y451 VanDerWaalsContact O-CD2 3.22Å; D447-Y451 WeakPolarHBondContact O-CD2 3.32Å; D447-Y451 PolarHBondContact O-N 3.45Å; V448-Y451 PolarHBondContact O-N 2.68Å; E449-Y451 VanDerWaalsContact C-N 3.28Å; E449-Y451 PolarHBondContact O-N 2.73Å; Y451-Q453 VanDerWaalsContact C-N 3.34Å; Y451-Q453 PolarHBondContact O-N 2.89Å; Y451-H454 WeakPolarHBondContact O-CB 3.33Å; Y451-H454 PolarHBondContact O-N 3.22Å; Y451-H454 VanDerWaalsContact O-N 3.16Å; Y451-L455 WeakPolarHBondContact O-CG 3.45Å; Y451-L455 PolarHBondContact O-N 3.19Å
452	C	97.1	Very high	94.8	Very high	10 Å²	10	53.3 Å²	53.3	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-45.9	174.6	-70.2	0	0	0	0	111.4	R420 V448 E449 H454 L455 D456	R420-C452 HydrophobicContact CG-CB 4.13Å; V448-C452 PolarHBondContact O-N 3.09Å; V448-C452 PolarHBondContact O-SG 2.74Å; E449-C452 PolarHBondContact O-N 3.46Å; C452-H454 VanDerWaalsContact C-N 3.28Å; C452-H454 PolarHBondContact O-N 3.29Å; C452-L455 PolarHBondContact O-N 3.49Å; C452-D456 PolarHBondContact O-N 3.46Å
453	Q	96.9	Very high	95.2	Very high	112 Å²	112	47 Å²	47	52%	0.523	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-37.7	175.4	-69.9	175.6	6.1	0	0	111.9	E449 Y451 M457	E449-Q453 HydrophobicContact CG-CG 4.5Å; E449-Q453 WeakPolarHBondContact O-CG 3.35Å; E449-Q453 PolarHBondContact O-N 3.19Å; E449-Q453 PolarHBondContact OE1-NE2 3.4Å; Y451-Q453 VanDerWaalsContact C-N 3.34Å; Y451-Q453 PolarHBondContact O-N 2.89Å; Q453-M457 WeakPolarHBondContact O-CB 3.33Å; Q453-M457 PolarHBondContact O-N 3.09Å
454	H	96	Very high	95.4	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-45.6	175.4	-177	-152.4	0	0	0	112	R285 L286 L290 Y380 L384 A450 Y451 C452 D456 M457 L458	R285-H454 PolarHBondContact O-NE2 3.35Å; L286-H454 VanDerWaalsContact CD2-CE1 3.49Å; L286-H454 WeakPolarHBondContact CD2-CE1 3.49Å; L290-H454 HydrophobicContact CD1-CB 3.94Å; L290-H454 WeakPolarHBondContact CD1-ND1 3.41Å; Y380-H454 AromaticContact CE1-ND1 3.33Å; Y380-H454 VanDerWaalsContact CE1-ND1 3.33Å; Y380-H454 WeakPolarHBondContact CE1-ND1 3.4Å; Y380-H454 AromaticContact CZ-ND1 3.52Å; Y380-H454 PolarHBondContact OH-ND1 3.06Å; L384-H454 VanDerWaalsContact CD2-CE1 3.41Å; L384-H454 WeakPolarHBondContact CD2-CE1 3.14Å; A450-H454 PolarHBondContact O-N 2.93Å; A450-H454 VanDerWaalsContact O-N 3.07Å; Y451-H454 WeakPolarHBondContact O-CB 3.33Å; Y451-H454 PolarHBondContact O-N 3.22Å; Y451-H454 VanDerWaalsContact O-N 3.16Å; C452-H454 VanDerWaalsContact C-N 3.28Å; C452-H454 PolarHBondContact O-N 3.29Å; H454-D456 VanDerWaalsContact C-N 3.33Å; H454-D456 PolarHBondContact O-N 2.95Å; H454-M457 VanDerWaalsContact CD2-CE 3.45Å; H454-M457 WeakPolarHBondContact CD2-CE 3.49Å; H454-M457 PolarHBondContact O-N 2.93Å; H454-L458 WeakPolarHBondContact NE2-CD1 3.41Å; H454-L458 WeakPolarHBondContact O-CG 3.38Å; H454-L458 PolarHBondContact O-N 2.81Å
455	L	96.9	Very high	95.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-38.8	177.4	-69.6	171.9	0	0	0	112.4	L384 L416 L419 R420 L423 F431 Y451 C452 L458 H459	L384-L455 HydrophobicContact CD1-CD2 4.25Å; L416-L455 HydrophobicContact CD2-CD2 4.05Å; L419-L455 HydrophobicContact CB-CD1 4.1Å; R420-L455 HydrophobicContact CB-CB 3.97Å; R420-L455 HydrophobicContact CB-CD1 4.03Å; R420-L455 HydrophobicContact CG-CB 4.43Å; L423-L455 HydrophobicContact CD2-CD1 3.82Å; F431-L455 HydrophobicContact CZ-CD1 4.14Å; Y451-L455 WeakPolarHBondContact O-CG 3.45Å; Y451-L455 PolarHBondContact O-N 3.19Å; C452-L455 PolarHBondContact O-N 3.49Å; L455-L458 PolarHBondContact O-N 2.84Å; L455-H459 WeakPolarHBondContact O-CB 3.27Å; L455-H459 PolarHBondContact O-N 3.32Å
456	D	96.8	Very high	95.4	Very high	54 Å²	54	41.5 Å²	41.5	29%	0.289	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-47	174	-71.7	-29.1	0	0	0	112.2	R420 C452 H454 L458 H459 H460	R420-D456 WeakPolarHBondContact CD-OD1 3.45Å; R420-D456 IonicContact CZ-OD1 2.77Å; R420-D456 IonicContact CZ-OD2 3.55Å; R420-D456 IonicContact NE-OD1 2.68Å; R420-D456 IonicContact NE-OD2 2.66Å; R420-D456 IonicContact NH1-OD1 3.61Å; R420-D456 PolarHBondContact NH1-OD1 3.4Å; R420-D456 IonicContact NH1-OD2 3.45Å; R420-D456 PolarHBondContact NH1-OD2 2.58Å; R420-D456 IonicContact NH2-OD2 3.72Å; C452-D456 PolarHBondContact O-N 3.46Å; H454-D456 VanDerWaalsContact C-N 3.33Å; H454-D456 PolarHBondContact O-N 2.95Å; D456-L458 VanDerWaalsContact C-N 3.28Å; D456-L458 PolarHBondContact O-N 3.31Å; D456-H459 PolarHBondContact O-N 3.39Å; D456-H460 PolarHBondContact O-N 3.26Å
457	M	95.9	Very high	95.4	Very high	47 Å²	47	43 Å²	43	23%	0.232	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-43.2	177	-179.8	-176.5	59.3	0	0	110.7	R285 Q453 H454 H460 D461	R285-M457 HydrophobicContact CG-CE 3.97Å; R285-M457 HydrophobicContact CG-CG 4.41Å; R285-M457 HydrophobicContact CG-SD 3.8Å; R285-M457 PolarHBondContact NE-SD 3.19Å; R285-M457 WeakPolarHBondContact O-CE 3.18Å; Q453-M457 WeakPolarHBondContact O-CB 3.33Å; Q453-M457 PolarHBondContact O-N 3.09Å; H454-M457 VanDerWaalsContact CD2-CE 3.45Å; H454-M457 WeakPolarHBondContact CD2-CE 3.49Å; H454-M457 PolarHBondContact O-N 2.93Å; M457-H460 PolarHBondContact O-N 3.34Å; M457-D461 VanDerWaalsContact O-CB 3.27Å; M457-D461 WeakPolarHBondContact O-CB 3.48Å; M457-D461 PolarHBondContact O-N 3.33Å
