A0A087YCH6_POEFO Loading...

Gap junction protein

One gap junction consists of a cluster of closely packed pairs of transmembrane channels, the connexons, through which materials of low MW diffuse from one cell to a neighboring cell.

AlphaFold DB , UniProt , Accession A0A087YCH6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 226 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	W	40.9	Very low	54.2	Low	275 Å²	275	125 Å²	125	100%	1.042	62%	0.622	S	S	*	*				0	86.5	0	-71.4	88.3	0	0	0	107.4	T3	W1-T3 PolarHBondContact O-N 3.04Å
2	E	39.8	Very low	54.9	Low	192 Å²	192	121.5 Å²	121.5	90%	0.897	61%	0.607	S	S	*	*			trans	-57.8	139.3	170.4	-72.1	-172.9	155.8	0	0	109	M4	E2-M4 PolarHBondContact O-N 3.18Å
3	T	42.7	Very low	55.7	Low	132 Å²	132	115.5 Å²	115.5	81%	0.81	58%	0.577	S	S	*	*			trans	-47.3	106.9	-176.7	46.4	0	0	0	0	111.1	W1 N5	W1-T3 PolarHBondContact O-N 3.04Å; T3-N5 PolarHBondContact O-N 3.36Å
4	M	48.6	Very low	56.4	Low	126 Å²	126	112.1 Å²	112.1	62%	0.621	57%	0.57	S	S	*	*			trans	-57.4	109.1	162.5	-169.6	153	64.9	0	0	106.6	E2 W6	E2-M4 PolarHBondContact O-N 3.18Å; M4-W6 VanDerWaalsContact O-CD1 3.28Å; M4-W6 PolarHBondContact O-N 3.22Å
5	N	56.9	Low	57	Low	110 Å²	110	105.6 Å²	105.6	59%	0.588	54%	0.542	S	S	*	.			trans	-70.6	93.7	-171.4	-166.7	-10	0	0	0	109	T3 G7 S8	T3-N5 PolarHBondContact O-N 3.36Å; N5-G7 PolarHBondContact O-N 3.03Å; N5-G7 VanDerWaalsContact O-N 3.09Å; N5-G7 PolarHBondContact OD1-N 3.26Å; N5-S8 WeakPolarHBondContact O-CB 3.47Å; N5-S8 PolarHBondContact O-N 2.93Å
6	W	60.1	Low	57.8	Low	148 Å²	148	99.9 Å²	99.9	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-53.4	-28.7	180	-68.8	97.6	0	0	0	112.5	M4 S8 L9 E10	M4-W6 VanDerWaalsContact O-CD1 3.28Å; M4-W6 PolarHBondContact O-N 3.22Å; W6-S8 VanDerWaalsContact C-N 3.34Å; W6-S8 PolarHBondContact O-N 3.41Å; W6-L9 HydrophobicContact CE3-CD2 4.1Å; W6-L9 HydrophobicContact CZ3-CD2 4.11Å; W6-L9 PolarHBondContact O-N 3.47Å; W6-E10 WeakPolarHBondContact O-CB 3.26Å; W6-E10 PolarHBondContact O-N 2.73Å
7	G	58	Low	58.7	Low	30 Å²	30	98.2 Å²	98.2	31%	0.309	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-36.7	174.5	0	0	0	0	0	113.3	N5 E10 V11	N5-G7 PolarHBondContact O-N 3.03Å; N5-G7 VanDerWaalsContact O-N 3.09Å; N5-G7 PolarHBondContact OD1-N 3.26Å; G7-E10 PolarHBondContact O-N 2.6Å; G7-V11 VanDerWaalsContact O-CG2 3.26Å; G7-V11 WeakPolarHBondContact O-CG2 3.37Å; G7-V11 PolarHBondContact O-N 3.27Å
8	S	57.5	Low	59.3	Low	66 Å²	66	101.3 Å²	101.3	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-39.5	175	-63.2	0	0	0	0	111.5	N5 W6 V11 L12	N5-S8 WeakPolarHBondContact O-CB 3.47Å; N5-S8 PolarHBondContact O-N 2.93Å; W6-S8 VanDerWaalsContact C-N 3.34Å; W6-S8 PolarHBondContact O-N 3.41Å; S8-V11 PolarHBondContact O-N 2.79Å; S8-L12 WeakPolarHBondContact O-CG 3.27Å; S8-L12 PolarHBondContact O-N 2.8Å
9	L	62.1	Low	59.7	Low	55 Å²	55	98.5 Å²	98.5	29%	0.288	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-40.3	176.5	-172.9	64.4	0	0	0	111.2	W6 L12 L13 F32	W6-L9 HydrophobicContact CE3-CD2 4.1Å; W6-L9 HydrophobicContact CZ3-CD2 4.11Å; W6-L9 PolarHBondContact O-N 3.47Å; L9-L12 PolarHBondContact O-N 3.25Å; L9-L13 HydrophobicContact CD1-CD1 4.41Å; L9-L13 HydrophobicContact CD1-CG 4.5Å; L9-L13 HydrophobicContact CG-CD1 3.87Å; L9-L13 HydrophobicContact CG-CG 4.39Å; L9-L13 WeakPolarHBondContact O-CB 3.39Å; L9-L13 WeakPolarHBondContact O-CG 3.42Å; L9-L13 PolarHBondContact O-N 2.92Å; L9-F32 HydrophobicContact CD2-CE2 3.87Å
10	E	65.2	Low	60.2	Low	139 Å²	139	94.4 Å²	94.4	65%	0.65	48%	0.479	S	S	*	.	H	α-helix	trans	-62.4	-43.2	175.5	-172.5	-178.4	178.5	0	0	112.3	W6 G7 L12 L13 S14	W6-E10 WeakPolarHBondContact O-CB 3.26Å; W6-E10 PolarHBondContact O-N 2.73Å; G7-E10 PolarHBondContact O-N 2.6Å; E10-L12 VanDerWaalsContact C-N 3.33Å; E10-L12 PolarHBondContact O-N 2.99Å; E10-L13 PolarHBondContact O-N 3.3Å; E10-S14 WeakPolarHBondContact O-CB 3.35Å; E10-S14 PolarHBondContact O-N 2.83Å; E10-S14 PolarHBondContact O-OG 3.16Å
11	V	63.9	Low	61.1	Low	102 Å²	102	91.2 Å²	91.2	62%	0.618	46%	0.464	S	S	*	.	H	α-helix	trans	-63.6	-39.3	175.1	170.9	0	0	0	0	111.3	G7 S8 S14 G15	G7-V11 VanDerWaalsContact O-CG2 3.26Å; G7-V11 WeakPolarHBondContact O-CG2 3.37Å; G7-V11 PolarHBondContact O-N 3.27Å; S8-V11 PolarHBondContact O-N 2.79Å; V11-S14 WeakPolarHBondContact CA-OG 3.03Å; V11-S14 PolarHBondContact O-OG 3.13Å; V11-G15 PolarHBondContact O-N 3.38Å
12	L	63	Low	62.8	Low	83 Å²	83	82.5 Å²	82.5	44%	0.435	44%	0.441	S	S	.	.	H	α-helix	trans	-68.6	-43.6	176.2	-66.6	168.8	0	0	0	111.6	S8 L9 E10 G15 V16 L92	S8-L12 WeakPolarHBondContact O-CG 3.27Å; S8-L12 PolarHBondContact O-N 2.8Å; L9-L12 PolarHBondContact O-N 3.25Å; E10-L12 VanDerWaalsContact C-N 3.33Å; E10-L12 PolarHBondContact O-N 2.99Å; L12-G15 PolarHBondContact O-N 2.8Å; L12-V16 WeakPolarHBondContact O-CG2 3.18Å; L12-V16 PolarHBondContact O-N 2.98Å; L12-L92 HydrophobicContact CB-CD2 4.23Å; L12-L92 HydrophobicContact CD1-CD2 4.5Å; L12-L92 HydrophobicContact CD2-CD2 3.7Å; L12-L92 HydrophobicContact CG-CD2 4.34Å
13	L	65.1	Low	64.6	Low	43 Å²	43	77.6 Å²	77.6	23%	0.225	42%	0.417	C	S	.	.	H	α-helix	trans	-66.8	-42.2	179.6	-70.4	167.1	0	0	0	112.1	L9 E10 G15 V16 N17 L28 F32	L9-L13 HydrophobicContact CD1-CD1 4.41Å; L9-L13 HydrophobicContact CD1-CG 4.5Å; L9-L13 HydrophobicContact CG-CD1 3.87Å; L9-L13 HydrophobicContact CG-CG 4.39Å; L9-L13 WeakPolarHBondContact O-CB 3.39Å; L9-L13 WeakPolarHBondContact O-CG 3.42Å; L9-L13 PolarHBondContact O-N 2.92Å; E10-L13 PolarHBondContact O-N 3.3Å; L13-G15 VanDerWaalsContact C-N 3.34Å; L13-G15 PolarHBondContact O-N 3.41Å; L13-V16 PolarHBondContact O-N 3.04Å; L13-N17 WeakPolarHBondContact O-CB 3.4Å; L13-N17 PolarHBondContact O-N 3.3Å; L13-L28 HydrophobicContact CB-CD2 4.48Å; L13-L28 HydrophobicContact CD2-CD1 4.31Å; L13-L28 HydrophobicContact CD2-CD2 3.57Å; L13-L28 HydrophobicContact CD2-CG 4.02Å; L13-F32 HydrophobicContact CD1-CD2 3.6Å; L13-F32 HydrophobicContact CD1-CE2 3.53Å; L13-F32 HydrophobicContact CD1-CG 4.38Å; L13-F32 HydrophobicContact CD1-CZ 4.27Å; L13-F32 HydrophobicContact CD2-CD2 4.31Å
14	S	65.3	Low	66.3	Low	69 Å²	69	71.5 Å²	71.5	48%	0.483	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-39.9	177	59.5	0	0	0	0	111.9	E10 V11 N17 K18	E10-S14 WeakPolarHBondContact O-CB 3.35Å; E10-S14 PolarHBondContact O-N 2.83Å; E10-S14 PolarHBondContact O-OG 3.16Å; V11-S14 WeakPolarHBondContact CA-OG 3.03Å; V11-S14 PolarHBondContact O-OG 3.13Å; S14-N17 PolarHBondContact O-N 3.03Å; S14-K18 WeakPolarHBondContact O-CB 3.36Å; S14-K18 PolarHBondContact O-N 3.24Å
15	G	65.1	Low	67.9	Low	14 Å²	14	70.6 Å²	70.6	14%	0.144	37%	0.37	C	S	.	.	H	α-helix	trans	-60.5	-50.7	173.1	0	0	0	0	0	112.5	V11 L12 L13 N17 K18 Y19	V11-G15 PolarHBondContact O-N 3.38Å; L12-G15 PolarHBondContact O-N 2.8Å; L13-G15 VanDerWaalsContact C-N 3.34Å; L13-G15 PolarHBondContact O-N 3.41Å; G15-N17 PolarHBondContact O-N 3.48Å; G15-K18 PolarHBondContact O-N 2.9Å; G15-Y19 WeakPolarHBondContact O-CD2 3.14Å
16	V	70.1	Confident	69.2	Low	14 Å²	14	69.1 Å²	69.1	9%	0.085	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-39.8	179.6	-177.3	0	0	0	0	111	L12 L13 K18 Y19 S20 L28 V95	L12-V16 WeakPolarHBondContact O-CG2 3.18Å; L12-V16 PolarHBondContact O-N 2.98Å; L13-V16 PolarHBondContact O-N 3.04Å; V16-K18 PolarHBondContact O-N 3.49Å; V16-Y19 PolarHBondContact O-N 3.23Å; V16-S20 VanDerWaalsContact O-CB 3.27Å; V16-S20 WeakPolarHBondContact O-CB 3.37Å; V16-S20 PolarHBondContact O-N 2.67Å; V16-S20 VanDerWaalsContact O-N 3.1Å; V16-L28 HydrophobicContact CB-CD1 3.47Å; V16-L28 VanDerWaalsContact CB-CD1 3.47Å; V16-L28 HydrophobicContact CG1-CD1 3.3Å; V16-L28 HydrophobicContact CG2-CD1 4.5Å; V16-V95 HydrophobicContact CB-CG2 4.05Å; V16-V95 HydrophobicContact CG2-CG2 3.51Å
17	N	73.7	Confident	70.3	Confident	72 Å²	72	62.6 Å²	62.6	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-40.4	179.5	-166.3	29.9	0	0	0	112.5	L13 S14 G15 Y19 R25	L13-N17 WeakPolarHBondContact O-CB 3.4Å; L13-N17 PolarHBondContact O-N 3.3Å; S14-N17 PolarHBondContact O-N 3.03Å; G15-N17 PolarHBondContact O-N 3.48Å; N17-Y19 PolarHBondContact O-N 3.45Å; N17-R25 WeakPolarHBondContact OD1-CD 3.46Å; N17-R25 WeakPolarHBondContact OD1-CG 3.46Å
18	K	69	Low	71.4	Confident	154 Å²	154	62.3 Å²	62.3	67%	0.67	33%	0.331	S	S	*	.	H	α-helix	trans	-63.4	-36.4	-178.6	-173.9	178.3	-179.7	-172.3	0	113.5	S14 G15 V16	S14-K18 WeakPolarHBondContact O-CB 3.36Å; S14-K18 PolarHBondContact O-N 3.24Å; G15-K18 PolarHBondContact O-N 2.9Å; V16-K18 PolarHBondContact O-N 3.49Å
19	Y	66.7	Low	72.7	Confident	48 Å²	48	62.4 Å²	62.4	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-103.7	-1.5	-175.4	-56.8	-71.2	0	0	0	113.6	G15 V16 N17 V98 E102	G15-Y19 WeakPolarHBondContact O-CD2 3.14Å; V16-Y19 PolarHBondContact O-N 3.23Å; N17-Y19 PolarHBondContact O-N 3.45Å; Y19-V98 HydrophobicContact CD1-CG1 3.76Å; Y19-V98 HydrophobicContact CD2-CG1 4.19Å; Y19-V98 HydrophobicContact CE1-CG1 3.57Å; Y19-V98 HydrophobicContact CE2-CG1 4.07Å; Y19-V98 HydrophobicContact CG-CG1 4.07Å; Y19-V98 HydrophobicContact CG-CG2 4.46Å; Y19-E102 WeakPolarHBondContact CE1-OE1 3.46Å; Y19-E102 PolarHBondContact OH-OE1 3.38Å; Y19-E102 PolarHBondContact OH-OE2 2.86Å; Y19-E102 VanDerWaalsContact OH-OE2 3.14Å
20	S	70.5	Confident	73.6	Confident	16 Å²	16	61 Å²	61	11%	0.112	32%	0.324	C	S	.	.	S	Bend	trans	-77.7	152.1	177.2	-117.4	0	0	0	0	113.1	V16 G24 R25	V16-S20 VanDerWaalsContact O-CB 3.27Å; V16-S20 WeakPolarHBondContact O-CB 3.37Å; V16-S20 PolarHBondContact O-N 2.67Å; V16-S20 VanDerWaalsContact O-N 3.1Å; S20-G24 WeakPolarHBondContact OG-CA 3.35Å; S20-R25 PolarHBondContact O-NH1 2.89Å
21	T	77.9	Confident	74.4	Confident	28 Å²	28	54.9 Å²	54.9	17%	0.172	30%	0.296	C	S	.	.			trans	-69.8	171.5	164.9	56.9	0	0	0	0	109.9	F23 G24 R25 E205	T21-F23 PolarHBondContact O-N 3.34Å; T21-G24 PolarHBondContact O-N 3.46Å; T21-G24 VanDerWaalsContact O-N 3.08Å; T21-G24 PolarHBondContact OG1-N 3Å; T21-G24 VanDerWaalsContact OG1-N 3.08Å; T21-R25 WeakPolarHBondContact O-CG 3.38Å; T21-R25 PolarHBondContact O-N 2.9Å; T21-E205 WeakPolarHBondContact CB-OE1 3.3Å; T21-E205 WeakPolarHBondContact CG2-OE1 3.4Å; T21-E205 PolarHBondContact OG1-OE1 3.46Å; T21-E205 PolarHBondContact OG1-OE2 3.03Å
22	V	78.4	Confident	75.1	Confident	92 Å²	92	53.6 Å²	53.6	56%	0.558	28%	0.282	S	S	*	.	H	α-helix	trans	-50.5	-46.4	170.9	-179.1	0	0	0	0	110.7	G24 R25 V26	V22-G24 PolarHBondContact O-N 2.91Å; V22-R25 PolarHBondContact O-N 3.48Å; V22-V26 WeakPolarHBondContact O-CG2 3.36Å; V22-V26 PolarHBondContact O-N 3.23Å; V22-V26 VanDerWaalsContact O-N 3.08Å
23	F	76	Confident	75.8	Confident	89 Å²	89	52.6 Å²	52.6	39%	0.39	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-45.9	176.2	-65.7	-76	0	0	0	112.5	T21 R25 V26 W27 E205	T21-F23 PolarHBondContact O-N 3.34Å; F23-R25 VanDerWaalsContact C-N 3.27Å; F23-R25 PolarHBondContact O-N 2.73Å; F23-V26 PolarHBondContact O-N 3.42Å; F23-W27 WeakPolarHBondContact O-CB 3.4Å; F23-W27 PolarHBondContact O-N 2.97Å; F23-E205 HydrophobicContact CB-CB 4.19Å; F23-E205 HydrophobicContact CB-CG 4.31Å
24	G	78.4	Confident	76.5	Confident	3 Å²	3	55.9 Å²	55.9	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-26.7	177.5	0	0	0	0	0	114.1	S20 T21 V22 L28	S20-G24 WeakPolarHBondContact OG-CA 3.35Å; T21-G24 PolarHBondContact O-N 3.46Å; T21-G24 VanDerWaalsContact O-N 3.08Å; T21-G24 PolarHBondContact OG1-N 3Å; T21-G24 VanDerWaalsContact OG1-N 3.08Å; V22-G24 PolarHBondContact O-N 2.91Å; G24-L28 WeakPolarHBondContact O-CB 3.37Å; G24-L28 PolarHBondContact O-N 3.47Å; G24-L28 VanDerWaalsContact O-N 3.1Å
25	R	81.8	Confident	77.4	Confident	108 Å²	108	52.6 Å²	52.6	41%	0.408	27%	0.269	S	S	.	.	H	α-helix	trans	-73.5	-43.4	172.7	-64.6	-163.5	-68.4	-92.4	7.4	112.1	N17 S20 T21 V22 F23 W27 L28 S29	N17-R25 WeakPolarHBondContact OD1-CD 3.46Å; N17-R25 WeakPolarHBondContact OD1-CG 3.46Å; S20-R25 PolarHBondContact O-NH1 2.89Å; T21-R25 WeakPolarHBondContact O-CG 3.38Å; T21-R25 PolarHBondContact O-N 2.9Å; V22-R25 PolarHBondContact O-N 3.48Å; F23-R25 VanDerWaalsContact C-N 3.27Å; F23-R25 PolarHBondContact O-N 2.73Å; R25-W27 VanDerWaalsContact C-N 3.33Å; R25-L28 PolarHBondContact O-N 2.05Å; R25-S29 PolarHBondContact O-N 2.96Å
26	V	84.3	Confident	78.4	Confident	79 Å²	79	53.6 Å²	53.6	48%	0.479	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-44.9	174.2	176.4	0	0	0	0	110.2	V22 F23 L28 S29 M30 M201	V22-V26 WeakPolarHBondContact O-CG2 3.36Å; V22-V26 PolarHBondContact O-N 3.23Å; V22-V26 VanDerWaalsContact O-N 3.08Å; F23-V26 PolarHBondContact O-N 3.42Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 2.88Å; V26-S29 WeakPolarHBondContact O-CB 3.47Å; V26-S29 PolarHBondContact O-N 3.46Å; V26-M30 WeakPolarHBondContact O-CB 3.45Å; V26-M30 PolarHBondContact O-N 3.49Å; V26-M201 HydrophobicContact CG1-SD 3.85Å
27	W	84.9	Confident	79.1	Confident	11 Å²	11	57.7 Å²	57.7	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-56.7	-44.5	174.8	180	91.5	0	0	0	112.3	F23 R25 M30 V31 V87 K139 M201	F23-W27 WeakPolarHBondContact O-CB 3.4Å; F23-W27 PolarHBondContact O-N 2.97Å; R25-W27 VanDerWaalsContact C-N 3.33Å; W27-M30 WeakPolarHBondContact O-CB 3.34Å; W27-M30 PolarHBondContact O-N 3.4Å; W27-V31 HydrophobicContact CD2-CG2 3.95Å; W27-V31 HydrophobicContact CE3-CG2 4.23Å; W27-V31 HydrophobicContact CH2-CG2 3.99Å; W27-V31 HydrophobicContact CZ2-CG2 3.71Å; W27-V31 HydrophobicContact CZ3-CG2 4.24Å; W27-V31 WeakPolarHBondContact O-CG2 3.43Å; W27-V31 PolarHBondContact O-N 3.26Å; W27-V87 HydrophobicContact CH2-CG1 3.68Å; W27-V87 HydrophobicContact CZ2-CG1 3.37Å; W27-K139 HydrophobicContact CH2-CD 4.18Å; W27-K139 HydrophobicContact CZ2-CD 4.05Å; W27-M201 HydrophobicContact CB-CE 4.15Å; W27-M201 HydrophobicContact CG-CE 4.43Å
28	L	81	Confident	79.6	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.12	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-41.1	-179.7	-168.5	148	0	0	0	112.1	L13 V16 G24 R25 V26 M30 V31 F32	L13-L28 HydrophobicContact CB-CD2 4.48Å; L13-L28 HydrophobicContact CD2-CD1 4.31Å; L13-L28 HydrophobicContact CD2-CD2 3.57Å; L13-L28 HydrophobicContact CD2-CG 4.02Å; V16-L28 HydrophobicContact CB-CD1 3.47Å; V16-L28 VanDerWaalsContact CB-CD1 3.47Å; V16-L28 HydrophobicContact CG1-CD1 3.3Å; V16-L28 HydrophobicContact CG2-CD1 4.5Å; G24-L28 WeakPolarHBondContact O-CB 3.37Å; G24-L28 PolarHBondContact O-N 3.47Å; G24-L28 VanDerWaalsContact O-N 3.1Å; R25-L28 PolarHBondContact O-N 2.05Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 2.88Å; L28-M30 VanDerWaalsContact C-N 3.28Å; L28-M30 PolarHBondContact O-N 3.47Å; L28-V31 PolarHBondContact O-N 3.26Å; L28-F32 WeakPolarHBondContact O-CB 3.18Å; L28-F32 PolarHBondContact O-N 3.28Å
29	S	83.4	Confident	80.4	Confident	69 Å²	69	50.5 Å²	50.5	48%	0.483	26%	0.261	S	S	.	.	H	α-helix	trans	-58.6	-42.6	170.8	-172	0	0	0	0	111.2	R25 V26 V33	R25-S29 PolarHBondContact O-N 2.96Å; V26-S29 WeakPolarHBondContact O-CB 3.47Å; V26-S29 PolarHBondContact O-N 3.46Å; S29-V33 VanDerWaalsContact O-CB 3.31Å; S29-V33 WeakPolarHBondContact O-CB 3.43Å; S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.07Å; S29-V33 PolarHBondContact O-N 3.4Å
30	M	81.1	Confident	81.3	Confident	26 Å²	26	51.3 Å²	51.3	13%	0.128	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-47.3	-179.5	-176.5	164.7	-167.7	0	0	112.4	V26 W27 L28 F32 F34 V197 M201	V26-M30 WeakPolarHBondContact O-CB 3.45Å; V26-M30 PolarHBondContact O-N 3.49Å; W27-M30 WeakPolarHBondContact O-CB 3.34Å; W27-M30 PolarHBondContact O-N 3.4Å; L28-M30 VanDerWaalsContact C-N 3.28Å; L28-M30 PolarHBondContact O-N 3.47Å; M30-F32 VanDerWaalsContact C-N 3.33Å; M30-F32 PolarHBondContact O-N 2.94Å; M30-F34 HydrophobicContact CG-CD2 3.95Å; M30-F34 WeakPolarHBondContact O-CB 3.26Å; M30-F34 PolarHBondContact O-N 2.85Å; M30-V197 HydrophobicContact CE-CB 3.52Å; M30-V197 HydrophobicContact CE-CG1 3.63Å; M30-V197 HydrophobicContact CE-CG2 4.17Å; M30-V197 HydrophobicContact SD-CB 3.93Å; M30-V197 HydrophobicContact SD-CG1 3.48Å; M30-V197 WeakPolarHBondContact SD-CG1 3.37Å; M30-M201 HydrophobicContact CB-CE 4.06Å; M30-M201 HydrophobicContact CG-CE 4.24Å; M30-M201 HydrophobicContact SD-CE 3.32Å; M30-M201 WeakPolarHBondContact SD-CE 3.47Å
31	V	83.1	Confident	81.9	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.055	29%	0.289	C	S	.	.	I	π-helix	trans	-62	-42.1	177.5	171.4	0	0	0	0	111.1	W27 L28 R35 V36 L84	W27-V31 HydrophobicContact CD2-CG2 3.95Å; W27-V31 HydrophobicContact CE3-CG2 4.23Å; W27-V31 HydrophobicContact CH2-CG2 3.99Å; W27-V31 HydrophobicContact CZ2-CG2 3.71Å; W27-V31 HydrophobicContact CZ3-CG2 4.24Å; W27-V31 WeakPolarHBondContact O-CG2 3.43Å; W27-V31 PolarHBondContact O-N 3.26Å; L28-V31 PolarHBondContact O-N 3.26Å; V31-R35 WeakPolarHBondContact O-CA 3.46Å; V31-R35 VanDerWaalsContact O-CB 3.28Å; V31-R35 WeakPolarHBondContact O-CB 3.14Å; V31-R35 PolarHBondContact O-N 3.48Å; V31-R35 VanDerWaalsContact O-N 3.14Å; V31-V36 PolarHBondContact O-N 3.4Å; V31-L84 HydrophobicContact CG1-CD2 4.19Å
32	F	78	Confident	82.1	Confident	75 Å²	75	53.2 Å²	53.2	33%	0.329	28%	0.281	S	S	.	.	I	π-helix	trans	-69.8	-51.2	-178.9	-172.6	-102.2	0	0	0	112.3	L9 L13 L28 M30 V36 L37	L9-F32 HydrophobicContact CD2-CE2 3.87Å; L13-F32 HydrophobicContact CD1-CD2 3.6Å; L13-F32 HydrophobicContact CD1-CE2 3.53Å; L13-F32 HydrophobicContact CD1-CG 4.38Å; L13-F32 HydrophobicContact CD1-CZ 4.27Å; L13-F32 HydrophobicContact CD2-CD2 4.31Å; L28-F32 WeakPolarHBondContact O-CB 3.18Å; L28-F32 PolarHBondContact O-N 3.28Å; M30-F32 VanDerWaalsContact C-N 3.33Å; M30-F32 PolarHBondContact O-N 2.94Å; F32-V36 WeakPolarHBondContact O-CB 3.38Å; F32-V36 PolarHBondContact O-N 3.36Å; F32-L37 PolarHBondContact O-N 2.85Å
