A0A087YKT2_POEFO Loading...

Germ cell-specific gene 1-like protein

AlphaFold DB , UniProt , Accession A0A087YKT2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 310 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.9	Low	73.6	Confident	184 Å²	184	105 Å²	105	91%	0.906	53%	0.534	S	S	*	.				0	-47.8	0	-79.8	173.6	89.1	0	0	114.5	T3 T4 R5	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.98Å; M1-T4 PolarHBondContact O-N 3.45Å; M1-R5 PolarHBondContact O-N 3.26Å
2	K	54	Low	75.1	Confident	185 Å²	185	96.6 Å²	96.6	80%	0.804	49%	0.491	S	S	*	.	H	α-helix	trans	-57.4	-38.2	178.1	-80.3	178.5	176.6	175.4	0	113.9	R5 K6	K2-R5 PolarHBondContact O-N 2.92Å; K2-K6 PolarHBondContact O-N 3.49Å
3	T	59.5	Low	76.5	Confident	117 Å²	117	90.5 Å²	90.5	72%	0.718	46%	0.462	S	S	*	.	H	α-helix	trans	-64.2	-38.8	179.2	-12.2	0	0	0	0	112.6	M1 C7	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.98Å; T3-C7 VanDerWaalsContact O-CB 3.31Å; T3-C7 WeakPolarHBondContact O-CB 3.46Å; T3-C7 PolarHBondContact O-N 3.25Å
4	T	70.5	Confident	77.7	Confident	90 Å²	90	89.5 Å²	89.5	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-69.3	-34.9	179.9	-38.9	0	0	0	0	112.2	M1 R8	M1-T4 PolarHBondContact O-N 3.45Å; T4-R8 VanDerWaalsContact O-CD 3.32Å; T4-R8 WeakPolarHBondContact O-CD 3.35Å; T4-R8 VanDerWaalsContact O-CG 3.22Å; T4-R8 WeakPolarHBondContact O-CG 3.33Å; T4-R8 PolarHBondContact O-N 3.5Å
5	R	69.4	Low	78.9	Confident	95 Å²	95	86.1 Å²	86.1	36%	0.358	45%	0.448	S	S	.	.	H	α-helix	trans	-70.3	-45.8	177.2	-168	-174.5	-76.8	-169.1	-3.9	111.5	M1 K2 R8 A9 E227	M1-R5 PolarHBondContact O-N 3.26Å; K2-R5 PolarHBondContact O-N 2.92Å; R5-R8 PolarHBondContact O-N 3.12Å; R5-A9 PolarHBondContact O-N 2.9Å; R5-A9 VanDerWaalsContact O-N 3.08Å; R5-E227 IonicContact CZ-OE2 3.69Å; R5-E227 IonicContact NH2-OE1 3.82Å; R5-E227 IonicContact NH2-OE2 2.94Å; R5-E227 PolarHBondContact NH2-OE2 3.3Å
6	K	75.5	Confident	79.9	Confident	148 Å²	148	80.7 Å²	80.7	64%	0.643	42%	0.42	S	S	*	.	H	α-helix	trans	-63.5	-41.9	177.1	-70.5	-171.4	175.6	-170.3	0	112.4	K2 R8 A9 L10	K2-K6 PolarHBondContact O-N 3.49Å; K6-R8 VanDerWaalsContact C-N 3.31Å; K6-R8 PolarHBondContact O-N 3.43Å; K6-A9 PolarHBondContact O-N 2.95Å; K6-L10 WeakPolarHBondContact O-CB 3.46Å; K6-L10 VanDerWaalsContact O-CG 3.3Å; K6-L10 WeakPolarHBondContact O-CG 3.09Å; K6-L10 PolarHBondContact O-N 2.94Å
7	C	82.6	Confident	80.9	Confident	83 Å²	83	80.2 Å²	80.2	56%	0.561	42%	0.417	S	S	*	.	H	α-helix	trans	-59.1	-41.7	176.9	-172.4	0	0	0	0	112	T3 L11	T3-C7 VanDerWaalsContact O-CB 3.31Å; T3-C7 WeakPolarHBondContact O-CB 3.46Å; T3-C7 PolarHBondContact O-N 3.25Å; C7-L11 WeakPolarHBondContact O-CB 3.34Å; C7-L11 PolarHBondContact O-N 3.46Å
8	R	82.4	Confident	81.8	Confident	47 Å²	47	77.3 Å²	77.3	18%	0.177	41%	0.407	C	S	.	.	H	α-helix	trans	-69.6	-40	177.9	-68.8	166.4	59.5	-152.4	6.4	113.5	T4 R5 K6 L11 S12 N219 S220	T4-R8 VanDerWaalsContact O-CD 3.32Å; T4-R8 WeakPolarHBondContact O-CD 3.35Å; T4-R8 VanDerWaalsContact O-CG 3.22Å; T4-R8 WeakPolarHBondContact O-CG 3.33Å; T4-R8 PolarHBondContact O-N 3.5Å; R5-R8 PolarHBondContact O-N 3.12Å; K6-R8 VanDerWaalsContact C-N 3.31Å; K6-R8 PolarHBondContact O-N 3.43Å; R8-L11 PolarHBondContact O-N 3Å; R8-S12 PolarHBondContact O-N 2.72Å; R8-N219 PolarHBondContact NH2-O 2.92Å; R8-S220 VanDerWaalsContact CZ-OG 3.26Å; R8-S220 PolarHBondContact NE-OG 3.38Å; R8-S220 PolarHBondContact NH2-OG 3.39Å
9	A	83.4	Confident	82.6	Confident	23 Å²	23	73.2 Å²	73.2	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-64.9	-45.1	175.3	0	0	0	0	0	111.1	R5 K6 L11 S12 V13 L140	R5-A9 PolarHBondContact O-N 2.9Å; R5-A9 VanDerWaalsContact O-N 3.08Å; K6-A9 PolarHBondContact O-N 2.95Å; A9-L11 PolarHBondContact O-N 3.42Å; A9-S12 PolarHBondContact O-N 2.91Å; A9-V13 VanDerWaalsContact O-CG2 3.23Å; A9-V13 WeakPolarHBondContact O-CG2 3.3Å; A9-V13 PolarHBondContact O-N 3.24Å; A9-L140 HydrophobicContact CB-CD2 3.92Å
10	L	88.3	Confident	83.3	Confident	91 Å²	91	70.9 Å²	70.9	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-43.7	174.3	-74.6	168.2	0	0	0	112	K6 S12 V13 C14 L140	K6-L10 WeakPolarHBondContact O-CB 3.46Å; K6-L10 VanDerWaalsContact O-CG 3.3Å; K6-L10 WeakPolarHBondContact O-CG 3.09Å; K6-L10 PolarHBondContact O-N 2.94Å; L10-S12 VanDerWaalsContact C-N 3.33Å; L10-S12 PolarHBondContact O-N 3.1Å; L10-V13 PolarHBondContact O-N 2.85Å; L10-C14 WeakPolarHBondContact O-CB 3.42Å; L10-C14 PolarHBondContact O-N 3.45Å; L10-C14 PolarHBondContact O-SG 2.87Å; L10-L140 HydrophobicContact CD2-CD1 4.23Å
11	L	91	Very high	83.9	Confident	92 Å²	92	72.3 Å²	72.3	48%	0.482	38%	0.381	S	S	.	.	H	α-helix	trans	-58.5	-46	176.4	179.8	63.9	0	0	0	111.3	C7 R8 A9 V13 C14 L15	C7-L11 WeakPolarHBondContact O-CB 3.34Å; C7-L11 PolarHBondContact O-N 3.46Å; R8-L11 PolarHBondContact O-N 3Å; A9-L11 PolarHBondContact O-N 3.42Å; L11-V13 PolarHBondContact O-N 2.88Å; L11-C14 PolarHBondContact O-N 2.93Å; L11-L15 HydrophobicContact CD1-CD1 4.17Å; L11-L15 HydrophobicContact CD1-CG 4.28Å; L11-L15 HydrophobicContact CG-CD1 3.99Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 VanDerWaalsContact O-CG 3.25Å; L11-L15 WeakPolarHBondContact O-CG 3.39Å; L11-L15 PolarHBondContact O-N 3.44Å
12	S	91.6	Very high	86	Confident	4 Å²	4	67.5 Å²	67.5	3%	0.028	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-44.5	178.1	-165.6	0	0	0	0	112.1	R8 A9 L10 C14 L15 N16 M136 A213 T217	R8-S12 PolarHBondContact O-N 2.72Å; A9-S12 PolarHBondContact O-N 2.91Å; L10-S12 VanDerWaalsContact C-N 3.33Å; L10-S12 PolarHBondContact O-N 3.1Å; S12-C14 PolarHBondContact O-N 3.26Å; S12-L15 PolarHBondContact O-N 3.47Å; S12-N16 WeakPolarHBondContact O-CB 3.35Å; S12-N16 PolarHBondContact O-N 3.4Å; S12-M136 PolarHBondContact OG-SD 2.9Å; S12-A213 PolarHBondContact OG-O 3.06Å; S12-T217 PolarHBondContact OG-OG1 2.94Å
13	V	92.6	Very high	88.1	Confident	18 Å²	18	58.7 Å²	58.7	11%	0.109	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-44.3	178.4	172.1	0	0	0	0	111.3	A9 L10 L11 N16 L17 F133 M136 L140	A9-V13 VanDerWaalsContact O-CG2 3.23Å; A9-V13 WeakPolarHBondContact O-CG2 3.3Å; A9-V13 PolarHBondContact O-N 3.24Å; L10-V13 PolarHBondContact O-N 2.85Å; L11-V13 PolarHBondContact O-N 2.88Å; V13-N16 PolarHBondContact O-N 2.85Å; V13-L17 WeakPolarHBondContact O-CB 3.19Å; V13-L17 PolarHBondContact O-N 3.02Å; V13-F133 HydrophobicContact CG1-CD2 4.38Å; V13-F133 HydrophobicContact CG1-CE2 3.79Å; V13-M136 HydrophobicContact CG2-CB 3.66Å; V13-L140 HydrophobicContact CB-CD1 4.31Å; V13-L140 HydrophobicContact CG1-CD1 4.25Å; V13-L140 HydrophobicContact CG2-CD1 3.71Å; V13-L140 HydrophobicContact CG2-CG 4.29Å