458	L	95.2	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-44.1	176.5	-75.4	175.5	0	0	0	112.1	A282 L384 F388 L416 H454 L455 D456 H460 D461 L462	A282-L458 VanDerWaalsContact O-CD2 3.25Å; A282-L458 WeakPolarHBondContact O-CD2 3.41Å; L384-L458 HydrophobicContact CD1-CD1 4.18Å; L384-L458 HydrophobicContact CD2-CD1 3.75Å; F388-L458 HydrophobicContact CE2-CD1 4.24Å; F388-L458 HydrophobicContact CZ-CD1 4.2Å; F388-L458 HydrophobicContact CZ-CD2 4.13Å; L416-L458 HydrophobicContact CD1-CB 4.37Å; H454-L458 WeakPolarHBondContact NE2-CD1 3.41Å; H454-L458 WeakPolarHBondContact O-CG 3.38Å; H454-L458 PolarHBondContact O-N 2.81Å; L455-L458 PolarHBondContact O-N 2.84Å; D456-L458 VanDerWaalsContact C-N 3.28Å; D456-L458 PolarHBondContact O-N 3.31Å; L458-H460 VanDerWaalsContact C-N 3.33Å; L458-H460 PolarHBondContact O-N 2.86Å; L458-D461 PolarHBondContact O-N 3.2Å; L458-L462 VanDerWaalsContact O-CB 3.28Å; L458-L462 WeakPolarHBondContact O-CB 3.47Å; L458-L462 WeakPolarHBondContact O-CG 3.12Å; L458-L462 PolarHBondContact O-N 3.16Å
459	H	96.7	Very high	94.8	Very high	61 Å²	61	45 Å²	45	28%	0.282	23%	0.229	S	C	.	.	H	α-helix	trans	-58.6	-46.6	177.3	176	-104.2	0	0	0	111.1	V413 L416 L455 D456 S463	V413-H459 PolarHBondContact O-CD2 3.21Å; L416-H459 HydrophobicContact CB-CB 4Å; L416-H459 HydrophobicContact CD1-CB 4.13Å; L455-H459 WeakPolarHBondContact O-CB 3.27Å; L455-H459 PolarHBondContact O-N 3.32Å; D456-H459 PolarHBondContact O-N 3.39Å; H459-S463 VanDerWaalsContact O-CB 3.23Å; H459-S463 WeakPolarHBondContact O-CB 3.18Å; H459-S463 PolarHBondContact O-N 3.44Å; H459-S463 PolarHBondContact O-OG 3.17Å
460	H	95.9	Very high	94.6	Very high	132 Å²	132	41.9 Å²	41.9	61%	0.611	22%	0.216	S	C	*	.	H	α-helix	trans	-65.1	-45.2	177.8	-165.3	74.1	0	0	0	112	D456 M457 L458 S463 A464	D456-H460 PolarHBondContact O-N 3.26Å; M457-H460 PolarHBondContact O-N 3.34Å; L458-H460 VanDerWaalsContact C-N 3.33Å; L458-H460 PolarHBondContact O-N 2.86Å; H460-S463 PolarHBondContact O-N 3.19Å; H460-A464 PolarHBondContact O-N 2.99Å
461	D	94.9	Very high	94.2	Very high	9 Å²	9	44 Å²	44	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-45.4	-179.6	-165.4	57.4	0	0	0	112.2	A282 R285 M457 L458 A464 R465	A282-D461 WeakPolarHBondContact CA-OD2 3.15Å; R285-D461 VanDerWaalsContact CD-CG 3.48Å; R285-D461 IonicContact CZ-OD1 3.61Å; R285-D461 IonicContact NH1-OD1 3.81Å; R285-D461 PolarHBondContact NH1-OD1 3.27Å; M457-D461 VanDerWaalsContact O-CB 3.27Å; M457-D461 WeakPolarHBondContact O-CB 3.48Å; M457-D461 PolarHBondContact O-N 3.33Å; L458-D461 PolarHBondContact O-N 3.2Å; D461-A464 PolarHBondContact O-N 2.86Å; D461-R465 VanDerWaalsContact CG-NE 3.28Å; D461-R465 WeakPolarHBondContact O-CB 3.17Å; D461-R465 VanDerWaalsContact O-CG 3.24Å; D461-R465 WeakPolarHBondContact O-CG 3.23Å; D461-R465 PolarHBondContact O-N 3.19Å; D461-R465 IonicContact OD1-CZ 3.41Å; D461-R465 IonicContact OD1-NE 2.76Å; D461-R465 PolarHBondContact OD1-NE 3.38Å; D461-R465 IonicContact OD1-NH2 3.88Å; D461-R465 PolarHBondContact OD1-NH2 2.99Å; D461-R465 VanDerWaalsContact OD1-NH2 3.08Å; D461-R465 IonicContact OD2-CZ 2.8Å; D461-R465 IonicContact OD2-NE 3.19Å; D461-R465 PolarHBondContact OD2-NE 3.18Å; D461-R465 IonicContact OD2-NH2 2.73Å; D461-R465 PolarHBondContact OD2-NH2 2.96Å; D461-R465 VanDerWaalsContact OD2-NH2 3.12Å
462	L	94.8	Very high	93.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-39.5	176.8	-73.9	162.9	0	0	0	111.6	A282 F388 F412 V413 L416 L458 A464 R465 Y466	A282-L462 HydrophobicContact CB-CD2 3.43Å; A282-L462 VanDerWaalsContact CB-CD2 3.43Å; A282-L462 HydrophobicContact CB-CG 3.75Å; F388-L462 HydrophobicContact CE1-CD1 4.5Å; F412-L462 HydrophobicContact CD1-CD1 4.05Å; F412-L462 HydrophobicContact CE1-CD1 3.81Å; V413-L462 HydrophobicContact CG2-CB 3.91Å; L416-L462 HydrophobicContact CD1-CD1 3.52Å; L458-L462 VanDerWaalsContact O-CB 3.28Å; L458-L462 WeakPolarHBondContact O-CB 3.47Å; L458-L462 WeakPolarHBondContact O-CG 3.12Å; L458-L462 PolarHBondContact O-N 3.16Å; L462-A464 VanDerWaalsContact C-N 3.33Å; L462-A464 PolarHBondContact O-N 2.91Å; L462-R465 PolarHBondContact O-N 2.68Å; L462-Y466 HydrophobicContact CB-CD2 4.4Å; L462-Y466 HydrophobicContact CD2-CD2 3.97Å; L462-Y466 HydrophobicContact CD2-CE2 3.56Å; L462-Y466 WeakPolarHBondContact O-CB 3.31Å; L462-Y466 VanDerWaalsContact O-CD2 3.32Å; L462-Y466 WeakPolarHBondContact O-CD2 3.3Å; L462-Y466 PolarHBondContact O-N 3.2Å