33	V	77.6	Confident	82.2	Confident	63 Å²	63	49.6 Å²	49.6	38%	0.382	26%	0.261	S	S	.	.	I	π-helix	trans	-74.8	-43.9	-174.7	177.1	0	0	0	0	112	S29 L37	S29-V33 VanDerWaalsContact O-CB 3.31Å; S29-V33 WeakPolarHBondContact O-CB 3.43Å; S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.07Å; S29-V33 PolarHBondContact O-N 3.4Å; V33-L37 WeakPolarHBondContact O-CB 3.35Å
34	F	79.3	Confident	82.2	Confident	112 Å²	112	51 Å²	51	49%	0.491	27%	0.269	S	S	.	.	I	π-helix	trans	-95.3	-23.4	-172.9	-67.1	-75	0	0	0	114.1	M30 V38	M30-F34 HydrophobicContact CG-CD2 3.95Å; M30-F34 WeakPolarHBondContact O-CB 3.26Å; M30-F34 PolarHBondContact O-N 2.85Å; F34-V38 VanDerWaalsContact O-CB 3.26Å; F34-V38 WeakPolarHBondContact O-CB 3.38Å; F34-V38 WeakPolarHBondContact O-CG2 2.96Å
35	R	85.9	Confident	82.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.305	C	S	.	.	I	π-helix	trans	-105	-54.9	179	-61.4	-177	168.3	175.1	-8.3	113	V31 F39 Q83 L84 D143 M191 S195	V31-R35 WeakPolarHBondContact O-CA 3.46Å; V31-R35 VanDerWaalsContact O-CB 3.28Å; V31-R35 WeakPolarHBondContact O-CB 3.14Å; V31-R35 PolarHBondContact O-N 3.48Å; V31-R35 VanDerWaalsContact O-N 3.14Å; R35-F39 WeakPolarHBondContact O-CB 3.13Å; R35-F39 PolarHBondContact O-N 2.03Å; R35-Q83 VanDerWaalsContact NH2-NE2 3.16Å; R35-L84 HydrophobicContact CB-CD2 3.8Å; R35-D143 IonicContact CZ-OD1 2.6Å; R35-D143 VanDerWaalsContact CZ-OD1 3.29Å; R35-D143 IonicContact CZ-OD2 2.73Å; R35-D143 IonicContact NH1-OD1 3.74Å; R35-D143 PolarHBondContact NH1-OD1 3.14Å; R35-D143 IonicContact NH1-OD2 2.73Å; R35-D143 PolarHBondContact NH1-OD2 3.15Å; R35-D143 IonicContact NH2-OD1 2.67Å; R35-D143 PolarHBondContact NH2-OD1 3.03Å; R35-D143 IonicContact NH2-OD2 2.8Å; R35-D143 PolarHBondContact NH2-OD2 3.41Å; R35-M191 HydrophobicContact CB-CE 4.13Å; R35-M191 HydrophobicContact CB-SD 4.33Å; R35-M191 HydrophobicContact CG-CE 4.18Å; R35-M191 HydrophobicContact CG-SD 4.29Å; R35-S195 PolarHBondContact NH2-OG 3.44Å
36	V	86	Confident	82.6	Confident	35 Å²	35	56.3 Å²	56.3	21%	0.212	29%	0.289	C	S	.	.	I	π-helix	trans	-65.1	-48.1	-176.2	177.9	0	0	0	0	110.9	V31 F32 F39 V40 L84	V31-V36 PolarHBondContact O-N 3.4Å; F32-V36 WeakPolarHBondContact O-CB 3.38Å; F32-V36 PolarHBondContact O-N 3.36Å; V36-F39 PolarHBondContact O-N 3.39Å; V36-V40 HydrophobicContact CG1-CG2 4.44Å; V36-V40 WeakPolarHBondContact O-CB 3.16Å; V36-V40 VanDerWaalsContact O-CG2 3.27Å; V36-V40 WeakPolarHBondContact O-CG2 3.09Å; V36-V40 PolarHBondContact O-N 3.5Å; V36-L84 HydrophobicContact CG2-CD1 4.43Å; V36-L84 HydrophobicContact CG2-CD2 4.37Å
37	L	83.8	Confident	82.7	Confident	99 Å²	99	53 Å²	53	52%	0.518	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-47.6	179.2	-176.4	154	0	0	0	111.8	F32 V33 F39 V40 V41	F32-L37 PolarHBondContact O-N 2.85Å; V33-L37 WeakPolarHBondContact O-CB 3.35Å; L37-F39 VanDerWaalsContact C-N 3.34Å; L37-F39 PolarHBondContact O-N 3.36Å; L37-V40 PolarHBondContact O-N 3.5Å; L37-V41 HydrophobicContact CD2-CG2 4.2Å; L37-V41 WeakPolarHBondContact O-CG2 3.46Å; L37-V41 PolarHBondContact O-N 3.28Å
38	V	84.2	Confident	82.5	Confident	27 Å²	27	54.5 Å²	54.5	16%	0.164	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-43.7	178.5	175	0	0	0	0	110.9	F34 V40 V41 A42 F187 M191	F34-V38 VanDerWaalsContact O-CB 3.26Å; F34-V38 WeakPolarHBondContact O-CB 3.38Å; F34-V38 WeakPolarHBondContact O-CG2 2.96Å; V38-V40 PolarHBondContact O-N 3.47Å; V38-V41 PolarHBondContact O-N 2.98Å; V38-A42 WeakPolarHBondContact O-CB 3.31Å; V38-A42 PolarHBondContact O-N 3.29Å; V38-F187 HydrophobicContact CG1-CD1 3.72Å; V38-F187 HydrophobicContact CG1-CE1 4.12Å; V38-M191 HydrophobicContact CG1-SD 4.35Å
39	F	86.6	Confident	82.7	Confident	49 Å²	49	56.9 Å²	56.9	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-57.5	-48.4	175.1	176.2	-98.8	0	0	0	111.6	R35 V36 L37 V41 A42 A43 I77 W80 A81 L84	R35-F39 WeakPolarHBondContact O-CB 3.13Å; R35-F39 PolarHBondContact O-N 2.03Å; V36-F39 PolarHBondContact O-N 3.39Å; L37-F39 VanDerWaalsContact C-N 3.34Å; L37-F39 PolarHBondContact O-N 3.36Å; F39-V41 PolarHBondContact O-N 3.25Å; F39-A42 PolarHBondContact O-N 3.09Å; F39-A43 HydrophobicContact CE2-CB 4.32Å; F39-A43 HydrophobicContact CZ-CB 4.31Å; F39-A43 WeakPolarHBondContact O-CB 3.5Å; F39-A43 PolarHBondContact O-N 3.43Å; F39-I77 HydrophobicContact CE2-CB 4.2Å; F39-I77 WeakPolarHBondContact CE2-O 3.02Å; F39-W80 HydrophobicContact CD2-CB 4.13Å; F39-W80 HydrophobicContact CE2-CB 4.37Å; F39-A81 HydrophobicContact CE2-CB 4.06Å; F39-A81 HydrophobicContact CZ-CB 3.78Å; F39-L84 HydrophobicContact CB-CD1 4.24Å; F39-L84 HydrophobicContact CD1-CD1 4.44Å; F39-L84 HydrophobicContact CG-CD1 4.2Å
40	V	85.1	Confident	82.8	Confident	65 Å²	65	53.9 Å²	53.9	39%	0.394	28%	0.279	S	S	.	.	H	α-helix	trans	-63.7	-43.8	-179.3	169.6	0	0	0	0	111.7	V36 L37 V38	V36-V40 HydrophobicContact CG1-CG2 4.44Å; V36-V40 WeakPolarHBondContact O-CB 3.16Å; V36-V40 VanDerWaalsContact O-CG2 3.27Å; V36-V40 WeakPolarHBondContact O-CG2 3.09Å; V36-V40 PolarHBondContact O-N 3.5Å; L37-V40 PolarHBondContact O-N 3.5Å; V38-V40 PolarHBondContact O-N 3.47Å
41	V	83.9	Confident	83	Confident	81 Å²	81	55.8 Å²	55.8	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-67.7	-43.5	-180	171.9	0	0	0	0	111.2	L37 V38 F39 R45	L37-V41 HydrophobicContact CD2-CG2 4.2Å; L37-V41 WeakPolarHBondContact O-CG2 3.46Å; L37-V41 PolarHBondContact O-N 3.28Å; V38-V41 PolarHBondContact O-N 2.98Å; F39-V41 PolarHBondContact O-N 3.25Å; V41-R45 WeakPolarHBondContact O-CG 3.48Å
42	A	81.8	Confident	83.2	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-84.7	-33.7	-171.5	0	0	0	0	0	113.2	V38 F39 Q44 R45 V46 W47 F187	V38-A42 WeakPolarHBondContact O-CB 3.31Å; V38-A42 PolarHBondContact O-N 3.29Å; F39-A42 PolarHBondContact O-N 3.09Å; A42-Q44 VanDerWaalsContact C-N 3.34Å; A42-Q44 PolarHBondContact O-N 2.85Å; A42-R45 PolarHBondContact O-N 3.27Å; A42-V46 WeakPolarHBondContact O-CB 3.38Å; A42-V46 PolarHBondContact O-N 3.29Å; A42-W47 HydrophobicContact CB-CE3 4.32Å; A42-W47 HydrophobicContact CB-CZ3 3.91Å; A42-F187 HydrophobicContact CB-CD1 3.73Å; A42-F187 HydrophobicContact CB-CD2 4.27Å; A42-F187 HydrophobicContact CB-CE1 3.76Å; A42-F187 HydrophobicContact CB-CE2 4.33Å; A42-F187 HydrophobicContact CB-CG 4.01Å; A42-F187 HydrophobicContact CB-CZ 4.07Å
43	A	79.8	Confident	83.9	Confident	17 Å²	17	62.2 Å²	62.2	14%	0.14	33%	0.325	C	S	.	.	H	α-helix	trans	-56.4	-44.5	-172.4	0	0	0	0	0	113	F39 G48 I77	F39-A43 HydrophobicContact CE2-CB 4.32Å; F39-A43 HydrophobicContact CZ-CB 4.31Å; F39-A43 WeakPolarHBondContact O-CB 3.5Å; F39-A43 PolarHBondContact O-N 3.43Å; A43-G48 PolarHBondContact O-N 3.43Å; A43-I77 HydrophobicContact CB-CG2 4.32Å
44	Q	75.9	Confident	84.6	Confident	119 Å²	119	59.2 Å²	59.2	56%	0.556	31%	0.307	S	S	*	.	H	α-helix	trans	-83.4	-37.3	179.1	-69	-175	-23.4	0	0	112.7	A42 G48	A42-Q44 VanDerWaalsContact C-N 3.34Å; A42-Q44 PolarHBondContact O-N 2.85Å; Q44-G48 WeakPolarHBondContact O-CA 3.26Å; Q44-G48 PolarHBondContact O-N 3.01Å
45	R	83.2	Confident	85.3	Confident	210 Å²	210	57.6 Å²	57.6	79%	0.792	31%	0.306	S	S	*	.	H	α-helix	trans	-78.8	-33.6	-171.7	-67.5	-64.7	-169.8	147.6	1.2	114	V41 A42	V41-R45 WeakPolarHBondContact O-CG 3.48Å; A42-R45 PolarHBondContact O-N 3.27Å
46	V	85.1	Confident	85.8	Confident	11 Å²	11	58 Å²	58	7%	0.067	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-34.5	-170.9	179.1	0	0	0	0	111.7	A42 E183 K184 F187	A42-V46 WeakPolarHBondContact O-CB 3.38Å; A42-V46 PolarHBondContact O-N 3.29Å; V46-E183 HydrophobicContact CG1-CB 4.4Å; V46-K184 HydrophobicContact CG1-CG 3.55Å; V46-F187 HydrophobicContact CG1-CD2 4.42Å; V46-F187 HydrophobicContact CG2-CD2 3.95Å; V46-F187 HydrophobicContact CG2-CE2 3.58Å; V46-F187 HydrophobicContact CG2-CZ 4.41Å
47	W	86.1	Confident	86.3	Confident	9 Å²	9	62 Å²	62	3%	0.034	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-4.3	-178.3	-77.8	-90	0	0	0	114.3	A42 D49 E50 H76 I77 W80 K184 F187	A42-W47 HydrophobicContact CB-CE3 4.32Å; A42-W47 HydrophobicContact CB-CZ3 3.91Å; W47-D49 VanDerWaalsContact C-N 3.35Å; W47-D49 PolarHBondContact O-N 2.89Å; W47-E50 VanDerWaalsContact CD1-CD 3.5Å; W47-E50 VanDerWaalsContact CD1-OE2 3.28Å; W47-E50 PolarHBondContact NE1-OE1 3.01Å; W47-E50 WeakPolarHBondContact O-CB 3.46Å; W47-E50 PolarHBondContact O-N 3.37Å; W47-H76 HydrophobicContact CZ2-CB 4.17Å; W47-I77 HydrophobicContact CB-CD1 3.88Å; W47-I77 HydrophobicContact CB-CG1 4.19Å; W47-I77 HydrophobicContact CB-CG2 3.64Å; W47-I77 HydrophobicContact CD2-CG2 3.52Å; W47-I77 HydrophobicContact CE3-CG2 3.74Å; W47-I77 HydrophobicContact CG-CG1 4.39Å; W47-I77 HydrophobicContact CG-CG2 3.45Å; W47-I77 VanDerWaalsContact CG-CG2 3.45Å; W47-W80 HydrophobicContact CE3-CZ3 4.32Å; W47-W80 AromaticContact CH2-CH2 3.38Å; W47-W80 HydrophobicContact CH2-CH2 3.38Å; W47-W80 AromaticContact CH2-CZ3 3.49Å; W47-W80 HydrophobicContact CH2-CZ3 3.49Å; W47-W80 VanDerWaalsContact CH2-CZ3 3.49Å; W47-W80 AromaticContact CZ2-CH2 3.58Å; W47-W80 HydrophobicContact CZ2-CH2 3.58Å; W47-W80 AromaticContact CZ2-CZ3 3.85Å; W47-W80 HydrophobicContact CZ2-CZ3 3.85Å; W47-W80 HydrophobicContact CZ3-CH2 4.13Å; W47-W80 AromaticContact CZ3-CZ3 3.75Å; W47-W80 HydrophobicContact CZ3-CZ3 3.75Å; W47-K184 HydrophobicContact CD2-CG 4.49Å; W47-K184 HydrophobicContact CH2-CB 4.18Å; W47-K184 HydrophobicContact CH2-CG 4.18Å; W47-K184 HydrophobicContact CZ2-CB 3.71Å; W47-K184 HydrophobicContact CZ2-CD 4.36Å; W47-K184 HydrophobicContact CZ2-CG 3.65Å; W47-F187 HydrophobicContact CH2-CB 3.58Å; W47-F187 HydrophobicContact CH2-CD2 4.46Å; W47-F187 HydrophobicContact CH2-CG 4.33Å; W47-F187 HydrophobicContact CZ3-CB 3.87Å; W47-F187 HydrophobicContact CZ3-CD2 4.21Å; W47-F187 HydrophobicContact CZ3-CG 4.18Å
48	G	82.5	Confident	86.8	Confident	44 Å²	44	59.2 Å²	59.2	45%	0.454	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-36.1	-176.8	0	0	0	0	0	114.2	A43 Q44	A43-G48 PolarHBondContact O-N 3.43Å; Q44-G48 WeakPolarHBondContact O-CA 3.26Å; Q44-G48 PolarHBondContact O-N 3.01Å
49	D	84.1	Confident	87.3	Confident	73 Å²	73	68.1 Å²	68.1	39%	0.39	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	21.8	179.8	-61.8	-58.9	0	0	0	112.2	W47 S51 K52 D53	W47-D49 VanDerWaalsContact C-N 3.35Å; W47-D49 PolarHBondContact O-N 2.89Å; D49-S51 VanDerWaalsContact C-N 3.29Å; D49-S51 PolarHBondContact O-N 3.46Å; D49-K52 HydrophobicContact CB-CB 4.46Å; D49-K52 PolarHBondContact O-N 2.84Å; D49-K52 IonicContact OD1-NZ 3.84Å; D49-K52 PolarHBondContact OD1-NZ 3.02Å; D49-D53 PolarHBondContact O-N 2.62Å
50	E	85.5	Confident	87.7	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.028	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-39.8	-175.9	169.1	168.8	-111.6	0	0	113.2	W47 F54 Y68 K184	W47-E50 VanDerWaalsContact CD1-CD 3.5Å; W47-E50 VanDerWaalsContact CD1-OE2 3.28Å; W47-E50 PolarHBondContact NE1-OE1 3.01Å; W47-E50 WeakPolarHBondContact O-CB 3.46Å; W47-E50 PolarHBondContact O-N 3.37Å; E50-F54 WeakPolarHBondContact O-CB 3.11Å; E50-Y68 HydrophobicContact CG-CE2 3.86Å; E50-K184 VanDerWaalsContact CG-NZ 3.3Å; E50-K184 WeakPolarHBondContact OE1-CE 3.44Å; E50-K184 IonicContact OE1-NZ 3.89Å; E50-K184 PolarHBondContact OE1-NZ 3Å
51	S	85.4	Confident	88.2	Confident	66 Å²	66	71.4 Å²	71.4	46%	0.462	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-24.7	178.4	69.2	0	0	0	0	113.5	D49	D49-S51 VanDerWaalsContact C-N 3.29Å; D49-S51 PolarHBondContact O-N 3.46Å
52	K	88.3	Confident	88.7	Confident	147 Å²	147	69.1 Å²	69.1	64%	0.639	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-35.8	-177.1	-64.4	-177.9	-163.8	149.6	0	112	D49 F54	D49-K52 HydrophobicContact CB-CB 4.46Å; D49-K52 PolarHBondContact O-N 2.84Å; D49-K52 IonicContact OD1-NZ 3.84Å; D49-K52 PolarHBondContact OD1-NZ 3.02Å; K52-F54 VanDerWaalsContact C-N 3.3Å
53	D	91	Very high	89.3	Confident	71 Å²	71	69 Å²	69	38%	0.38	37%	0.365	S	S	.	.	S	Bend	trans	-90.3	4.2	-179.7	-67	-13.3	0	0	0	112.4	D49 S179	D49-D53 PolarHBondContact O-N 2.62Å; D53-S179 WeakPolarHBondContact CB-OG 3.25Å; D53-S179 PolarHBondContact OD2-OG 3.18Å
54	F	93.3	Very high	90	Very high	1 Å²	1	71.3 Å²	71.3	0%	0.004	37%	0.373	C	S	.	.			trans	-82.4	114.6	174.3	178.3	-97.3	0	0	0	108.8	E50 K52 C56 E64 C67 Y68 I71 F72 C176 I178	E50-F54 WeakPolarHBondContact O-CB 3.11Å; K52-F54 VanDerWaalsContact C-N 3.3Å; F54-C56 WeakPolarHBondContact CE1-SG 3.2Å; F54-E64 HydrophobicContact CD1-CG 3.72Å; F54-E64 HydrophobicContact CE1-CG 4.11Å; F54-E64 WeakPolarHBondContact O-CG 3.07Å; F54-C67 HydrophobicContact CE1-CB 4.2Å; F54-C67 HydrophobicContact CZ-CB 4.29Å; F54-Y68 HydrophobicContact CB-CD2 3.87Å; F54-Y68 HydrophobicContact CB-CE2 4.4Å; F54-Y68 AromaticContact CD1-CD2 3.93Å; F54-Y68 HydrophobicContact CD1-CD2 3.93Å; F54-Y68 HydrophobicContact CD1-CG 4.33Å; F54-Y68 HydrophobicContact CD2-CD2 4.15Å; F54-Y68 AromaticContact CG-CD2 3.72Å; F54-Y68 HydrophobicContact CG-CD2 3.72Å; F54-I71 HydrophobicContact CE2-CD1 4Å; F54-I71 HydrophobicContact CZ-CD1 3.72Å; F54-F72 HydrophobicContact CD2-CE2 4.27Å; F54-F72 HydrophobicContact CE2-CE2 4.31Å; F54-C176 HydrophobicContact CE1-CB 4.07Å; F54-C176 HydrophobicContact CE2-CB 3.89Å; F54-C176 HydrophobicContact CZ-CB 3.38Å; F54-I178 HydrophobicContact CD2-CG1 4.31Å; F54-I178 HydrophobicContact CE2-CG1 4.14Å
55	V	94.7	Very high	90.9	Very high	78 Å²	78	71.2 Å²	71.2	47%	0.473	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129	-171.5	179	0	0	0	0	110.2	C176 Y177	V55-C176 CarbonylContact O-C 3.58Å; V55-C176 WeakPolarHBondContact O-CA 3.19Å; V55-Y177 PolarHBondContact N-O 2.81Å; V55-Y177 PolarHBondContact O-N 3.42Å
56	C	95.9	Very high	91.5	Very high	7 Å²	7	63.5 Å²	63.5	5%	0.047	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	141.2	171.4	-62.8	0	0	0	0	111.6	F54 T58 D175 C176	F54-C56 WeakPolarHBondContact CE1-SG 3.2Å; C56-T58 HydrophobicContact CB-CG2 3.95Å; C56-T58 PolarHBondContact O-N 3.01Å; C56-D175 CarbonylContact C-O 3.56Å; C56-D175 WeakPolarHBondContact CA-O 3.35Å; C56-C176 HydrophobicContact CB-CB 4.13Å; C56-C176 WeakPolarHBondContact CB-SG 3.43Å; C56-C176 WeakPolarHBondContact SG-CB 3.32Å; C56-C176 CovalentContact SG-SG 2.05Å; C56-C176 PolarHBondContact SG-SG 3.14Å
57	N	95.7	Very high	92	Very high	121 Å²	121	63 Å²	63	65%	0.647	35%	0.349	S	S	*	.	S	Bend	trans	-75.3	70.7	176.1	-172.8	11.3	0	0	0	111.2	D175	N57-D175 HydrophobicContact CB-CB 4.38Å; N57-D175 PolarHBondContact N-O 3.29Å
58	T	94.9	Very high	92.4	Very high	40 Å²	40	64.9 Å²	64.9	25%	0.245	36%	0.357	C	S	.	.			trans	-157.1	152	179.9	-175	0	0	0	0	110.5	C56 Q60 C63 V174	C56-T58 HydrophobicContact CB-CG2 3.95Å; C56-T58 PolarHBondContact O-N 3.01Å; T58-Q60 WeakPolarHBondContact OG1-CB 3.03Å; T58-Q60 PolarHBondContact OG1-N 3.24Å; T58-Q60 VanDerWaalsContact OG1-N 3.13Å; T58-C63 HydrophobicContact CG2-CB 3.92Å; T58-V174 HydrophobicContact CG2-CG1 4.5Å
59	K	94.2	Very high	92.9	Very high	214 Å²	214	67.9 Å²	67.9	93%	0.93	36%	0.362	S	S	*	.			trans	-99.8	1.5	170.2	-64.4	-176	179.6	179.8	0	112.4	P61	K59-P61 WeakPolarHBondContact O-CD 3.44Å
60	Q	94.6	Very high	93.3	Very high	84 Å²	84	67.8 Å²	67.8	39%	0.393	37%	0.367	S	S	.	.			trans	-73.4	120.4	-176.7	-177.4	63.4	24	0	0	110.5	T58 C63 P169	T58-Q60 WeakPolarHBondContact OG1-CB 3.03Å; T58-Q60 PolarHBondContact OG1-N 3.24Å; T58-Q60 VanDerWaalsContact OG1-N 3.13Å; Q60-C63 HydrophobicContact CB-CB 4.2Å; Q60-C63 HydrophobicContact CG-CB 4.34Å; Q60-C63 PolarHBondContact O-N 2.87Å; Q60-P169 VanDerWaalsContact CG-O 3.3Å; Q60-P169 WeakPolarHBondContact CG-O 3.29Å
61	P	95.3	Very high	93.6	Very high	99 Å²	99	69.3 Å²	69.3	64%	0.643	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	139.5	178.7	26.2	-34.5	0	0	0	111.1	K59 C63	K59-P61 WeakPolarHBondContact O-CD 3.44Å; P61-C63 VanDerWaalsContact C-N 3.25Å; P61-C63 PolarHBondContact O-N 3.5Å
62	G	94.5	Very high	93.9	Very high	33 Å²	33	66.6 Å²	66.6	34%	0.34	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	-13.8	177.9	0	0	0	0	0	115.7	E64 N65 V66	G62-E64 PolarHBondContact O-N 3.14Å; G62-N65 PolarHBondContact O-N 3.18Å; G62-V66 PolarHBondContact O-N 3.22Å
63	C	95.8	Very high	94.1	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-42.7	177.7	175.6	0	0	0	0	111.8	T58 Q60 P61 N65 V66 C67 C170	T58-C63 HydrophobicContact CG2-CB 3.92Å; Q60-C63 HydrophobicContact CB-CB 4.2Å; Q60-C63 HydrophobicContact CG-CB 4.34Å; Q60-C63 PolarHBondContact O-N 2.87Å; P61-C63 VanDerWaalsContact C-N 3.25Å; P61-C63 PolarHBondContact O-N 3.5Å; C63-N65 VanDerWaalsContact C-N 3.34Å; C63-N65 PolarHBondContact O-N 2.93Å; C63-V66 WeakPolarHBondContact O-CG2 3.3Å; C63-V66 PolarHBondContact O-N 3.47Å; C63-C67 WeakPolarHBondContact O-CB 3.39Å; C63-C67 PolarHBondContact O-N 3Å; C63-C67 PolarHBondContact O-SG 3.35Å; C63-C170 VanDerWaalsContact CA-SG 3.57Å; C63-C170 HydrophobicContact CB-CB 4.1Å; C63-C170 WeakPolarHBondContact CB-SG 3.37Å; C63-C170 WeakPolarHBondContact SG-CB 3.31Å; C63-C170 CovalentContact SG-SG 2.03Å; C63-C170 PolarHBondContact SG-SG 3.46Å
64	E	94.4	Very high	94.1	Very high	64 Å²	64	63.3 Å²	63.3	30%	0.299	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-43.7	177.1	-169	173	115.3	0	0	112.3	F54 G62 C67 Y68	F54-E64 HydrophobicContact CD1-CG 3.72Å; F54-E64 HydrophobicContact CE1-CG 4.11Å; F54-E64 WeakPolarHBondContact O-CG 3.07Å; G62-E64 PolarHBondContact O-N 3.14Å; E64-C67 PolarHBondContact O-N 3.19Å; E64-Y68 VanDerWaalsContact O-CB 3.26Å; E64-Y68 WeakPolarHBondContact O-CB 3.44Å; E64-Y68 PolarHBondContact O-N 2.84Å