14	C	94.5	Very high	89.8	Confident	76 Å²	76	55.4 Å²	55.4	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-42.5	176.5	-69.9	0	0	0	0	112	L10 L11 S12 N16 L17 A18	L10-C14 WeakPolarHBondContact O-CB 3.42Å; L10-C14 PolarHBondContact O-N 3.45Å; L10-C14 PolarHBondContact O-SG 2.87Å; L11-C14 PolarHBondContact O-N 2.93Å; S12-C14 PolarHBondContact O-N 3.26Å; C14-N16 VanDerWaalsContact C-N 3.35Å; C14-L17 PolarHBondContact O-N 3.34Å; C14-A18 WeakPolarHBondContact O-CB 3.49Å; C14-A18 PolarHBondContact O-N 2.92Å
15	L	94.9	Very high	91	Very high	38 Å²	38	54 Å²	54	20%	0.199	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-40.2	176.6	-73	169.7	0	0	0	111.6	L11 S12 A18 A19 A212 A213	L11-L15 HydrophobicContact CD1-CD1 4.17Å; L11-L15 HydrophobicContact CD1-CG 4.28Å; L11-L15 HydrophobicContact CG-CD1 3.99Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 VanDerWaalsContact O-CG 3.25Å; L11-L15 WeakPolarHBondContact O-CG 3.39Å; L11-L15 PolarHBondContact O-N 3.44Å; S12-L15 PolarHBondContact O-N 3.47Å; L15-A18 PolarHBondContact O-N 2.86Å; L15-A19 WeakPolarHBondContact O-CB 3.5Å; L15-A19 PolarHBondContact O-N 3Å; L15-A212 HydrophobicContact CD1-CB 4.11Å; L15-A213 HydrophobicContact CB-CB 3.8Å
16	N	95.2	Very high	92.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-39.6	178.4	-148.7	-71.4	0	0	0	111.6	S12 V13 C14 A19 L20 L129 F133 M136 T160 A213	S12-N16 WeakPolarHBondContact O-CB 3.35Å; S12-N16 PolarHBondContact O-N 3.4Å; V13-N16 PolarHBondContact O-N 2.85Å; C14-N16 VanDerWaalsContact C-N 3.35Å; N16-A19 WeakPolarHBondContact O-CB 3.34Å; N16-A19 PolarHBondContact O-N 3.29Å; N16-L20 WeakPolarHBondContact O-CB 3.39Å; N16-L20 PolarHBondContact O-N 3.46Å; N16-L129 PolarHBondContact OD1-O 2.81Å; N16-F133 HydrophobicContact CB-CD2 4.42Å; N16-M136 HydrophobicContact CB-SD 4.15Å; N16-M136 WeakPolarHBondContact ND2-CE 3.47Å; N16-T160 VanDerWaalsContact ND2-CG2 3.32Å; N16-T160 WeakPolarHBondContact ND2-CG2 3.36Å; N16-A213 HydrophobicContact CB-CB 4.31Å
17	L	96.1	Very high	93.2	Very high	72 Å²	72	43.6 Å²	43.6	38%	0.377	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-45.7	172.5	179.8	61.5	0	0	0	111.8	V13 C14 A19 L20 L21 F133	V13-L17 WeakPolarHBondContact O-CB 3.19Å; V13-L17 PolarHBondContact O-N 3.02Å; C14-L17 PolarHBondContact O-N 3.34Å; L17-A19 VanDerWaalsContact C-N 3.33Å; L17-A19 PolarHBondContact O-N 2.92Å; L17-L20 PolarHBondContact O-N 3Å; L17-L21 HydrophobicContact CD1-CD1 4.41Å; L17-L21 HydrophobicContact CD1-CG 4.37Å; L17-L21 HydrophobicContact CG-CD1 4.25Å; L17-L21 WeakPolarHBondContact O-CG 3.42Å; L17-L21 PolarHBondContact O-N 3.45Å; L17-F133 HydrophobicContact CB-CD2 4.32Å; L17-F133 HydrophobicContact CB-CE2 3.85Å; L17-F133 HydrophobicContact CD1-CE2 4.23Å; L17-F133 HydrophobicContact CD1-CZ 4.15Å
18	A	97.2	Very high	93.7	Very high	28 Å²	28	45.3 Å²	45.3	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-43.1	176.5	0	0	0	0	0	111.4	C14 L15 L21 F22	C14-A18 WeakPolarHBondContact O-CB 3.49Å; C14-A18 PolarHBondContact O-N 2.92Å; L15-A18 PolarHBondContact O-N 2.86Å; A18-L21 PolarHBondContact O-N 3.31Å; A18-F22 WeakPolarHBondContact O-CB 3.47Å; A18-F22 WeakPolarHBondContact O-CD2 3.49Å; A18-F22 VanDerWaalsContact O-CG 3.27Å; A18-F22 WeakPolarHBondContact O-CG 3.44Å; A18-F22 PolarHBondContact O-N 3.45Å
19	A	97	Very high	94.3	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-51	173.1	0	0	0	0	0	111.1	L15 N16 L17 L21 F22 S23 L129 S206 C209 C210	L15-A19 WeakPolarHBondContact O-CB 3.5Å; L15-A19 PolarHBondContact O-N 3Å; N16-A19 WeakPolarHBondContact O-CB 3.34Å; N16-A19 PolarHBondContact O-N 3.29Å; L17-A19 VanDerWaalsContact C-N 3.33Å; L17-A19 PolarHBondContact O-N 2.92Å; A19-L21 VanDerWaalsContact C-N 3.32Å; A19-L21 PolarHBondContact O-N 3.02Å; A19-F22 PolarHBondContact O-N 3.49Å; A19-S23 WeakPolarHBondContact O-CB 2.99Å; A19-S23 PolarHBondContact O-N 3.15Å; A19-L129 HydrophobicContact CB-CD1 4.27Å; A19-L129 HydrophobicContact CB-CD2 4.29Å; A19-S206 VanDerWaalsContact C-OG 3.28Å; A19-S206 WeakPolarHBondContact CA-OG 3.37Å; A19-S206 WeakPolarHBondContact CB-O 3.31Å; A19-S206 PolarHBondContact O-OG 3.24Å; A19-C209 HydrophobicContact CB-CB 3.86Å; A19-C210 HydrophobicContact CB-CB 4.2Å
20	L	96.6	Very high	94.7	Very high	27 Å²	27	44.3 Å²	44.3	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-44.6	-179.7	-175.9	64.9	0	0	0	112.5	N16 L17 T24 I126 L129 V130	N16-L20 WeakPolarHBondContact O-CB 3.39Å; N16-L20 PolarHBondContact O-N 3.46Å; L17-L20 PolarHBondContact O-N 3Å; L20-T24 VanDerWaalsContact O-CB 3.23Å; L20-T24 WeakPolarHBondContact O-CB 3.46Å; L20-T24 PolarHBondContact O-N 2.88Å; L20-T24 PolarHBondContact O-OG1 2.89Å; L20-I126 HydrophobicContact CD1-CG2 4.12Å; L20-L129 HydrophobicContact CD1-CB 4.15Å; L20-V130 HydrophobicContact CD1-CG2 3.5Å; L20-V130 VanDerWaalsContact CD1-CG2 3.5Å; L20-V130 HydrophobicContact CD2-CG2 4.06Å; L20-V130 HydrophobicContact CG-CG2 4.44Å
21	L	97.2	Very high	94.9	Very high	100 Å²	100	43.7 Å²	43.7	52%	0.524	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-46.4	177.8	-68.6	173.6	0	0	0	111.6	L17 A18 A19 T25	L17-L21 HydrophobicContact CD1-CD1 4.41Å; L17-L21 HydrophobicContact CD1-CG 4.37Å; L17-L21 HydrophobicContact CG-CD1 4.25Å; L17-L21 WeakPolarHBondContact O-CG 3.42Å; L17-L21 PolarHBondContact O-N 3.45Å; A18-L21 PolarHBondContact O-N 3.31Å; A19-L21 VanDerWaalsContact C-N 3.32Å; A19-L21 PolarHBondContact O-N 3.02Å; L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 3.38Å; L21-T25 PolarHBondContact O-OG1 3.07Å
22	F	97.2	Very high	95	Very high	83 Å²	83	39.3 Å²	39.3	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-45.6	-179.7	-69.6	-17.7	0	0	0	112.6	A18 A19 T25 A26 M202	A18-F22 WeakPolarHBondContact O-CB 3.47Å; A18-F22 WeakPolarHBondContact O-CD2 3.49Å; A18-F22 VanDerWaalsContact O-CG 3.27Å; A18-F22 WeakPolarHBondContact O-CG 3.44Å; A18-F22 PolarHBondContact O-N 3.45Å; A19-F22 PolarHBondContact O-N 3.49Å; F22-T25 PolarHBondContact O-N 3.01Å; F22-A26 VanDerWaalsContact O-CB 3.25Å; F22-A26 WeakPolarHBondContact O-CB 3.49Å; F22-A26 PolarHBondContact O-N 3.04Å; F22-M202 HydrophobicContact CB-CB 4.27Å; F22-M202 HydrophobicContact CD1-SD 4.32Å
23	S	96.6	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-43.4	176.9	170.9	0	0	0	0	111.7	A19 T25 A26 F27 E122 Y125 I126 S206	A19-S23 WeakPolarHBondContact O-CB 2.99Å; A19-S23 PolarHBondContact O-N 3.15Å; S23-T25 VanDerWaalsContact C-N 3.34Å; S23-T25 PolarHBondContact O-N 3.06Å; S23-A26 PolarHBondContact O-N 3.24Å; S23-F27 WeakPolarHBondContact O-CB 3.42Å; S23-F27 PolarHBondContact O-N 3.33Å; S23-E122 PolarHBondContact OG-OE1 2.95Å; S23-Y125 VanDerWaalsContact OG-CE1 3.22Å; S23-Y125 WeakPolarHBondContact OG-CE1 3.43Å; S23-I126 WeakPolarHBondContact OG-CG1 3.22Å; S23-S206 VanDerWaalsContact CB-OG 3.27Å; S23-S206 WeakPolarHBondContact CB-OG 3.41Å