463	S	95.7	Very high	93	Very high	35 Å²	35	52.2 Å²	52.2	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-43.5	176	-61.6	0	0	0	0	111.6	H459 H460 E467	H459-S463 VanDerWaalsContact O-CB 3.23Å; H459-S463 WeakPolarHBondContact O-CB 3.18Å; H459-S463 PolarHBondContact O-N 3.44Å; H459-S463 PolarHBondContact O-OG 3.17Å; H460-S463 PolarHBondContact O-N 3.19Å; S463-E467 PolarHBondContact O-N 3.31Å; S463-E467 VanDerWaalsContact O-N 3.12Å
464	A	94.6	Very high	92.2	Very high	60 Å²	60	48.2 Å²	48.2	50%	0.496	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-43.8	176.8	0	0	0	0	0	112.5	H460 D461 L462 Y466 E467	H460-A464 PolarHBondContact O-N 2.99Å; D461-A464 PolarHBondContact O-N 2.86Å; L462-A464 VanDerWaalsContact C-N 3.33Å; L462-A464 PolarHBondContact O-N 2.91Å; A464-Y466 VanDerWaalsContact C-N 3.26Å; A464-Y466 PolarHBondContact O-N 3.47Å; A464-E467 PolarHBondContact O-N 3.44Å
465	R	92.1	Very high	91.3	Very high	78 Å²	78	50.2 Å²	50.2	29%	0.294	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-25.6	-179.5	-72.9	178.2	-166.2	-66.9	-11.3	113.8	R278 D461 L462	R278-R465 HydrophobicContact CB-CB 4.46Å; R278-R465 WeakPolarHBondContact CD-O 3.34Å; R278-R465 PolarHBondContact NH1-O 3.34Å; D461-R465 VanDerWaalsContact CG-NE 3.28Å; D461-R465 WeakPolarHBondContact O-CB 3.17Å; D461-R465 VanDerWaalsContact O-CG 3.24Å; D461-R465 WeakPolarHBondContact O-CG 3.23Å; D461-R465 PolarHBondContact O-N 3.19Å; D461-R465 IonicContact OD1-CZ 3.41Å; D461-R465 IonicContact OD1-NE 2.76Å; D461-R465 PolarHBondContact OD1-NE 3.38Å; D461-R465 IonicContact OD1-NH2 3.88Å; D461-R465 PolarHBondContact OD1-NH2 2.99Å; D461-R465 VanDerWaalsContact OD1-NH2 3.08Å; D461-R465 IonicContact OD2-CZ 2.8Å; D461-R465 IonicContact OD2-NE 3.19Å; D461-R465 PolarHBondContact OD2-NE 3.18Å; D461-R465 IonicContact OD2-NH2 2.73Å; D461-R465 PolarHBondContact OD2-NH2 2.96Å; D461-R465 VanDerWaalsContact OD2-NH2 3.12Å; L462-R465 PolarHBondContact O-N 2.68Å
466	Y	93	Very high	90.3	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	17.3	-178	-68.1	-61.7	0	0	0	113.3	V275 R278 E279 V409 L462 A464 D468 I469 L470	V275-Y466 HydrophobicContact CB-CE1 4.31Å; V275-Y466 HydrophobicContact CG1-CE1 3.58Å; V275-Y466 WeakPolarHBondContact CG1-OH 3.48Å; V275-Y466 PolarHBondContact O-OH 2.93Å; R278-Y466 HydrophobicContact CB-CE1 3.83Å; R278-Y466 HydrophobicContact CG-CE1 4.49Å; E279-Y466 WeakPolarHBondContact CB-OH 3.22Å; E279-Y466 PolarHBondContact N-OH 3.36Å; E279-Y466 VanDerWaalsContact N-OH 3.11Å; V409-Y466 HydrophobicContact CG1-CD1 4.09Å; V409-Y466 HydrophobicContact CG1-CD2 3.57Å; V409-Y466 HydrophobicContact CG1-CE2 4.03Å; V409-Y466 HydrophobicContact CG1-CG 3.57Å; V409-Y466 HydrophobicContact CG2-CD1 4.45Å; V409-Y466 HydrophobicContact CG2-CE1 4.24Å; V409-Y466 HydrophobicContact CG2-CE2 4.47Å; L462-Y466 HydrophobicContact CB-CD2 4.4Å; L462-Y466 HydrophobicContact CD2-CD2 3.97Å; L462-Y466 HydrophobicContact CD2-CE2 3.56Å; L462-Y466 WeakPolarHBondContact O-CB 3.31Å; L462-Y466 VanDerWaalsContact O-CD2 3.32Å; L462-Y466 WeakPolarHBondContact O-CD2 3.3Å; L462-Y466 PolarHBondContact O-N 3.2Å; A464-Y466 VanDerWaalsContact C-N 3.26Å; A464-Y466 PolarHBondContact O-N 3.47Å; Y466-D468 PolarHBondContact O-N 2.94Å; Y466-D468 VanDerWaalsContact O-N 3.15Å; Y466-I469 HydrophobicContact CD1-CD1 3.72Å; Y466-I469 HydrophobicContact CD1-CG1 4.32Å; Y466-I469 HydrophobicContact CE1-CD1 4.1Å; Y466-I469 PolarHBondContact O-N 3.16Å; Y466-L470 WeakPolarHBondContact O-CB 3.41Å; Y466-L470 VanDerWaalsContact O-CG 3.27Å; Y466-L470 WeakPolarHBondContact O-CG 3.27Å; Y466-L470 PolarHBondContact O-N 3.4Å
467	E	93.1	Very high	89.4	Confident	146 Å²	146	57.2 Å²	57.2	68%	0.682	30%	0.304	S	S	*	.	H	α-helix	trans	-49.4	-43.2	179.7	-176	179.8	-173.6	0	0	112.3	S463 A464 I469 G471	S463-E467 PolarHBondContact O-N 3.31Å; S463-E467 VanDerWaalsContact O-N 3.12Å; A464-E467 PolarHBondContact O-N 3.44Å; E467-I469 VanDerWaalsContact C-N 3.35Å; E467-I469 PolarHBondContact O-N 3.26Å; E467-G471 PolarHBondContact O-N 3.07Å
468	D	88.2	Confident	88.2	Confident	65 Å²	65	56.3 Å²	56.3	35%	0.348	30%	0.301	S	S	.	.	H	α-helix	trans	-66.5	-27.8	177.4	63.3	-32.3	0	0	0	114.8	R278 R402 Y466	R278-D468 IonicContact CZ-OD1 3.53Å; R278-D468 IonicContact CZ-OD2 2.68Å; R278-D468 VanDerWaalsContact NH1-CG 3.28Å; R278-D468 IonicContact NH1-OD1 3.22Å; R278-D468 PolarHBondContact NH1-OD1 3.01Å; R278-D468 IonicContact NH1-OD2 2.73Å; R278-D468 PolarHBondContact NH1-OD2 3.25Å; R278-D468 VanDerWaalsContact NH1-OD2 3.08Å; R278-D468 IonicContact NH2-OD1 3.13Å; R278-D468 IonicContact NH2-OD2 2.89Å; R278-D468 PolarHBondContact NH2-OD2 2.9Å; R402-D468 PolarHBondContact NH2-O 2.96Å; Y466-D468 PolarHBondContact O-N 2.94Å; Y466-D468 VanDerWaalsContact O-N 3.15Å