65	N	94.7	Very high	93.9	Very high	117 Å²	117	63.7 Å²	63.7	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-62.4	-46.6	-179.9	-66.5	-7.8	0	0	0	112.4	G62 C63 Y68 D69	G62-N65 PolarHBondContact O-N 3.18Å; C63-N65 VanDerWaalsContact C-N 3.34Å; C63-N65 PolarHBondContact O-N 2.93Å; N65-Y68 PolarHBondContact O-N 2.91Å; N65-D69 WeakPolarHBondContact O-CB 3.29Å; N65-D69 PolarHBondContact O-N 2.55Å
66	V	95.7	Very high	93.6	Very high	49 Å²	49	60 Å²	60	30%	0.297	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-35.4	-179.3	-60.3	0	0	0	0	112	G62 C63 S70 L167	G62-V66 PolarHBondContact O-N 3.22Å; C63-V66 WeakPolarHBondContact O-CG2 3.3Å; C63-V66 PolarHBondContact O-N 3.47Å; V66-S70 WeakPolarHBondContact O-CB 3.45Å; V66-S70 PolarHBondContact O-N 2.83Å; V66-L167 HydrophobicContact CG2-CB 4.16Å
67	C	95.4	Very high	93.3	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-69.5	-41.4	176.6	-66.6	0	0	0	0	111.1	F54 C63 E64 S70 I71 C165 C170	F54-C67 HydrophobicContact CE1-CB 4.2Å; F54-C67 HydrophobicContact CZ-CB 4.29Å; C63-C67 WeakPolarHBondContact O-CB 3.39Å; C63-C67 PolarHBondContact O-N 3Å; C63-C67 PolarHBondContact O-SG 3.35Å; E64-C67 PolarHBondContact O-N 3.19Å; C67-S70 PolarHBondContact O-N 3.28Å; C67-I71 WeakPolarHBondContact O-CB 3.47Å; C67-I71 WeakPolarHBondContact O-CD1 3.3Å; C67-I71 VanDerWaalsContact O-CG1 3.23Å; C67-I71 WeakPolarHBondContact O-CG1 3.28Å; C67-I71 PolarHBondContact O-N 2.97Å; C67-C165 VanDerWaalsContact CA-SG 3.51Å; C67-C165 HydrophobicContact CB-CB 3.72Å; C67-C165 WeakPolarHBondContact CB-SG 3.21Å; C67-C165 WeakPolarHBondContact SG-CB 3.27Å; C67-C165 CovalentContact SG-SG 2.03Å; C67-C165 PolarHBondContact SG-SG 3.49Å; C67-C170 PolarHBondContact SG-SG 3.44Å
68	Y	94.1	Very high	93.1	Very high	49 Å²	49	63.5 Å²	63.5	19%	0.192	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-50.2	174.4	178.3	-94.6	0	0	0	111.4	E50 F54 E64 N65 S70 I71 F72	E50-Y68 HydrophobicContact CG-CE2 3.86Å; F54-Y68 HydrophobicContact CB-CD2 3.87Å; F54-Y68 HydrophobicContact CB-CE2 4.4Å; F54-Y68 AromaticContact CD1-CD2 3.93Å; F54-Y68 HydrophobicContact CD1-CD2 3.93Å; F54-Y68 HydrophobicContact CD1-CG 4.33Å; F54-Y68 HydrophobicContact CD2-CD2 4.15Å; F54-Y68 AromaticContact CG-CD2 3.72Å; F54-Y68 HydrophobicContact CG-CD2 3.72Å; E64-Y68 VanDerWaalsContact O-CB 3.26Å; E64-Y68 WeakPolarHBondContact O-CB 3.44Å; E64-Y68 PolarHBondContact O-N 2.84Å; N65-Y68 PolarHBondContact O-N 2.91Å; Y68-S70 VanDerWaalsContact C-N 3.32Å; Y68-S70 PolarHBondContact O-N 3.19Å; Y68-I71 PolarHBondContact O-N 2.03Å; Y68-F72 AromaticContact CD2-CD2 3.9Å; Y68-F72 HydrophobicContact CD2-CD2 3.9Å; Y68-F72 HydrophobicContact CE2-CB 4.48Å; Y68-F72 AromaticContact CE2-CD2 3.77Å; Y68-F72 HydrophobicContact CE2-CD2 3.77Å; Y68-F72 HydrophobicContact CE2-CE2 4.47Å; Y68-F72 HydrophobicContact CE2-CG 4.43Å; Y68-F72 PolarHBondContact O-N 3.42Å
69	D	94.1	Very high	92.9	Very high	107 Å²	107	62.1 Å²	62.1	57%	0.572	33%	0.325	S	S	*	.	H	α-helix	trans	-62	-39.2	-179.7	-170.4	67.1	0	0	0	112.1	N65 F72 P73	N65-D69 WeakPolarHBondContact O-CB 3.29Å; N65-D69 PolarHBondContact O-N 2.55Å; D69-F72 CarbonylContact O-C 3.37Å; D69-P73 WeakPolarHBondContact O-CA 3.37Å; D69-P73 VanDerWaalsContact O-N 3.09Å
70	S	92.7	Very high	92.8	Very high	71 Å²	71	52.2 Å²	52.2	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-71.5	-34.6	176.9	-178	0	0	0	0	114.1	V66 C67 Y68 L167	V66-S70 WeakPolarHBondContact O-CB 3.45Å; V66-S70 PolarHBondContact O-N 2.83Å; C67-S70 PolarHBondContact O-N 3.28Å; Y68-S70 VanDerWaalsContact C-N 3.32Å; Y68-S70 PolarHBondContact O-N 3.19Å; S70-L167 WeakPolarHBondContact OG-CD1 3.42Å
71	I	91.4	Very high	92.6	Very high	37 Å²	37	49.6 Å²	49.6	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-80.1	-34.6	180	-67.2	162.9	0	0	0	110.3	F54 C67 Y68 P73 I178	F54-I71 HydrophobicContact CE2-CD1 4Å; F54-I71 HydrophobicContact CZ-CD1 3.72Å; C67-I71 WeakPolarHBondContact O-CB 3.47Å; C67-I71 WeakPolarHBondContact O-CD1 3.3Å; C67-I71 VanDerWaalsContact O-CG1 3.23Å; C67-I71 WeakPolarHBondContact O-CG1 3.28Å; C67-I71 PolarHBondContact O-N 2.97Å; Y68-I71 PolarHBondContact O-N 2.03Å; I71-P73 VanDerWaalsContact C-CD 3.42Å; I71-P73 WeakPolarHBondContact O-CD 3.35Å; I71-I178 HydrophobicContact CG2-CD1 4.31Å
72	F	92.1	Very high	92.4	Very high	9 Å²	9	48.4 Å²	48.4	4%	0.039	26%	0.262	C	S	.	.			trans	-124.4	64.6	-179	-59.7	-72.1	0	0	0	111.6	F54 Y68 D69 I74 Y154 M159 I178	F54-F72 HydrophobicContact CD2-CE2 4.27Å; F54-F72 HydrophobicContact CE2-CE2 4.31Å; Y68-F72 AromaticContact CD2-CD2 3.9Å; Y68-F72 HydrophobicContact CD2-CD2 3.9Å; Y68-F72 HydrophobicContact CE2-CB 4.48Å; Y68-F72 AromaticContact CE2-CD2 3.77Å; Y68-F72 HydrophobicContact CE2-CD2 3.77Å; Y68-F72 HydrophobicContact CE2-CE2 4.47Å; Y68-F72 HydrophobicContact CE2-CG 4.43Å; Y68-F72 PolarHBondContact O-N 3.42Å; D69-F72 CarbonylContact O-C 3.37Å; F72-I74 PolarHBondContact O-N 3.22Å; F72-Y154 HydrophobicContact CD1-CE1 4.09Å; F72-M159 HydrophobicContact CE1-CE 4.28Å; F72-M159 HydrophobicContact CE1-SD 3.72Å; F72-M159 HydrophobicContact CZ-SD 3.92Å; F72-I178 HydrophobicContact CE2-CD1 4.24Å; F72-I178 HydrophobicContact CE2-CG1 4.03Å; F72-I178 HydrophobicContact CE2-CG2 4.36Å; F72-I178 HydrophobicContact CZ-CD1 3.77Å; F72-I178 HydrophobicContact CZ-CG1 3.91Å; F72-I178 HydrophobicContact CZ-CG2 3.81Å
73	P	91.2	Very high	92.3	Very high	72 Å²	72	47.2 Å²	47.2	47%	0.468	25%	0.247	S	C	.	.	S	Bend	trans	-60.1	-35	-176.8	23.9	-34.4	0	0	0	112.2	D69 I71 V153	D69-P73 WeakPolarHBondContact O-CA 3.37Å; D69-P73 VanDerWaalsContact O-N 3.09Å; I71-P73 VanDerWaalsContact C-CD 3.42Å; I71-P73 WeakPolarHBondContact O-CD 3.35Å; P73-V153 HydrophobicContact CG-CG1 4.21Å
74	I	90.8	Very high	92.1	Very high	77 Å²	77	48.1 Å²	48.1	40%	0.395	25%	0.252	S	S	.	.	S	Bend	trans	-129.5	142.5	164.3	-55.6	176	0	0	0	105.2	F72 R78 L79 Y154	F72-I74 PolarHBondContact O-N 3.22Å; I74-R78 HydrophobicContact CG2-CB 3.9Å; I74-L79 HydrophobicContact CB-CG 4.38Å; I74-L79 HydrophobicContact CD1-CD2 4.33Å; I74-L79 HydrophobicContact CG2-CD1 4.47Å; I74-L79 HydrophobicContact CG2-CD2 3.98Å; I74-L79 HydrophobicContact CG2-CG 3.76Å; I74-Y154 PolarHBondContact O-OH 2.93Å
75	S	89.3	Confident	91.8	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.063	26%	0.261	C	S	.	.			trans	-80.9	150	174.6	64.4	0	0	0	0	111.7	I77 R78 L79	S75-I77 PolarHBondContact O-N 3.49Å; S75-I77 WeakPolarHBondContact OG-CG1 3.34Å; S75-R78 WeakPolarHBondContact O-CB 3.28Å; S75-R78 PolarHBondContact O-N 2.83Å; S75-R78 WeakPolarHBondContact OG-CD 3.41Å; S75-R78 VanDerWaalsContact OG-CG 3.29Å; S75-R78 WeakPolarHBondContact OG-CG 3.39Å; S75-L79 PolarHBondContact O-N 3.24Å
76	H	89.5	Confident	91.7	Very high	2 Å²	2	48 Å²	48	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-52.3	-44.2	179.6	-72.4	75.7	0	0	0	112	W47 R78 L79 W80 Y154 M159 T188	W47-H76 HydrophobicContact CZ2-CB 4.17Å; H76-R78 VanDerWaalsContact C-N 3.3Å; H76-R78 PolarHBondContact O-N 3.05Å; H76-L79 PolarHBondContact O-N 3.41Å; H76-W80 HydrophobicContact CB-CH2 3.95Å; H76-W80 HydrophobicContact CB-CZ2 3.88Å; H76-W80 HydrophobicContact CB-CZ3 4.29Å; H76-W80 VanDerWaalsContact O-CG 3.26Å; H76-W80 PolarHBondContact O-N 3.41Å; H76-Y154 AromaticContact CD2-CD2 3.99Å; H76-Y154 AromaticContact CD2-CE2 3.69Å; H76-Y154 AromaticContact CE1-CD1 3.4Å; H76-Y154 VanDerWaalsContact CE1-CD1 3.4Å; H76-Y154 WeakPolarHBondContact CE1-CD1 3.4Å; H76-Y154 AromaticContact CE1-CD2 3.68Å; H76-Y154 AromaticContact CE1-CE1 3.15Å; H76-Y154 WeakPolarHBondContact CE1-CE1 3.33Å; H76-Y154 AromaticContact CE1-CE2 3.4Å; H76-Y154 VanDerWaalsContact CE1-CE2 3.4Å; H76-Y154 WeakPolarHBondContact CE1-CE2 3.4Å; H76-Y154 AromaticContact CE1-CG 3.64Å; H76-Y154 AromaticContact CE1-CZ 3.1Å; H76-Y154 AromaticContact CG-CE2 3.89Å; H76-Y154 AromaticContact CG-CZ 3.88Å; H76-Y154 PolarHBondContact N-OH 3.2Å; H76-Y154 AromaticContact ND1-CE1 3.69Å; H76-Y154 AromaticContact ND1-CE2 3.74Å; H76-Y154 AromaticContact ND1-CZ 3.29Å; H76-Y154 VanDerWaalsContact ND1-CZ 3.29Å; H76-Y154 PolarHBondContact ND1-OH 3.04Å; H76-Y154 AromaticContact NE2-CD1 3.84Å; H76-Y154 AromaticContact NE2-CD2 3.39Å; H76-Y154 WeakPolarHBondContact NE2-CD2 3.28Å; H76-Y154 AromaticContact NE2-CE1 3.9Å; H76-Y154 AromaticContact NE2-CE2 3.41Å; H76-Y154 WeakPolarHBondContact NE2-CE2 3.31Å; H76-Y154 AromaticContact NE2-CG 3.56Å; H76-Y154 AromaticContact NE2-CZ 3.65Å; H76-M159 WeakPolarHBondContact CE1-CE 3.34Å; H76-T188 PolarHBondContact CD2-OG1 3.2Å
77	I	88.6	Confident	91.4	Very high	36 Å²	36	45.7 Å²	45.7	19%	0.185	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-35.9	179.4	56.5	162	0	0	0	112.6	F39 A43 W47 S75 W80 A81	F39-I77 HydrophobicContact CE2-CB 4.2Å; F39-I77 WeakPolarHBondContact CE2-O 3.02Å; A43-I77 HydrophobicContact CB-CG2 4.32Å; W47-I77 HydrophobicContact CB-CD1 3.88Å; W47-I77 HydrophobicContact CB-CG1 4.19Å; W47-I77 HydrophobicContact CB-CG2 3.64Å; W47-I77 HydrophobicContact CD2-CG2 3.52Å; W47-I77 HydrophobicContact CE3-CG2 3.74Å; W47-I77 HydrophobicContact CG-CG1 4.39Å; W47-I77 HydrophobicContact CG-CG2 3.45Å; W47-I77 VanDerWaalsContact CG-CG2 3.45Å; S75-I77 PolarHBondContact O-N 3.49Å; S75-I77 WeakPolarHBondContact OG-CG1 3.34Å; I77-W80 HydrophobicContact CG2-CE3 4.2Å; I77-W80 HydrophobicContact CG2-CZ3 4.26Å; I77-W80 PolarHBondContact O-N 3.03Å; I77-A81 WeakPolarHBondContact O-CB 3.04Å; I77-A81 PolarHBondContact O-N 3.01Å
78	R	91.3	Very high	91	Very high	164 Å²	164	48.3 Å²	48.3	62%	0.619	25%	0.251	S	S	*	.	H	α-helix	trans	-69.4	-42.2	178	-71.9	173.9	-174	172.1	4	110.2	I74 S75 H76 A81 L82	I74-R78 HydrophobicContact CG2-CB 3.9Å; S75-R78 WeakPolarHBondContact O-CB 3.28Å; S75-R78 PolarHBondContact O-N 2.83Å; S75-R78 WeakPolarHBondContact OG-CD 3.41Å; S75-R78 VanDerWaalsContact OG-CG 3.29Å; S75-R78 WeakPolarHBondContact OG-CG 3.39Å; H76-R78 VanDerWaalsContact C-N 3.3Å; H76-R78 PolarHBondContact O-N 3.05Å; R78-A81 PolarHBondContact O-N 3.49Å; R78-L82 WeakPolarHBondContact O-CG 3.46Å; R78-L82 PolarHBondContact O-N 2.89Å
79	L	91.6	Very high	90.8	Very high	12 Å²	12	49 Å²	49	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-43.2	174.4	-70.4	173.8	0	0	0	111.7	I74 S75 H76 L82 Q83 V149 L150 Y154	I74-L79 HydrophobicContact CB-CG 4.38Å; I74-L79 HydrophobicContact CD1-CD2 4.33Å; I74-L79 HydrophobicContact CG2-CD1 4.47Å; I74-L79 HydrophobicContact CG2-CD2 3.98Å; I74-L79 HydrophobicContact CG2-CG 3.76Å; S75-L79 PolarHBondContact O-N 3.24Å; H76-L79 PolarHBondContact O-N 3.41Å; L79-L82 PolarHBondContact O-N 2.87Å; L79-Q83 VanDerWaalsContact O-CB 3.3Å; L79-Q83 WeakPolarHBondContact O-CB 3.49Å; L79-Q83 PolarHBondContact O-N 2.94Å; L79-V149 HydrophobicContact CD2-CG1 4.49Å; L79-L150 HydrophobicContact CD1-CD1 3.9Å; L79-Y154 HydrophobicContact CD1-CE2 3.97Å
80	W	91.4	Very high	90.6	Very high	5 Å²	5	44.3 Å²	44.3	2%	0.019	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-37.9	176.9	-62.2	-25.1	0	0	0	113.2	F39 W47 H76 I77 Q83 L84 T188 M191	F39-W80 HydrophobicContact CD2-CB 4.13Å; F39-W80 HydrophobicContact CE2-CB 4.37Å; W47-W80 HydrophobicContact CE3-CZ3 4.32Å; W47-W80 AromaticContact CH2-CH2 3.38Å; W47-W80 HydrophobicContact CH2-CH2 3.38Å; W47-W80 AromaticContact CH2-CZ3 3.49Å; W47-W80 HydrophobicContact CH2-CZ3 3.49Å; W47-W80 VanDerWaalsContact CH2-CZ3 3.49Å; W47-W80 AromaticContact CZ2-CH2 3.58Å; W47-W80 HydrophobicContact CZ2-CH2 3.58Å; W47-W80 AromaticContact CZ2-CZ3 3.85Å; W47-W80 HydrophobicContact CZ2-CZ3 3.85Å; W47-W80 HydrophobicContact CZ3-CH2 4.13Å; W47-W80 AromaticContact CZ3-CZ3 3.75Å; W47-W80 HydrophobicContact CZ3-CZ3 3.75Å; H76-W80 HydrophobicContact CB-CH2 3.95Å; H76-W80 HydrophobicContact CB-CZ2 3.88Å; H76-W80 HydrophobicContact CB-CZ3 4.29Å; H76-W80 VanDerWaalsContact O-CG 3.26Å; H76-W80 PolarHBondContact O-N 3.41Å; I77-W80 HydrophobicContact CG2-CE3 4.2Å; I77-W80 HydrophobicContact CG2-CZ3 4.26Å; I77-W80 PolarHBondContact O-N 3.03Å; W80-Q83 PolarHBondContact O-N 3.31Å; W80-L84 WeakPolarHBondContact O-CB 3.41Å; W80-L84 WeakPolarHBondContact O-CG 3.41Å; W80-L84 PolarHBondContact O-N 2.91Å; W80-T188 HydrophobicContact CZ2-CG2 4.16Å; W80-T188 WeakPolarHBondContact CZ2-OG1 3.28Å; W80-M191 HydrophobicContact CB-CE 4Å; W80-M191 HydrophobicContact CD2-CB 4.46Å; W80-M191 HydrophobicContact CD2-CE 4.19Å; W80-M191 HydrophobicContact CD2-CG 4.07Å; W80-M191 HydrophobicContact CE3-CG 4.26Å; W80-M191 HydrophobicContact CG-CE 3.89Å; W80-M191 HydrophobicContact CH2-CG 4.34Å; W80-M191 HydrophobicContact CZ2-CB 4.19Å; W80-M191 HydrophobicContact CZ2-CG 4.17Å; W80-M191 HydrophobicContact CZ3-CG 4.39Å
81	A	90.5	Very high	90.2	Very high	29 Å²	29	41.4 Å²	41.4	24%	0.24	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-48.3	174.4	0	0	0	0	0	110.9	F39 I77 R78 Q83 L84 I85	F39-A81 HydrophobicContact CE2-CB 4.06Å; F39-A81 HydrophobicContact CZ-CB 3.78Å; I77-A81 WeakPolarHBondContact O-CB 3.04Å; I77-A81 PolarHBondContact O-N 3.01Å; R78-A81 PolarHBondContact O-N 3.49Å; A81-Q83 PolarHBondContact O-N 3.47Å; A81-L84 PolarHBondContact O-N 2.98Å; A81-I85 VanDerWaalsContact O-CG1 3.31Å; A81-I85 WeakPolarHBondContact O-CG1 3.15Å; A81-I85 PolarHBondContact O-N 3.23Å
82	L	92.1	Very high	89.9	Confident	75 Å²	75	43 Å²	43	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-60.6	-45.5	175.5	-70.3	172.5	0	0	0	111.2	R78 L79 L84 I85 F86 F146	R78-L82 WeakPolarHBondContact O-CG 3.46Å; R78-L82 PolarHBondContact O-N 2.89Å; L79-L82 PolarHBondContact O-N 2.87Å; L82-L84 VanDerWaalsContact C-N 3.34Å; L82-L84 PolarHBondContact O-N 3.1Å; L82-I85 PolarHBondContact O-N 3.3Å; L82-I85 VanDerWaalsContact O-N 3.15Å; L82-F86 VanDerWaalsContact O-CD2 3.27Å; L82-F86 WeakPolarHBondContact O-CD2 3.4Å; L82-F86 PolarHBondContact O-N 3.04Å; L82-F146 HydrophobicContact CB-CE1 3.73Å; L82-F146 HydrophobicContact CB-CZ 3.77Å
83	Q	92.8	Very high	89.7	Confident	7 Å²	7	47 Å²	47	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-55	-48.2	175.9	-175.4	-175.4	1.4	0	0	111.5	R35 L79 W80 A81 I85 F86 V87 D143 F146 S195	R35-Q83 VanDerWaalsContact NH2-NE2 3.16Å; L79-Q83 VanDerWaalsContact O-CB 3.3Å; L79-Q83 WeakPolarHBondContact O-CB 3.49Å; L79-Q83 PolarHBondContact O-N 2.94Å; W80-Q83 PolarHBondContact O-N 3.31Å; A81-Q83 PolarHBondContact O-N 3.47Å; Q83-I85 VanDerWaalsContact C-N 3.35Å; Q83-I85 PolarHBondContact O-N 3.41Å; Q83-F86 PolarHBondContact O-N 2.97Å; Q83-V87 HydrophobicContact CG-CG2 4.35Å; Q83-V87 VanDerWaalsContact O-CB 3.24Å; Q83-V87 WeakPolarHBondContact O-CB 3.23Å; Q83-V87 WeakPolarHBondContact O-CG2 3.44Å; Q83-V87 PolarHBondContact O-N 3.27Å; Q83-D143 PolarHBondContact NE2-OD1 3.29Å; Q83-F146 HydrophobicContact CB-CB 4.03Å; Q83-F146 HydrophobicContact CB-CD1 4.07Å; Q83-F146 HydrophobicContact CB-CD2 3.92Å; Q83-F146 HydrophobicContact CB-CE2 4.46Å; Q83-F146 HydrophobicContact CB-CG 3.74Å; Q83-F146 HydrophobicContact CG-CB 3.82Å; Q83-F146 HydrophobicContact CG-CD2 4.03Å; Q83-F146 HydrophobicContact CG-CG 3.96Å; Q83-S195 PolarHBondContact NE2-OG 2.97Å; Q83-S195 VanDerWaalsContact NE2-OG 3.15Å
84	L	89.6	Confident	89.5	Confident	19 Å²	19	44.3 Å²	44.3	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-41	177.4	-76.3	175.2	0	0	0	112.5	V31 R35 V36 F39 W80 A81 L82 T88	V31-L84 HydrophobicContact CG1-CD2 4.19Å; R35-L84 HydrophobicContact CB-CD2 3.8Å; V36-L84 HydrophobicContact CG2-CD1 4.43Å; V36-L84 HydrophobicContact CG2-CD2 4.37Å; F39-L84 HydrophobicContact CB-CD1 4.24Å; F39-L84 HydrophobicContact CD1-CD1 4.44Å; F39-L84 HydrophobicContact CG-CD1 4.2Å; W80-L84 WeakPolarHBondContact O-CB 3.41Å; W80-L84 WeakPolarHBondContact O-CG 3.41Å; W80-L84 PolarHBondContact O-N 2.91Å; A81-L84 PolarHBondContact O-N 2.98Å; L82-L84 VanDerWaalsContact C-N 3.34Å; L82-L84 PolarHBondContact O-N 3.1Å; L84-T88 WeakPolarHBondContact O-CB 3.44Å; L84-T88 WeakPolarHBondContact O-CG2 3.05Å; L84-T88 PolarHBondContact O-N 2.95Å; L84-T88 PolarHBondContact O-OG1 3.08Å
85	I	89.9	Confident	89.2	Confident	93 Å²	93	42 Å²	42	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-53.2	177.1	-67.9	164	0	0	0	110.2	A81 L82 Q83 V87 T88 C89	A81-I85 VanDerWaalsContact O-CG1 3.31Å; A81-I85 WeakPolarHBondContact O-CG1 3.15Å; A81-I85 PolarHBondContact O-N 3.23Å; L82-I85 PolarHBondContact O-N 3.3Å; L82-I85 VanDerWaalsContact O-N 3.15Å; Q83-I85 VanDerWaalsContact C-N 3.35Å; Q83-I85 PolarHBondContact O-N 3.41Å; I85-V87 VanDerWaalsContact C-N 3.26Å; I85-V87 PolarHBondContact O-N 3.35Å; I85-T88 PolarHBondContact O-N 3.27Å; I85-T88 PolarHBondContact O-OG1 2.98Å; I85-C89 PolarHBondContact O-N 2.93Å; I85-C89 PolarHBondContact O-SG 3.36Å
86	F	91.8	Very high	89	Confident	86 Å²	86	43.4 Å²	43.4	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-32.2	-178.1	-83.6	-78.2	0	0	0	113	L82 Q83 P90 F142 F146	L82-F86 VanDerWaalsContact O-CD2 3.27Å; L82-F86 WeakPolarHBondContact O-CD2 3.4Å; L82-F86 PolarHBondContact O-N 3.04Å; Q83-F86 PolarHBondContact O-N 2.97Å; F86-P90 WeakPolarHBondContact O-CD 3.32Å; F86-F142 HydrophobicContact CB-CB 4.2Å; F86-F142 HydrophobicContact CB-CD1 4.28Å; F86-F142 HydrophobicContact CB-CD2 4.05Å; F86-F142 HydrophobicContact CB-CG 3.94Å; F86-F142 HydrophobicContact CD1-CD1 4.17Å; F86-F142 HydrophobicContact CD1-CD2 4.43Å; F86-F142 AromaticContact CD1-CE1 3.84Å; F86-F142 HydrophobicContact CD1-CE1 3.84Å; F86-F142 HydrophobicContact CD1-CE2 4.12Å; F86-F142 HydrophobicContact CD1-CG 4.47Å; F86-F142 AromaticContact CD1-CZ 3.83Å; F86-F142 HydrophobicContact CD1-CZ 3.83Å; F86-F142 HydrophobicContact CE1-CE1 4.39Å; F86-F142 HydrophobicContact CE1-CZ 4.44Å; F86-F142 HydrophobicContact CG-CD1 4.43Å; F86-F142 WeakPolarHBondContact O-CD2 3.44Å; F86-F146 HydrophobicContact CB-CE2 3.96Å; F86-F146 AromaticContact CD2-CE2 3.77Å; F86-F146 HydrophobicContact CD2-CE2 3.77Å; F86-F146 AromaticContact CD2-CZ 3.7Å; F86-F146 HydrophobicContact CD2-CZ 3.7Å; F86-F146 HydrophobicContact CE2-CZ 4.24Å; F86-F146 HydrophobicContact CG-CE2 4.07Å; F86-F146 HydrophobicContact CG-CZ 4.44Å