24	T	95.6	Very high	95.1	Very high	48 Å²	48	42.2 Å²	42.2	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-42.6	177.4	-55	0	0	0	0	111.4	L20 F27 I28	L20-T24 VanDerWaalsContact O-CB 3.23Å; L20-T24 WeakPolarHBondContact O-CB 3.46Å; L20-T24 PolarHBondContact O-N 2.88Å; L20-T24 PolarHBondContact O-OG1 2.89Å; T24-F27 PolarHBondContact O-N 3.3Å; T24-I28 HydrophobicContact CG2-CD1 3.8Å; T24-I28 WeakPolarHBondContact O-CG1 3.44Å; T24-I28 PolarHBondContact O-N 3.32Å
25	T	95.9	Very high	95	Very high	60 Å²	60	39.2 Å²	39.2	37%	0.368	21%	0.207	S	C	.	.	H	α-helix	trans	-65.6	-45.7	178.2	-50	0	0	0	0	110.4	L21 F22 S23 F27 I28 T29 W198 M202	L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 3.38Å; L21-T25 PolarHBondContact O-OG1 3.07Å; F22-T25 PolarHBondContact O-N 3.01Å; S23-T25 VanDerWaalsContact C-N 3.34Å; S23-T25 PolarHBondContact O-N 3.06Å; T25-F27 VanDerWaalsContact C-N 3.28Å; T25-F27 PolarHBondContact O-N 3.38Å; T25-I28 PolarHBondContact O-N 3.45Å; T25-T29 VanDerWaalsContact O-CB 3.27Å; T25-T29 WeakPolarHBondContact O-CB 3.49Å; T25-T29 WeakPolarHBondContact O-CG2 3.42Å; T25-T29 PolarHBondContact O-N 3.09Å; T25-T29 VanDerWaalsContact O-N 3.1Å; T25-W198 HydrophobicContact CG2-CH2 4.1Å; T25-W198 HydrophobicContact CG2-CZ3 4.01Å; T25-M202 HydrophobicContact CG2-CE 3.57Å; T25-M202 HydrophobicContact CG2-SD 4.25Å
26	A	95.3	Very high	94.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-37.9	175.4	0	0	0	0	0	111.6	F22 S23 I28 T29 W32 S199 M202 A203	F22-A26 VanDerWaalsContact O-CB 3.25Å; F22-A26 WeakPolarHBondContact O-CB 3.49Å; F22-A26 PolarHBondContact O-N 3.04Å; S23-A26 PolarHBondContact O-N 3.24Å; A26-I28 PolarHBondContact O-N 3.27Å; A26-T29 WeakPolarHBondContact O-CG2 3.3Å; A26-W32 HydrophobicContact CB-CZ2 4.09Å; A26-W32 PolarHBondContact O-NE1 2.88Å; A26-S199 WeakPolarHBondContact CB-O 3.47Å; A26-M202 HydrophobicContact CB-CB 4.42Å; A26-M202 HydrophobicContact CB-CE 4.38Å; A26-A203 HydrophobicContact CB-CB 4.03Å
27	F	95.1	Very high	94.4	Very high	25 Å²	25	39.1 Å²	39.1	11%	0.11	21%	0.208	C	C	.	.	H	α-helix	trans	-69	-34.2	-178.4	-171.1	-114.7	0	0	0	114.2	S23 T24 T25 I85 W86 V119 E122 V123 I126	S23-F27 WeakPolarHBondContact O-CB 3.42Å; S23-F27 PolarHBondContact O-N 3.33Å; T24-F27 PolarHBondContact O-N 3.3Å; T25-F27 VanDerWaalsContact C-N 3.28Å; T25-F27 PolarHBondContact O-N 3.38Å; F27-I85 HydrophobicContact CD2-CD1 3.66Å; F27-I85 HydrophobicContact CE2-CD1 4.18Å; F27-I85 HydrophobicContact CE2-CG2 4.47Å; F27-W86 AromaticContact CD1-NE1 3.99Å; F27-W86 AromaticContact CE1-CE2 3.95Å; F27-W86 AromaticContact CE1-CZ2 3.61Å; F27-W86 HydrophobicContact CE1-CZ2 3.61Å; F27-W86 AromaticContact CE1-NE1 3.66Å; F27-W86 HydrophobicContact CE2-CZ2 4.17Å; F27-W86 AromaticContact CZ-CE2 3.76Å; F27-W86 HydrophobicContact CZ-CH2 4.38Å; F27-W86 AromaticContact CZ-CZ2 3.3Å; F27-W86 HydrophobicContact CZ-CZ2 3.3Å; F27-W86 AromaticContact CZ-NE1 3.7Å; F27-W86 VanDerWaalsContact O-CD1 3.28Å; F27-W86 PolarHBondContact O-NE1 3.46Å; F27-V119 HydrophobicContact CZ-CG1 4.34Å; F27-E122 HydrophobicContact CD2-CB 4.25Å; F27-E122 HydrophobicContact CD2-CG 3.44Å; F27-E122 VanDerWaalsContact CD2-CG 3.44Å; F27-E122 HydrophobicContact CE2-CB 4.02Å; F27-E122 HydrophobicContact CE2-CG 3.73Å; F27-E122 HydrophobicContact CG-CG 4.43Å; F27-V123 HydrophobicContact CE1-CG2 4.12Å; F27-V123 HydrophobicContact CE2-CG2 4.3Å; F27-V123 HydrophobicContact CZ-CG2 3.54Å; F27-I126 HydrophobicContact CB-CD1 3.83Å; F27-I126 HydrophobicContact CD1-CD1 4.08Å; F27-I126 HydrophobicContact CD2-CD1 4.41Å; F27-I126 HydrophobicContact CG-CD1 3.87Å
28	I	94.2	Very high	94	Very high	120 Å²	120	39.4 Å²	39.4	62%	0.615	20%	0.204	S	C	*	.	H	α-helix	trans	-89.3	-33.2	-174	-63.5	169	0	0	0	111.9	T24 T25 A26	T24-I28 HydrophobicContact CG2-CD1 3.8Å; T24-I28 WeakPolarHBondContact O-CG1 3.44Å; T24-I28 PolarHBondContact O-N 3.32Å; T25-I28 PolarHBondContact O-N 3.45Å; A26-I28 PolarHBondContact O-N 3.27Å
29	T	94.2	Very high	93.4	Very high	19 Å²	19	38.8 Å²	38.8	12%	0.117	20%	0.197	C	C	.	.			trans	-71.4	156	-174.7	-175.2	0	0	0	0	113.5	T25 A26 Y31 W198 S199	T25-T29 VanDerWaalsContact O-CB 3.27Å; T25-T29 WeakPolarHBondContact O-CB 3.49Å; T25-T29 WeakPolarHBondContact O-CG2 3.42Å; T25-T29 PolarHBondContact O-N 3.09Å; T25-T29 VanDerWaalsContact O-N 3.1Å; A26-T29 WeakPolarHBondContact O-CG2 3.3Å; T29-Y31 WeakPolarHBondContact OG1-CD2 3.49Å; T29-W198 HydrophobicContact CG2-CH2 4.31Å; T29-W198 HydrophobicContact CG2-CZ2 4.49Å; T29-W198 WeakPolarHBondContact OG1-CH2 3.43Å; T29-W198 WeakPolarHBondContact OG1-CZ2 3.43Å; T29-S199 WeakPolarHBondContact CG2-OG 3.34Å; T29-S199 PolarHBondContact OG1-OG 3.39Å
30	T	92.7	Very high	92.7	Very high	30 Å²	30	43.3 Å²	43.3	18%	0.184	23%	0.227	C	C	.	.	S	Bend	trans	-101.9	16.6	-178.8	51.3	0	0	0	0	113.3	H82 T83 G84	T30-H82 VanDerWaalsContact CB-ND1 3.33Å; T30-H82 WeakPolarHBondContact CB-ND1 3.38Å; T30-H82 CarbonylContact O-C 3.58Å; T30-H82 WeakPolarHBondContact O-CB 3.35Å; T30-H82 PolarHBondContact O-ND1 3.08Å; T30-H82 PolarHBondContact OG1-CE1 3.12Å; T30-H82 PolarHBondContact OG1-ND1 2.65Å; T30-H82 VanDerWaalsContact OG1-ND1 3.12Å; T30-T83 CarbonylContact C-O 3.54Å; T30-T83 CarbonylContact O-C 3.53Å; T30-T83 WeakPolarHBondContact O-CA 3.5Å; T30-T83 PolarHBondContact O-N 3.5Å; T30-G84 PolarHBondContact O-N 2.72Å
31	Y	93.1	Very high	91.9	Very high	77 Å²	77	43.6 Å²	43.6	30%	0.302	23%	0.227	S	C	.	.			trans	-118.4	44.3	-173.7	-63.6	-84.1	0	0	0	112.1	T29 E34 H82 G197 W198 S199	T29-Y31 WeakPolarHBondContact OG1-CD2 3.49Å; Y31-E34 HydrophobicContact CD1-CG 3.99Å; Y31-E34 WeakPolarHBondContact CD1-OE1 3.4Å; Y31-H82 HydrophobicContact CD1-CB 3.74Å; Y31-H82 HydrophobicContact CE1-CB 3.88Å; Y31-H82 AromaticContact CE1-CG 3.75Å; Y31-G197 CarbonylContact O-C 3.55Å; Y31-G197 WeakPolarHBondContact O-CA 3.08Å; Y31-W198 AromaticContact CD2-CZ2 3.82Å; Y31-W198 HydrophobicContact CD2-CZ2 3.82Å; Y31-W198 AromaticContact CD2-NE1 3.71Å; Y31-W198 HydrophobicContact CG-CZ2 4.27Å; Y31-W198 AromaticContact CG-NE1 3.35Å; Y31-W198 VanDerWaalsContact CG-NE1 3.35Å; Y31-S199 VanDerWaalsContact C-OG 3.25Å; Y31-S199 WeakPolarHBondContact CB-OG 3.37Å; Y31-S199 WeakPolarHBondContact O-CB 3.49Å; Y31-S199 PolarHBondContact O-N 3.44Å; Y31-S199 PolarHBondContact O-OG 2.93Å
32	W	93.2	Very high	91.1	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.208	C	C	.	.	S	Bend	trans	-71.1	-41.5	169.9	-85.9	72.3	0	0	0	111.3	A26 T83 I85 Y174 G197 F200 A203	A26-W32 HydrophobicContact CB-CZ2 4.09Å; A26-W32 PolarHBondContact O-NE1 2.88Å; W32-T83 WeakPolarHBondContact CA-O 3.41Å; W32-T83 VanDerWaalsContact CB-O 3.3Å; W32-T83 WeakPolarHBondContact CB-O 3.27Å; W32-T83 PolarHBondContact N-O 3.01Å; W32-I85 HydrophobicContact CD2-CG1 4.41Å; W32-I85 HydrophobicContact CZ2-CD1 3.66Å; W32-I85 HydrophobicContact CZ2-CG1 4.22Å; W32-Y174 HydrophobicContact CB-CE1 4.26Å; W32-Y174 HydrophobicContact CD2-CD1 4.19Å; W32-Y174 AromaticContact CD2-CE1 3.73Å; W32-Y174 HydrophobicContact CD2-CE1 3.73Å; W32-Y174 AromaticContact CE3-CD1 3.63Å; W32-Y174 HydrophobicContact CE3-CD1 3.63Å; W32-Y174 AromaticContact CE3-CE1 3.53Å; W32-Y174 HydrophobicContact CE3-CE1 3.53Å; W32-Y174 HydrophobicContact CG-CE1 4.07Å; W32-Y174 HydrophobicContact CH2-CD1 4.4Å; W32-Y174 AromaticContact CZ3-CD1 3.75Å; W32-Y174 HydrophobicContact CZ3-CD1 3.75Å; W32-Y174 HydrophobicContact CZ3-CE1 4.13Å; W32-G197 PolarHBondContact O-N 3.43Å; W32-F200 HydrophobicContact CE3-CB 4.27Å; W32-F200 AromaticContact CE3-CD2 3.94Å; W32-F200 HydrophobicContact CE3-CD2 3.94Å; W32-F200 HydrophobicContact CZ3-CD2 4Å; W32-F200 WeakPolarHBondContact O-CB 3.25Å; W32-A203 HydrophobicContact CH2-CB 3.36Å; W32-A203 HydrophobicContact CZ2-CB 3.82Å; W32-A203 HydrophobicContact CZ3-CB 4.03Å