469	I	89.4	Confident	87	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-88.8	-43.3	177.1	-60.5	-171.9	0	0	0	110.4	V275 T405 K406 Y466 E467 M472	V275-I469 HydrophobicContact CG1-CD1 4.49Å; V275-I469 HydrophobicContact CG2-CD1 3.77Å; T405-I469 HydrophobicContact CG2-CD1 4Å; T405-I469 HydrophobicContact CG2-CG2 4.47Å; K406-I469 HydrophobicContact CB-CG2 3.89Å; K406-I469 WeakPolarHBondContact CD-O 3.27Å; K406-I469 HydrophobicContact CG-CG2 4.27Å; K406-I469 WeakPolarHBondContact CG-O 3.25Å; Y466-I469 HydrophobicContact CD1-CD1 3.72Å; Y466-I469 HydrophobicContact CD1-CG1 4.32Å; Y466-I469 HydrophobicContact CE1-CD1 4.1Å; Y466-I469 PolarHBondContact O-N 3.16Å; E467-I469 VanDerWaalsContact C-N 3.35Å; E467-I469 PolarHBondContact O-N 3.26Å; I469-M472 WeakPolarHBondContact O-CB 3.44Å; I469-M472 PolarHBondContact O-N 3.26Å
470	L	90.6	Very high	85.8	Confident	46 Å²	46	62.8 Å²	62.8	24%	0.241	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-42.5	179.2	-65.5	176.5	0	0	0	110.7	K406 V409 C410 V413 Y466 M472	K406-L470 WeakPolarHBondContact CE-O 3.5Å; K406-L470 PolarHBondContact NZ-O 3.24Å; V409-L470 HydrophobicContact CG1-CD2 4.12Å; C410-L470 HydrophobicContact CB-CD2 4.33Å; C410-L470 WeakPolarHBondContact SG-CD2 3.35Å; V413-L470 HydrophobicContact CG1-CD1 4.49Å; Y466-L470 WeakPolarHBondContact O-CB 3.41Å; Y466-L470 VanDerWaalsContact O-CG 3.27Å; Y466-L470 WeakPolarHBondContact O-CG 3.27Å; Y466-L470 PolarHBondContact O-N 3.4Å; L470-M472 VanDerWaalsContact C-N 3.33Å
471	G	88.4	Confident	84.5	Confident	58 Å²	58	60.9 Å²	60.9	60%	0.598	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.2	178.3	0	0	0	0	0	115.2	E467 E473	E467-G471 PolarHBondContact O-N 3.07Å; G471-E473 PolarHBondContact O-N 3.41Å
472	M	85.7	Confident	83.4	Confident	13 Å²	13	68.4 Å²	68.4	6%	0.064	37%	0.371	C	S	.	.			trans	-65.4	116.8	179.2	175.2	-174.9	57.5	0	0	111	R402 K406 I469 L470 V474 M531	R402-M472 HydrophobicContact CB-CE 4.33Å; R402-M472 HydrophobicContact CB-SD 4.18Å; R402-M472 WeakPolarHBondContact CD-SD 3.4Å; R402-M472 HydrophobicContact CG-CE 3.78Å; R402-M472 HydrophobicContact CG-SD 3.49Å; R402-M472 WeakPolarHBondContact CG-SD 3.38Å; R402-M472 VanDerWaalsContact CZ-SD 3.56Å; R402-M472 PolarHBondContact NE-SD 2.86Å; R402-M472 WeakPolarHBondContact O-CE 3.45Å; K406-M472 HydrophobicContact CB-CE 3.62Å; K406-M472 HydrophobicContact CD-CB 4.46Å; K406-M472 HydrophobicContact CD-CE 3.65Å; K406-M472 HydrophobicContact CG-CE 4.16Å; K406-M472 PolarHBondContact NZ-O 2.82Å; I469-M472 WeakPolarHBondContact O-CB 3.44Å; I469-M472 PolarHBondContact O-N 3.26Å; L470-M472 VanDerWaalsContact C-N 3.33Å; M472-V474 HydrophobicContact CE-CG2 3.62Å; M472-V474 HydrophobicContact CG-CG2 4.38Å; M472-V474 PolarHBondContact O-N 3.39Å; M472-V474 HydrophobicContact SD-CG2 4.33Å; M472-M531 HydrophobicContact CG-CE 4.2Å; M472-M531 HydrophobicContact SD-CE 4.15Å
473	E	82.7	Confident	81.8	Confident	170 Å²	170	70 Å²	70	79%	0.794	38%	0.382	S	S	*	.			trans	-73	126.1	171.3	-64.9	-175.3	171.4	0	0	110.3	G471 M531	G471-E473 PolarHBondContact O-N 3.41Å; E473-M531 VanDerWaalsContact O-CE 3.23Å; E473-M531 WeakPolarHBondContact O-CE 3.39Å
474	V	78.8	Confident	79.8	Confident	28 Å²	28	69.6 Å²	69.6	17%	0.17	38%	0.381	C	S	.	.			trans	-110.6	113.9	173.2	-177.8	0	0	0	0	106.3	I403 K406 M472 S476 V478 I479	I403-V474 HydrophobicContact CD1-CG1 3.76Å; I403-V474 HydrophobicContact CG1-CG1 4.02Å; I403-V474 HydrophobicContact CG1-CG2 4.18Å; I403-V474 HydrophobicContact CG2-CG1 4.08Å; I403-V474 HydrophobicContact CG2-CG2 4.47Å; K406-V474 HydrophobicContact CD-CG2 4.11Å; M472-V474 HydrophobicContact CE-CG2 3.62Å; M472-V474 HydrophobicContact CG-CG2 4.38Å; M472-V474 PolarHBondContact O-N 3.39Å; M472-V474 HydrophobicContact SD-CG2 4.33Å; V474-S476 PolarHBondContact O-N 2.91Å; V474-V478 HydrophobicContact CG1-CB 4.18Å; V474-V478 HydrophobicContact CG1-CG1 4.38Å; V474-I479 HydrophobicContact CB-CD1 4.33Å; V474-I479 HydrophobicContact CG1-CD1 3.87Å; V474-I479 HydrophobicContact CG1-CG1 3.79Å
475	P	78.2	Confident	77.7	Confident	47 Å²	47	69 Å²	69	31%	0.305	38%	0.376	S	S	.	.			trans	-56.4	138	175.4	-23.4	32.9	0	0	0	110.7	W477 V478	P475-W477 VanDerWaalsContact C-N 3.26Å; P475-W477 VanDerWaalsContact CB-CD1 3.43Å; P475-W477 HydrophobicContact CB-CG 4.26Å; P475-W477 PolarHBondContact O-N 3.04Å; P475-V478 HydrophobicContact CB-CG2 4.1Å; P475-V478 HydrophobicContact CG-CG2 4.32Å; P475-V478 WeakPolarHBondContact O-CB 3.4Å; P475-V478 PolarHBondContact O-N 2.95Å
476	S	76.6	Confident	75.6	Confident	59 Å²	59	70.8 Å²	70.8	41%	0.413	39%	0.391	S	S	.	.	H	α-helix	trans	-57.5	-39	-174.9	55.8	0	0	0	0	112.7	V474 V478 I479 D480 S483	V474-S476 PolarHBondContact O-N 2.91Å; S476-V478 PolarHBondContact O-N 3.02Å; S476-I479 PolarHBondContact O-N 2.63Å; S476-D480 PolarHBondContact O-N 2.86Å; S476-S483 WeakPolarHBondContact CB-OG 3.44Å; S476-S483 PolarHBondContact O-OG 3.48Å; S476-S483 VanDerWaalsContact O-OG 3.11Å