87	V	90.1	Very high	88.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-78.1	-30.2	178.3	171	0	0	0	0	112.4	W27 Q83 I85 F142 D143	W27-V87 HydrophobicContact CH2-CG1 3.68Å; W27-V87 HydrophobicContact CZ2-CG1 3.37Å; Q83-V87 HydrophobicContact CG-CG2 4.35Å; Q83-V87 VanDerWaalsContact O-CB 3.24Å; Q83-V87 WeakPolarHBondContact O-CB 3.23Å; Q83-V87 WeakPolarHBondContact O-CG2 3.44Å; Q83-V87 PolarHBondContact O-N 3.27Å; I85-V87 VanDerWaalsContact C-N 3.26Å; I85-V87 PolarHBondContact O-N 3.35Å; V87-F142 HydrophobicContact CG2-CB 4.37Å; V87-D143 HydrophobicContact CG2-CB 4.43Å; V87-D143 WeakPolarHBondContact CG2-OD1 3.04Å
88	T	85.9	Confident	88.7	Confident	55 Å²	55	44.2 Å²	44.2	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-78.2	-35.5	177.1	52.2	0	0	0	0	112.3	L84 I85 S91 L92	L84-T88 WeakPolarHBondContact O-CB 3.44Å; L84-T88 WeakPolarHBondContact O-CG2 3.05Å; L84-T88 PolarHBondContact O-N 2.95Å; L84-T88 PolarHBondContact O-OG1 3.08Å; I85-T88 PolarHBondContact O-N 3.27Å; I85-T88 PolarHBondContact O-OG1 2.98Å; T88-S91 WeakPolarHBondContact O-CA 3.35Å; T88-S91 VanDerWaalsContact O-CB 3.25Å; T88-S91 WeakPolarHBondContact O-CB 3.4Å; T88-S91 PolarHBondContact O-N 2.9Å; T88-L92 PolarHBondContact O-N 2.89Å; T88-L92 VanDerWaalsContact O-N 3.09Å
89	C	89.2	Confident	88.5	Confident	64 Å²	64	43.7 Å²	43.7	43%	0.432	24%	0.239	S	C	.	.	H	α-helix	trans	-49.9	-50.6	-179.8	-78.1	0	0	0	0	114.5	I85 S91 L92 M93	I85-C89 PolarHBondContact O-N 2.93Å; I85-C89 PolarHBondContact O-SG 3.36Å; C89-S91 VanDerWaalsContact C-N 3.28Å; C89-S91 PolarHBondContact O-N 3.44Å; C89-L92 PolarHBondContact O-N 2.89Å; C89-M93 PolarHBondContact O-N 3.27Å
90	P	90.6	Very high	88.2	Confident	9 Å²	9	50 Å²	50	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-32.4	176.4	-24.4	32.4	0	0	0	113.8	F86 V94 F138 K139 F142	F86-P90 WeakPolarHBondContact O-CD 3.32Å; P90-V94 WeakPolarHBondContact O-CG2 3.27Å; P90-V94 PolarHBondContact O-N 3.18Å; P90-V94 VanDerWaalsContact O-N 3.16Å; P90-F138 HydrophobicContact CB-CB 4.48Å; P90-F138 HydrophobicContact CG-CB 3.95Å; P90-K139 HydrophobicContact CB-CG 4.05Å; P90-K139 HydrophobicContact CG-CG 4.2Å; P90-F142 HydrophobicContact CG-CE2 4.46Å
91	S	85.2	Confident	87.9	Confident	10 Å²	10	50.9 Å²	50.9	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-44.9	175.5	-51.1	0	0	0	0	111	T88 C89 M93 V94 V95 K139	T88-S91 WeakPolarHBondContact O-CA 3.35Å; T88-S91 VanDerWaalsContact O-CB 3.25Å; T88-S91 WeakPolarHBondContact O-CB 3.4Å; T88-S91 PolarHBondContact O-N 2.9Å; C89-S91 VanDerWaalsContact C-N 3.28Å; C89-S91 PolarHBondContact O-N 3.44Å; S91-M93 VanDerWaalsContact C-N 3.34Å; S91-V94 PolarHBondContact O-N 3.38Å; S91-V95 PolarHBondContact O-N 3.1Å; S91-V95 VanDerWaalsContact O-N 3.13Å; S91-K139 WeakPolarHBondContact OG-CE 3.29Å; S91-K139 PolarHBondContact OG-NZ 3.43Å
92	L	84.5	Confident	87.6	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.366	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-39.6	178.8	-63.2	-174.9	0	0	0	111.4	L12 T88 C89 V94 V95 G96	L12-L92 HydrophobicContact CB-CD2 4.23Å; L12-L92 HydrophobicContact CD1-CD2 4.5Å; L12-L92 HydrophobicContact CD2-CD2 3.7Å; L12-L92 HydrophobicContact CG-CD2 4.34Å; T88-L92 PolarHBondContact O-N 2.89Å; T88-L92 VanDerWaalsContact O-N 3.09Å; C89-L92 PolarHBondContact O-N 2.89Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 3.28Å; L92-V95 PolarHBondContact O-N 3.35Å; L92-G96 PolarHBondContact O-N 3.15Å
93	M	88.3	Confident	87.4	Confident	94 Å²	94	54.7 Å²	54.7	46%	0.463	28%	0.275	S	S	.	.	H	α-helix	trans	-57.6	-44.8	174	-178.6	-172.1	65.3	0	0	111.7	C89 S91 G96 H97	C89-M93 PolarHBondContact O-N 3.27Å; S91-M93 VanDerWaalsContact C-N 3.34Å; M93-G96 PolarHBondContact O-N 2.75Å; M93-H97 WeakPolarHBondContact O-CB 3.47Å; M93-H97 PolarHBondContact O-N 3.24Å
94	V	87.1	Confident	87.1	Confident	14 Å²	14	58.6 Å²	58.6	9%	0.085	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-46.9	177.7	169.7	0	0	0	0	111.4	P90 S91 L92 G96 H97 V98 Y132 S135	P90-V94 WeakPolarHBondContact O-CG2 3.27Å; P90-V94 PolarHBondContact O-N 3.18Å; P90-V94 VanDerWaalsContact O-N 3.16Å; S91-V94 PolarHBondContact O-N 3.38Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 3.28Å; V94-G96 VanDerWaalsContact C-N 3.35Å; V94-H97 PolarHBondContact O-N 2.76Å; V94-V98 WeakPolarHBondContact O-CG2 3.37Å; V94-V98 PolarHBondContact O-N 3.49Å; V94-Y132 HydrophobicContact CG1-CD2 3.92Å; V94-Y132 HydrophobicContact CG1-CE2 4.45Å; V94-Y132 HydrophobicContact CG2-CD2 4.3Å; V94-S135 WeakPolarHBondContact CG2-OG 3.18Å
95	V	84.3	Confident	86.9	Confident	28 Å²	28	58.3 Å²	58.3	17%	0.17	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-43.3	178.4	173.3	0	0	0	0	111.1	V16 S91 L92 H97 V98 K99	V16-V95 HydrophobicContact CB-CG2 4.05Å; V16-V95 HydrophobicContact CG2-CG2 3.51Å; S91-V95 PolarHBondContact O-N 3.1Å; S91-V95 VanDerWaalsContact O-N 3.13Å; L92-V95 PolarHBondContact O-N 3.35Å; V95-H97 VanDerWaalsContact C-N 3.33Å; V95-H97 PolarHBondContact O-N 3.28Å; V95-V98 PolarHBondContact O-N 3.1Å; V95-K99 WeakPolarHBondContact O-CB 3.46Å; V95-K99 PolarHBondContact O-N 3.48Å
96	G	85.8	Confident	86.6	Confident	39 Å²	39	59.8 Å²	59.8	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-58.6	-44.2	174.5	0	0	0	0	0	112	L92 M93 V94 K99 Y100	L92-G96 PolarHBondContact O-N 3.15Å; M93-G96 PolarHBondContact O-N 2.75Å; V94-G96 VanDerWaalsContact C-N 3.35Å; G96-K99 PolarHBondContact O-N 3.45Å; G96-Y100 VanDerWaalsContact O-CB 3.29Å; G96-Y100 WeakPolarHBondContact O-CB 3.32Å; G96-Y100 PolarHBondContact O-N 2.85Å
97	H	86.8	Confident	86.4	Confident	53 Å²	53	60.8 Å²	60.8	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-40.1	176.3	-178.2	-148.2	0	0	0	112.5	M93 V94 V95 R101 L128 T131	M93-H97 WeakPolarHBondContact O-CB 3.47Å; M93-H97 PolarHBondContact O-N 3.24Å; V94-H97 PolarHBondContact O-N 2.76Å; V95-H97 VanDerWaalsContact C-N 3.33Å; V95-H97 PolarHBondContact O-N 3.28Å; H97-R101 WeakPolarHBondContact O-CG 3.49Å; H97-R101 PolarHBondContact O-N 2.88Å; H97-L128 WeakPolarHBondContact ND1-CD1 3.32Å; H97-T131 PolarHBondContact CE1-OG1 3.04Å; H97-T131 WeakPolarHBondContact ND1-CG2 3.19Å; H97-T131 PolarHBondContact ND1-OG1 2.96Å
98	V	85.2	Confident	86.2	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-50.4	173.7	174.6	0	0	0	0	110.7	Y19 V94 V95 Y100 R101 E102 L128	Y19-V98 HydrophobicContact CD1-CG1 3.76Å; Y19-V98 HydrophobicContact CD2-CG1 4.19Å; Y19-V98 HydrophobicContact CE1-CG1 3.57Å; Y19-V98 HydrophobicContact CE2-CG1 4.07Å; Y19-V98 HydrophobicContact CG-CG1 4.07Å; Y19-V98 HydrophobicContact CG-CG2 4.46Å; V94-V98 WeakPolarHBondContact O-CG2 3.37Å; V94-V98 PolarHBondContact O-N 3.49Å; V95-V98 PolarHBondContact O-N 3.1Å; V98-Y100 VanDerWaalsContact C-N 3.31Å; V98-Y100 PolarHBondContact O-N 2.9Å; V98-R101 PolarHBondContact O-N 2.91Å; V98-R101 VanDerWaalsContact O-N 3.11Å; V98-E102 HydrophobicContact CG1-CG 4.38Å; V98-E102 WeakPolarHBondContact O-CG 3.36Å; V98-E102 PolarHBondContact O-N 3Å; V98-L128 HydrophobicContact CG2-CD1 3.8Å; V98-L128 HydrophobicContact CG2-CD2 4.01Å; V98-L128 HydrophobicContact CG2-CG 4.49Å
99	K	85.1	Confident	86.2	Confident	152 Å²	152	63.1 Å²	63.1	66%	0.661	31%	0.309	S	S	*	.	H	α-helix	trans	-61.8	-40	-179	-168.9	177.1	-172.9	179.7	0	111.9	V95 G96 E102 K103	V95-K99 WeakPolarHBondContact O-CB 3.46Å; V95-K99 PolarHBondContact O-N 3.48Å; G96-K99 PolarHBondContact O-N 3.45Å; K99-E102 PolarHBondContact O-N 2.84Å; K99-K103 WeakPolarHBondContact O-CB 3.48Å; K99-K103 PolarHBondContact O-N 3.39Å
100	Y	86.7	Confident	86	Confident	144 Å²	144	65.7 Å²	65.7	57%	0.565	32%	0.323	S	S	*	.	H	α-helix	trans	-60.7	-44.3	174	176.7	-100.3	0	0	0	111.7	G96 V98 K103 K104	G96-Y100 VanDerWaalsContact O-CB 3.29Å; G96-Y100 WeakPolarHBondContact O-CB 3.32Å; G96-Y100 PolarHBondContact O-N 2.85Å; V98-Y100 VanDerWaalsContact C-N 3.31Å; V98-Y100 PolarHBondContact O-N 2.9Å; Y100-K103 PolarHBondContact O-N 2.9Å; Y100-K104 HydrophobicContact CE1-CD 4.46Å; Y100-K104 WeakPolarHBondContact O-CB 3.33Å; Y100-K104 PolarHBondContact O-N 2.99Å
101	R	85.4	Confident	85.8	Confident	25 Å²	25	69.6 Å²	69.6	9%	0.094	35%	0.35	C	S	.	.	H	α-helix	trans	-67.1	-38.4	177.3	-73.8	-174.5	66.6	178.9	-3.8	113.1	H97 V98 D105 Y118 L128	H97-R101 WeakPolarHBondContact O-CG 3.49Å; H97-R101 PolarHBondContact O-N 2.88Å; V98-R101 PolarHBondContact O-N 2.91Å; V98-R101 VanDerWaalsContact O-N 3.11Å; R101-D105 WeakPolarHBondContact O-CB 3.48Å; R101-D105 PolarHBondContact O-N 3.02Å; R101-Y118 HydrophobicContact CB-CE2 4.37Å; R101-Y118 HydrophobicContact CG-CE2 4.35Å; R101-L128 VanDerWaalsContact NH1-CB 3.3Å
102	E	84.4	Confident	85.8	Confident	61 Å²	61	72.8 Å²	72.8	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-46.3	174.4	-73.8	178.1	166	0	0	111.1	Y19 V98 K99 K104 D105 M106 P121	Y19-E102 WeakPolarHBondContact CE1-OE1 3.46Å; Y19-E102 PolarHBondContact OH-OE1 3.38Å; Y19-E102 PolarHBondContact OH-OE2 2.86Å; Y19-E102 VanDerWaalsContact OH-OE2 3.14Å; V98-E102 HydrophobicContact CG1-CG 4.38Å; V98-E102 WeakPolarHBondContact O-CG 3.36Å; V98-E102 PolarHBondContact O-N 3Å; K99-E102 PolarHBondContact O-N 2.84Å; E102-K104 PolarHBondContact O-N 2.99Å; E102-D105 PolarHBondContact O-N 3.37Å; E102-M106 PolarHBondContact O-N 2.95Å; E102-P121 HydrophobicContact CG-CB 3.89Å; E102-P121 HydrophobicContact CG-CG 3.92Å
103	K	87.4	Confident	85.7	Confident	123 Å²	123	79.4 Å²	79.4	54%	0.535	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-46.9	176.9	-173.6	-179	176.5	-173.6	0	111.8	K99 Y100 D105 M106 E107	K99-K103 WeakPolarHBondContact O-CB 3.48Å; K99-K103 PolarHBondContact O-N 3.39Å; Y100-K103 PolarHBondContact O-N 2.9Å; K103-D105 VanDerWaalsContact C-N 3.34Å; K103-D105 PolarHBondContact O-N 3.48Å; K103-M106 WeakPolarHBondContact O-CB 3.1Å; K103-M106 PolarHBondContact O-N 3.4Å; K103-E107 WeakPolarHBondContact CE-OE1 3.21Å; K103-E107 PolarHBondContact O-N 3.19Å
104	K	86.1	Confident	85.1	Confident	89 Å²	89	77.1 Å²	77.1	39%	0.387	39%	0.39	S	S	.	.	H	α-helix	trans	-64.9	-36.6	179.5	-167.7	176	-176.6	170.3	0	112.7	Y100 E102 Y108	Y100-K104 HydrophobicContact CE1-CD 4.46Å; Y100-K104 WeakPolarHBondContact O-CB 3.33Å; Y100-K104 PolarHBondContact O-N 2.99Å; E102-K104 PolarHBondContact O-N 2.99Å; K104-Y108 WeakPolarHBondContact O-CB 3.47Å; K104-Y108 PolarHBondContact O-N 2.97Å; K104-Y108 VanDerWaalsContact O-N 3.08Å
105	D	85.4	Confident	84.6	Confident	12 Å²	12	83.6 Å²	83.6	6%	0.064	42%	0.417	C	S	.	.	H	α-helix	trans	-66.6	-40.7	175.5	-168.1	65.5	0	0	0	111.7	R101 E102 K103 Y108 S109 H116 L117 Y118	R101-D105 WeakPolarHBondContact O-CB 3.48Å; R101-D105 PolarHBondContact O-N 3.02Å; E102-D105 PolarHBondContact O-N 3.37Å; K103-D105 VanDerWaalsContact C-N 3.34Å; K103-D105 PolarHBondContact O-N 3.48Å; D105-Y108 PolarHBondContact O-N 3.47Å; D105-S109 WeakPolarHBondContact O-CB 3.49Å; D105-S109 PolarHBondContact O-N 3.43Å; D105-H116 IonicContact OD2-CE1 3.29Å; D105-H116 IonicContact OD2-CG 3.8Å; D105-H116 IonicContact OD2-ND1 3.24Å; D105-H116 PolarHBondContact OD2-ND1 3.39Å; D105-L117 PolarHBondContact OD1-N 2.91Å; D105-Y118 HydrophobicContact CB-CD2 4.28Å; D105-Y118 PolarHBondContact OD1-N 3.38Å
106	M	84.6	Confident	84.2	Confident	124 Å²	124	87.9 Å²	87.9	61%	0.611	44%	0.435	S	S	*	.	H	α-helix	trans	-62.7	-47.6	176.7	-173.9	175.7	70	0	0	111.7	E102 K103 Y108 S109 T110	E102-M106 PolarHBondContact O-N 2.95Å; K103-M106 WeakPolarHBondContact O-CB 3.1Å; K103-M106 PolarHBondContact O-N 3.4Å; M106-Y108 VanDerWaalsContact C-N 3.33Å; M106-Y108 PolarHBondContact O-N 2.89Å; M106-S109 PolarHBondContact O-N 3.09Å; M106-T110 PolarHBondContact O-N 3.2Å; M106-T110 VanDerWaalsContact O-N 3.12Å; M106-T110 PolarHBondContact O-OG1 3.44Å; M106-T110 VanDerWaalsContact O-OG1 3.08Å
107	E	86.9	Confident	83.5	Confident	108 Å²	108	89.4 Å²	89.4	51%	0.505	43%	0.434	S	S	.	.	H	α-helix	trans	-60.1	-42.3	176.1	-72.9	171.7	-177.5	0	0	111.8	K103 S111	K103-E107 WeakPolarHBondContact CE-OE1 3.21Å; K103-E107 PolarHBondContact O-N 3.19Å; E107-S111 PolarHBondContact O-N 2.86Å
108	Y	85.3	Confident	82.5	Confident	82 Å²	82	90.3 Å²	90.3	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-43.6	178.3	-170.2	-92.6	0	0	0	112.5	K104 D105 M106 T110 S111 H112 K115 L117	K104-Y108 WeakPolarHBondContact O-CB 3.47Å; K104-Y108 PolarHBondContact O-N 2.97Å; K104-Y108 VanDerWaalsContact O-N 3.08Å; D105-Y108 PolarHBondContact O-N 3.47Å; M106-Y108 VanDerWaalsContact C-N 3.33Å; M106-Y108 PolarHBondContact O-N 2.89Å; Y108-T110 PolarHBondContact O-N 3.28Å; Y108-S111 PolarHBondContact O-N 3.22Å; Y108-H112 HydrophobicContact CD1-CB 4.47Å; Y108-H112 AromaticContact CD2-CE1 3.92Å; Y108-H112 AromaticContact CD2-ND1 3.83Å; Y108-H112 HydrophobicContact CE1-CB 4.15Å; Y108-H112 AromaticContact CE1-CG 3.88Å; Y108-H112 AromaticContact CE1-ND1 3.98Å; Y108-H112 AromaticContact CE2-CE1 3.4Å; Y108-H112 WeakPolarHBondContact CE2-CE1 3.47Å; Y108-H112 AromaticContact CE2-ND1 3.6Å; Y108-H112 AromaticContact CE2-NE2 3.83Å; Y108-H112 AromaticContact CZ-CD2 3.81Å; Y108-H112 AromaticContact CZ-CE1 3.7Å; Y108-H112 AromaticContact CZ-CG 3.76Å; Y108-H112 AromaticContact CZ-ND1 3.68Å; Y108-H112 AromaticContact CZ-NE2 3.76Å; Y108-H112 PolarHBondContact O-N 3.44Å; Y108-H112 PolarHBondContact O-ND1 2.95Å; Y108-K115 WeakPolarHBondContact CD1-O 3.47Å; Y108-L117 HydrophobicContact CD1-CB 3.67Å; Y108-L117 HydrophobicContact CD1-CD1 4.4Å; Y108-L117 HydrophobicContact CD2-CB 4.48Å; Y108-L117 HydrophobicContact CD2-CD1 4.3Å; Y108-L117 HydrophobicContact CD2-CD2 4.43Å; Y108-L117 HydrophobicContact CE1-CB 4.18Å; Y108-L117 HydrophobicContact CE1-CD1 4.21Å; Y108-L117 HydrophobicContact CE2-CD1 4.13Å; Y108-L117 HydrophobicContact CG-CB 3.83Å; Y108-L117 HydrophobicContact CG-CD1 4.44Å; Y108-L117 HydrophobicContact CG-CD2 4.44Å; Y108-L117 HydrophobicContact CG-CG 4.46Å
109	S	85.8	Confident	81.2	Confident	22 Å²	22	95 Å²	95	15%	0.154	48%	0.475	C	S	.	.	H	α-helix	trans	-60.5	-42.5	178.5	178.4	0	0	0	0	112.3	D105 M106 S111 H112 K113 G114 K115	D105-S109 WeakPolarHBondContact O-CB 3.49Å; D105-S109 PolarHBondContact O-N 3.43Å; M106-S109 PolarHBondContact O-N 3.09Å; S109-S111 VanDerWaalsContact C-N 3.35Å; S109-S111 PolarHBondContact O-N 3.28Å; S109-H112 PolarHBondContact O-N 2.93Å; S109-K113 PolarHBondContact O-N 3.27Å; S109-G114 PolarHBondContact O-N 3.15Å; S109-K115 WeakPolarHBondContact CA-O 3.41Å
110	T	85.1	Confident	80.1	Confident	118 Å²	118	95.9 Å²	95.9	72%	0.724	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-42.7	175.4	-56	0	0	0	0	111.5	M106 Y108	M106-T110 PolarHBondContact O-N 3.2Å; M106-T110 VanDerWaalsContact O-N 3.12Å; M106-T110 PolarHBondContact O-OG1 3.44Å; M106-T110 VanDerWaalsContact O-OG1 3.08Å; Y108-T110 PolarHBondContact O-N 3.28Å
111	S	85.9	Confident	78.9	Confident	90 Å²	90	90.3 Å²	90.3	63%	0.629	46%	0.455	S	S	*	.	H	α-helix	trans	-70.8	-32.2	-180	176	0	0	0	0	113.3	E107 Y108 S109	E107-S111 PolarHBondContact O-N 2.86Å; Y108-S111 PolarHBondContact O-N 3.22Å; S109-S111 VanDerWaalsContact C-N 3.35Å; S109-S111 PolarHBondContact O-N 3.28Å
112	H	86.4	Confident	77.6	Confident	77 Å²	77	90.6 Å²	90.6	36%	0.356	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	31.1	-173.4	-69.1	71	0	0	0	114.1	Y108 S109 G114 K115	Y108-H112 HydrophobicContact CD1-CB 4.47Å; Y108-H112 AromaticContact CD2-CE1 3.92Å; Y108-H112 AromaticContact CD2-ND1 3.83Å; Y108-H112 HydrophobicContact CE1-CB 4.15Å; Y108-H112 AromaticContact CE1-CG 3.88Å; Y108-H112 AromaticContact CE1-ND1 3.98Å; Y108-H112 AromaticContact CE2-CE1 3.4Å; Y108-H112 WeakPolarHBondContact CE2-CE1 3.47Å; Y108-H112 AromaticContact CE2-ND1 3.6Å; Y108-H112 AromaticContact CE2-NE2 3.83Å; Y108-H112 AromaticContact CZ-CD2 3.81Å; Y108-H112 AromaticContact CZ-CE1 3.7Å; Y108-H112 AromaticContact CZ-CG 3.76Å; Y108-H112 AromaticContact CZ-ND1 3.68Å; Y108-H112 AromaticContact CZ-NE2 3.76Å; Y108-H112 PolarHBondContact O-N 3.44Å; Y108-H112 PolarHBondContact O-ND1 2.95Å; S109-H112 PolarHBondContact O-N 2.93Å; H112-G114 VanDerWaalsContact C-N 3.35Å; H112-G114 PolarHBondContact O-N 2.97Å; H112-K115 HydrophobicContact CB-CB 3.99Å; H112-K115 WeakPolarHBondContact O-CG 3.49Å; H112-K115 PolarHBondContact O-N 3.41Å
113	K	81.5	Confident	76.7	Confident	210 Å²	210	91.8 Å²	91.8	91%	0.913	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	48	176.4	-61.8	-176.1	178.7	-177.4	0	113.1	S109	S109-K113 PolarHBondContact O-N 3.27Å
114	G	76.4	Confident	75.5	Confident	45 Å²	45	88.3 Å²	88.3	46%	0.464	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	6.9	175	0	0	0	0	0	115.6	S109 H112	S109-G114 PolarHBondContact O-N 3.15Å; H112-G114 VanDerWaalsContact C-N 3.35Å; H112-G114 PolarHBondContact O-N 2.97Å
115	K	76.8	Confident	74.5	Confident	150 Å²	150	90.6 Å²	90.6	65%	0.652	46%	0.461	S	S	*	.			trans	-78.4	124.4	171.8	-67.5	-178.3	-179.4	179.8	0	110.4	Y108 S109 H112	Y108-K115 WeakPolarHBondContact CD1-O 3.47Å; S109-K115 WeakPolarHBondContact CA-O 3.41Å; H112-K115 HydrophobicContact CB-CB 3.99Å; H112-K115 WeakPolarHBondContact O-CG 3.49Å; H112-K115 PolarHBondContact O-N 3.41Å