33	C	92.4	Very high	90.1	Very high	3 Å²	3	41 Å²	41	2%	0.02	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.1	172.1	-52.2	0	0	0	0	109.2	H82 T83 F178 W194 D195	C33-H82 WeakPolarHBondContact O-CA 3.35Å; C33-T83 HydrophobicContact CB-CG2 3.67Å; C33-T83 PolarHBondContact N-O 3.28Å; C33-T83 VanDerWaalsContact N-O 3.1Å; C33-T83 PolarHBondContact O-N 3.45Å; C33-F178 HydrophobicContact CB-CE1 3.87Å; C33-F178 HydrophobicContact CB-CE2 4.4Å; C33-F178 HydrophobicContact CB-CZ 3.64Å; C33-F178 WeakPolarHBondContact SG-CE1 3.04Å; C33-W194 HydrophobicContact CB-CE3 4.37Å; C33-D195 VanDerWaalsContact CA-O 3.32Å; C33-D195 WeakPolarHBondContact CA-O 3.43Å
34	E	93.3	Very high	89	Confident	79 Å²	79	43.2 Å²	43.2	37%	0.369	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.9	175.8	-69.9	176	-151.3	0	0	108.1	Y31 H82 W194 D195	Y31-E34 HydrophobicContact CD1-CG 3.99Å; Y31-E34 WeakPolarHBondContact CD1-OE1 3.4Å; E34-H82 HydrophobicContact CG-CB 4.12Å; E34-W194 WeakPolarHBondContact O-CA 3.45Å; E34-D195 PolarHBondContact N-O 2.78Å; E34-D195 PolarHBondContact O-N 2.99Å
35	G	92.1	Very high	87.7	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	-175.7	-177.5	0	0	0	0	0	113.6	R80 F81 S193	G35-R80 WeakPolarHBondContact O-CA 3.39Å; G35-F81 PolarHBondContact N-O 3.34Å; G35-F81 WeakPolarHBondContact O-CD1 3.23Å; G35-F81 PolarHBondContact O-N 3.39Å; G35-S193 CarbonylContact C-O 3.57Å; G35-S193 VanDerWaalsContact CA-O 3.22Å; G35-S193 WeakPolarHBondContact CA-O 3.48Å
36	T	89.9	Confident	86.5	Confident	30 Å²	30	51.4 Å²	51.4	18%	0.184	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.5	174	68.3	0	0	0	0	110.9	F78 R79 R80 H192 S193	T36-F78 HydrophobicContact CG2-CB 4.46Å; T36-R79 CarbonylContact C-O 3.53Å; T36-R79 WeakPolarHBondContact CA-O 3.42Å; T36-R80 HydrophobicContact CG2-CG 4.26Å; T36-H192 PolarHBondContact O-N 2.95Å; T36-S193 PolarHBondContact N-O 3.49Å; T36-S193 PolarHBondContact O-N 3.4Å; T36-S193 PolarHBondContact OG1-OG 2.91Å
37	Q	88.4	Confident	85.1	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.028	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.7	173.9	-169.3	-172.1	23.8	0	0	109.5	V39 F78 R79 F81 D188 W189	Q37-V39 HydrophobicContact CG-CG1 4.02Å; Q37-F78 WeakPolarHBondContact O-CA 3.44Å; Q37-R79 PolarHBondContact N-O 3.33Å; Q37-R79 PolarHBondContact O-N 2.89Å; Q37-F81 HydrophobicContact CB-CD1 4.38Å; Q37-D188 PolarHBondContact NE2-O 2.95Å; Q37-W189 VanDerWaalsContact NE2-C 3.28Å; Q37-W189 VanDerWaalsContact NE2-CA 3.27Å
38	R	85.9	Confident	83.8	Confident	79 Å²	79	62.4 Å²	62.4	30%	0.298	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.9	174.7	-174.5	176.6	170.9	157	-0.8	109.4	D73 F76 F78 H192	R38-D73 IonicContact CZ-OD1 2.69Å; R38-D73 IonicContact NH1-OD1 3.7Å; R38-D73 PolarHBondContact NH1-OD1 2.88Å; R38-D73 IonicContact NH1-OD2 2.86Å; R38-D73 IonicContact NH2-OD1 3.27Å; R38-D73 PolarHBondContact NH2-OD1 3.28Å; R38-F76 HydrophobicContact CG-CB 3.64Å; R38-F76 HydrophobicContact CG-CD1 3.77Å; R38-F76 HydrophobicContact CG-CG 3.84Å; R38-F78 HydrophobicContact CB-CE1 4.38Å; R38-H192 HydrophobicContact CB-CB 4.06Å
39	V	85.1	Confident	82.3	Confident	15 Å²	15	66.7 Å²	66.7	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.8	-178.9	-66.3	0	0	0	0	110.7	Q37 F76 L77 R79 I93	Q37-V39 HydrophobicContact CG-CG1 4.02Å; V39-F76 CarbonylContact O-C 3.59Å; V39-F76 WeakPolarHBondContact O-CA 3.37Å; V39-L77 HydrophobicContact CG2-CD1 3.98Å; V39-L77 HydrophobicContact CG2-CD2 3.88Å; V39-L77 HydrophobicContact CG2-CG 3.58Å; V39-L77 PolarHBondContact N-O 2.9Å; V39-L77 PolarHBondContact O-N 2.84Å; V39-R79 HydrophobicContact CG2-CB 3.92Å; V39-I93 HydrophobicContact CB-CD1 4.27Å; V39-I93 HydrophobicContact CG2-CD1 3.45Å; V39-I93 VanDerWaalsContact CG2-CD1 3.45Å
40	P	81.7	Confident	80.9	Confident	94 Å²	94	73.2 Å²	73.2	61%	0.61	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	140.3	178.5	-22.3	33.2	0	0	0	111.8	F76 L77	P40-F76 HydrophobicContact CG-CE1 4.43Å; P40-L77 WeakPolarHBondContact O-CD2 3.42Å
41	K	81.3	Confident	79.9	Confident	33 Å²	33	77 Å²	77	14%	0.143	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-61.6	131.6	175	-78.6	176	174.5	173.1	0	110.7	I53 E70 D74 R75 L77	K41-I53 HydrophobicContact CB-CD1 3.86Å; K41-I53 HydrophobicContact CB-CG1 3.55Å; K41-I53 HydrophobicContact CD-CG1 3.96Å; K41-I53 HydrophobicContact CG-CG1 4.44Å; K41-E70 IonicContact NZ-OE1 3Å; K41-E70 PolarHBondContact NZ-OE1 3.33Å; K41-E70 IonicContact NZ-OE2 3.93Å; K41-E70 PolarHBondContact NZ-OE2 2.95Å; K41-D74 WeakPolarHBondContact CD-O 3.32Å; K41-D74 WeakPolarHBondContact CE-O 3.34Å; K41-D74 PolarHBondContact NZ-O 3.25Å; K41-R75 PolarHBondContact N-O 3.43Å; K41-L77 VanDerWaalsContact CA-CD2 3.42Å; K41-L77 HydrophobicContact CB-CD2 4.25Å; K41-L77 HydrophobicContact CG-CB 4.33Å; K41-L77 HydrophobicContact CG-CD2 4.01Å
42	P	78.9	Confident	78.9	Confident	20 Å²	20	73.9 Å²	73.9	13%	0.13	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-72.1	164.1	174.3	34.4	-38.7	0	0	0	110.5	C52 I53 I93	P42-C52 CarbonylContact O-C 3.59Å; P42-C52 WeakPolarHBondContact O-CA 3.3Å; P42-C52 VanDerWaalsContact O-CB 3.31Å; P42-C52 WeakPolarHBondContact O-CB 3.09Å; P42-I53 PolarHBondContact O-N 3.33Å; P42-I93 HydrophobicContact CB-CG2 4.47Å; P42-I93 HydrophobicContact CG-CG2 3.71Å
43	N	76.6	Confident	77.9	Confident	108 Å²	108	74.1 Å²	74.1	58%	0.578	36%	0.364	S	S	*	.	B	Isolated β-bridge	trans	-67.1	143.6	175.5	-63.8	-1.5	0	0	0	111	I53 Y55	N43-I53 WeakPolarHBondContact CA-O 3.46Å; N43-Y55 WeakPolarHBondContact OD1-CD2 3.36Å; N43-Y55 WeakPolarHBondContact OD1-CE2 3.48Å
44	C	73.4	Confident	76.9	Confident	47 Å²	47	79.4 Å²	79.4	32%	0.318	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.3	137.7	174.6	-66.7	0	0	0	0	111	C52 I53 D54	C44-C52 WeakPolarHBondContact CA-SG 3.31Å; C44-C52 HydrophobicContact CB-CB 3.9Å; C44-C52 WeakPolarHBondContact CB-SG 3.32Å; C44-C52 WeakPolarHBondContact SG-CB 3.3Å; C44-C52 PolarHBondContact SG-O 3.38Å; C44-C52 VanDerWaalsContact SG-O 3.4Å; C44-C52 CovalentContact SG-SG 2.04Å; C44-C52 PolarHBondContact SG-SG 3.03Å; C44-I53 PolarHBondContact N-O 3.34Å; C44-D54 HydrophobicContact CB-CB 4.29Å