477	W	77.6	Confident	73.4	Confident	142 Å²	142	73.3 Å²	73.3	54%	0.538	41%	0.412	S	S	.	.	H	α-helix	trans	-57.3	-23.1	177.4	66.6	-98.4	0	0	0	114.5	P475 D480 S481 A484	P475-W477 VanDerWaalsContact C-N 3.26Å; P475-W477 VanDerWaalsContact CB-CD1 3.43Å; P475-W477 HydrophobicContact CB-CG 4.26Å; P475-W477 PolarHBondContact O-N 3.04Å; W477-D480 VanDerWaalsContact CA-O 3.26Å; W477-D480 WeakPolarHBondContact CA-O 3.23Å; W477-D480 CarbonylContact O-C 3.47Å; W477-S481 WeakPolarHBondContact O-CA 3.31Å; W477-S481 PolarHBondContact O-N 3.16Å; W477-S481 PolarHBondContact O-OG 2.72Å; W477-A484 HydrophobicContact CB-CB 3.58Å
478	V	69	Low	71.3	Confident	27 Å²	27	68.3 Å²	68.3	16%	0.164	40%	0.396	C	S	.	.	H	α-helix	trans	-77.2	-33.3	178.3	-179.9	0	0	0	0	111.5	I403 V474 P475 S476 I530	I403-V478 HydrophobicContact CD1-CB 4.33Å; I403-V478 HydrophobicContact CD1-CG1 3.21Å; V474-V478 HydrophobicContact CG1-CB 4.18Å; V474-V478 HydrophobicContact CG1-CG1 4.38Å; P475-V478 HydrophobicContact CB-CG2 4.1Å; P475-V478 HydrophobicContact CG-CG2 4.32Å; P475-V478 WeakPolarHBondContact O-CB 3.4Å; P475-V478 PolarHBondContact O-N 2.95Å; S476-V478 PolarHBondContact O-N 3.02Å; V478-I530 HydrophobicContact CG1-CB 4.32Å; V478-I530 HydrophobicContact CG1-CD1 4.01Å; V478-I530 HydrophobicContact CG1-CG2 3.48Å; V478-I530 VanDerWaalsContact CG1-CG2 3.48Å; V478-I530 HydrophobicContact CG2-CG2 4.2Å
479	I	70.2	Confident	69.2	Low	122 Å²	122	70.3 Å²	70.3	63%	0.626	40%	0.403	S	S	*	.	H	α-helix	trans	-85	-41.2	178.6	-60.5	175	0	0	0	109.8	I403 V474 S476	I403-I479 HydrophobicContact CG2-CD1 4.46Å; I403-I479 HydrophobicContact CG2-CG1 4.12Å; V474-I479 HydrophobicContact CB-CD1 4.33Å; V474-I479 HydrophobicContact CG1-CD1 3.87Å; V474-I479 HydrophobicContact CG1-CG1 3.79Å; S476-I479 PolarHBondContact O-N 2.63Å
480	D	72.2	Confident	66.8	Low	76 Å²	76	75.9 Å²	75.9	41%	0.406	43%	0.432	S	S	.	.			trans	-139.3	105.1	176.4	174.2	7.8	0	0	0	108.3	S476 W477 F482 S483	S476-D480 PolarHBondContact O-N 2.86Å; W477-D480 VanDerWaalsContact CA-O 3.26Å; W477-D480 WeakPolarHBondContact CA-O 3.23Å; W477-D480 CarbonylContact O-C 3.47Å; D480-F482 PolarHBondContact O-N 3.23Å; D480-F482 WeakPolarHBondContact OD1-CA 3.4Å; D480-F482 WeakPolarHBondContact OD1-CB 3.33Å; D480-F482 PolarHBondContact OD1-N 3.42Å; D480-S483 VanDerWaalsContact CG-N 3.33Å; D480-S483 WeakPolarHBondContact O-CB 3.22Å; D480-S483 PolarHBondContact O-N 2.73Å; D480-S483 PolarHBondContact O-OG 3.19Å; D480-S483 PolarHBondContact OD1-N 3.15Å; D480-S483 WeakPolarHBondContact OD2-CB 3.47Å; D480-S483 PolarHBondContact OD2-N 3.45Å
481	S	69.1	Low	64.3	Low	92 Å²	92	81.4 Å²	81.4	64%	0.643	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.5	179.5	-54.1	0	0	0	0	113.5	W477	W477-S481 WeakPolarHBondContact O-CA 3.31Å; W477-S481 PolarHBondContact O-N 3.16Å; W477-S481 PolarHBondContact O-OG 2.72Å
482	F	72.3	Confident	61.9	Low	167 Å²	167	83.9 Å²	83.9	73%	0.732	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-17.2	175.3	-56.2	-77.6	0	0	0	113	D480 A484 A485	D480-F482 PolarHBondContact O-N 3.23Å; D480-F482 WeakPolarHBondContact OD1-CA 3.4Å; D480-F482 WeakPolarHBondContact OD1-CB 3.33Å; D480-F482 PolarHBondContact OD1-N 3.42Å; F482-A484 PolarHBondContact O-N 3.43Å; F482-A485 WeakPolarHBondContact O-CB 3.02Å; F482-A485 PolarHBondContact O-N 3.42Å
483	S	60.8	Low	59.3	Low	33 Å²	33	90.1 Å²	90.1	23%	0.231	49%	0.485	C	S	.	.	H	α-helix	trans	-66.8	-24	177.3	67.9	0	0	0	0	113.6	S476 D480 A485	S476-S483 WeakPolarHBondContact CB-OG 3.44Å; S476-S483 PolarHBondContact O-OG 3.48Å; S476-S483 VanDerWaalsContact O-OG 3.11Å; D480-S483 VanDerWaalsContact CG-N 3.33Å; D480-S483 WeakPolarHBondContact O-CB 3.22Å; D480-S483 PolarHBondContact O-N 2.73Å; D480-S483 PolarHBondContact O-OG 3.19Å; D480-S483 PolarHBondContact OD1-N 3.15Å; D480-S483 WeakPolarHBondContact OD2-CB 3.47Å; D480-S483 PolarHBondContact OD2-N 3.45Å; S483-A485 VanDerWaalsContact C-N 3.3Å
484	A	52.6	Low	57	Low	26 Å²	26	90.9 Å²	90.9	22%	0.215	49%	0.489	C	S	.	.	H	α-helix	trans	-80.7	-10.5	170.8	0	0	0	0	0	113.3	W477 F482 D486 A487 A488	W477-A484 HydrophobicContact CB-CB 3.58Å; F482-A484 PolarHBondContact O-N 3.43Å; A484-D486 VanDerWaalsContact C-N 3.27Å; A484-D486 PolarHBondContact O-N 3.29Å; A484-A487 PolarHBondContact O-N 2.87Å; A484-A488 WeakPolarHBondContact O-CB 3.46Å; A484-A488 PolarHBondContact O-N 3.02Å
485	A	51.7	Low	54.7	Low	48 Å²	48	90.9 Å²	90.9	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-39.6	169.5	0	0	0	0	0	109.8	F482 S483 A487 A488 E489	F482-A485 WeakPolarHBondContact O-CB 3.02Å; F482-A485 PolarHBondContact O-N 3.42Å; S483-A485 VanDerWaalsContact C-N 3.3Å; A485-A487 PolarHBondContact O-N 3.43Å; A485-A488 PolarHBondContact O-N 2.95Å; A485-E489 WeakPolarHBondContact O-CA 3.45Å; A485-E489 WeakPolarHBondContact O-CB 3.16Å; A485-E489 PolarHBondContact O-N 3.36Å
486	D	47.9	Very low	52.2	Low	115 Å²	115	100.8 Å²	100.8	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-68.8	-34	177.4	-69.7	-21.1	0	0	0	113	A484 L490	A484-D486 VanDerWaalsContact C-N 3.27Å; A484-D486 PolarHBondContact O-N 3.29Å; D486-L490 PolarHBondContact O-N 3.17Å; D486-L490 VanDerWaalsContact O-N 3.16Å