116	H	76.1	Confident	74.1	Confident	119 Å²	119	92.6 Å²	92.6	55%	0.551	49%	0.485	S	S	*	.			trans	-87.4	134.5	178.2	-70.2	-86.3	0	0	0	112.2	D105	D105-H116 IonicContact OD2-CE1 3.29Å; D105-H116 IonicContact OD2-CG 3.8Å; D105-H116 IonicContact OD2-ND1 3.24Å; D105-H116 PolarHBondContact OD2-ND1 3.39Å
117	L	69.7	Low	73.7	Confident	71 Å²	71	89 Å²	89	37%	0.372	48%	0.479	S	S	.	.	S	Bend	trans	-74.2	-33.5	174.7	-171.5	64.9	0	0	0	111	D105 Y108	D105-L117 PolarHBondContact OD1-N 2.91Å; Y108-L117 HydrophobicContact CD1-CB 3.67Å; Y108-L117 HydrophobicContact CD1-CD1 4.4Å; Y108-L117 HydrophobicContact CD2-CB 4.48Å; Y108-L117 HydrophobicContact CD2-CD1 4.3Å; Y108-L117 HydrophobicContact CD2-CD2 4.43Å; Y108-L117 HydrophobicContact CE1-CB 4.18Å; Y108-L117 HydrophobicContact CE1-CD1 4.21Å; Y108-L117 HydrophobicContact CE2-CD1 4.13Å; Y108-L117 HydrophobicContact CG-CB 3.83Å; Y108-L117 HydrophobicContact CG-CD1 4.44Å; Y108-L117 HydrophobicContact CG-CD2 4.44Å; Y108-L117 HydrophobicContact CG-CG 4.46Å
118	Y	65.6	Low	73.5	Confident	72 Å²	72	84 Å²	84	28%	0.282	46%	0.456	S	S	.	.	S	Bend	trans	-123.4	113.8	175.9	-60.9	-60.7	0	0	0	110.4	R101 D105 R120	R101-Y118 HydrophobicContact CB-CE2 4.37Å; R101-Y118 HydrophobicContact CG-CE2 4.35Å; D105-Y118 HydrophobicContact CB-CD2 4.28Å; D105-Y118 PolarHBondContact OD1-N 3.38Å; Y118-R120 PolarHBondContact O-N 3.4Å
119	A	59.4	Low	73.5	Confident	102 Å²	102	82 Å²	82	84%	0.843	45%	0.448	S	S	*	.	S	Bend	trans	-53.9	-28.4	178.9	0	0	0	0	0	114.4
120	R	61.9	Low	73.5	Confident	170 Å²	170	88.3 Å²	88.3	64%	0.642	47%	0.468	S	S	*	.			trans	-152.8	94.4	171.7	-64.3	-170.2	-173	-176	4.7	111	Y118 G122 K123	Y118-R120 PolarHBondContact O-N 3.4Å; R120-G122 VanDerWaalsContact C-N 3.33Å; R120-G122 PolarHBondContact O-N 2.87Å; R120-K123 HydrophobicContact CB-CB 3.77Å; R120-K123 HydrophobicContact CB-CD 4.45Å; R120-K123 PolarHBondContact O-N 3.25Å; R120-K123 VanDerWaalsContact O-N 3.16Å
121	P	60.3	Low	73.7	Confident	27 Å²	27	84.6 Å²	84.6	18%	0.175	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-34	-173.5	20.7	-30.8	0	0	0	114	E102	E102-P121 HydrophobicContact CG-CB 3.89Å; E102-P121 HydrophobicContact CG-CG 3.92Å
122	G	58.4	Low	73.8	Confident	30 Å²	30	80.8 Å²	80.8	31%	0.309	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-5.7	177.7	0	0	0	0	0	115.7	R120	R120-G122 VanDerWaalsContact C-N 3.33Å; R120-G122 PolarHBondContact O-N 2.87Å
123	K	64.9	Low	74	Confident	87 Å²	87	77.9 Å²	77.9	38%	0.378	41%	0.405	S	S	.	.	S	Bend	trans	-85.5	125.5	-178.1	-160.6	164.7	-172.4	171.5	0	109.4	R120 R125	R120-K123 HydrophobicContact CB-CB 3.77Å; R120-K123 HydrophobicContact CB-CD 4.45Å; R120-K123 PolarHBondContact O-N 3.25Å; R120-K123 VanDerWaalsContact O-N 3.16Å; K123-R125 VanDerWaalsContact C-N 3.26Å; K123-R125 PolarHBondContact O-N 3.42Å
124	K	63.8	Low	74.5	Confident	49 Å²	49	70.2 Å²	70.2	21%	0.213	38%	0.375	C	S	.	.			trans	-58.5	76.2	178.4	-57	-177	-176	-170.1	0	112.6	Y132 E205	K124-Y132 HydrophobicContact CD-CD1 4.32Å; K124-Y132 HydrophobicContact CD-CD2 4.46Å; K124-Y132 HydrophobicContact CD-CG 4.27Å; K124-Y132 PolarHBondContact NZ-OH 2.9Å; K124-Y132 VanDerWaalsContact NZ-OH 3.11Å; K124-E205 IonicContact NZ-OE1 2.86Å
125	R	65.1	Low	75.3	Confident	137 Å²	137	68.1 Å²	68.1	52%	0.517	35%	0.353	S	S	.	.			trans	-135.6	146.5	179.2	-78.6	-173	-177.5	-179.1	0.2	110.4	K123	K123-R125 VanDerWaalsContact C-N 3.26Å; K123-R125 PolarHBondContact O-N 3.42Å
126	G	76.9	Confident	76	Confident	55 Å²	55	61 Å²	61	57%	0.567	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	-134.9	-179.6	0	0	0	0	0	111.6	L128 W129	G126-L128 PolarHBondContact O-N 3.3Å; G126-W129 WeakPolarHBondContact O-CB 3.36Å; G126-W129 PolarHBondContact O-N 2.93Å
127	G	76.2	Confident	76.9	Confident	48 Å²	48	59.8 Å²	59.8	50%	0.495	32%	0.319	S	S	.	.	H	α-helix	trans	-59.5	-25.1	-179.3	0	0	0	0	0	115.5	W129 W130 T131	G127-W129 VanDerWaalsContact C-N 3.28Å; G127-W129 PolarHBondContact O-N 3.5Å; G127-W130 PolarHBondContact O-N 3.08Å; G127-T131 PolarHBondContact O-N 3.39Å; G127-T131 VanDerWaalsContact O-N 3.07Å; G127-T131 PolarHBondContact O-OG1 3.33Å; G127-T131 VanDerWaalsContact O-OG1 3.11Å
128	L	81.2	Confident	78.1	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-29	174.8	-167.9	61.5	0	0	0	112.7	H97 V98 R101 G126 T131 Y132	H97-L128 WeakPolarHBondContact ND1-CD1 3.32Å; V98-L128 HydrophobicContact CG2-CD1 3.8Å; V98-L128 HydrophobicContact CG2-CD2 4.01Å; V98-L128 HydrophobicContact CG2-CG 4.49Å; R101-L128 VanDerWaalsContact NH1-CB 3.3Å; G126-L128 PolarHBondContact O-N 3.3Å; L128-T131 WeakPolarHBondContact CA-OG1 3.42Å; L128-T131 PolarHBondContact O-OG1 3.21Å; L128-T131 VanDerWaalsContact O-OG1 3.07Å; L128-Y132 VanDerWaalsContact O-CB 3.31Å; L128-Y132 WeakPolarHBondContact O-CB 3.39Å; L128-Y132 PolarHBondContact O-N 3.46Å; L128-Y132 VanDerWaalsContact O-N 3.08Å
129	W	85.2	Confident	79.4	Confident	40 Å²	40	58.5 Å²	58.5	15%	0.152	31%	0.312	C	S	.	.	H	α-helix	trans	-70.6	-38.4	176.4	-177.3	78.1	0	0	0	111.1	G126 G127 Y132 L133 R213	G126-W129 WeakPolarHBondContact O-CB 3.36Å; G126-W129 PolarHBondContact O-N 2.93Å; G127-W129 VanDerWaalsContact C-N 3.28Å; G127-W129 PolarHBondContact O-N 3.5Å; W129-Y132 PolarHBondContact O-N 2.9Å; W129-L133 HydrophobicContact CH2-CD2 4.01Å; W129-L133 HydrophobicContact CZ2-CD2 4.39Å; W129-L133 HydrophobicContact CZ3-CD2 4.4Å; W129-L133 WeakPolarHBondContact O-CB 3.31Å; W129-L133 PolarHBondContact O-N 3.43Å; W129-R213 HydrophobicContact CH2-CG 4.35Å; W129-R213 HydrophobicContact CZ2-CB 4.18Å; W129-R213 HydrophobicContact CZ2-CG 4.33Å
130	W	86.6	Confident	81.1	Confident	155 Å²	155	54.2 Å²	54.2	59%	0.587	28%	0.277	S	S	*	.	H	α-helix	trans	-69.3	-46	178.2	-147.1	-122.1	0	0	0	112.1	G127 Y132 L133 V134	G127-W130 PolarHBondContact O-N 3.08Å; W130-Y132 VanDerWaalsContact C-N 3.26Å; W130-Y132 PolarHBondContact O-N 3.43Å; W130-L133 HydrophobicContact CE3-CD2 3.9Å; W130-L133 HydrophobicContact CH2-CD2 4.29Å; W130-L133 HydrophobicContact CZ3-CD2 3.6Å; W130-L133 PolarHBondContact O-N 3.45Å; W130-V134 WeakPolarHBondContact O-CB 3.3Å; W130-V134 VanDerWaalsContact O-CG2 3.3Å; W130-V134 WeakPolarHBondContact O-CG2 3.38Å; W130-V134 PolarHBondContact O-N 3.08Å
131	T	89.1	Confident	82.8	Confident	40 Å²	40	48.2 Å²	48.2	25%	0.245	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-38	173.5	49.9	0	0	0	0	112.2	H97 G127 L128 S135	H97-T131 PolarHBondContact CE1-OG1 3.04Å; H97-T131 WeakPolarHBondContact ND1-CG2 3.19Å; H97-T131 PolarHBondContact ND1-OG1 2.96Å; G127-T131 PolarHBondContact O-N 3.39Å; G127-T131 VanDerWaalsContact O-N 3.07Å; G127-T131 PolarHBondContact O-OG1 3.33Å; G127-T131 VanDerWaalsContact O-OG1 3.11Å; L128-T131 WeakPolarHBondContact CA-OG1 3.42Å; L128-T131 PolarHBondContact O-OG1 3.21Å; L128-T131 VanDerWaalsContact O-OG1 3.07Å; T131-S135 WeakPolarHBondContact O-CB 3.34Å; T131-S135 PolarHBondContact O-N 3.42Å
132	Y	88.8	Confident	84.5	Confident	9 Å²	9	50 Å²	50	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-65.5	-47	173.6	-166.1	-96.6	0	0	0	112.6	V94 K124 L128 W129 W130 S135 L136 E205 L209	V94-Y132 HydrophobicContact CG1-CD2 3.92Å; V94-Y132 HydrophobicContact CG1-CE2 4.45Å; V94-Y132 HydrophobicContact CG2-CD2 4.3Å; K124-Y132 HydrophobicContact CD-CD1 4.32Å; K124-Y132 HydrophobicContact CD-CD2 4.46Å; K124-Y132 HydrophobicContact CD-CG 4.27Å; K124-Y132 PolarHBondContact NZ-OH 2.9Å; K124-Y132 VanDerWaalsContact NZ-OH 3.11Å; L128-Y132 VanDerWaalsContact O-CB 3.31Å; L128-Y132 WeakPolarHBondContact O-CB 3.39Å; L128-Y132 PolarHBondContact O-N 3.46Å; L128-Y132 VanDerWaalsContact O-N 3.08Å; W129-Y132 PolarHBondContact O-N 2.9Å; W130-Y132 VanDerWaalsContact C-N 3.26Å; W130-Y132 PolarHBondContact O-N 3.43Å; Y132-S135 WeakPolarHBondContact O-CB 3.5Å; Y132-S135 PolarHBondContact O-N 2.89Å; Y132-S135 PolarHBondContact O-OG 3.26Å; Y132-L136 HydrophobicContact CD1-CD1 4Å; Y132-L136 HydrophobicContact CD1-CG 4.23Å; Y132-L136 HydrophobicContact CE1-CD1 3.61Å; Y132-L136 HydrophobicContact CE1-CD2 4.19Å; Y132-L136 HydrophobicContact CE1-CG 3.89Å; Y132-L136 PolarHBondContact O-N 3.4Å; Y132-E205 HydrophobicContact CE1-CG 4.48Å; Y132-E205 WeakPolarHBondContact CE1-OE1 3.39Å; Y132-E205 VanDerWaalsContact CZ-OE1 3.25Å; Y132-E205 PolarHBondContact OH-OE1 3.02Å; Y132-E205 PolarHBondContact OH-OE2 3.06Å; Y132-L209 HydrophobicContact CD1-CD1 3.42Å; Y132-L209 VanDerWaalsContact CD1-CD1 3.42Å; Y132-L209 HydrophobicContact CE1-CD1 3.48Å; Y132-L209 VanDerWaalsContact CE1-CD1 3.48Å
133	L	90.4	Very high	86.2	Confident	17 Å²	17	48.5 Å²	48.5	9%	0.089	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-48	179.2	-178.2	65	0	0	0	111.4	W129 W130 S135 L136 I137 M206	W129-L133 HydrophobicContact CH2-CD2 4.01Å; W129-L133 HydrophobicContact CZ2-CD2 4.39Å; W129-L133 HydrophobicContact CZ3-CD2 4.4Å; W129-L133 WeakPolarHBondContact O-CB 3.31Å; W129-L133 PolarHBondContact O-N 3.43Å; W130-L133 HydrophobicContact CE3-CD2 3.9Å; W130-L133 HydrophobicContact CH2-CD2 4.29Å; W130-L133 HydrophobicContact CZ3-CD2 3.6Å; W130-L133 PolarHBondContact O-N 3.45Å; L133-S135 VanDerWaalsContact C-N 3.26Å; L133-S135 PolarHBondContact O-N 3.47Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 2.87Å; L133-L136 VanDerWaalsContact O-N 3.09Å; L133-I137 HydrophobicContact CG-CD1 4.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.26Å; L133-I137 PolarHBondContact O-N 3.46Å; L133-M206 HydrophobicContact CD1-CG 4.29Å
134	V	91.8	Very high	87.7	Confident	48 Å²	48	46.5 Å²	46.5	29%	0.291	26%	0.257	S	S	.	.	H	α-helix	trans	-58.5	-40.4	175.6	170.4	0	0	0	0	110.7	W130 L136 I137 F138	W130-V134 WeakPolarHBondContact O-CB 3.3Å; W130-V134 VanDerWaalsContact O-CG2 3.3Å; W130-V134 WeakPolarHBondContact O-CG2 3.38Å; W130-V134 PolarHBondContact O-N 3.08Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.48Å; V134-I137 PolarHBondContact O-N 2.96Å; V134-F138 HydrophobicContact CG1-CD2 3.51Å; V134-F138 HydrophobicContact CG1-CE2 3.35Å; V134-F138 VanDerWaalsContact O-CD2 3.24Å; V134-F138 WeakPolarHBondContact O-CD2 3.33Å; V134-F138 PolarHBondContact O-N 3.27Å
135	S	92.6	Very high	89.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-37.6	175.9	81	0	0	0	0	113.2	V94 T131 Y132 L133 K139	V94-S135 WeakPolarHBondContact CG2-OG 3.18Å; T131-S135 WeakPolarHBondContact O-CB 3.34Å; T131-S135 PolarHBondContact O-N 3.42Å; Y132-S135 WeakPolarHBondContact O-CB 3.5Å; Y132-S135 PolarHBondContact O-N 2.89Å; Y132-S135 PolarHBondContact O-OG 3.26Å; L133-S135 VanDerWaalsContact C-N 3.26Å; L133-S135 PolarHBondContact O-N 3.47Å; S135-K139 WeakPolarHBondContact O-CB 3.48Å; S135-K139 VanDerWaalsContact O-CG 3.25Å; S135-K139 WeakPolarHBondContact O-CG 3.49Å; S135-K139 PolarHBondContact O-N 3.29Å
136	L	92.3	Very high	90.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-68.4	-39.9	177.1	-69.9	179.3	0	0	0	111.6	Y132 L133 V134 K139 A140 E205 M206 L209	Y132-L136 HydrophobicContact CD1-CD1 4Å; Y132-L136 HydrophobicContact CD1-CG 4.23Å; Y132-L136 HydrophobicContact CE1-CD1 3.61Å; Y132-L136 HydrophobicContact CE1-CD2 4.19Å; Y132-L136 HydrophobicContact CE1-CG 3.89Å; Y132-L136 PolarHBondContact O-N 3.4Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 2.87Å; L133-L136 VanDerWaalsContact O-N 3.09Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.48Å; L136-K139 PolarHBondContact O-N 3.38Å; L136-A140 WeakPolarHBondContact O-CB 3.24Å; L136-A140 PolarHBondContact O-N 3.1Å; L136-E205 HydrophobicContact CD1-CB 4.27Å; L136-E205 HydrophobicContact CD1-CG 3.99Å; L136-M206 HydrophobicContact CB-CG 3.6Å; L136-M206 HydrophobicContact CB-SD 3.98Å; L136-M206 HydrophobicContact CD1-CB 4.49Å; L136-M206 HydrophobicContact CD1-CG 3.6Å; L136-M206 HydrophobicContact CG-CG 4.27Å; L136-L209 HydrophobicContact CD1-CD1 4.03Å
137	I	94.6	Very high	91.5	Very high	93 Å²	93	39.7 Å²	39.7	48%	0.477	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-49	175.8	-66	168.1	0	0	0	110	L133 V134 K139 A140 G141 M206	L133-I137 HydrophobicContact CG-CD1 4.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.26Å; L133-I137 PolarHBondContact O-N 3.46Å; V134-I137 PolarHBondContact O-N 2.96Å; I137-K139 PolarHBondContact O-N 2.92Å; I137-A140 PolarHBondContact O-N 3.44Å; I137-G141 PolarHBondContact O-N 3.38Å; I137-M206 HydrophobicContact CG1-SD 3.77Å
138	F	95.4	Very high	92.4	Very high	105 Å²	105	44.6 Å²	44.6	46%	0.461	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-40.9	177.6	-81.5	-63.6	0	0	0	112.5	P90 V134 G141 F142	P90-F138 HydrophobicContact CB-CB 4.48Å; P90-F138 HydrophobicContact CG-CB 3.95Å; V134-F138 HydrophobicContact CG1-CD2 3.51Å; V134-F138 HydrophobicContact CG1-CE2 3.35Å; V134-F138 VanDerWaalsContact O-CD2 3.24Å; V134-F138 WeakPolarHBondContact O-CD2 3.33Å; V134-F138 PolarHBondContact O-N 3.27Å; F138-G141 PolarHBondContact O-N 3.49Å; F138-F142 HydrophobicContact CB-CD2 4.25Å; F138-F142 HydrophobicContact CB-CE2 4.01Å; F138-F142 AromaticContact CD1-CE2 3.95Å; F138-F142 HydrophobicContact CD1-CE2 3.95Å; F138-F142 HydrophobicContact CD1-CZ 4.05Å; F138-F142 HydrophobicContact CG-CE2 4.34Å; F138-F142 WeakPolarHBondContact O-CB 3.44Å; F138-F142 WeakPolarHBondContact O-CD2 3.47Å; F138-F142 WeakPolarHBondContact O-CG 3.35Å; F138-F142 PolarHBondContact O-N 3.07Å
139	K	93.7	Very high	93	Very high	11 Å²	11	47.4 Å²	47.4	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-53.3	175.3	-77.4	174.3	178.8	-163.3	0	112.1	W27 P90 S91 S135 L136 I137 G141 F142 D143	W27-K139 HydrophobicContact CH2-CD 4.18Å; W27-K139 HydrophobicContact CZ2-CD 4.05Å; P90-K139 HydrophobicContact CB-CG 4.05Å; P90-K139 HydrophobicContact CG-CG 4.2Å; S91-K139 WeakPolarHBondContact OG-CE 3.29Å; S91-K139 PolarHBondContact OG-NZ 3.43Å; S135-K139 WeakPolarHBondContact O-CB 3.48Å; S135-K139 VanDerWaalsContact O-CG 3.25Å; S135-K139 WeakPolarHBondContact O-CG 3.49Å; S135-K139 PolarHBondContact O-N 3.29Å; L136-K139 PolarHBondContact O-N 3.38Å; I137-K139 PolarHBondContact O-N 2.92Å; K139-G141 VanDerWaalsContact C-N 3.32Å; K139-G141 PolarHBondContact O-N 3.35Å; K139-F142 PolarHBondContact O-N 3.47Å; K139-D143 WeakPolarHBondContact O-CB 2.98Å; K139-D143 PolarHBondContact O-N 3.21Å
140	A	95.1	Very high	93.4	Very high	12 Å²	12	45.8 Å²	45.8	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-40.7	-179.9	0	0	0	0	0	111.4	L136 I137 A144 C202 M206	L136-A140 WeakPolarHBondContact O-CB 3.24Å; L136-A140 PolarHBondContact O-N 3.1Å; I137-A140 PolarHBondContact O-N 3.44Å; A140-A144 WeakPolarHBondContact O-CB 3.38Å; A140-A144 PolarHBondContact O-N 2.86Å; A140-C202 HydrophobicContact CB-CB 4.19Å; A140-M206 HydrophobicContact CB-CE 4.45Å
141	G	96.6	Very high	93.7	Very high	43 Å²	43	44.4 Å²	44.4	44%	0.443	24%	0.238	S	C	.	.	H	α-helix	trans	-65.2	-46.6	178.1	0	0	0	0	0	113.1	I137 F138 K139 G145	I137-G141 PolarHBondContact O-N 3.38Å; F138-G141 PolarHBondContact O-N 3.49Å; K139-G141 VanDerWaalsContact C-N 3.32Å; K139-G141 PolarHBondContact O-N 3.35Å; G141-G145 PolarHBondContact O-N 2.81Å
142	F	95.9	Very high	93.8	Very high	64 Å²	64	50.6 Å²	50.6	28%	0.281	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-47.1	175.6	-70.4	-48.3	0	0	0	111.3	F86 V87 P90 F138 K139 A144 G145 F146	F86-F142 HydrophobicContact CB-CB 4.2Å; F86-F142 HydrophobicContact CB-CD1 4.28Å; F86-F142 HydrophobicContact CB-CD2 4.05Å; F86-F142 HydrophobicContact CB-CG 3.94Å; F86-F142 HydrophobicContact CD1-CD1 4.17Å; F86-F142 HydrophobicContact CD1-CD2 4.43Å; F86-F142 AromaticContact CD1-CE1 3.84Å; F86-F142 HydrophobicContact CD1-CE1 3.84Å; F86-F142 HydrophobicContact CD1-CE2 4.12Å; F86-F142 HydrophobicContact CD1-CG 4.47Å; F86-F142 AromaticContact CD1-CZ 3.83Å; F86-F142 HydrophobicContact CD1-CZ 3.83Å; F86-F142 HydrophobicContact CE1-CE1 4.39Å; F86-F142 HydrophobicContact CE1-CZ 4.44Å; F86-F142 HydrophobicContact CG-CD1 4.43Å; F86-F142 WeakPolarHBondContact O-CD2 3.44Å; V87-F142 HydrophobicContact CG2-CB 4.37Å; P90-F142 HydrophobicContact CG-CE2 4.46Å; F138-F142 HydrophobicContact CB-CD2 4.25Å; F138-F142 HydrophobicContact CB-CE2 4.01Å; F138-F142 AromaticContact CD1-CE2 3.95Å; F138-F142 HydrophobicContact CD1-CE2 3.95Å; F138-F142 HydrophobicContact CD1-CZ 4.05Å; F138-F142 HydrophobicContact CG-CE2 4.34Å; F138-F142 WeakPolarHBondContact O-CB 3.44Å; F138-F142 WeakPolarHBondContact O-CD2 3.47Å; F138-F142 WeakPolarHBondContact O-CG 3.35Å; F138-F142 PolarHBondContact O-N 3.07Å; K139-F142 PolarHBondContact O-N 3.47Å; F142-A144 PolarHBondContact O-N 3.37Å; F142-G145 PolarHBondContact O-N 3.44Å; F142-F146 VanDerWaalsContact O-CD2 3.25Å; F142-F146 WeakPolarHBondContact O-CD2 3.33Å; F142-F146 PolarHBondContact O-N 3.19Å
143	D	94.7	Very high	93.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-45.6	177.8	-95	-29.3	0	0	0	112.1	R35 Q83 V87 K139 L147 I199	R35-D143 IonicContact CZ-OD1 2.6Å; R35-D143 VanDerWaalsContact CZ-OD1 3.29Å; R35-D143 IonicContact CZ-OD2 2.73Å; R35-D143 IonicContact NH1-OD1 3.74Å; R35-D143 PolarHBondContact NH1-OD1 3.14Å; R35-D143 IonicContact NH1-OD2 2.73Å; R35-D143 PolarHBondContact NH1-OD2 3.15Å; R35-D143 IonicContact NH2-OD1 2.67Å; R35-D143 PolarHBondContact NH2-OD1 3.03Å; R35-D143 IonicContact NH2-OD2 2.8Å; R35-D143 PolarHBondContact NH2-OD2 3.41Å; Q83-D143 PolarHBondContact NE2-OD1 3.29Å; V87-D143 HydrophobicContact CG2-CB 4.43Å; V87-D143 WeakPolarHBondContact CG2-OD1 3.04Å; K139-D143 WeakPolarHBondContact O-CB 2.98Å; K139-D143 PolarHBondContact O-N 3.21Å; D143-L147 VanDerWaalsContact O-CB 3.24Å; D143-L147 WeakPolarHBondContact O-CB 3.32Å; D143-L147 PolarHBondContact O-N 3Å; D143-I199 HydrophobicContact CB-CD1 4.01Å; D143-I199 HydrophobicContact CB-CG1 3.64Å