45	S	69.6	Low	75.5	Confident	67 Å²	67	81 Å²	81	47%	0.469	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-127.8	168.4	177.7	83.4	0	0	0	0	110	Q47 R48	S45-Q47 PolarHBondContact O-N 3.26Å; S45-Q47 PolarHBondContact OG-N 3.33Å; S45-R48 PolarHBondContact N-O 2.91Å; S45-R48 CarbonylContact O-C 3.34Å; S45-R48 PolarHBondContact O-N 3.37Å; S45-R48 VanDerWaalsContact O-O 3.05Å; S45-R48 PolarHBondContact OG-N 2.94Å
46	K	69.1	Low	73.9	Confident	213 Å²	213	81 Å²	81	93%	0.926	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-22.9	178	-65.7	-175.3	-178.3	178.3	0	113.1
47	Q	67.5	Low	72.3	Confident	189 Å²	189	85.6 Å²	85.6	88%	0.883	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-17.9	-178	-161.4	162.8	7.4	0	0	113.6	S45	S45-Q47 PolarHBondContact O-N 3.26Å; S45-Q47 PolarHBondContact OG-N 3.33Å
48	R	67.2	Low	70.6	Confident	68 Å²	68	88.4 Å²	88.4	26%	0.257	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-130.6	107	179.8	-167.7	-177.8	-165.2	162.1	18.3	111.2	S45 H50 C52 I93	S45-R48 PolarHBondContact N-O 2.91Å; S45-R48 CarbonylContact O-C 3.34Å; S45-R48 PolarHBondContact O-N 3.37Å; S45-R48 VanDerWaalsContact O-O 3.05Å; S45-R48 PolarHBondContact OG-N 2.94Å; R48-H50 WeakPolarHBondContact CG-O 3.33Å; R48-H50 PolarHBondContact NE-O 3.38Å; R48-H50 VanDerWaalsContact NE-O 3.14Å; R48-C52 PolarHBondContact O-SG 3.34Å; R48-I93 PolarHBondContact NH1-O 3.5Å
49	R	63.2	Low	69	Low	210 Å²	210	94 Å²	94	79%	0.792	47%	0.468	S	S	*	.			trans	-104.2	-5.3	177.8	-65.6	-173.9	177.5	-173.7	-1.8	114.4
50	H	65.3	Low	67.6	Low	156 Å²	156	99.6 Å²	99.6	72%	0.722	50%	0.503	S	S	*	.	S	Bend	trans	-123.2	144.2	179.8	-62.8	-78.6	0	0	0	111	R48	R48-H50 WeakPolarHBondContact CG-O 3.33Å; R48-H50 PolarHBondContact NE-O 3.38Å; R48-H50 VanDerWaalsContact NE-O 3.14Å
51	N	70.1	Confident	66.3	Low	108 Å²	108	99.4 Å²	99.4	58%	0.578	50%	0.497	S	S	*	.	S	Bend	trans	56.6	44.2	-177.3	-61	-16.8	0	0	0	114.1
52	C	73.2	Confident	65.1	Low	13 Å²	13	107.5 Å²	107.5	9%	0.088	54%	0.535	C	S	.	.	S	Bend	trans	-138.7	156.5	178.7	58.6	0	0	0	0	109.7	P42 C44 R48	P42-C52 CarbonylContact O-C 3.59Å; P42-C52 WeakPolarHBondContact O-CA 3.3Å; P42-C52 VanDerWaalsContact O-CB 3.31Å; P42-C52 WeakPolarHBondContact O-CB 3.09Å; C44-C52 WeakPolarHBondContact CA-SG 3.31Å; C44-C52 HydrophobicContact CB-CB 3.9Å; C44-C52 WeakPolarHBondContact CB-SG 3.32Å; C44-C52 WeakPolarHBondContact SG-CB 3.3Å; C44-C52 PolarHBondContact SG-O 3.38Å; C44-C52 VanDerWaalsContact SG-O 3.4Å; C44-C52 CovalentContact SG-SG 2.04Å; C44-C52 PolarHBondContact SG-SG 3.03Å; R48-C52 PolarHBondContact O-SG 3.34Å
53	I	72.3	Confident	64.1	Low	6 Å²	6	113.8 Å²	113.8	3%	0.031	57%	0.567	C	S	.	*	B	Isolated β-bridge	trans	-94.8	122.1	174.5	-55	-178.4	0	0	0	108.1	K41 P42 N43 C44 Y55 E70 R75	K41-I53 HydrophobicContact CB-CD1 3.86Å; K41-I53 HydrophobicContact CB-CG1 3.55Å; K41-I53 HydrophobicContact CD-CG1 3.96Å; K41-I53 HydrophobicContact CG-CG1 4.44Å; P42-I53 PolarHBondContact O-N 3.33Å; N43-I53 WeakPolarHBondContact CA-O 3.46Å; C44-I53 PolarHBondContact N-O 3.34Å; I53-Y55 HydrophobicContact CB-CD2 4.29Å; I53-Y55 HydrophobicContact CB-CE2 3.77Å; I53-Y55 HydrophobicContact CG2-CD1 4.19Å; I53-Y55 HydrophobicContact CG2-CD2 3.89Å; I53-Y55 HydrophobicContact CG2-CE1 3.85Å; I53-Y55 HydrophobicContact CG2-CE2 3.52Å; I53-Y55 HydrophobicContact CG2-CG 4.22Å; I53-E70 WeakPolarHBondContact CG1-OE2 3.34Å; I53-R75 HydrophobicContact CD1-CB 4.38Å; I53-R75 HydrophobicContact CD1-CG 4.35Å
54	D	69.8	Low	62.6	Low	113 Å²	113	115.2 Å²	115.2	60%	0.604	57%	0.568	S	S	*	*			trans	-90.7	102.8	169.8	-169	2.2	0	0	0	108.9	C44 G56	C44-D54 HydrophobicContact CB-CB 4.29Å; D54-G56 PolarHBondContact O-N 2.85Å; D54-G56 WeakPolarHBondContact OD1-CA 3.34Å; D54-G56 PolarHBondContact OD1-N 3.21Å
55	Y	65.3	Low	61.8	Low	112 Å²	112	117.9 Å²	117.9	44%	0.439	58%	0.583	S	S	.	*			trans	-77.3	1.2	172.9	-70.6	-75.5	0	0	0	112.6	N43 I53 V57	N43-Y55 WeakPolarHBondContact OD1-CD2 3.36Å; N43-Y55 WeakPolarHBondContact OD1-CE2 3.48Å; I53-Y55 HydrophobicContact CB-CD2 4.29Å; I53-Y55 HydrophobicContact CB-CE2 3.77Å; I53-Y55 HydrophobicContact CG2-CD1 4.19Å; I53-Y55 HydrophobicContact CG2-CD2 3.89Å; I53-Y55 HydrophobicContact CG2-CE1 3.85Å; I53-Y55 HydrophobicContact CG2-CE2 3.52Å; I53-Y55 HydrophobicContact CG2-CG 4.22Å; Y55-V57 PolarHBondContact O-N 3.43Å
56	G	57.7	Low	61.1	Low	14 Å²	14	119.5 Å²	119.5	14%	0.144	58%	0.583	C	S	.	*			trans	55.8	53	174.2	0	0	0	0	0	111.4	D54 N58	D54-G56 PolarHBondContact O-N 2.85Å; D54-G56 WeakPolarHBondContact OD1-CA 3.34Å; D54-G56 PolarHBondContact OD1-N 3.21Å; G56-N58 VanDerWaalsContact C-N 3.28Å; G56-N58 PolarHBondContact O-N 3.02Å
57	V	57.1	Low	60.4	Low	126 Å²	126	117.4 Å²	117.4	76%	0.764	57%	0.571	S	S	*	*			trans	-74.2	91.1	172.7	-169.6	0	0	0	0	107.2	Y55 E59	Y55-V57 PolarHBondContact O-N 3.43Å; V57-E59 PolarHBondContact O-N 3.23Å; V57-E59 VanDerWaalsContact O-N 3.13Å
58	N	51.9	Low	60	Low	66 Å²	66	110.8 Å²	110.8	35%	0.353	55%	0.545	S	S	.	.			trans	-66.2	107.8	168.2	-83.6	-29.9	0	0	0	108	G56 T60 D61	G56-N58 VanDerWaalsContact C-N 3.28Å; G56-N58 PolarHBondContact O-N 3.02Å; N58-T60 PolarHBondContact O-N 2.95Å; N58-T60 VanDerWaalsContact O-N 3.08Å; N58-D61 PolarHBondContact O-N 3Å
59	E	53.6	Low	59.6	Low	196 Å²	196	118.2 Å²	118.2	92%	0.916	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-11.9	169.2	-69	-146	159.9	0	0	112.7	V57	V57-E59 PolarHBondContact O-N 3.23Å; V57-E59 VanDerWaalsContact O-N 3.13Å
60	T	55.3	Low	59.6	Low	132 Å²	132	110.8 Å²	110.8	81%	0.81	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-12.2	-175.6	51	0	0	0	0	115.2	N58	N58-T60 PolarHBondContact O-N 2.95Å; N58-T60 VanDerWaalsContact O-N 3.08Å
61	D	54	Low	59.3	Low	91 Å²	91	108.4 Å²	108.4	49%	0.487	54%	0.544	S	S	.	.			trans	-158.1	104.2	178.6	-159.7	-6.1	0	0	0	112.4	N58 N63	N58-D61 PolarHBondContact O-N 3Å; D61-N63 PolarHBondContact O-N 3.38Å; D61-N63 PolarHBondContact OD1-N 3.39Å
62	Q	57	Low	59.4	Low	202 Å²	202	104.8 Å²	104.8	94%	0.944	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-10	-179.9	-71.6	-178.5	-13.6	0	0	113.4
63	N	56.2	Low	59	Low	152 Å²	152	109.6 Å²	109.6	81%	0.813	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	0.3	-170.1	-128.3	23.8	0	0	0	114.3	D61	D61-N63 PolarHBondContact O-N 3.38Å; D61-N63 PolarHBondContact OD1-N 3.39Å
64	K	46	Very low	59.1	Low	138 Å²	138	114.2 Å²	114.2	60%	0.6	58%	0.582	S	S	*	*			trans	-111	93.7	-177.8	-154.6	178.2	-173.1	-176.7	0	110.7	H66	K64-H66 PolarHBondContact O-N 3.3Å; K64-H66 VanDerWaalsContact O-N 3.15Å
65	V	55.9	Low	59.4	Low	104 Å²	104	114.5 Å²	114.5	63%	0.63	58%	0.575	S	S	*	*			trans	-65.1	110.7	176.2	-178.3	0	0	0	0	109.2	Y67	V65-Y67 HydrophobicContact CB-CE2 4.37Å; V65-Y67 HydrophobicContact CG1-CE1 4.25Å; V65-Y67 HydrophobicContact CG1-CE2 4.19Å; V65-Y67 PolarHBondContact O-N 3.43Å