487	A	47.1	Very low	49.7	Very low	54 Å²	54	101 Å²	101	45%	0.446	54%	0.537	S	S	.	.	H	α-helix	trans	-74.8	-40.1	176.2	0	0	0	0	0	112	A484 A485 L490 E491	A484-A487 PolarHBondContact O-N 2.87Å; A485-A487 PolarHBondContact O-N 3.43Å; A487-L490 PolarHBondContact O-N 2.89Å; A487-E491 PolarHBondContact O-N 2.93Å
488	A	48.9	Very low	47.3	Very low	41 Å²	41	100.7 Å²	100.7	34%	0.339	55%	0.551	S	S	.	*	H	α-helix	trans	-71.8	-30.9	174.5	0	0	0	0	0	111.6	A484 A485 L490 E491 L492	A484-A488 WeakPolarHBondContact O-CB 3.46Å; A484-A488 PolarHBondContact O-N 3.02Å; A485-A488 PolarHBondContact O-N 2.95Å; A488-L490 VanDerWaalsContact C-N 3.35Å; A488-E491 CarbonylContact O-C 3.53Å; A488-E491 PolarHBondContact O-N 3.24Å; A488-L492 HydrophobicContact CB-CD1 4.42Å; A488-L492 WeakPolarHBondContact O-CB 3.49Å; A488-L492 WeakPolarHBondContact O-CD1 3.44Å; A488-L492 WeakPolarHBondContact O-CG 3.19Å; A488-L492 PolarHBondContact O-N 3.41Å
489	E	42.3	Very low	45.2	Very low	106 Å²	106	105.1 Å²	105.1	50%	0.495	58%	0.584	S	S	.	*	H	α-helix	trans	-73.1	-28.6	176.2	-166.4	157.4	-164.3	0	0	111.1	A485 Q493	A485-E489 WeakPolarHBondContact O-CA 3.45Å; A485-E489 WeakPolarHBondContact O-CB 3.16Å; A485-E489 PolarHBondContact O-N 3.36Å; E489-Q493 HydrophobicContact CG-CG 4.38Å; E489-Q493 WeakPolarHBondContact O-CB 3.47Å; E489-Q493 WeakPolarHBondContact O-CG 3.39Å; E489-Q493 PolarHBondContact O-N 3.02Å
490	L	40.2	Very low	43.2	Very low	123 Å²	123	102.9 Å²	102.9	64%	0.644	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-34.2	167	-84.4	161.9	0	0	0	112.9	D486 A487 A488	D486-L490 PolarHBondContact O-N 3.17Å; D486-L490 VanDerWaalsContact O-N 3.16Å; A487-L490 PolarHBondContact O-N 2.89Å; A488-L490 VanDerWaalsContact C-N 3.35Å
491	E	37.9	Very low	41.2	Very low	162 Å²	162	104.8 Å²	104.8	76%	0.757	61%	0.607	S	S	*	*	H	α-helix	trans	-78.7	-34	174	-69.5	-172.1	164.6	0	0	112.5	A487 A488	A487-E491 PolarHBondContact O-N 2.93Å; A488-E491 CarbonylContact O-C 3.53Å; A488-E491 PolarHBondContact O-N 3.24Å
492	L	37.1	Very low	39.1	Very low	111 Å²	111	110.8 Å²	110.8	58%	0.581	62%	0.616	S	S	*	*	H	α-helix	trans	-84	-17.4	179	-69.8	165.6	0	0	0	113.1	A488 Q494 G495	A488-L492 HydrophobicContact CB-CD1 4.42Å; A488-L492 WeakPolarHBondContact O-CB 3.49Å; A488-L492 WeakPolarHBondContact O-CD1 3.44Å; A488-L492 WeakPolarHBondContact O-CG 3.19Å; A488-L492 PolarHBondContact O-N 3.41Å; L492-Q494 PolarHBondContact O-N 3.26Å; L492-G495 CarbonylContact O-C 3.54Å; L492-G495 VanDerWaalsContact O-CA 3.26Å; L492-G495 WeakPolarHBondContact O-CA 3.45Å; L492-G495 PolarHBondContact O-N 3.48Å
493	Q	32.8	Very low	37	Very low	143 Å²	143	109.2 Å²	109.2	67%	0.668	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-19	170.1	-86.3	175.4	18.3	0	0	112.5	E489 G495	E489-Q493 HydrophobicContact CG-CG 4.38Å; E489-Q493 WeakPolarHBondContact O-CB 3.47Å; E489-Q493 WeakPolarHBondContact O-CG 3.39Å; E489-Q493 PolarHBondContact O-N 3.02Å; Q493-G495 VanDerWaalsContact C-N 3.29Å
494	Q	33.1	Very low	35.2	Very low	187 Å²	187	116.8 Å²	116.8	87%	0.874	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-1.9	165.4	-62	-162	8	0	0	113.1	L492	L492-Q494 PolarHBondContact O-N 3.26Å
495	G	30	Very low	34	Very low	28 Å²	28	125.1 Å²	125.1	29%	0.289	68%	0.678	S	S	.	*	S	Bend	trans	-139	65	-163	0	0	0	0	0	113.2	L492 Q493	L492-G495 CarbonylContact O-C 3.54Å; L492-G495 VanDerWaalsContact O-CA 3.26Å; L492-G495 WeakPolarHBondContact O-CA 3.45Å; L492-G495 PolarHBondContact O-N 3.48Å; Q493-G495 VanDerWaalsContact C-N 3.29Å
496	W	26.7	Very low	32.8	Very low	254 Å²	254	128.1 Å²	128.1	96%	0.962	69%	0.693	S	S	*	*			trans	84.9	126.7	157.3	-60.3	41.3	0	0	0	117.3
497	G	24.3	Very low	31.9	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	70%	0.704	S	S	*	*			trans	-78.1	172.7	173.5	0	0	0	0	0	114.4
498	T	26.7	Very low	30.9	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	72%	0.719	S	S	*	*			trans	84.3	92.2	164.3	67.1	0	0	0	0	118.2
499	S	26	Very low	29.5	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	75%	0.746	S	S	*	*				62.5	121	119.4	66	0	0	0	0	121.2
500	G	27.7	Very low	28.8	Very low	75 Å²	75	148.1 Å²	148.1	77%	0.773	77%	0.766	S	S	*	*			trans	179.5	123.2	151	0	0	0	0	0	112.1
501	P	28.9	Very low	27.9	Very low	115 Å²	115	145.4 Å²	145.4	75%	0.747	77%	0.768	S	S	*	*			trans	-97.8	172.3	-176.3	37.5	-31.4	0	0	0	112.7
502	R	25.8	Very low	27.2	Very low	219 Å²	219	145.8 Å²	145.8	83%	0.826	78%	0.775	S	S	*	*			trans	108.9	141.4	161.9	-68.1	-176.7	-166.4	-168.4	3.4	114.8
503	D	27.9	Very low	26.7	Very low	134 Å²	134	149.9 Å²	149.9	72%	0.717	79%	0.791	S	S	*	*			cis	-153.9	153	10.4	-95	-35.3	0	0	0	109.9
504	H	24	Very low	26.2	Very low	192 Å²	192	147.7 Å²	147.7	89%	0.889	80%	0.797	S	S	*	*			trans	-78.7	136.8	173.8	-74.5	-63	0	0	0	112.4
505	F	27	Very low	25.7	Very low	201 Å²	201	150.6 Å²	150.6	88%	0.882	80%	0.8	S	S	*	*			trans	-124.4	139.5	161.4	-92.7	-86.8	0	0	0	111.4