144	A	96.3	Very high	93.8	Very high	44 Å²	44	52.9 Å²	52.9	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-66.4	-39.9	177.3	0	0	0	0	0	112.2	A140 F142 L147 Y148 I199	A140-A144 WeakPolarHBondContact O-CB 3.38Å; A140-A144 PolarHBondContact O-N 2.86Å; F142-A144 PolarHBondContact O-N 3.37Å; A144-L147 PolarHBondContact O-N 2.85Å; A144-Y148 WeakPolarHBondContact O-CB 3.34Å; A144-Y148 PolarHBondContact O-N 2.92Å; A144-I199 HydrophobicContact CB-CD1 4.08Å
145	G	96.6	Very high	93.5	Very high	34 Å²	34	59.3 Å²	59.3	35%	0.351	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-48.1	178	0	0	0	0	0	112.5	G141 F142 L147 Y148 V149	G141-G145 PolarHBondContact O-N 2.81Å; F142-G145 PolarHBondContact O-N 3.44Å; G145-L147 VanDerWaalsContact C-N 3.32Å; G145-L147 PolarHBondContact O-N 2.9Å; G145-Y148 PolarHBondContact O-N 3.15Å; G145-V149 WeakPolarHBondContact O-CG2 3.25Å; G145-V149 PolarHBondContact O-N 3.19Å
146	F	95.5	Very high	93.1	Very high	35 Å²	35	60.7 Å²	60.7	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-39.2	175.4	-84.3	-76.5	0	0	0	112	L82 Q83 F86 F142 V149 L150	L82-F146 HydrophobicContact CB-CE1 3.73Å; L82-F146 HydrophobicContact CB-CZ 3.77Å; Q83-F146 HydrophobicContact CB-CB 4.03Å; Q83-F146 HydrophobicContact CB-CD1 4.07Å; Q83-F146 HydrophobicContact CB-CD2 3.92Å; Q83-F146 HydrophobicContact CB-CE2 4.46Å; Q83-F146 HydrophobicContact CB-CG 3.74Å; Q83-F146 HydrophobicContact CG-CB 3.82Å; Q83-F146 HydrophobicContact CG-CD2 4.03Å; Q83-F146 HydrophobicContact CG-CG 3.96Å; F86-F146 HydrophobicContact CB-CE2 3.96Å; F86-F146 AromaticContact CD2-CE2 3.77Å; F86-F146 HydrophobicContact CD2-CE2 3.77Å; F86-F146 AromaticContact CD2-CZ 3.7Å; F86-F146 HydrophobicContact CD2-CZ 3.7Å; F86-F146 HydrophobicContact CE2-CZ 4.24Å; F86-F146 HydrophobicContact CG-CE2 4.07Å; F86-F146 HydrophobicContact CG-CZ 4.44Å; F142-F146 VanDerWaalsContact O-CD2 3.25Å; F142-F146 WeakPolarHBondContact O-CD2 3.33Å; F142-F146 PolarHBondContact O-N 3.19Å; F146-V149 PolarHBondContact O-N 2.93Å; F146-L150 WeakPolarHBondContact O-CB 3.33Å; F146-L150 PolarHBondContact O-N 3.49Å
147	L	94.3	Very high	92.8	Very high	29 Å²	29	63.2 Å²	63.2	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-42.9	176.1	-173.4	64	0	0	0	111.6	D143 A144 G145 L150 Y151 Y157 V192 I199	D143-L147 VanDerWaalsContact O-CB 3.24Å; D143-L147 WeakPolarHBondContact O-CB 3.32Å; D143-L147 PolarHBondContact O-N 3Å; A144-L147 PolarHBondContact O-N 2.85Å; G145-L147 VanDerWaalsContact C-N 3.32Å; G145-L147 PolarHBondContact O-N 2.9Å; L147-L150 PolarHBondContact O-N 3.27Å; L147-Y151 WeakPolarHBondContact O-CB 3.27Å; L147-Y151 PolarHBondContact O-N 3.03Å; L147-Y157 HydrophobicContact CD1-CE1 3.96Å; L147-Y157 WeakPolarHBondContact CD1-OH 3.21Å; L147-Y157 WeakPolarHBondContact CG-OH 3.41Å; L147-Y157 PolarHBondContact O-OH 3.2Å; L147-V192 HydrophobicContact CD1-CB 4.13Å; L147-V192 HydrophobicContact CD1-CG1 3.89Å; L147-V192 HydrophobicContact CD1-CG2 3.77Å; L147-I199 HydrophobicContact CD2-CD1 4.32Å
148	Y	94.9	Very high	92.3	Very high	152 Å²	152	62.6 Å²	62.6	60%	0.596	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-46.2	175.1	177.1	-97.1	0	0	0	112.3	A144 G145 L150 Y151 Y152	A144-Y148 WeakPolarHBondContact O-CB 3.34Å; A144-Y148 PolarHBondContact O-N 2.92Å; G145-Y148 PolarHBondContact O-N 3.15Å; Y148-L150 VanDerWaalsContact C-N 3.3Å; Y148-L150 PolarHBondContact O-N 2.99Å; Y148-Y151 WeakPolarHBondContact O-CB 3.21Å; Y148-Y151 PolarHBondContact O-N 3.07Å; Y148-Y152 WeakPolarHBondContact O-CB 3.41Å; Y148-Y152 PolarHBondContact O-N 3.44Å
149	V	94.1	Very high	91.9	Very high	61 Å²	61	58.2 Å²	58.2	37%	0.37	30%	0.302	S	S	.	.	H	α-helix	trans	-59.2	-43.9	175.5	169.9	0	0	0	0	110.5	L79 G145 F146 Y151 Y152 V153	L79-V149 HydrophobicContact CD2-CG1 4.49Å; G145-V149 WeakPolarHBondContact O-CG2 3.25Å; G145-V149 PolarHBondContact O-N 3.19Å; F146-V149 PolarHBondContact O-N 2.93Å; V149-Y151 PolarHBondContact O-N 3.47Å; V149-Y152 PolarHBondContact O-N 2.92Å; V149-V153 HydrophobicContact CG1-CG2 4.12Å; V149-V153 WeakPolarHBondContact O-CB 3.09Å; V149-V153 VanDerWaalsContact O-CG2 3.26Å; V149-V153 WeakPolarHBondContact O-CG2 3.24Å; V149-V153 PolarHBondContact O-N 3.18Å
150	L	92.6	Very high	91.7	Very high	6 Å²	6	60.7 Å²	60.7	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-42.9	178	-167.1	78.2	0	0	0	111.8	L79 F146 L147 Y148 Y154 Y157 T188 V192	L79-L150 HydrophobicContact CD1-CD1 3.9Å; F146-L150 WeakPolarHBondContact O-CB 3.33Å; F146-L150 PolarHBondContact O-N 3.49Å; L147-L150 PolarHBondContact O-N 3.27Å; Y148-L150 VanDerWaalsContact C-N 3.3Å; Y148-L150 PolarHBondContact O-N 2.99Å; L150-Y154 HydrophobicContact CD1-CD2 3.53Å; L150-Y154 HydrophobicContact CD1-CE2 3.46Å; L150-Y154 VanDerWaalsContact CD1-CE2 3.46Å; L150-Y154 HydrophobicContact CG-CD2 4.02Å; L150-Y154 HydrophobicContact CG-CE2 4.43Å; L150-Y154 WeakPolarHBondContact O-CD2 3.26Å; L150-Y154 PolarHBondContact O-N 3.36Å; L150-Y154 VanDerWaalsContact O-N 3.1Å; L150-Y157 HydrophobicContact CB-CE1 4.07Å; L150-Y157 HydrophobicContact CD2-CD1 3.84Å; L150-Y157 HydrophobicContact CD2-CE1 3.81Å; L150-Y157 HydrophobicContact CG-CD1 4.03Å; L150-Y157 HydrophobicContact CG-CE1 4.03Å; L150-T188 HydrophobicContact CD2-CG2 4.16Å; L150-V192 HydrophobicContact CD2-CG2 3.92Å
151	Y	92.6	Very high	91.4	Very high	127 Å²	127	68.8 Å²	68.8	50%	0.498	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-44.1	176.8	-179.4	-96.8	0	0	0	112.2	L147 Y148 V149 E155 G156 Y157	L147-Y151 WeakPolarHBondContact O-CB 3.27Å; L147-Y151 PolarHBondContact O-N 3.03Å; Y148-Y151 WeakPolarHBondContact O-CB 3.21Å; Y148-Y151 PolarHBondContact O-N 3.07Å; V149-Y151 PolarHBondContact O-N 3.47Å; Y151-E155 PolarHBondContact O-N 3.35Å; Y151-G156 PolarHBondContact O-N 2.55Å; Y151-Y157 HydrophobicContact CD2-CD2 4.07Å; Y151-Y157 HydrophobicContact CD2-CE1 4.46Å; Y151-Y157 AromaticContact CD2-CE2 3.6Å; Y151-Y157 HydrophobicContact CD2-CE2 3.6Å; Y151-Y157 AromaticContact CD2-CZ 3.82Å; Y151-Y157 HydrophobicContact CE2-CE2 4.44Å; Y151-Y157 HydrophobicContact CG-CE2 4.48Å
152	Y	92	Very high	91.2	Very high	170 Å²	170	69.6 Å²	69.6	67%	0.667	34%	0.341	S	S	*	.	H	α-helix	trans	-72.3	-43.4	-177.1	-175.6	-95	0	0	0	112.4	Y148 V149	Y148-Y152 WeakPolarHBondContact O-CB 3.41Å; Y148-Y152 PolarHBondContact O-N 3.44Å; V149-Y152 PolarHBondContact O-N 2.92Å
153	V	90.9	Very high	91.1	Very high	58 Å²	58	68 Å²	68	35%	0.352	34%	0.338	S	S	.	.	H	α-helix	trans	-71.5	-34.7	-178.4	172.5	0	0	0	0	111.9	P73 V149	P73-V153 HydrophobicContact CG-CG1 4.21Å; V149-V153 HydrophobicContact CG1-CG2 4.12Å; V149-V153 WeakPolarHBondContact O-CB 3.09Å; V149-V153 VanDerWaalsContact O-CG2 3.26Å; V149-V153 WeakPolarHBondContact O-CG2 3.24Å; V149-V153 PolarHBondContact O-N 3.18Å
154	Y	88.2	Confident	91.1	Very high	16 Å²	16	73.9 Å²	73.9	6%	0.063	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	36.1	-177	-56.8	-69	0	0	0	113.2	F72 I74 H76 L79 L150 G156 Y157 D158	F72-Y154 HydrophobicContact CD1-CE1 4.09Å; I74-Y154 PolarHBondContact O-OH 2.93Å; H76-Y154 AromaticContact CD2-CD2 3.99Å; H76-Y154 AromaticContact CD2-CE2 3.69Å; H76-Y154 AromaticContact CE1-CD1 3.4Å; H76-Y154 VanDerWaalsContact CE1-CD1 3.4Å; H76-Y154 WeakPolarHBondContact CE1-CD1 3.4Å; H76-Y154 AromaticContact CE1-CD2 3.68Å; H76-Y154 AromaticContact CE1-CE1 3.15Å; H76-Y154 WeakPolarHBondContact CE1-CE1 3.33Å; H76-Y154 AromaticContact CE1-CE2 3.4Å; H76-Y154 VanDerWaalsContact CE1-CE2 3.4Å; H76-Y154 WeakPolarHBondContact CE1-CE2 3.4Å; H76-Y154 AromaticContact CE1-CG 3.64Å; H76-Y154 AromaticContact CE1-CZ 3.1Å; H76-Y154 AromaticContact CG-CE2 3.89Å; H76-Y154 AromaticContact CG-CZ 3.88Å; H76-Y154 PolarHBondContact N-OH 3.2Å; H76-Y154 AromaticContact ND1-CE1 3.69Å; H76-Y154 AromaticContact ND1-CE2 3.74Å; H76-Y154 AromaticContact ND1-CZ 3.29Å; H76-Y154 VanDerWaalsContact ND1-CZ 3.29Å; H76-Y154 PolarHBondContact ND1-OH 3.04Å; H76-Y154 AromaticContact NE2-CD1 3.84Å; H76-Y154 AromaticContact NE2-CD2 3.39Å; H76-Y154 WeakPolarHBondContact NE2-CD2 3.28Å; H76-Y154 AromaticContact NE2-CE1 3.9Å; H76-Y154 AromaticContact NE2-CE2 3.41Å; H76-Y154 WeakPolarHBondContact NE2-CE2 3.31Å; H76-Y154 AromaticContact NE2-CG 3.56Å; H76-Y154 AromaticContact NE2-CZ 3.65Å; L79-Y154 HydrophobicContact CD1-CE2 3.97Å; L150-Y154 HydrophobicContact CD1-CD2 3.53Å; L150-Y154 HydrophobicContact CD1-CE2 3.46Å; L150-Y154 VanDerWaalsContact CD1-CE2 3.46Å; L150-Y154 HydrophobicContact CG-CD2 4.02Å; L150-Y154 HydrophobicContact CG-CE2 4.43Å; L150-Y154 WeakPolarHBondContact O-CD2 3.26Å; L150-Y154 PolarHBondContact O-N 3.36Å; L150-Y154 VanDerWaalsContact O-N 3.1Å; Y154-G156 VanDerWaalsContact C-N 3.31Å; Y154-G156 PolarHBondContact O-N 3.32Å; Y154-Y157 PolarHBondContact O-N 3.11Å; Y154-D158 PolarHBondContact O-N 3.49Å
155	E	84.4	Confident	91	Very high	182 Å²	182	72.1 Å²	72.1	85%	0.85	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.4	54.8	170.6	-63.8	-172.5	178.2	0	0	114.5	Y151	Y151-E155 PolarHBondContact O-N 3.35Å
156	G	84.4	Confident	91	Very high	30 Å²	30	78.7 Å²	78.7	31%	0.309	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	25.3	177.6	0	0	0	0	0	116.3	Y151 Y154 D158	Y151-G156 PolarHBondContact O-N 2.55Å; Y154-G156 VanDerWaalsContact C-N 3.31Å; Y154-G156 PolarHBondContact O-N 3.32Å; G156-D158 PolarHBondContact O-N 2.54Å
157	Y	85.4	Confident	91	Very high	56 Å²	56	80 Å²	80	22%	0.22	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	18.7	-177.8	-42.3	-66.3	0	0	0	113.8	L147 L150 Y151 Y154 V192	L147-Y157 HydrophobicContact CD1-CE1 3.96Å; L147-Y157 WeakPolarHBondContact CD1-OH 3.21Å; L147-Y157 WeakPolarHBondContact CG-OH 3.41Å; L147-Y157 PolarHBondContact O-OH 3.2Å; L150-Y157 HydrophobicContact CB-CE1 4.07Å; L150-Y157 HydrophobicContact CD2-CD1 3.84Å; L150-Y157 HydrophobicContact CD2-CE1 3.81Å; L150-Y157 HydrophobicContact CG-CD1 4.03Å; L150-Y157 HydrophobicContact CG-CE1 4.03Å; Y151-Y157 HydrophobicContact CD2-CD2 4.07Å; Y151-Y157 HydrophobicContact CD2-CE1 4.46Å; Y151-Y157 AromaticContact CD2-CE2 3.6Å; Y151-Y157 HydrophobicContact CD2-CE2 3.6Å; Y151-Y157 AromaticContact CD2-CZ 3.82Å; Y151-Y157 HydrophobicContact CE2-CE2 4.44Å; Y151-Y157 HydrophobicContact CG-CE2 4.48Å; Y154-Y157 PolarHBondContact O-N 3.11Å; Y157-V192 HydrophobicContact CD1-CG2 3.69Å; Y157-V192 HydrophobicContact CD2-CG1 4.43Å; Y157-V192 HydrophobicContact CD2-CG2 4.43Å; Y157-V192 HydrophobicContact CE1-CG2 3.62Å; Y157-V192 HydrophobicContact CE2-CG1 4.01Å; Y157-V192 HydrophobicContact CE2-CG2 4.36Å; Y157-V192 HydrophobicContact CG-CG2 4.1Å
158	D	84.5	Confident	90.9	Very high	79 Å²	79	83.6 Å²	83.6	42%	0.422	40%	0.401	S	S	.	.			trans	-87.7	147.8	177.5	-156.3	15.3	0	0	0	111	Y154 G156 K185	Y154-D158 PolarHBondContact O-N 3.49Å; G156-D158 PolarHBondContact O-N 2.54Å; D158-K185 WeakPolarHBondContact OD1-CE 2.94Å; D158-K185 IonicContact OD1-NZ 3.61Å; D158-K185 PolarHBondContact OD1-NZ 3.29Å
159	M	86.6	Confident	91	Very high	13 Å²	13	79.2 Å²	79.2	6%	0.064	39%	0.39	C	S	.	.			trans	-130.2	89.6	177.4	-168.2	81.1	66.4	0	0	107.4	F72 H76 I178 P181 K184 K185	F72-M159 HydrophobicContact CE1-CE 4.28Å; F72-M159 HydrophobicContact CE1-SD 3.72Å; F72-M159 HydrophobicContact CZ-SD 3.92Å; H76-M159 WeakPolarHBondContact CE1-CE 3.34Å; M159-I178 HydrophobicContact CG-CG2 4.28Å; M159-I178 HydrophobicContact SD-CD1 4.35Å; M159-I178 HydrophobicContact SD-CG2 4.22Å; M159-P181 HydrophobicContact CG-CB 3.93Å; M159-K184 HydrophobicContact CE-CB 4.09Å; M159-K184 HydrophobicContact CE-CD 4.33Å; M159-K185 HydrophobicContact CB-CB 4.37Å
160	P	89.2	Confident	91	Very high	63 Å²	63	77 Å²	77	41%	0.409	38%	0.378	S	S	.	.			trans	-66	153.6	-179.8	28	-34	0	0	0	110.3	L162 I178	P160-L162 VanDerWaalsContact C-N 3.26Å; P160-L162 PolarHBondContact O-N 2.97Å; P160-I178 WeakPolarHBondContact O-CD1 3.19Å
161	R	89.4	Confident	91	Very high	183 Å²	183	80.6 Å²	80.6	69%	0.691	40%	0.401	S	S	*	.	S	Bend	trans	-70.6	-27.7	177.2	-59.6	-170.8	175.5	168.9	-1.1	112.6	I178 P181	R161-I178 PolarHBondContact O-N 3.39Å; R161-P181 HydrophobicContact CB-CG 4.24Å; R161-P181 HydrophobicContact CG-CB 4.5Å; R161-P181 HydrophobicContact CG-CG 3.73Å
162	L	92.8	Very high	91.1	Very high	60 Å²	60	80.5 Å²	80.5	31%	0.314	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.8	-175.4	176	142.6	0	0	0	108.9	P160 K164 D175 C176 Y177	P160-L162 VanDerWaalsContact C-N 3.26Å; P160-L162 PolarHBondContact O-N 2.97Å; L162-K164 HydrophobicContact CD2-CD 3.89Å; L162-K164 HydrophobicContact CD2-CG 4.26Å; L162-D175 HydrophobicContact CD1-CB 3.93Å; L162-C176 WeakPolarHBondContact CA-O 3.37Å; L162-Y177 HydrophobicContact CD1-CD1 4.43Å; L162-Y177 HydrophobicContact CD1-CE1 3.75Å
163	S	92.8	Very high	91.2	Very high	31 Å²	31	76.1 Å²	76.1	22%	0.217	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.9	172.2	-172.5	0	0	0	0	109.6	C176	S163-C176 PolarHBondContact N-O 3.45Å; S163-C176 PolarHBondContact O-N 2.98Å
164	K	94.7	Very high	91.5	Very high	123 Å²	123	73.9 Å²	73.9	54%	0.535	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.4	-179.4	-61.6	-65.8	-166.4	178.1	0	108.8	L162 T173 D175	L162-K164 HydrophobicContact CD2-CD 3.89Å; L162-K164 HydrophobicContact CD2-CG 4.26Å; K164-T173 HydrophobicContact CB-CG2 3.89Å; K164-T173 HydrophobicContact CD-CG2 4.36Å; K164-D175 WeakPolarHBondContact CD-OD1 3.33Å; K164-D175 WeakPolarHBondContact CE-OD1 3.45Å; K164-D175 IonicContact NZ-OD1 3.67Å; K164-D175 PolarHBondContact NZ-OD1 2.96Å; K164-D175 IonicContact NZ-OD2 2.88Å; K164-D175 PolarHBondContact NZ-OD2 2.77Å
165	C	95.9	Very high	91.9	Very high	7 Å²	7	75 Å²	75	5%	0.047	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.5	-177.8	179.6	0	0	0	0	111.6	C67 T173 V174	C67-C165 VanDerWaalsContact CA-SG 3.51Å; C67-C165 HydrophobicContact CB-CB 3.72Å; C67-C165 WeakPolarHBondContact CB-SG 3.21Å; C67-C165 WeakPolarHBondContact SG-CB 3.27Å; C67-C165 CovalentContact SG-SG 2.03Å; C67-C165 PolarHBondContact SG-SG 3.49Å; C165-T173 CarbonylContact O-C 3.55Å; C165-T173 VanDerWaalsContact O-CA 3.31Å; C165-T173 WeakPolarHBondContact O-CA 3.47Å; C165-V174 HydrophobicContact CB-CG2 4.01Å; C165-V174 PolarHBondContact N-O 3.16Å; C165-V174 PolarHBondContact O-N 2.83Å
166	K	95.6	Very high	92.4	Very high	171 Å²	171	66.3 Å²	66.3	74%	0.743	35%	0.353	S	S	*	.			trans	-130	34.4	-179.1	-161.4	-168.8	171.2	179.9	0	112.5
167	L	94.8	Very high	92.9	Very high	62 Å²	62	70.3 Å²	70.3	33%	0.325	36%	0.36	S	S	.	.			trans	-93	145.7	-177	-72.5	156.2	0	0	0	111.6	V66 S70 C170	V66-L167 HydrophobicContact CG2-CB 4.16Å; S70-L167 WeakPolarHBondContact OG-CD1 3.42Å; L167-C170 WeakPolarHBondContact O-CA 3.48Å; L167-C170 WeakPolarHBondContact O-CB 3.5Å; L167-C170 PolarHBondContact O-N 2.85Å; L167-C170 PolarHBondContact O-SG 2.82Å
168	P	93.8	Very high	93.3	Very high	106 Å²	106	68.3 Å²	68.3	69%	0.688	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	137.9	168.9	28	-32.8	0	0	0	110
169	P	95.3	Very high	93.6	Very high	59 Å²	59	65.4 Å²	65.4	38%	0.383	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.5	18.4	13.6	37.3	-37.6	0	0	0	115.5	Q60	Q60-P169 VanDerWaalsContact CG-O 3.3Å; Q60-P169 WeakPolarHBondContact CG-O 3.29Å
170	C	95.1	Very high	93.8	Very high	16 Å²	16	70.5 Å²	70.5	11%	0.108	36%	0.357	C	S	.	.			trans	-65.4	135.1	-178.7	-52.5	0	0	0	0	111.6	C63 C67 L167 N172 V174	C63-C170 VanDerWaalsContact CA-SG 3.57Å; C63-C170 HydrophobicContact CB-CB 4.1Å; C63-C170 WeakPolarHBondContact CB-SG 3.37Å; C63-C170 WeakPolarHBondContact SG-CB 3.31Å; C63-C170 CovalentContact SG-SG 2.03Å; C63-C170 PolarHBondContact SG-SG 3.46Å; C67-C170 PolarHBondContact SG-SG 3.44Å; L167-C170 WeakPolarHBondContact O-CA 3.48Å; L167-C170 WeakPolarHBondContact O-CB 3.5Å; L167-C170 PolarHBondContact O-N 2.85Å; L167-C170 PolarHBondContact O-SG 2.82Å; C170-N172 VanDerWaalsContact C-N 3.35Å; C170-N172 PolarHBondContact O-N 3.4Å; C170-V174 HydrophobicContact CB-CG1 4.41Å; C170-V174 HydrophobicContact CB-CG2 4.42Å
171	P	93.3	Very high	93.9	Very high	80 Å²	80	68.3 Å²	68.3	52%	0.519	34%	0.343	S	S	.	.	S	Bend	trans	-70.9	-29.4	-172.2	26.5	-34.5	0	0	0	113.5
172	N	93.8	Very high	94	Very high	126 Å²	126	63.2 Å²	63.2	67%	0.674	33%	0.332	S	S	*	.	S	Bend	trans	-152.8	-169.8	179.2	-74.4	-57.9	0	0	0	108.4	C170 V174	C170-N172 VanDerWaalsContact C-N 3.35Å; C170-N172 PolarHBondContact O-N 3.4Å; N172-V174 PolarHBondContact O-N 2.76Å
173	T	95.4	Very high	93.9	Very high	78 Å²	78	64 Å²	64	48%	0.479	34%	0.335	S	S	.	.			trans	-64.3	117.7	166	-50.3	0	0	0	0	109.8	K164 C165	K164-T173 HydrophobicContact CB-CG2 3.89Å; K164-T173 HydrophobicContact CD-CG2 4.36Å; C165-T173 CarbonylContact O-C 3.55Å; C165-T173 VanDerWaalsContact O-CA 3.31Å; C165-T173 WeakPolarHBondContact O-CA 3.47Å
174	V	96.2	Very high	93.8	Very high	11 Å²	11	62.6 Å²	62.6	7%	0.067	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	154	178	-61.5	0	0	0	0	110.9	T58 C165 C170 N172	T58-V174 HydrophobicContact CG2-CG1 4.5Å; C165-V174 HydrophobicContact CB-CG2 4.01Å; C165-V174 PolarHBondContact N-O 3.16Å; C165-V174 PolarHBondContact O-N 2.83Å; C170-V174 HydrophobicContact CB-CG1 4.41Å; C170-V174 HydrophobicContact CB-CG2 4.42Å; N172-V174 PolarHBondContact O-N 2.76Å