66	H	55.6	Low	60.1	Low	100 Å²	100	112.4 Å²	112.4	46%	0.463	57%	0.568	S	S	.	*			trans	-79.8	113.6	170.9	-104.2	-96.5	0	0	0	109.4	K64 S68	K64-H66 PolarHBondContact O-N 3.3Å; K64-H66 VanDerWaalsContact O-N 3.15Å; H66-S68 PolarHBondContact O-N 2.92Å
67	Y	53.8	Low	61.3	Low	170 Å²	170	112.7 Å²	112.7	67%	0.667	57%	0.566	S	S	*	*			trans	-80.3	110.6	171.9	-64.5	-84.6	0	0	0	108.9	V65 W69	V65-Y67 HydrophobicContact CB-CE2 4.37Å; V65-Y67 HydrophobicContact CG1-CE1 4.25Å; V65-Y67 HydrophobicContact CG1-CE2 4.19Å; V65-Y67 PolarHBondContact O-N 3.43Å; Y67-W69 PolarHBondContact O-N 3.25Å
68	S	59.5	Low	62.7	Low	50 Å²	50	112.1 Å²	112.1	35%	0.35	55%	0.554	S	S	.	*			trans	-70.5	114.8	164.2	160.7	0	0	0	0	108.4	H66 E70	H66-S68 PolarHBondContact O-N 2.92Å; S68-E70 VanDerWaalsContact C-N 3.26Å; S68-E70 PolarHBondContact O-N 3.47Å
69	W	58.9	Low	64.3	Low	223 Å²	223	110.8 Å²	110.8	85%	0.845	54%	0.544	S	S	*	.			trans	-80.4	-0.2	178.8	-62.5	98.6	0	0	0	113.9	Y67 T71	Y67-W69 PolarHBondContact O-N 3.25Å; W69-T71 PolarHBondContact O-N 2.96Å; W69-T71 VanDerWaalsContact O-N 3.08Å; W69-T71 PolarHBondContact O-OG1 2.99Å; W69-T71 VanDerWaalsContact O-OG1 3.07Å
70	E	63.1	Low	66	Low	54 Å²	54	109.6 Å²	109.6	25%	0.252	53%	0.531	S	S	.	.			trans	-64.8	108.7	176	-70.3	-167.9	158.9	0	0	110.6	K41 I53 S68 D74 R75	K41-E70 IonicContact NZ-OE1 3Å; K41-E70 PolarHBondContact NZ-OE1 3.33Å; K41-E70 IonicContact NZ-OE2 3.93Å; K41-E70 PolarHBondContact NZ-OE2 2.95Å; I53-E70 WeakPolarHBondContact CG1-OE2 3.34Å; S68-E70 VanDerWaalsContact C-N 3.26Å; S68-E70 PolarHBondContact O-N 3.47Å; E70-D74 HydrophobicContact CB-CB 4.15Å; E70-D74 HydrophobicContact CG-CB 4.32Å; E70-R75 HydrophobicContact CB-CG 4.06Å; E70-R75 WeakPolarHBondContact O-CD 3.05Å
71	T	59.5	Low	67.8	Low	106 Å²	106	103.7 Å²	103.7	65%	0.65	49%	0.494	S	S	*	.			trans	-113.5	136.5	-174.4	-52.2	0	0	0	0	110	W69 D73	W69-T71 PolarHBondContact O-N 2.96Å; W69-T71 VanDerWaalsContact O-N 3.08Å; W69-T71 PolarHBondContact O-OG1 2.99Å; W69-T71 VanDerWaalsContact O-OG1 3.07Å; T71-D73 PolarHBondContact O-N 2.67Å
72	G	71.1	Confident	69.7	Low	33 Å²	33	100 Å²	100	34%	0.34	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	72.7	-121.6	175.3	0	0	0	0	0	114.2
73	D	66.4	Low	71.4	Confident	114 Å²	114	90.3 Å²	90.3	61%	0.61	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-73.3	-22.1	-172.7	-82.2	-4.1	0	0	0	114	R38 T71 R75 F76	R38-D73 IonicContact CZ-OD1 2.69Å; R38-D73 IonicContact NH1-OD1 3.7Å; R38-D73 PolarHBondContact NH1-OD1 2.88Å; R38-D73 IonicContact NH1-OD2 2.86Å; R38-D73 IonicContact NH2-OD1 3.27Å; R38-D73 PolarHBondContact NH2-OD1 3.28Å; T71-D73 PolarHBondContact O-N 2.67Å; D73-R75 PolarHBondContact O-N 3.43Å; D73-F76 PolarHBondContact O-N 2.92Å
74	D	72.5	Confident	73.2	Confident	102 Å²	102	83.1 Å²	83.1	55%	0.545	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-64.4	-15.2	179	-68	-31.3	0	0	0	113	K41 E70 F76	K41-D74 WeakPolarHBondContact CD-O 3.32Å; K41-D74 WeakPolarHBondContact CE-O 3.34Å; K41-D74 PolarHBondContact NZ-O 3.25Å; E70-D74 HydrophobicContact CB-CB 4.15Å; E70-D74 HydrophobicContact CG-CB 4.32Å; D74-F76 PolarHBondContact O-N 3.44Å
75	R	76.2	Confident	75.3	Confident	119 Å²	119	77 Å²	77	45%	0.449	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-79.5	-4.6	179.3	-68.7	-174	-79.5	-155.9	-3	114.2	K41 I53 E70 D73	K41-R75 PolarHBondContact N-O 3.43Å; I53-R75 HydrophobicContact CD1-CB 4.38Å; I53-R75 HydrophobicContact CD1-CG 4.35Å; E70-R75 HydrophobicContact CB-CG 4.06Å; E70-R75 WeakPolarHBondContact O-CD 3.05Å; D73-R75 PolarHBondContact O-N 3.43Å
76	F	80.3	Confident	77.1	Confident	68 Å²	68	76.7 Å²	76.7	30%	0.298	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148	-174.2	-58.2	-93.9	0	0	0	110.9	R38 V39 P40 D73 D74	R38-F76 HydrophobicContact CG-CB 3.64Å; R38-F76 HydrophobicContact CG-CD1 3.77Å; R38-F76 HydrophobicContact CG-CG 3.84Å; V39-F76 CarbonylContact O-C 3.59Å; V39-F76 WeakPolarHBondContact O-CA 3.37Å; P40-F76 HydrophobicContact CG-CE1 4.43Å; D73-F76 PolarHBondContact O-N 2.92Å; D74-F76 PolarHBondContact O-N 3.44Å
77	L	83.4	Confident	78.9	Confident	21 Å²	21	78.1 Å²	78.1	11%	0.11	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	154.1	165.2	68.8	136.9	0	0	0	109.8	V39 P40 K41 I93	V39-L77 HydrophobicContact CG2-CD1 3.98Å; V39-L77 HydrophobicContact CG2-CD2 3.88Å; V39-L77 HydrophobicContact CG2-CG 3.58Å; V39-L77 PolarHBondContact N-O 2.9Å; V39-L77 PolarHBondContact O-N 2.84Å; P40-L77 WeakPolarHBondContact O-CD2 3.42Å; K41-L77 VanDerWaalsContact CA-CD2 3.42Å; K41-L77 HydrophobicContact CB-CD2 4.25Å; K41-L77 HydrophobicContact CG-CB 4.33Å; K41-L77 HydrophobicContact CG-CD2 4.01Å; L77-I93 HydrophobicContact CD1-CD1 4.17Å; L77-I93 HydrophobicContact CD1-CG1 4.1Å; L77-I93 HydrophobicContact CD1-CG2 4.04Å; L77-I93 HydrophobicContact CD2-CG2 4.36Å
78	F	85.4	Confident	80.8	Confident	113 Å²	113	70 Å²	70	50%	0.496	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	110.8	170.9	-63.9	-77	0	0	0	108.6	T36 Q37 R38 H192	T36-F78 HydrophobicContact CG2-CB 4.46Å; Q37-F78 WeakPolarHBondContact O-CA 3.44Å; R38-F78 HydrophobicContact CB-CE1 4.38Å; F78-H192 AromaticContact CE1-ND1 3.85Å
79	R	87.4	Confident	82.3	Confident	39 Å²	39	67.9 Å²	67.9	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.9	174.3	171.4	166.9	62.4	165.5	8.6	109.1	T36 Q37 V39 E90 E91	T36-R79 CarbonylContact C-O 3.53Å; T36-R79 WeakPolarHBondContact CA-O 3.42Å; Q37-R79 PolarHBondContact N-O 3.33Å; Q37-R79 PolarHBondContact O-N 2.89Å; V39-R79 HydrophobicContact CG2-CB 3.92Å; R79-E90 IonicContact CZ-OE2 3.47Å; R79-E90 IonicContact NE-OE2 2.63Å; R79-E90 IonicContact NH1-OE2 3.15Å; R79-E90 PolarHBondContact NH1-OE2 3.39Å; R79-E90 IonicContact NH2-OE2 2.78Å; R79-E90 PolarHBondContact NH2-OE2 3.27Å; R79-E91 WeakPolarHBondContact CD-O 3.38Å; R79-E91 HydrophobicContact CG-CB 4.25Å
80	R	89	Confident	83.9	Confident	171 Å²	171	57.6 Å²	57.6	65%	0.645	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	143	174.4	-70	-175.9	175.9	91.9	0.2	110.3	G35 T36 E91	G35-R80 WeakPolarHBondContact O-CA 3.39Å; T36-R80 HydrophobicContact CG2-CG 4.26Å; R80-E91 PolarHBondContact O-N 3.19Å
81	F	92.6	Very high	85	Confident	7 Å²	7	59.4 Å²	59.4	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	153.1	170.5	76	-85.6	0	0	0	109.5	G35 Q37 T83 C89 E90 W189 P191 W194	G35-F81 PolarHBondContact N-O 3.34Å; G35-F81 WeakPolarHBondContact O-CD1 3.23Å; G35-F81 PolarHBondContact O-N 3.39Å; Q37-F81 HydrophobicContact CB-CD1 4.38Å; F81-T83 HydrophobicContact CE2-CG2 4.26Å; F81-C89 CarbonylContact C-O 3.53Å; F81-C89 VanDerWaalsContact CA-O 3.27Å; F81-C89 WeakPolarHBondContact CA-O 3.36Å; F81-C89 WeakPolarHBondContact CB-O 3.4Å; F81-E90 HydrophobicContact CB-CB 4.38Å; F81-E90 HydrophobicContact CB-CG 3.67Å; F81-W189 HydrophobicContact CE2-CZ2 4.4Å; F81-P191 HydrophobicContact CE1-CB 3.39Å; F81-P191 HydrophobicContact CZ-CB 3.4Å; F81-P191 VanDerWaalsContact CZ-CB 3.4Å; F81-P191 HydrophobicContact CZ-CG 4.12Å; F81-W194 HydrophobicContact CZ-CB 4.2Å