506	P	27	Very low	25.4	Very low	110 Å²	110	157.2 Å²	157.2	71%	0.714	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-92.1	164.5	-171.7	36.5	-34.1	0	0	0	114
507	P	28.1	Very low	25.1	Very low	129 Å²	129	155.9 Å²	155.9	84%	0.838	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-89.2	133.2	-170.2	32.8	-32.2	0	0	0	114
508	T	25.8	Very low	25.1	Very low	124 Å²	124	160 Å²	160	76%	0.761	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-90.1	128.6	173	36.8	0	0	0	0	113
509	R	20.5	Very low	24.9	Very low	245 Å²	245	157.9 Å²	157.9	93%	0.925	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-80.1	125	178.3	-160.9	-177.8	-159	-177.1	5.5	109.9
510	W	26.8	Very low	25	Very low	239 Å²	239	156.8 Å²	156.8	91%	0.905	81%	0.805	S	S	*	*			trans	-122.8	137.4	172.6	-76.5	86	0	0	0	111.9
511	G	22.7	Very low	25.3	Very low	66 Å²	66	157.8 Å²	157.8	68%	0.68	79%	0.789	S	S	*	*			trans	-90.6	164.2	-163.9	0	0	0	0	0	115.5
512	N	21.3	Very low	25.4	Very low	169 Å²	169	153 Å²	153	90%	0.904	76%	0.758	S	S	*	*			trans	-61.1	129	-179.8	-66.5	-40.4	0	0	0	113
513	H	27.4	Very low	25.8	Very low	198 Å²	198	144.2 Å²	144.2	92%	0.917	73%	0.727	S	S	*	*			trans	-120.4	154	161.8	-91.6	-79.2	0	0	0	112.5
514	A	23.1	Very low	26.2	Very low	96 Å²	96	138.2 Å²	138.2	79%	0.793	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-77.9	160.7	-147.4	0	0	0	0	0	117
515	R	21.9	Very low	26.6	Very low	249 Å²	249	129.2 Å²	129.2	94%	0.94	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.7	129	-178.3	-61.4	169.1	-176.3	175.1	-1.2	113.1
516	M	23.8	Very low	27.4	Very low	166 Å²	166	120.1 Å²	120.1	82%	0.818	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-103.1	137.3	158	-103.1	176.8	172.4	0	0	109.9
517	R	20.7	Very low	27.7	Very low	226 Å²	226	115 Å²	115	85%	0.853	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-101.7	153.7	171.3	-78	-175.6	-178.2	177.4	0.7	109.5
518	D	23.1	Very low	28	Very low	151 Å²	151	110.5 Å²	110.5	81%	0.807	55%	0.549	S	S	*	.	S	Bend	trans	71.6	74.2	155.7	-53.1	-27.7	0	0	0	118
519	S	24.3	Very low	28.1	Very low	91 Å²	91	108.5 Å²	108.5	64%	0.636	53%	0.529	S	S	*	.			trans	-177.9	106.8	139.4	164.9	0	0	0	0	105.8	K521	S519-K521 PolarHBondContact O-N 2.89Å
520	V	26.8	Very low	28.3	Very low	97 Å²	97	100.7 Å²	100.7	59%	0.588	51%	0.505	S	S	*	.			trans	-76	90.6	-172.6	-179.2	0	0	0	0	108.7	L337	L337-V520 HydrophobicContact CB-CG1 3.24Å; L337-V520 HydrophobicContact CD1-CG1 4.45Å; L337-V520 HydrophobicContact CG-CG1 4.47Å; L337-V520 WeakPolarHBondContact O-CG1 3.48Å
521	K	33.6	Very low	28.1	Very low	97 Å²	97	94.4 Å²	94.4	42%	0.422	49%	0.487	S	S	.	.			trans	-67.2	139.5	176	-68.6	177.9	177.1	179.3	0	110.7	S519 D523	S519-K521 PolarHBondContact O-N 2.89Å; K521-D523 VanDerWaalsContact C-N 3.34Å; K521-D523 PolarHBondContact O-N 2.95Å
522	C	31.9	Very low	28.3	Very low	15 Å²	15	105.8 Å²	105.8	10%	0.101	51%	0.51	C	S	.	.			trans	-66.2	99.9	154.7	-174.8	0	0	0	0	107.3	Q178 C274 L337 C524	Q178-C522 PolarHBondContact NE2-O 3.36Å; C274-C522 PolarHBondContact SG-SG 2.97Å; L337-C522 HydrophobicContact CD1-CB 4.05Å; C522-C524 HydrophobicContact CB-CB 4.49Å; C522-C524 WeakPolarHBondContact CB-SG 3.48Å; C522-C524 PolarHBondContact O-N 3.19Å; C522-C524 PolarHBondContact O-SG 3.01Å; C522-C524 VanDerWaalsContact O-SG 3.39Å; C522-C524 WeakPolarHBondContact SG-CB 3.17Å; C522-C524 CovalentContact SG-SG 2.07Å; C522-C524 PolarHBondContact SG-SG 2.59Å
523	D	34.5	Very low	28.7	Very low	34 Å²	34	102.7 Å²	102.7	18%	0.182	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-73	17.1	177.5	-84.8	-27.2	0	0	0	113.5	K521 G525 K526	K521-D523 VanDerWaalsContact C-N 3.34Å; K521-D523 PolarHBondContact O-N 2.95Å; D523-G525 VanDerWaalsContact C-N 3.28Å; D523-G525 PolarHBondContact O-N 2.65Å; D523-K526 HydrophobicContact CB-CD 3.93Å; D523-K526 WeakPolarHBondContact O-CB 3.49Å; D523-K526 VanDerWaalsContact O-CG 3.3Å; D523-K526 WeakPolarHBondContact O-CG 3.33Å; D523-K526 PolarHBondContact O-N 2.87Å; D523-K526 WeakPolarHBondContact OD1-CE 3.26Å; D523-K526 IonicContact OD1-NZ 3.75Å; D523-K526 PolarHBondContact OD1-NZ 3.33Å; D523-K526 IonicContact OD2-NZ 2.78Å; D523-K526 PolarHBondContact OD2-NZ 3.46Å
524	C	35.7	Very low	28.8	Very low	7 Å²	7	97.6 Å²	97.6	5%	0.047	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-68	-18.8	-177.6	49.2	0	0	0	0	115.2	C274 C522 K526 L527	C274-C524 HydrophobicContact CB-CB 3.64Å; C274-C524 WeakPolarHBondContact SG-CB 3.39Å; C522-C524 HydrophobicContact CB-CB 4.49Å; C522-C524 WeakPolarHBondContact CB-SG 3.48Å; C522-C524 PolarHBondContact O-N 3.19Å; C522-C524 PolarHBondContact O-SG 3.01Å; C522-C524 VanDerWaalsContact O-SG 3.39Å; C522-C524 WeakPolarHBondContact SG-CB 3.17Å; C522-C524 CovalentContact SG-SG 2.07Å; C522-C524 PolarHBondContact SG-SG 2.59Å; C524-K526 PolarHBondContact O-N 2.66Å; C524-L527 VanDerWaalsContact O-CD1 3.32Å; C524-L527 WeakPolarHBondContact O-CD1 3.41Å