175	D	96.5	Very high	93.7	Very high	38 Å²	38	61.3 Å²	61.3	20%	0.203	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.8	179.4	-71.1	12.4	0	0	0	109	C56 N57 L162 K164 Y177	C56-D175 CarbonylContact C-O 3.56Å; C56-D175 WeakPolarHBondContact CA-O 3.35Å; N57-D175 HydrophobicContact CB-CB 4.38Å; N57-D175 PolarHBondContact N-O 3.29Å; L162-D175 HydrophobicContact CD1-CB 3.93Å; K164-D175 WeakPolarHBondContact CD-OD1 3.33Å; K164-D175 WeakPolarHBondContact CE-OD1 3.45Å; K164-D175 IonicContact NZ-OD1 3.67Å; K164-D175 PolarHBondContact NZ-OD1 2.96Å; K164-D175 IonicContact NZ-OD2 2.88Å; K164-D175 PolarHBondContact NZ-OD2 2.77Å; D175-Y177 HydrophobicContact CB-CE2 4.43Å
176	C	95.9	Very high	93.4	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.7	178.2	-57.6	0	0	0	0	110.9	F54 V55 C56 L162 S163	F54-C176 HydrophobicContact CE1-CB 4.07Å; F54-C176 HydrophobicContact CE2-CB 3.89Å; F54-C176 HydrophobicContact CZ-CB 3.38Å; V55-C176 CarbonylContact O-C 3.58Å; V55-C176 WeakPolarHBondContact O-CA 3.19Å; C56-C176 HydrophobicContact CB-CB 4.13Å; C56-C176 WeakPolarHBondContact CB-SG 3.43Å; C56-C176 WeakPolarHBondContact SG-CB 3.32Å; C56-C176 CovalentContact SG-SG 2.05Å; C56-C176 PolarHBondContact SG-SG 3.14Å; L162-C176 WeakPolarHBondContact CA-O 3.37Å; S163-C176 PolarHBondContact N-O 3.45Å; S163-C176 PolarHBondContact O-N 2.98Å
177	Y	94.6	Very high	93.2	Very high	115 Å²	115	59.7 Å²	59.7	45%	0.451	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.4	-175.9	-63.3	-89	0	0	0	109.9	V55 L162 D175	V55-Y177 PolarHBondContact N-O 2.81Å; V55-Y177 PolarHBondContact O-N 3.42Å; L162-Y177 HydrophobicContact CD1-CD1 4.43Å; L162-Y177 HydrophobicContact CD1-CE1 3.75Å; D175-Y177 HydrophobicContact CB-CE2 4.43Å
178	I	92.4	Very high	93	Very high	13 Å²	13	56.9 Å²	56.9	7%	0.067	30%	0.3	C	S	.	.			trans	-89.9	132.1	-179.9	-64.1	165.5	0	0	0	108.8	F54 I71 F72 M159 P160 R161 P181	F54-I178 HydrophobicContact CD2-CG1 4.31Å; F54-I178 HydrophobicContact CE2-CG1 4.14Å; I71-I178 HydrophobicContact CG2-CD1 4.31Å; F72-I178 HydrophobicContact CE2-CD1 4.24Å; F72-I178 HydrophobicContact CE2-CG1 4.03Å; F72-I178 HydrophobicContact CE2-CG2 4.36Å; F72-I178 HydrophobicContact CZ-CD1 3.77Å; F72-I178 HydrophobicContact CZ-CG1 3.91Å; F72-I178 HydrophobicContact CZ-CG2 3.81Å; M159-I178 HydrophobicContact CG-CG2 4.28Å; M159-I178 HydrophobicContact SD-CD1 4.35Å; M159-I178 HydrophobicContact SD-CG2 4.22Å; P160-I178 WeakPolarHBondContact O-CD1 3.19Å; R161-I178 PolarHBondContact O-N 3.39Å; I178-P181 HydrophobicContact CG2-CB 4.47Å; I178-P181 WeakPolarHBondContact O-CD 3.39Å
179	S	90.7	Very high	92.9	Very high	19 Å²	19	56.9 Å²	56.9	13%	0.133	29%	0.293	C	S	.	.	S	Bend	trans	-68.4	134.8	175.4	-177.3	0	0	0	0	112.1	D53 K184	D53-S179 WeakPolarHBondContact CB-OG 3.25Å; D53-S179 PolarHBondContact OD2-OG 3.18Å; S179-K184 WeakPolarHBondContact O-CD 3.2Å; S179-K184 WeakPolarHBondContact O-CE 3.48Å; S179-K184 PolarHBondContact O-NZ 3.3Å; S179-K184 VanDerWaalsContact O-NZ 3.16Å
180	R	91.1	Very high	92.6	Very high	120 Å²	120	60 Å²	60	45%	0.453	30%	0.301	S	S	.	.	S	Bend	trans	46.6	50.4	174.4	-57.5	165	-169.4	-91.2	-1.3	114.1	T182 E183 K184	R180-T182 VanDerWaalsContact C-N 3.28Å; R180-T182 PolarHBondContact O-N 3.3Å; R180-E183 HydrophobicContact CB-CB 4.18Å; R180-E183 HydrophobicContact CB-CG 4.42Å; R180-E183 WeakPolarHBondContact CD-OE2 3.25Å; R180-E183 IonicContact NH1-OE1 3.28Å; R180-E183 IonicContact NH1-OE2 2.76Å; R180-E183 PolarHBondContact O-N 2.97Å; R180-K184 WeakPolarHBondContact O-CG 3.06Å; R180-K184 PolarHBondContact O-N 3.01Å
181	P	91.6	Very high	92.4	Very high	17 Å²	17	59.3 Å²	59.3	11%	0.11	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-34.3	-170.9	27.1	-32.5	0	0	0	111.9	M159 R161 I178 K185	M159-P181 HydrophobicContact CG-CB 3.93Å; R161-P181 HydrophobicContact CB-CG 4.24Å; R161-P181 HydrophobicContact CG-CB 4.5Å; R161-P181 HydrophobicContact CG-CG 3.73Å; I178-P181 HydrophobicContact CG2-CB 4.47Å; I178-P181 WeakPolarHBondContact O-CD 3.39Å; P181-K185 VanDerWaalsContact O-CB 3.27Å; P181-K185 WeakPolarHBondContact O-CB 3.35Å; P181-K185 PolarHBondContact O-N 3.09Å
182	T	91.6	Very high	92.4	Very high	75 Å²	75	56.4 Å²	56.4	46%	0.46	28%	0.277	S	S	.	.	H	α-helix	trans	-68.3	-44.1	176.7	48.2	0	0	0	0	112.5	R180 K185 I186	R180-T182 VanDerWaalsContact C-N 3.28Å; R180-T182 PolarHBondContact O-N 3.3Å; T182-K185 PolarHBondContact O-N 3.13Å; T182-I186 WeakPolarHBondContact O-CD1 3.46Å; T182-I186 VanDerWaalsContact O-CG1 3.26Å; T182-I186 WeakPolarHBondContact O-CG1 3.45Å; T182-I186 PolarHBondContact O-N 2.94Å
183	E	90.9	Very high	92.3	Very high	78 Å²	78	54.2 Å²	54.2	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-48.3	176.6	-64.6	179.2	-178.8	0	0	110.1	V46 R180 K185 I186 F187	V46-E183 HydrophobicContact CG1-CB 4.4Å; R180-E183 HydrophobicContact CB-CB 4.18Å; R180-E183 HydrophobicContact CB-CG 4.42Å; R180-E183 WeakPolarHBondContact CD-OE2 3.25Å; R180-E183 IonicContact NH1-OE1 3.28Å; R180-E183 IonicContact NH1-OE2 2.76Å; R180-E183 PolarHBondContact O-N 2.97Å; E183-K185 VanDerWaalsContact C-N 3.32Å; E183-K185 PolarHBondContact O-N 3.34Å; E183-I186 PolarHBondContact O-N 2.93Å; E183-F187 WeakPolarHBondContact O-CD2 2.93Å; E183-F187 PolarHBondContact O-N 3.21Å
184	K	91.3	Very high	92.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-55.6	-46.6	176.3	-70.7	179.8	-179.2	178.2	0	111.6	V46 W47 E50 M159 S179 R180 I186 F187 T188	V46-K184 HydrophobicContact CG1-CG 3.55Å; W47-K184 HydrophobicContact CD2-CG 4.49Å; W47-K184 HydrophobicContact CH2-CB 4.18Å; W47-K184 HydrophobicContact CH2-CG 4.18Å; W47-K184 HydrophobicContact CZ2-CB 3.71Å; W47-K184 HydrophobicContact CZ2-CD 4.36Å; W47-K184 HydrophobicContact CZ2-CG 3.65Å; E50-K184 VanDerWaalsContact CG-NZ 3.3Å; E50-K184 WeakPolarHBondContact OE1-CE 3.44Å; E50-K184 IonicContact OE1-NZ 3.89Å; E50-K184 PolarHBondContact OE1-NZ 3Å; M159-K184 HydrophobicContact CE-CB 4.09Å; M159-K184 HydrophobicContact CE-CD 4.33Å; S179-K184 WeakPolarHBondContact O-CD 3.2Å; S179-K184 WeakPolarHBondContact O-CE 3.48Å; S179-K184 PolarHBondContact O-NZ 3.3Å; S179-K184 VanDerWaalsContact O-NZ 3.16Å; R180-K184 WeakPolarHBondContact O-CG 3.06Å; R180-K184 PolarHBondContact O-N 3.01Å; K184-I186 PolarHBondContact O-N 3.26Å; K184-F187 PolarHBondContact O-N 3.48Å; K184-T188 WeakPolarHBondContact O-CB 3.46Å; K184-T188 PolarHBondContact O-N 2.91Å; K184-T188 PolarHBondContact O-OG1 3.06Å
185	K	91.3	Very high	92	Very high	96 Å²	96	50.3 Å²	50.3	42%	0.417	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-43.1	177.9	-174.5	172.8	-178.5	169.9	0	112.5	D158 M159 P181 T182 E183 T188 L189	D158-K185 WeakPolarHBondContact OD1-CE 2.94Å; D158-K185 IonicContact OD1-NZ 3.61Å; D158-K185 PolarHBondContact OD1-NZ 3.29Å; M159-K185 HydrophobicContact CB-CB 4.37Å; P181-K185 VanDerWaalsContact O-CB 3.27Å; P181-K185 WeakPolarHBondContact O-CB 3.35Å; P181-K185 PolarHBondContact O-N 3.09Å; T182-K185 PolarHBondContact O-N 3.13Å; E183-K185 VanDerWaalsContact C-N 3.32Å; E183-K185 PolarHBondContact O-N 3.34Å; K185-T188 PolarHBondContact O-N 2.63Å; K185-L189 WeakPolarHBondContact O-CB 3.26Å; K185-L189 PolarHBondContact O-N 3.34Å
186	I	91.5	Very high	91.9	Very high	95 Å²	95	50.5 Å²	50.5	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-48.8	177.7	-69.8	163.9	0	0	0	110.5	T182 E183 K184 T188 L189 F190	T182-I186 WeakPolarHBondContact O-CD1 3.46Å; T182-I186 VanDerWaalsContact O-CG1 3.26Å; T182-I186 WeakPolarHBondContact O-CG1 3.45Å; T182-I186 PolarHBondContact O-N 2.94Å; E183-I186 PolarHBondContact O-N 2.93Å; K184-I186 PolarHBondContact O-N 3.26Å; I186-T188 PolarHBondContact O-N 3.06Å; I186-L189 PolarHBondContact O-N 3.41Å; I186-F190 HydrophobicContact CG2-CD2 3.76Å; I186-F190 HydrophobicContact CG2-CE2 3.46Å; I186-F190 VanDerWaalsContact CG2-CE2 3.46Å; I186-F190 WeakPolarHBondContact O-CD2 3.45Å; I186-F190 PolarHBondContact O-N 3.07Å
187	F	90.5	Very high	91.8	Very high	50 Å²	50	53.1 Å²	53.1	22%	0.219	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-41.3	177.4	-79.3	-65.4	0	0	0	112.3	V38 A42 V46 W47 E183 K184 L189 F190 M191	V38-F187 HydrophobicContact CG1-CD1 3.72Å; V38-F187 HydrophobicContact CG1-CE1 4.12Å; A42-F187 HydrophobicContact CB-CD1 3.73Å; A42-F187 HydrophobicContact CB-CD2 4.27Å; A42-F187 HydrophobicContact CB-CE1 3.76Å; A42-F187 HydrophobicContact CB-CE2 4.33Å; A42-F187 HydrophobicContact CB-CG 4.01Å; A42-F187 HydrophobicContact CB-CZ 4.07Å; V46-F187 HydrophobicContact CG1-CD2 4.42Å; V46-F187 HydrophobicContact CG2-CD2 3.95Å; V46-F187 HydrophobicContact CG2-CE2 3.58Å; V46-F187 HydrophobicContact CG2-CZ 4.41Å; W47-F187 HydrophobicContact CH2-CB 3.58Å; W47-F187 HydrophobicContact CH2-CD2 4.46Å; W47-F187 HydrophobicContact CH2-CG 4.33Å; W47-F187 HydrophobicContact CZ3-CB 3.87Å; W47-F187 HydrophobicContact CZ3-CD2 4.21Å; W47-F187 HydrophobicContact CZ3-CG 4.18Å; E183-F187 WeakPolarHBondContact O-CD2 2.93Å; E183-F187 PolarHBondContact O-N 3.21Å; K184-F187 PolarHBondContact O-N 3.48Å; F187-L189 VanDerWaalsContact C-N 3.33Å; F187-L189 PolarHBondContact O-N 3.08Å; F187-F190 PolarHBondContact O-N 3.41Å; F187-M191 WeakPolarHBondContact O-CG 3.15Å; F187-M191 PolarHBondContact O-N 3.19Å
188	T	90.8	Very high	91.6	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-44.1	173.8	-62.4	0	0	0	0	111.4	H76 W80 L150 K184 K185 I186 F190 M191 V192	H76-T188 PolarHBondContact CD2-OG1 3.2Å; W80-T188 HydrophobicContact CZ2-CG2 4.16Å; W80-T188 WeakPolarHBondContact CZ2-OG1 3.28Å; L150-T188 HydrophobicContact CD2-CG2 4.16Å; K184-T188 WeakPolarHBondContact O-CB 3.46Å; K184-T188 PolarHBondContact O-N 2.91Å; K184-T188 PolarHBondContact O-OG1 3.06Å; K185-T188 PolarHBondContact O-N 2.63Å; I186-T188 PolarHBondContact O-N 3.06Å; T188-F190 PolarHBondContact O-N 3.09Å; T188-M191 PolarHBondContact O-N 3.35Å; T188-V192 HydrophobicContact CG2-CG2 4.28Å; T188-V192 WeakPolarHBondContact O-CB 3.46Å; T188-V192 VanDerWaalsContact O-CG2 3.29Å; T188-V192 WeakPolarHBondContact O-CG2 3.48Å; T188-V192 PolarHBondContact O-N 3.31Å
189	L	90.8	Very high	91.7	Very high	106 Å²	106	48.2 Å²	48.2	56%	0.555	25%	0.249	S	C	*	.	H	α-helix	trans	-62.1	-44	177.5	-174.6	67.5	0	0	0	112	K185 I186 F187 M191 V192 V193	K185-L189 WeakPolarHBondContact O-CB 3.26Å; K185-L189 PolarHBondContact O-N 3.34Å; I186-L189 PolarHBondContact O-N 3.41Å; F187-L189 VanDerWaalsContact C-N 3.33Å; F187-L189 PolarHBondContact O-N 3.08Å; L189-M191 VanDerWaalsContact C-N 3.32Å; L189-M191 PolarHBondContact O-N 2.96Å; L189-V192 PolarHBondContact O-N 3.29Å; L189-V193 HydrophobicContact CD1-CG2 4.18Å; L189-V193 HydrophobicContact CG-CG2 4.29Å; L189-V193 WeakPolarHBondContact O-CB 3.24Å; L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.35Å; L189-V193 PolarHBondContact O-N 3.11Å
190	F	90.5	Very high	91.9	Very high	125 Å²	125	52.4 Å²	52.4	55%	0.548	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-42.6	175.2	-80.5	-64.2	0	0	0	112.2	I186 F187 T188 S194	I186-F190 HydrophobicContact CG2-CD2 3.76Å; I186-F190 HydrophobicContact CG2-CE2 3.46Å; I186-F190 VanDerWaalsContact CG2-CE2 3.46Å; I186-F190 WeakPolarHBondContact O-CD2 3.45Å; I186-F190 PolarHBondContact O-N 3.07Å; F187-F190 PolarHBondContact O-N 3.41Å; T188-F190 PolarHBondContact O-N 3.09Å; F190-S194 VanDerWaalsContact O-CB 3.28Å; F190-S194 WeakPolarHBondContact O-CB 3.49Å; F190-S194 PolarHBondContact O-N 3.24Å; F190-S194 PolarHBondContact O-OG 3.45Å
191	M	89.8	Confident	91.9	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-40.5	176.9	-69	-62	-72.3	0	0	112	R35 V38 W80 F187 T188 L189 S194 S195	R35-M191 HydrophobicContact CB-CE 4.13Å; R35-M191 HydrophobicContact CB-SD 4.33Å; R35-M191 HydrophobicContact CG-CE 4.18Å; R35-M191 HydrophobicContact CG-SD 4.29Å; V38-M191 HydrophobicContact CG1-SD 4.35Å; W80-M191 HydrophobicContact CB-CE 4Å; W80-M191 HydrophobicContact CD2-CB 4.46Å; W80-M191 HydrophobicContact CD2-CE 4.19Å; W80-M191 HydrophobicContact CD2-CG 4.07Å; W80-M191 HydrophobicContact CE3-CG 4.26Å; W80-M191 HydrophobicContact CG-CE 3.89Å; W80-M191 HydrophobicContact CH2-CG 4.34Å; W80-M191 HydrophobicContact CZ2-CB 4.19Å; W80-M191 HydrophobicContact CZ2-CG 4.17Å; W80-M191 HydrophobicContact CZ3-CG 4.39Å; F187-M191 WeakPolarHBondContact O-CG 3.15Å; F187-M191 PolarHBondContact O-N 3.19Å; T188-M191 PolarHBondContact O-N 3.35Å; L189-M191 VanDerWaalsContact C-N 3.32Å; L189-M191 PolarHBondContact O-N 2.96Å; M191-S194 PolarHBondContact O-OG 3.27Å; M191-S195 VanDerWaalsContact O-CB 3.3Å; M191-S195 WeakPolarHBondContact O-CB 3.29Å; M191-S195 PolarHBondContact O-N 2.97Å; M191-S195 PolarHBondContact O-OG 3.16Å
192	V	92.6	Very high	91.9	Very high	18 Å²	18	47.4 Å²	47.4	11%	0.109	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-51.2	176.7	163.6	0	0	0	0	111.5	L147 L150 Y157 T188 L189 S194 S195 A196	L147-V192 HydrophobicContact CD1-CB 4.13Å; L147-V192 HydrophobicContact CD1-CG1 3.89Å; L147-V192 HydrophobicContact CD1-CG2 3.77Å; L150-V192 HydrophobicContact CD2-CG2 3.92Å; Y157-V192 HydrophobicContact CD1-CG2 3.69Å; Y157-V192 HydrophobicContact CD2-CG1 4.43Å; Y157-V192 HydrophobicContact CD2-CG2 4.43Å; Y157-V192 HydrophobicContact CE1-CG2 3.62Å; Y157-V192 HydrophobicContact CE2-CG1 4.01Å; Y157-V192 HydrophobicContact CE2-CG2 4.36Å; Y157-V192 HydrophobicContact CG-CG2 4.1Å; T188-V192 HydrophobicContact CG2-CG2 4.28Å; T188-V192 WeakPolarHBondContact O-CB 3.46Å; T188-V192 VanDerWaalsContact O-CG2 3.29Å; T188-V192 WeakPolarHBondContact O-CG2 3.48Å; T188-V192 PolarHBondContact O-N 3.31Å; L189-V192 PolarHBondContact O-N 3.29Å; V192-S194 PolarHBondContact O-N 2.95Å; V192-S195 WeakPolarHBondContact O-CA 3.31Å; V192-S195 WeakPolarHBondContact O-CB 3.49Å; V192-S195 PolarHBondContact O-N 2.91Å; V192-S195 VanDerWaalsContact O-N 3.1Å; V192-A196 PolarHBondContact O-N 3.4Å
193	V	92.9	Very high	91.9	Very high	80 Å²	80	47.1 Å²	47.1	49%	0.485	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-46.7	-179.8	171.2	0	0	0	0	110.5	L189 S195 A196 V197	L189-V193 HydrophobicContact CD1-CG2 4.18Å; L189-V193 HydrophobicContact CG-CG2 4.29Å; L189-V193 WeakPolarHBondContact O-CB 3.24Å; L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.35Å; L189-V193 PolarHBondContact O-N 3.11Å; V193-S195 PolarHBondContact O-N 3.39Å; V193-A196 PolarHBondContact O-N 2.9Å; V193-V197 WeakPolarHBondContact O-CG2 3.38Å; V193-V197 PolarHBondContact O-N 3.35Å; V193-V197 VanDerWaalsContact O-N 3.09Å
194	S	92.1	Very high	92	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-33.4	177.2	62.2	0	0	0	0	112.1	F190 M191 V192 C198	F190-S194 VanDerWaalsContact O-CB 3.28Å; F190-S194 WeakPolarHBondContact O-CB 3.49Å; F190-S194 PolarHBondContact O-N 3.24Å; F190-S194 PolarHBondContact O-OG 3.45Å; M191-S194 PolarHBondContact O-OG 3.27Å; V192-S194 PolarHBondContact O-N 2.95Å; S194-C198 WeakPolarHBondContact O-CB 3.49Å; S194-C198 PolarHBondContact O-N 3.21Å; S194-C198 PolarHBondContact O-SG 3.03Å; S194-C198 VanDerWaalsContact O-SG 3.35Å
195	S	92.9	Very high	92	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.014	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-44.7	174.4	-57.8	0	0	0	0	114.1	R35 Q83 M191 V192 V193 V197 C198 I199	R35-S195 PolarHBondContact NH2-OG 3.44Å; Q83-S195 PolarHBondContact NE2-OG 2.97Å; Q83-S195 VanDerWaalsContact NE2-OG 3.15Å; M191-S195 VanDerWaalsContact O-CB 3.3Å; M191-S195 WeakPolarHBondContact O-CB 3.29Å; M191-S195 PolarHBondContact O-N 2.97Å; M191-S195 PolarHBondContact O-OG 3.16Å; V192-S195 WeakPolarHBondContact O-CA 3.31Å; V192-S195 WeakPolarHBondContact O-CB 3.49Å; V192-S195 PolarHBondContact O-N 2.91Å; V192-S195 VanDerWaalsContact O-N 3.1Å; V193-S195 PolarHBondContact O-N 3.39Å; S195-V197 VanDerWaalsContact C-N 3.3Å; S195-V197 PolarHBondContact O-N 3.48Å; S195-C198 WeakPolarHBondContact O-CB 3.4Å; S195-C198 PolarHBondContact O-N 3.28Å; S195-I199 WeakPolarHBondContact O-CG1 3.45Å; S195-I199 PolarHBondContact O-N 2.88Å
196	A	93.9	Very high	92	Very high	41 Å²	41	43.7 Å²	43.7	34%	0.339	24%	0.237	S	C	.	.	H	α-helix	trans	-58.5	-44.7	175.8	0	0	0	0	0	111.2	V192 V193 C198 I199 L200	V192-A196 PolarHBondContact O-N 3.4Å; V193-A196 PolarHBondContact O-N 2.9Å; A196-C198 PolarHBondContact O-N 3.02Å; A196-I199 PolarHBondContact O-N 2.85Å; A196-L200 WeakPolarHBondContact O-CG 3.34Å; A196-L200 PolarHBondContact O-N 3.02Å
197	V	93.3	Very high	91.9	Very high	56 Å²	56	43 Å²	43	34%	0.339	23%	0.234	S	C	.	.	H	α-helix	trans	-65.2	-40.1	177.7	179.1	0	0	0	0	111.7	M30 V193 S195 I199 L200 M201	M30-V197 HydrophobicContact CE-CB 3.52Å; M30-V197 HydrophobicContact CE-CG1 3.63Å; M30-V197 HydrophobicContact CE-CG2 4.17Å; M30-V197 HydrophobicContact SD-CB 3.93Å; M30-V197 HydrophobicContact SD-CG1 3.48Å; M30-V197 WeakPolarHBondContact SD-CG1 3.37Å; V193-V197 WeakPolarHBondContact O-CG2 3.38Å; V193-V197 PolarHBondContact O-N 3.35Å; V193-V197 VanDerWaalsContact O-N 3.09Å; S195-V197 VanDerWaalsContact C-N 3.3Å; S195-V197 PolarHBondContact O-N 3.48Å; V197-I199 PolarHBondContact O-N 2.9Å; V197-L200 PolarHBondContact O-N 3.32Å; V197-M201 HydrophobicContact CG1-CE 4.15Å; V197-M201 HydrophobicContact CG1-CG 4.48Å; V197-M201 WeakPolarHBondContact O-CG 3.39Å; V197-M201 PolarHBondContact O-N 3.35Å
198	C	92.2	Very high	91.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-44.2	173.8	-79.6	0	0	0	0	112.4	S194 S195 A196 M201 C202	S194-C198 WeakPolarHBondContact O-CB 3.49Å; S194-C198 PolarHBondContact O-N 3.21Å; S194-C198 PolarHBondContact O-SG 3.03Å; S194-C198 VanDerWaalsContact O-SG 3.35Å; S195-C198 WeakPolarHBondContact O-CB 3.4Å; S195-C198 PolarHBondContact O-N 3.28Å; A196-C198 PolarHBondContact O-N 3.02Å; C198-M201 PolarHBondContact O-N 3.33Å; C198-C202 PolarHBondContact O-N 3.11Å; C198-C202 PolarHBondContact O-SG 2.91Å; C198-C202 VanDerWaalsContact O-SG 3.38Å