82	H	93.3	Very high	86.1	Confident	13 Å²	13	57.4 Å²	57.4	6%	0.06	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145	169.4	63.4	85.6	0	0	0	108.6	T30 Y31 C33 E34 S88 C89 E98	T30-H82 VanDerWaalsContact CB-ND1 3.33Å; T30-H82 WeakPolarHBondContact CB-ND1 3.38Å; T30-H82 CarbonylContact O-C 3.58Å; T30-H82 WeakPolarHBondContact O-CB 3.35Å; T30-H82 PolarHBondContact O-ND1 3.08Å; T30-H82 PolarHBondContact OG1-CE1 3.12Å; T30-H82 PolarHBondContact OG1-ND1 2.65Å; T30-H82 VanDerWaalsContact OG1-ND1 3.12Å; Y31-H82 HydrophobicContact CD1-CB 3.74Å; Y31-H82 HydrophobicContact CE1-CB 3.88Å; Y31-H82 AromaticContact CE1-CG 3.75Å; C33-H82 WeakPolarHBondContact O-CA 3.35Å; E34-H82 HydrophobicContact CG-CB 4.12Å; H82-S88 WeakPolarHBondContact O-CA 3.41Å; H82-C89 WeakPolarHBondContact CE1-CB 3.32Å; H82-C89 PolarHBondContact N-O 3.43Å; H82-C89 WeakPolarHBondContact NE2-CB 3.22Å; H82-C89 PolarHBondContact O-N 3.2Å; H82-E98 IonicContact CD2-OE1 3.59Å; H82-E98 IonicContact NE2-OE1 2.67Å; H82-E98 IonicContact NE2-OE2 2.67Å; H82-E98 PolarHBondContact NE2-OE2 2.89Å
83	T	92.9	Very high	86.4	Confident	0 Å²	0	57 Å²	57	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134	-175.3	-168.4	0	0	0	0	110.3	T30 W32 C33 F81 S88 F103 F178	T30-T83 CarbonylContact C-O 3.54Å; T30-T83 CarbonylContact O-C 3.53Å; T30-T83 WeakPolarHBondContact O-CA 3.5Å; T30-T83 PolarHBondContact O-N 3.5Å; W32-T83 WeakPolarHBondContact CA-O 3.41Å; W32-T83 VanDerWaalsContact CB-O 3.3Å; W32-T83 WeakPolarHBondContact CB-O 3.27Å; W32-T83 PolarHBondContact N-O 3.01Å; C33-T83 HydrophobicContact CB-CG2 3.67Å; C33-T83 PolarHBondContact N-O 3.28Å; C33-T83 VanDerWaalsContact N-O 3.1Å; C33-T83 PolarHBondContact O-N 3.45Å; F81-T83 HydrophobicContact CE2-CG2 4.26Å; T83-S88 WeakPolarHBondContact OG1-CB 3.33Å; T83-F103 WeakPolarHBondContact OG1-CD2 3.34Å; T83-F178 HydrophobicContact CG2-CD2 4.35Å; T83-F178 HydrophobicContact CG2-CE2 3.28Å; T83-F178 HydrophobicContact CG2-CZ 3.57Å
84	G	93.4	Very high	86.5	Confident	0 Å²	0	59 Å²	59	0%	0	26%	0.257	C	S	.	.			trans	-115.8	-169.6	167	0	0	0	0	0	110.8	T30 W86 Y87 Y174	T30-G84 PolarHBondContact O-N 2.72Å; G84-W86 VanDerWaalsContact C-N 3.3Å; G84-W86 PolarHBondContact O-N 3.29Å; G84-Y87 PolarHBondContact N-O 2.84Å; G84-Y174 PolarHBondContact O-OH 2.92Å; G84-Y174 VanDerWaalsContact O-OH 3.05Å
85	I	91.9	Very high	86.6	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.056	25%	0.252	C	S	.	.	S	Bend	trans	-63.7	-37.7	-178.7	-63.5	171	0	0	0	111.6	F27 W32 V119 E122 Y174	F27-I85 HydrophobicContact CD2-CD1 3.66Å; F27-I85 HydrophobicContact CE2-CD1 4.18Å; F27-I85 HydrophobicContact CE2-CG2 4.47Å; W32-I85 HydrophobicContact CD2-CG1 4.41Å; W32-I85 HydrophobicContact CZ2-CD1 3.66Å; W32-I85 HydrophobicContact CZ2-CG1 4.22Å; I85-V119 HydrophobicContact CG2-CG2 3.78Å; I85-E122 HydrophobicContact CD1-CG 4.49Å; I85-Y174 WeakPolarHBondContact CA-OH 3.47Å; I85-Y174 HydrophobicContact CB-CE2 4.14Å; I85-Y174 HydrophobicContact CG1-CD2 4.16Å; I85-Y174 HydrophobicContact CG1-CE1 4.14Å; I85-Y174 HydrophobicContact CG1-CE2 3.77Å; I85-Y174 HydrophobicContact CG2-CE2 4.3Å; I85-Y174 PolarHBondContact N-OH 2.97Å
86	W	92.8	Very high	86.3	Confident	97 Å²	97	55.7 Å²	55.7	37%	0.367	27%	0.274	S	S	.	.	S	Bend	trans	-95.5	-43.8	-173.5	-60.9	102.5	0	0	0	113.2	F27 G84 S102 F103 V119	F27-W86 AromaticContact CD1-NE1 3.99Å; F27-W86 AromaticContact CE1-CE2 3.95Å; F27-W86 AromaticContact CE1-CZ2 3.61Å; F27-W86 HydrophobicContact CE1-CZ2 3.61Å; F27-W86 AromaticContact CE1-NE1 3.66Å; F27-W86 HydrophobicContact CE2-CZ2 4.17Å; F27-W86 AromaticContact CZ-CE2 3.76Å; F27-W86 HydrophobicContact CZ-CH2 4.38Å; F27-W86 AromaticContact CZ-CZ2 3.3Å; F27-W86 HydrophobicContact CZ-CZ2 3.3Å; F27-W86 AromaticContact CZ-NE1 3.7Å; F27-W86 VanDerWaalsContact O-CD1 3.28Å; F27-W86 PolarHBondContact O-NE1 3.46Å; G84-W86 VanDerWaalsContact C-N 3.3Å; G84-W86 PolarHBondContact O-N 3.29Å; W86-S102 WeakPolarHBondContact O-CA 3.29Å; W86-S102 PolarHBondContact O-OG 2.89Å; W86-F103 PolarHBondContact O-N 3.33Å; W86-V119 HydrophobicContact CH2-CG1 3.75Å; W86-V119 HydrophobicContact CZ2-CG1 4.07Å; W86-V119 HydrophobicContact CZ3-CG1 4.39Å
87	Y	93.1	Very high	86.4	Confident	129 Å²	129	54.8 Å²	54.8	51%	0.506	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142	-170.2	-56.9	-74.7	0	0	0	111.1	G84 R101	G84-Y87 PolarHBondContact N-O 2.84Å; Y87-R101 CarbonylContact C-O 3.51Å; Y87-R101 WeakPolarHBondContact CA-O 3.4Å
88	S	93.1	Very high	86.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123	164.3	-174.9	0	0	0	0	108.5	H82 T83 C100 R101 W189	H82-S88 WeakPolarHBondContact O-CA 3.41Å; T83-S88 WeakPolarHBondContact OG1-CB 3.33Å; S88-C100 CarbonylContact O-C 3.44Å; S88-C100 WeakPolarHBondContact O-CA 3.49Å; S88-R101 PolarHBondContact N-O 3.4Å; S88-R101 PolarHBondContact O-N 3.47Å; S88-W189 PolarHBondContact OG-NE1 3.06Å
89	C	92.3	Very high	86.9	Confident	5 Å²	5	61 Å²	61	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.4	-179.5	-56.7	0	0	0	0	110	F81 H82 E98 K99 C100	F81-C89 CarbonylContact C-O 3.53Å; F81-C89 VanDerWaalsContact CA-O 3.27Å; F81-C89 WeakPolarHBondContact CA-O 3.36Å; F81-C89 WeakPolarHBondContact CB-O 3.4Å; H82-C89 WeakPolarHBondContact CE1-CB 3.32Å; H82-C89 PolarHBondContact N-O 3.43Å; H82-C89 WeakPolarHBondContact NE2-CB 3.22Å; H82-C89 PolarHBondContact O-N 3.2Å; C89-E98 HydrophobicContact CB-CB 4.42Å; C89-K99 WeakPolarHBondContact CA-O 3.4Å; C89-C100 HydrophobicContact CB-CB 4.08Å; C89-C100 WeakPolarHBondContact CB-SG 3.34Å; C89-C100 WeakPolarHBondContact SG-CB 3.16Å; C89-C100 CovalentContact SG-SG 2.04Å; C89-C100 PolarHBondContact SG-SG 3.01Å
90	E	91.2	Very high	87.1	Confident	8 Å²	8	62.6 Å²	62.6	4%	0.037	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141.9	-178.1	-70.2	154	-127.2	0	0	110.2	R79 F81 N92 E98 K99 R101	R79-E90 IonicContact CZ-OE2 3.47Å; R79-E90 IonicContact NE-OE2 2.63Å; R79-E90 IonicContact NH1-OE2 3.15Å; R79-E90 PolarHBondContact NH1-OE2 3.39Å; R79-E90 IonicContact NH2-OE2 2.78Å; R79-E90 PolarHBondContact NH2-OE2 3.27Å; F81-E90 HydrophobicContact CB-CB 4.38Å; F81-E90 HydrophobicContact CB-CG 3.67Å; E90-N92 PolarHBondContact O-N 2.99Å; E90-E98 CarbonylContact O-C 3.55Å; E90-E98 VanDerWaalsContact O-CA 3.31Å; E90-E98 WeakPolarHBondContact O-CA 3.09Å; E90-K99 PolarHBondContact N-O 3.29Å; E90-K99 PolarHBondContact O-N 3.5Å; E90-R101 VanDerWaalsContact CD-NH2 3.25Å; E90-R101 IonicContact OE1-CZ 2.89Å; E90-R101 IonicContact OE1-NE 3.56Å; E90-R101 PolarHBondContact OE1-NE 2.69Å; E90-R101 IonicContact OE1-NH2 3.8Å; E90-R101 PolarHBondContact OE1-NH2 3.09Å; E90-R101 IonicContact OE2-NH2 3.98Å; E90-R101 PolarHBondContact OE2-NH2 3.44Å; E90-R101 VanDerWaalsContact OE2-NH2 3.17Å