525	G	33.4	Very low	29.1	Very low	3 Å²	3	97.7 Å²	97.7	3%	0.031	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-79.3	7.5	173.4	0	0	0	0	0	114.3	Q178 R196 D523 L527	Q178-G525 VanDerWaalsContact OE1-CA 3.3Å; R196-G525 WeakPolarHBondContact CD-O 3.4Å; R196-G525 PolarHBondContact NE-O 2.96Å; R196-G525 VanDerWaalsContact NE-O 3.15Å; D523-G525 VanDerWaalsContact C-N 3.28Å; D523-G525 PolarHBondContact O-N 2.65Å; G525-L527 PolarHBondContact O-N 2.93Å
526	K	42.3	Very low	29.5	Very low	10 Å²	10	88.8 Å²	88.8	4%	0.043	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-64.5	-5.4	-177.2	-78.6	175.7	-176.1	169.4	0	116.1	R196 Q396 G397 N398 L400 D523 C524 F528	R196-K526 VanDerWaalsContact CZ-CA 3.45Å; R196-K526 VanDerWaalsContact NH1-CA 3.3Å; R196-K526 PolarHBondContact NH1-O 3.03Å; Q396-K526 PolarHBondContact O-NZ 2.78Å; Q396-K526 VanDerWaalsContact O-NZ 3.16Å; G397-K526 WeakPolarHBondContact O-CD 3.1Å; G397-K526 WeakPolarHBondContact O-CE 3.17Å; G397-K526 PolarHBondContact O-NZ 3.3Å; N398-K526 VanDerWaalsContact CA-NZ 3.32Å; N398-K526 PolarHBondContact OD1-NZ 3.37Å; L400-K526 HydrophobicContact CB-CB 3.85Å; L400-K526 HydrophobicContact CB-CD 4.25Å; L400-K526 HydrophobicContact CD2-CB 4.39Å; L400-K526 CarbonylContact O-C 2.97Å; L400-K526 WeakPolarHBondContact O-CB 3.34Å; D523-K526 HydrophobicContact CB-CD 3.93Å; D523-K526 WeakPolarHBondContact O-CB 3.49Å; D523-K526 VanDerWaalsContact O-CG 3.3Å; D523-K526 WeakPolarHBondContact O-CG 3.33Å; D523-K526 PolarHBondContact O-N 2.87Å; D523-K526 WeakPolarHBondContact OD1-CE 3.26Å; D523-K526 IonicContact OD1-NZ 3.75Å; D523-K526 PolarHBondContact OD1-NZ 3.33Å; D523-K526 IonicContact OD2-NZ 2.78Å; D523-K526 PolarHBondContact OD2-NZ 3.46Å; C524-K526 PolarHBondContact O-N 2.66Å; K526-F528 PolarHBondContact O-N 2.8Å
527	L	33.6	Very low	29.8	Very low	4 Å²	4	84 Å²	84	2%	0.021	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-78	-4.7	-157.1	-72.9	155.4	0	0	0	118.8	V272 V275 R402 T405 C524 G525	V272-L527 HydrophobicContact CG1-CD1 3.51Å; V275-L527 HydrophobicContact CG2-CD1 3.72Å; V275-L527 HydrophobicContact CG2-CD2 4.28Å; R402-L527 HydrophobicContact CB-CD2 4.12Å; R402-L527 WeakPolarHBondContact CB-O 3.5Å; R402-L527 HydrophobicContact CG-CD2 4.21Å; R402-L527 PolarHBondContact N-O 3.25Å; R402-L527 VanDerWaalsContact N-O 3.12Å; T405-L527 HydrophobicContact CG2-CD2 3.94Å; T405-L527 WeakPolarHBondContact OG1-CD2 3.43Å; C524-L527 VanDerWaalsContact O-CD1 3.32Å; C524-L527 WeakPolarHBondContact O-CD1 3.41Å; G525-L527 PolarHBondContact O-N 2.93Å
528	F	33.9	Very low	30.5	Very low	33 Å²	33	74.5 Å²	74.5	15%	0.145	37%	0.365	C	S	.	.			trans	-128.8	110.3	-161.4	-73.8	-79.7	0	0	0	116.6	A242 V270 V272 K526	A242-F528 HydrophobicContact CB-CD1 4.12Å; A242-F528 HydrophobicContact CB-CD2 4.38Å; A242-F528 HydrophobicContact CB-CE1 4.32Å; A242-F528 HydrophobicContact CB-CG 4.19Å; V270-F528 HydrophobicContact CG1-CE1 4.08Å; V270-F528 HydrophobicContact CG1-CZ 4.18Å; V272-F528 HydrophobicContact CB-CE2 3.92Å; V272-F528 HydrophobicContact CB-CZ 4.25Å; V272-F528 HydrophobicContact CG1-CE2 4.11Å; V272-F528 HydrophobicContact CG2-CE1 4.32Å; V272-F528 HydrophobicContact CG2-CE2 3.26Å; V272-F528 HydrophobicContact CG2-CZ 3.11Å; K526-F528 PolarHBondContact O-N 2.8Å
529	F	28.6	Very low	31	Very low	82 Å²	82	69.1 Å²	69.1	36%	0.36	33%	0.334	S	S	.	.				173.7	75.1	128	-113.4	-82.3	0	0	0	109.7	I198	I198-F529 HydrophobicContact CD1-CB 4.24Å; I198-F529 HydrophobicContact CD1-CD1 3.39Å; I198-F529 HydrophobicContact CD1-CD2 4.28Å; I198-F529 HydrophobicContact CD1-CE1 3.65Å; I198-F529 HydrophobicContact CD1-CG 3.73Å; I198-F529 HydrophobicContact CD1-CZ 4.21Å; I198-F529 HydrophobicContact CG1-CD1 4.21Å; I198-F529 HydrophobicContact CG1-CD2 4.22Å; I198-F529 HydrophobicContact CG1-CE1 4.39Å; I198-F529 HydrophobicContact CG1-CE2 4.41Å; I198-F529 HydrophobicContact CG1-CG 4.11Å; I198-F529 HydrophobicContact CG1-CZ 4.49Å
530	I	25.3	Very low	31.5	Very low	82 Å²	82	67.4 Å²	67.4	42%	0.421	31%	0.311	S	S	.	.			trans	-149.5	93.7	154.2	-49.7	173.9	0	0	0	107.6	I403 V478	I403-I530 HydrophobicContact CD1-CB 4.3Å; I403-I530 HydrophobicContact CD1-CD1 3.85Å; V478-I530 HydrophobicContact CG1-CB 4.32Å; V478-I530 HydrophobicContact CG1-CD1 4.01Å; V478-I530 HydrophobicContact CG1-CG2 3.48Å; V478-I530 VanDerWaalsContact CG1-CG2 3.48Å; V478-I530 HydrophobicContact CG2-CG2 4.2Å
531	M	22.9	Very low	31.9	Very low	107 Å²	107	64.9 Å²	64.9	53%	0.527	29%	0.288	S	S	.	.			trans	166.4	80.2	155.3	-95.2	-170.7	-108.8	0	0	108.2	M472 E473	M472-M531 HydrophobicContact CG-CE 4.2Å; M472-M531 HydrophobicContact SD-CE 4.15Å; E473-M531 VanDerWaalsContact O-CE 3.23Å; E473-M531 WeakPolarHBondContact O-CE 3.39Å
532	R	26.9	Very low	31.7	Very low	305 Å²	305	62 Å²	62	100%	1.151	28%	0.275	S	S	*	.			trans	-151.3	0	137.1	-117.2	-173.1	-173.2	-172.2	3.7	108.4

Retrieved 532 of 532 residues in 3396.4 ms (Link to these results)

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