199	I	94.1	Very high	91.8	Very high	25 Å²	25	46 Å²	46	13%	0.128	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-48.3	176	-66.4	162.9	0	0	0	110.2	D143 A144 L147 S195 A196 V197 M201 C202 I203	D143-I199 HydrophobicContact CB-CD1 4.01Å; D143-I199 HydrophobicContact CB-CG1 3.64Å; A144-I199 HydrophobicContact CB-CD1 4.08Å; L147-I199 HydrophobicContact CD2-CD1 4.32Å; S195-I199 WeakPolarHBondContact O-CG1 3.45Å; S195-I199 PolarHBondContact O-N 2.88Å; A196-I199 PolarHBondContact O-N 2.85Å; V197-I199 PolarHBondContact O-N 2.9Å; I199-M201 VanDerWaalsContact C-N 3.34Å; I199-M201 PolarHBondContact O-N 2.96Å; I199-C202 WeakPolarHBondContact O-CB 3.29Å; I199-C202 PolarHBondContact O-N 3.07Å; I199-C202 VanDerWaalsContact O-N 3.15Å; I199-I203 HydrophobicContact CG2-CD1 3.79Å; I199-I203 HydrophobicContact CG2-CG1 4.43Å; I199-I203 WeakPolarHBondContact O-CG1 3.41Å; I199-I203 PolarHBondContact O-N 2.68Å
200	L	93.8	Very high	91.7	Very high	107 Å²	107	44.4 Å²	44.4	56%	0.56	24%	0.236	S	C	*	.	H	α-helix	trans	-58.2	-45.5	178	-71.2	174	0	0	0	111.5	A196 V197 C202 I203 C204	A196-L200 WeakPolarHBondContact O-CG 3.34Å; A196-L200 PolarHBondContact O-N 3.02Å; V197-L200 PolarHBondContact O-N 3.32Å; L200-C202 VanDerWaalsContact C-N 3.35Å; L200-C202 PolarHBondContact O-N 3.02Å; L200-I203 PolarHBondContact O-N 3.42Å; L200-C204 PolarHBondContact O-N 2.88Å; L200-C204 PolarHBondContact O-SG 3.28Å
201	M	91.3	Very high	91.6	Very high	30 Å²	30	45 Å²	45	15%	0.148	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-41.5	176	-73.3	-169.4	-65.6	0	0	112.4	V26 W27 M30 V197 C198 I199 C204 E205	V26-M201 HydrophobicContact CG1-SD 3.85Å; W27-M201 HydrophobicContact CB-CE 4.15Å; W27-M201 HydrophobicContact CG-CE 4.43Å; M30-M201 HydrophobicContact CB-CE 4.06Å; M30-M201 HydrophobicContact CG-CE 4.24Å; M30-M201 HydrophobicContact SD-CE 3.32Å; M30-M201 WeakPolarHBondContact SD-CE 3.47Å; V197-M201 HydrophobicContact CG1-CE 4.15Å; V197-M201 HydrophobicContact CG1-CG 4.48Å; V197-M201 WeakPolarHBondContact O-CG 3.39Å; V197-M201 PolarHBondContact O-N 3.35Å; C198-M201 PolarHBondContact O-N 3.33Å; I199-M201 VanDerWaalsContact C-N 3.34Å; I199-M201 PolarHBondContact O-N 2.96Å; M201-C204 PolarHBondContact O-N 3.06Å; M201-E205 WeakPolarHBondContact O-CB 3.46Å; M201-E205 PolarHBondContact O-N 3.07Å
202	C	92.1	Very high	91.5	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-42.5	174.5	-73	0	0	0	0	111.7	A140 C198 I199 L200 E205 M206	A140-C202 HydrophobicContact CB-CB 4.19Å; C198-C202 PolarHBondContact O-N 3.11Å; C198-C202 PolarHBondContact O-SG 2.91Å; C198-C202 VanDerWaalsContact O-SG 3.38Å; I199-C202 WeakPolarHBondContact O-CB 3.29Å; I199-C202 PolarHBondContact O-N 3.07Å; I199-C202 VanDerWaalsContact O-N 3.15Å; L200-C202 VanDerWaalsContact C-N 3.35Å; L200-C202 PolarHBondContact O-N 3.02Å; C202-E205 PolarHBondContact O-N 3.31Å; C202-M206 WeakPolarHBondContact O-CG 3.41Å; C202-M206 PolarHBondContact O-N 3.43Å
203	I	92.6	Very high	91.1	Very high	68 Å²	68	54.3 Å²	54.3	35%	0.349	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-48.4	176.5	-66.8	167.9	0	0	0	110.9	I199 L200 E205 M206 I207	I199-I203 HydrophobicContact CG2-CD1 3.79Å; I199-I203 HydrophobicContact CG2-CG1 4.43Å; I199-I203 WeakPolarHBondContact O-CG1 3.41Å; I199-I203 PolarHBondContact O-N 2.68Å; L200-I203 PolarHBondContact O-N 3.42Å; I203-E205 VanDerWaalsContact C-N 3.27Å; I203-E205 PolarHBondContact O-N 3.44Å; I203-M206 HydrophobicContact CB-CE 4.3Å; I203-M206 HydrophobicContact CG1-CE 3.85Å; I203-M206 WeakPolarHBondContact O-CB 3.41Å; I203-M206 PolarHBondContact O-N 3Å; I203-I207 HydrophobicContact CG2-CD1 3.72Å; I203-I207 HydrophobicContact CG2-CG1 4.35Å; I203-I207 WeakPolarHBondContact O-CB 3.5Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.36Å; I203-I207 PolarHBondContact O-N 2.86Å
204	C	91.9	Very high	90.9	Very high	67 Å²	67	54.3 Å²	54.3	45%	0.453	27%	0.272	S	S	.	.	H	α-helix	trans	-57.1	-41.3	176.2	-68.9	0	0	0	0	111.8	L200 M201 I207 Y208	L200-C204 PolarHBondContact O-N 2.88Å; L200-C204 PolarHBondContact O-SG 3.28Å; M201-C204 PolarHBondContact O-N 3.06Å; C204-I207 PolarHBondContact O-N 3.03Å; C204-Y208 WeakPolarHBondContact O-CB 3.43Å; C204-Y208 PolarHBondContact O-N 3.04Å
205	E	90.7	Very high	90.8	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.023	30%	0.3	C	S	.	.	H	α-helix	trans	-68.2	-41.6	177.4	-172.5	171.7	-175.6	0	0	112.5	T21 F23 K124 Y132 L136 M201 C202 I203 I207 Y208 L209	T21-E205 WeakPolarHBondContact CB-OE1 3.3Å; T21-E205 WeakPolarHBondContact CG2-OE1 3.4Å; T21-E205 PolarHBondContact OG1-OE1 3.46Å; T21-E205 PolarHBondContact OG1-OE2 3.03Å; F23-E205 HydrophobicContact CB-CB 4.19Å; F23-E205 HydrophobicContact CB-CG 4.31Å; K124-E205 IonicContact NZ-OE1 2.86Å; Y132-E205 HydrophobicContact CE1-CG 4.48Å; Y132-E205 WeakPolarHBondContact CE1-OE1 3.39Å; Y132-E205 VanDerWaalsContact CZ-OE1 3.25Å; Y132-E205 PolarHBondContact OH-OE1 3.02Å; Y132-E205 PolarHBondContact OH-OE2 3.06Å; L136-E205 HydrophobicContact CD1-CB 4.27Å; L136-E205 HydrophobicContact CD1-CG 3.99Å; M201-E205 WeakPolarHBondContact O-CB 3.46Å; M201-E205 PolarHBondContact O-N 3.07Å; C202-E205 PolarHBondContact O-N 3.31Å; I203-E205 VanDerWaalsContact C-N 3.27Å; I203-E205 PolarHBondContact O-N 3.44Å; E205-I207 VanDerWaalsContact C-N 3.33Å; E205-I207 PolarHBondContact O-N 3Å; E205-Y208 PolarHBondContact O-N 3.23Å; E205-L209 HydrophobicContact CG-CD1 4.27Å; E205-L209 HydrophobicContact CG-CG 4.46Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.96Å
206	M	91.1	Very high	90.4	Very high	31 Å²	31	64.1 Å²	64.1	15%	0.153	31%	0.314	C	S	.	.	H	α-helix	trans	-57	-49.3	173.8	-74.2	-171.9	-66.1	0	0	110.7	L133 L136 I137 A140 C202 I203 Y208 L209 I210	L133-M206 HydrophobicContact CD1-CG 4.29Å; L136-M206 HydrophobicContact CB-CG 3.6Å; L136-M206 HydrophobicContact CB-SD 3.98Å; L136-M206 HydrophobicContact CD1-CB 4.49Å; L136-M206 HydrophobicContact CD1-CG 3.6Å; L136-M206 HydrophobicContact CG-CG 4.27Å; I137-M206 HydrophobicContact CG1-SD 3.77Å; A140-M206 HydrophobicContact CB-CE 4.45Å; C202-M206 WeakPolarHBondContact O-CG 3.41Å; C202-M206 PolarHBondContact O-N 3.43Å; I203-M206 HydrophobicContact CB-CE 4.3Å; I203-M206 HydrophobicContact CG1-CE 3.85Å; I203-M206 WeakPolarHBondContact O-CB 3.41Å; I203-M206 PolarHBondContact O-N 3Å; M206-Y208 PolarHBondContact O-N 3.39Å; M206-L209 PolarHBondContact O-N 3.24Å; M206-I210 VanDerWaalsContact O-CG1 3.29Å; M206-I210 WeakPolarHBondContact O-CG1 3.32Å; M206-I210 PolarHBondContact O-N 3.18Å
207	I	91.3	Very high	90	Very high	81 Å²	81	66.4 Å²	66.4	42%	0.415	32%	0.32	S	S	.	.	H	α-helix	trans	-57.6	-51.2	177.8	-70.6	172.2	0	0	0	110.5	I203 C204 E205 L209 I210 F211	I203-I207 HydrophobicContact CG2-CD1 3.72Å; I203-I207 HydrophobicContact CG2-CG1 4.35Å; I203-I207 WeakPolarHBondContact O-CB 3.5Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.36Å; I203-I207 PolarHBondContact O-N 2.86Å; C204-I207 PolarHBondContact O-N 3.03Å; E205-I207 VanDerWaalsContact C-N 3.33Å; E205-I207 PolarHBondContact O-N 3Å; I207-L209 VanDerWaalsContact C-N 3.3Å; I207-L209 PolarHBondContact O-N 3.44Å; I207-I210 PolarHBondContact O-N 2.91Å; I207-F211 HydrophobicContact CG2-CD2 3.44Å; I207-F211 VanDerWaalsContact CG2-CD2 3.44Å; I207-F211 HydrophobicContact CG2-CE2 3.45Å; I207-F211 VanDerWaalsContact CG2-CE2 3.45Å; I207-F211 VanDerWaalsContact O-CD2 3.28Å; I207-F211 WeakPolarHBondContact O-CD2 3.49Å; I207-F211 PolarHBondContact O-N 3Å
208	Y	89.9	Confident	89.8	Confident	101 Å²	101	69 Å²	69	40%	0.396	33%	0.33	S	S	.	.	H	α-helix	trans	-55.2	-44.1	178.3	173.1	-97.1	0	0	0	112.5	C204 E205 M206 K212	C204-Y208 WeakPolarHBondContact O-CB 3.43Å; C204-Y208 PolarHBondContact O-N 3.04Å; E205-Y208 PolarHBondContact O-N 3.23Å; M206-Y208 PolarHBondContact O-N 3.39Å; Y208-K212 HydrophobicContact CE1-CD 4Å; Y208-K212 VanDerWaalsContact O-CB 3.26Å; Y208-K212 WeakPolarHBondContact O-CB 3.13Å; Y208-K212 PolarHBondContact O-N 3.18Å; Y208-K212 PolarHBondContact OH-NZ 3.35Å
209	L	87.8	Confident	89.6	Confident	12 Å²	12	73.3 Å²	73.3	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-68.6	-38.8	-179.4	-72.5	177.5	0	0	0	112.9	Y132 L136 E205 M206 I207 R213	Y132-L209 HydrophobicContact CD1-CD1 3.42Å; Y132-L209 VanDerWaalsContact CD1-CD1 3.42Å; Y132-L209 HydrophobicContact CE1-CD1 3.48Å; Y132-L209 VanDerWaalsContact CE1-CD1 3.48Å; L136-L209 HydrophobicContact CD1-CD1 4.03Å; E205-L209 HydrophobicContact CG-CD1 4.27Å; E205-L209 HydrophobicContact CG-CG 4.46Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.96Å; M206-L209 PolarHBondContact O-N 3.24Å; I207-L209 VanDerWaalsContact C-N 3.3Å; I207-L209 PolarHBondContact O-N 3.44Å; L209-R213 WeakPolarHBondContact O-CB 3.47Å; L209-R213 PolarHBondContact O-N 3.01Å
210	I	88.9	Confident	89.1	Confident	73 Å²	73	78.7 Å²	78.7	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-51.1	176.1	-67.8	166.2	0	0	0	109.7	M206 I207 K212 R213 I214	M206-I210 VanDerWaalsContact O-CG1 3.29Å; M206-I210 WeakPolarHBondContact O-CG1 3.32Å; M206-I210 PolarHBondContact O-N 3.18Å; I207-I210 PolarHBondContact O-N 2.91Å; I210-K212 VanDerWaalsContact C-N 3.33Å; I210-K212 PolarHBondContact O-N 2.8Å; I210-R213 WeakPolarHBondContact O-CB 3.41Å; I210-R213 PolarHBondContact O-N 2.87Å; I210-I214 HydrophobicContact CG2-CD1 3.72Å; I210-I214 HydrophobicContact CG2-CG1 4.38Å; I210-I214 WeakPolarHBondContact O-CG1 3.35Å; I210-I214 PolarHBondContact O-N 2.87Å
211	F	89.3	Confident	88.7	Confident	139 Å²	139	79.7 Å²	79.7	61%	0.61	37%	0.372	S	S	*	.	H	α-helix	trans	-58.1	-43.9	177.6	-86.8	-70.7	0	0	0	112.5	I207 R213 I214 K215	I207-F211 HydrophobicContact CG2-CD2 3.44Å; I207-F211 VanDerWaalsContact CG2-CD2 3.44Å; I207-F211 HydrophobicContact CG2-CE2 3.45Å; I207-F211 VanDerWaalsContact CG2-CE2 3.45Å; I207-F211 VanDerWaalsContact O-CD2 3.28Å; I207-F211 WeakPolarHBondContact O-CD2 3.49Å; I207-F211 PolarHBondContact O-N 3Å; F211-R213 VanDerWaalsContact C-N 3.27Å; F211-R213 PolarHBondContact O-N 2.98Å; F211-I214 PolarHBondContact O-N 3.2Å; F211-K215 WeakPolarHBondContact O-CB 3.34Å; F211-K215 PolarHBondContact O-N 2.9Å
212	K	86.6	Confident	88.3	Confident	121 Å²	121	84.6 Å²	84.6	53%	0.526	39%	0.392	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176.3	-173	172.8	-169.2	163.6	0	112.4	Y208 I210 K216	Y208-K212 HydrophobicContact CE1-CD 4Å; Y208-K212 VanDerWaalsContact O-CB 3.26Å; Y208-K212 WeakPolarHBondContact O-CB 3.13Å; Y208-K212 PolarHBondContact O-N 3.18Å; Y208-K212 PolarHBondContact OH-NZ 3.35Å; I210-K212 VanDerWaalsContact C-N 3.33Å; I210-K212 PolarHBondContact O-N 2.8Å; K212-K216 WeakPolarHBondContact O-CB 3.35Å; K212-K216 PolarHBondContact O-N 3.08Å
213	R	85.6	Confident	87.6	Confident	93 Å²	93	89.8 Å²	89.8	35%	0.351	42%	0.419	S	S	.	.	H	α-helix	trans	-69.9	-47.3	176.6	-175.2	65.9	179.4	-170.6	3	110.9	W129 L209 I210 F211 K216 L217	W129-R213 HydrophobicContact CH2-CG 4.35Å; W129-R213 HydrophobicContact CZ2-CB 4.18Å; W129-R213 HydrophobicContact CZ2-CG 4.33Å; L209-R213 WeakPolarHBondContact O-CB 3.47Å; L209-R213 PolarHBondContact O-N 3.01Å; I210-R213 WeakPolarHBondContact O-CB 3.41Å; I210-R213 PolarHBondContact O-N 2.87Å; F211-R213 VanDerWaalsContact C-N 3.27Å; F211-R213 PolarHBondContact O-N 2.98Å; R213-K216 PolarHBondContact O-N 3.5Å; R213-L217 HydrophobicContact CG-CD1 4.35Å; R213-L217 WeakPolarHBondContact O-CG 3.49Å; R213-L217 PolarHBondContact O-N 3.32Å
214	I	88.5	Confident	86.7	Confident	80 Å²	80	94.3 Å²	94.3	41%	0.41	44%	0.439	S	S	.	.	H	α-helix	trans	-58.6	-50.8	178.1	-66.8	169.2	0	0	0	110.4	I210 F211 K216 L217 I218	I210-I214 HydrophobicContact CG2-CD1 3.72Å; I210-I214 HydrophobicContact CG2-CG1 4.38Å; I210-I214 WeakPolarHBondContact O-CG1 3.35Å; I210-I214 PolarHBondContact O-N 2.87Å; F211-I214 PolarHBondContact O-N 3.2Å; I214-K216 PolarHBondContact O-N 3.3Å; I214-L217 WeakPolarHBondContact O-CB 3.34Å; I214-L217 PolarHBondContact O-N 3.37Å; I214-I218 HydrophobicContact CG2-CD1 3.69Å; I214-I218 HydrophobicContact CG2-CG1 4.28Å; I214-I218 WeakPolarHBondContact O-CG1 3.38Å; I214-I218 PolarHBondContact O-N 3.08Å
215	K	89.1	Confident	85.7	Confident	144 Å²	144	97.8 Å²	97.8	63%	0.626	45%	0.449	S	S	*	.	H	α-helix	trans	-55.3	-40.2	177.7	-174.1	174	-178.5	173.2	0	112.3	F211 I218 L219	F211-K215 WeakPolarHBondContact O-CB 3.34Å; F211-K215 PolarHBondContact O-N 2.9Å; K215-I218 PolarHBondContact O-N 3.37Å; K215-L219 HydrophobicContact CG-CD1 4.26Å; K215-L219 WeakPolarHBondContact O-CG 3.28Å; K215-L219 PolarHBondContact O-N 3.46Å
216	K	85.6	Confident	84.1	Confident	71 Å²	71	106.4 Å²	106.4	31%	0.309	49%	0.493	S	S	.	.	H	α-helix	trans	-69.4	-34	177.8	-169.4	179.6	179.8	-169.9	0	113	K212 R213 I214 R220	K212-K216 WeakPolarHBondContact O-CB 3.35Å; K212-K216 PolarHBondContact O-N 3.08Å; R213-K216 PolarHBondContact O-N 3.5Å; I214-K216 PolarHBondContact O-N 3.3Å; K216-R220 WeakPolarHBondContact O-CG 3.49Å; K216-R220 PolarHBondContact O-N 3.35Å
217	L	85.3	Confident	83.8	Confident	89 Å²	89	110.2 Å²	110.2	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-70.5	-41.7	175.2	-68	173.1	0	0	0	111	R213 I214 R220 K221	R213-L217 HydrophobicContact CG-CD1 4.35Å; R213-L217 WeakPolarHBondContact O-CG 3.49Å; R213-L217 PolarHBondContact O-N 3.32Å; I214-L217 WeakPolarHBondContact O-CB 3.34Å; I214-L217 PolarHBondContact O-N 3.37Å; L217-R220 PolarHBondContact O-N 3.16Å; L217-K221 PolarHBondContact O-N 3.2Å
218	I	89.3	Confident	83.4	Confident	109 Å²	109	111.7 Å²	111.7	56%	0.559	52%	0.515	S	S	*	.	H	α-helix	trans	-61.7	-48.4	176.6	-65.4	170.1	0	0	0	111	I214 K215 R220 K221 K222	I214-I218 HydrophobicContact CG2-CD1 3.69Å; I214-I218 HydrophobicContact CG2-CG1 4.28Å; I214-I218 WeakPolarHBondContact O-CG1 3.38Å; I214-I218 PolarHBondContact O-N 3.08Å; K215-I218 PolarHBondContact O-N 3.37Å; I218-R220 VanDerWaalsContact C-N 3.32Å; I218-R220 PolarHBondContact O-N 3.23Å; I218-K221 PolarHBondContact O-N 3.12Å; I218-K222 PolarHBondContact O-N 3.42Å
219	L	87.5	Confident	83	Confident	91 Å²	91	112.3 Å²	112.3	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-59.6	-42.1	178	-72.6	170.5	0	0	0	112	K215 K221 K222 D223	K215-L219 HydrophobicContact CG-CD1 4.26Å; K215-L219 WeakPolarHBondContact O-CG 3.28Å; K215-L219 PolarHBondContact O-N 3.46Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.37Å; L219-K222 PolarHBondContact O-N 3.44Å; L219-D223 VanDerWaalsContact O-CG 3.28Å; L219-D223 PolarHBondContact O-N 3.27Å
220	R	83.3	Confident	82.7	Confident	138 Å²	138	118.2 Å²	118.2	52%	0.521	55%	0.549	S	S	.	.	H	α-helix	trans	-63.6	-37.7	176.1	-79.2	177.1	169.1	-156.1	-10.6	113.4	K216 L217 I218 K222 D223 Q224	K216-R220 WeakPolarHBondContact O-CG 3.49Å; K216-R220 PolarHBondContact O-N 3.35Å; L217-R220 PolarHBondContact O-N 3.16Å; I218-R220 VanDerWaalsContact C-N 3.32Å; I218-R220 PolarHBondContact O-N 3.23Å; R220-K222 VanDerWaalsContact C-N 3.33Å; R220-D223 PolarHBondContact O-N 2.92Å; R220-Q224 WeakPolarHBondContact O-CG 3.4Å; R220-Q224 PolarHBondContact O-N 3.2Å
221	K	84.7	Confident	82.3	Confident	129 Å²	129	121.1 Å²	121.1	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-65.1	-41.5	176.2	-168	-178.1	177.5	-168.2	0	110.3	L217 I218 L219 Q224 E225	L217-K221 PolarHBondContact O-N 3.2Å; I218-K221 PolarHBondContact O-N 3.12Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.37Å; K221-Q224 PolarHBondContact O-N 3.46Å; K221-Q224 VanDerWaalsContact O-N 3.16Å; K221-E225 VanDerWaalsContact CE-OE1 3.28Å; K221-E225 WeakPolarHBondContact CE-OE1 3.4Å; K221-E225 IonicContact NZ-OE1 3.98Å; K221-E225 PolarHBondContact O-N 3.24Å
222	K	83.2	Confident	81.9	Confident	132 Å²	132	119.9 Å²	119.9	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-64.4	-39.7	176.6	-163.9	174	-176.1	177	0	112.8	I218 L219 R220 Q224 E225	I218-K222 PolarHBondContact O-N 3.42Å; L219-K222 PolarHBondContact O-N 3.44Å; R220-K222 VanDerWaalsContact C-N 3.33Å; K222-Q224 PolarHBondContact O-N 3.49Å; K222-E225 PolarHBondContact O-N 3.32Å
223	D	76.9	Confident	81.5	Confident	111 Å²	111	119.8 Å²	119.8	59%	0.594	56%	0.559	S	S	*	*	H	α-helix	trans	-69.4	-16.8	175.3	-63.1	-23	0	0	0	113.2	L219 R220	L219-D223 VanDerWaalsContact O-CG 3.28Å; L219-D223 PolarHBondContact O-N 3.27Å; R220-D223 PolarHBondContact O-N 2.92Å
224	Q	75.3	Confident	81.2	Confident	164 Å²	164	121.8 Å²	121.8	77%	0.766	58%	0.575	S	S	*	*	H	α-helix	trans	-91.7	-14.9	174.9	-75.4	-177.6	-49.1	0	0	113.1	R220 K221 K222	R220-Q224 WeakPolarHBondContact O-CG 3.4Å; R220-Q224 PolarHBondContact O-N 3.2Å; K221-Q224 PolarHBondContact O-N 3.46Å; K221-Q224 VanDerWaalsContact O-N 3.16Å; K222-Q224 PolarHBondContact O-N 3.49Å
225	E	69.4	Low	80.6	Confident	139 Å²	139	125.3 Å²	125.3	65%	0.65	59%	0.588	S	S	*	*			trans	-93.1	-4.5	178.1	-73.2	172.5	178.6	0	0	112.4	K221 K222	K221-E225 VanDerWaalsContact CE-OE1 3.28Å; K221-E225 WeakPolarHBondContact CE-OE1 3.4Å; K221-E225 IonicContact NZ-OE1 3.98Å; K221-E225 PolarHBondContact O-N 3.24Å; K222-E225 PolarHBondContact O-N 3.32Å
226	I	58.1	Low	79.9	Confident	187 Å²	187	123.6 Å²	123.6	96%	0.959	59%	0.585	S	S	*	*			trans	-106.2	0	174.2	-59.3	170.9	0	0	0	108.7

Retrieved 226 of 226 residues in 246.4 ms (Link to these results)

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