91	E	87.6	Confident	87.3	Confident	92 Å²	92	57.3 Å²	57.3	43%	0.43	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	131.1	175.9	-172.2	177.8	-168.8	0	0	110.9	R79 R80 I93	R79-E91 WeakPolarHBondContact CD-O 3.38Å; R79-E91 HydrophobicContact CG-CB 4.25Å; R80-E91 PolarHBondContact O-N 3.19Å; E91-I93 PolarHBondContact O-N 3.19Å
92	N	82.8	Confident	87.3	Confident	64 Å²	64	58.7 Å²	58.7	34%	0.342	32%	0.318	S	S	.	.			trans	-73.6	119.3	-179.4	-169.3	-8.5	0	0	0	110.3	E90 H94 G97	E90-N92 PolarHBondContact O-N 2.99Å; N92-H94 VanDerWaalsContact C-N 3.33Å; N92-H94 PolarHBondContact OD1-N 3.25Å; N92-G97 WeakPolarHBondContact CB-O 3.37Å; N92-G97 PolarHBondContact N-O 3.34Å
93	I	76.1	Confident	87.2	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.118	32%	0.316	C	S	.	.	S	Bend	trans	-70.6	-33.9	177.6	-53.2	174.4	0	0	0	110.2	V39 P42 R48 L77 E91	V39-I93 HydrophobicContact CB-CD1 4.27Å; V39-I93 HydrophobicContact CG2-CD1 3.45Å; V39-I93 VanDerWaalsContact CG2-CD1 3.45Å; P42-I93 HydrophobicContact CB-CG2 4.47Å; P42-I93 HydrophobicContact CG-CG2 3.71Å; R48-I93 PolarHBondContact NH1-O 3.5Å; L77-I93 HydrophobicContact CD1-CD1 4.17Å; L77-I93 HydrophobicContact CD1-CG1 4.1Å; L77-I93 HydrophobicContact CD1-CG2 4.04Å; L77-I93 HydrophobicContact CD2-CG2 4.36Å; E91-I93 PolarHBondContact O-N 3.19Å
94	H	70.3	Confident	87	Confident	157 Å²	157	60.2 Å²	60.2	73%	0.727	33%	0.327	S	S	*	.	S	Bend	trans	-94.5	-1.5	-169	-64.1	82.4	0	0	0	114.1	N92	N92-H94 VanDerWaalsContact C-N 3.33Å; N92-H94 PolarHBondContact OD1-N 3.25Å
95	G	72.6	Confident	86.7	Confident	43 Å²	43	65.4 Å²	65.4	44%	0.443	35%	0.354	S	S	.	.	S	Bend	trans	-169.6	-171.7	-176.9	0	0	0	0	0	112.6
96	A	70.7	Confident	86.5	Confident	109 Å²	109	65.1 Å²	65.1	90%	0.901	35%	0.353	S	S	*	.	S	Bend	trans	-81.7	137.7	173.1	0	0	0	0	0	110.7
97	G	83.4	Confident	86.2	Confident	49 Å²	49	60.6 Å²	60.6	51%	0.505	34%	0.336	S	S	.	.	S	Bend	trans	114.8	-172	174.4	0	0	0	0	0	114.3	N92	N92-G97 WeakPolarHBondContact CB-O 3.37Å; N92-G97 PolarHBondContact N-O 3.34Å
98	E	89.7	Confident	85.9	Confident	113 Å²	113	55.8 Å²	55.8	53%	0.528	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.3	-177.6	-64.9	171.9	166.7	0	0	110	H82 C89 E90	H82-E98 IonicContact CD2-OE1 3.59Å; H82-E98 IonicContact NE2-OE1 2.67Å; H82-E98 IonicContact NE2-OE2 2.67Å; H82-E98 PolarHBondContact NE2-OE2 2.89Å; C89-E98 HydrophobicContact CB-CB 4.42Å; E90-E98 CarbonylContact O-C 3.55Å; E90-E98 VanDerWaalsContact O-CA 3.31Å; E90-E98 WeakPolarHBondContact O-CA 3.09Å
99	K	89.5	Confident	85.6	Confident	151 Å²	151	59.5 Å²	59.5	66%	0.657	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	113	172.7	-174.6	-177.9	179.4	-174.7	0	108.5	C89 E90	C89-K99 WeakPolarHBondContact CA-O 3.4Å; E90-K99 PolarHBondContact N-O 3.29Å; E90-K99 PolarHBondContact O-N 3.5Å
100	C	91.9	Very high	85.1	Confident	73 Å²	73	63.6 Å²	63.6	49%	0.493	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.7	178.1	-58.9	0	0	0	0	111.9	S88 C89	S88-C100 CarbonylContact O-C 3.44Å; S88-C100 WeakPolarHBondContact O-CA 3.49Å; C89-C100 HydrophobicContact CB-CB 4.08Å; C89-C100 WeakPolarHBondContact CB-SG 3.34Å; C89-C100 WeakPolarHBondContact SG-CB 3.16Å; C89-C100 CovalentContact SG-SG 2.04Å; C89-C100 PolarHBondContact SG-SG 3.01Å
101	R	91.9	Very high	85	Confident	59 Å²	59	65.3 Å²	65.3	22%	0.223	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.2	169.7	52.2	173.3	150.1	-169.5	-9.9	110.2	Y87 S88 E90 L106 D188 W189	Y87-R101 CarbonylContact C-O 3.51Å; Y87-R101 WeakPolarHBondContact CA-O 3.4Å; S88-R101 PolarHBondContact N-O 3.4Å; S88-R101 PolarHBondContact O-N 3.47Å; E90-R101 VanDerWaalsContact CD-NH2 3.25Å; E90-R101 IonicContact OE1-CZ 2.89Å; E90-R101 IonicContact OE1-NE 3.56Å; E90-R101 PolarHBondContact OE1-NE 2.69Å; E90-R101 IonicContact OE1-NH2 3.8Å; E90-R101 PolarHBondContact OE1-NH2 3.09Å; E90-R101 IonicContact OE2-NH2 3.98Å; E90-R101 PolarHBondContact OE2-NH2 3.44Å; E90-R101 VanDerWaalsContact OE2-NH2 3.17Å; R101-L106 HydrophobicContact CG-CD1 4Å; R101-L106 HydrophobicContact CG-CG 4.49Å; R101-D188 IonicContact CZ-OD2 3.08Å; R101-D188 IonicContact NH1-OD2 3.19Å; R101-D188 PolarHBondContact NH1-OD2 3.01Å; R101-D188 PolarHBondContact NH2-O 3.32Å; R101-D188 VanDerWaalsContact NH2-O 3.09Å; R101-D188 IonicContact NH2-OD2 3.25Å; R101-W189 VanDerWaalsContact CZ-CD1 3.49Å; R101-W189 VanDerWaalsContact NH2-CD1 3.32Å
102	S	92.3	Very high	85	Confident	37 Å²	37	66.1 Å²	66.1	26%	0.259	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	135.9	177.3	-167.9	0	0	0	0	110.4	W86 I104 D105	W86-S102 WeakPolarHBondContact O-CA 3.29Å; W86-S102 PolarHBondContact O-OG 2.89Å; S102-I104 PolarHBondContact O-N 3.35Å; S102-I104 WeakPolarHBondContact OG-CG2 3.48Å; S102-D105 WeakPolarHBondContact CB-OD2 3.49Å; S102-D105 PolarHBondContact O-N 3.2Å
103	F	91.1	Very high	85.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-65.4	-28.1	178.8	-175.9	-104.3	0	0	0	112.3	T83 W86 D105 L106 A107 L115 Y174 F178 T181 W189	T83-F103 WeakPolarHBondContact OG1-CD2 3.34Å; W86-F103 PolarHBondContact O-N 3.33Å; F103-D105 VanDerWaalsContact C-N 3.26Å; F103-D105 PolarHBondContact O-N 3.38Å; F103-L106 HydrophobicContact CD2-CD1 4.24Å; F103-L106 WeakPolarHBondContact O-CB 3.44Å; F103-L106 PolarHBondContact O-N 3.23Å; F103-L106 VanDerWaalsContact O-N 3.16Å; F103-A107 PolarHBondContact O-N 2.82Å; F103-L115 HydrophobicContact CD1-CD1 4.14Å; F103-L115 HydrophobicContact CD1-CD2 4.02Å; F103-L115 HydrophobicContact CE1-CD1 3.9Å; F103-L115 HydrophobicContact CE1-CD2 4.24Å; F103-Y174 HydrophobicContact CD1-CE2 4.27Å; F103-Y174 HydrophobicContact CE1-CE2 4.01Å; F103-F178 AromaticContact CE2-CD2 3.66Å; F103-F178 HydrophobicContact CE2-CD2 3.66Å; F103-F178 AromaticContact CE2-CE2 3.84Å; F103-F178 HydrophobicContact CE2-CE2 3.84Å; F103-F178 AromaticContact CZ-CD2 3.56Å; F103-F178 HydrophobicContact CZ-CD2 3.56Å; F103-F178 HydrophobicContact CZ-CE2 4.22Å; F103-T181 HydrophobicContact CE2-CG2 4.02Å; F103-T181 HydrophobicContact CZ-CG2 3.97Å; F103-W189 HydrophobicContact CE2-CH2 4.02Å; F103-W189 HydrophobicContact CE2-CZ2 4.18Å
104	I	88.4	Confident	86	Confident	45 Å²	45	66.4 Å²	66.4	23%	0.231	40%	0.402	C	S	.	.	H	α-helix	trans	-67.2	-27.3	179	-162.2	154.6	0	0	0	113.8	S102 L106 L115 W116	S102-I104 PolarHBondContact O-N 3.35Å; S102-I104 WeakPolarHBondContact OG-CG2 3.48Å; I104-L106 VanDerWaalsContact C-N 3.27Å; I104-L115 HydrophobicContact CB-CD2 4.17Å; I104-L115 HydrophobicContact CD1-CD2 4.39Å; I104-L115 HydrophobicContact CG1-CD2 4Å; I104-W116 HydrophobicContact CD1-CZ2 4.32Å
105	D	88.1	Confident	87	Confident	109 Å²	109	59.1 Å²	59.1	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-75.8	-25	178.3	-63.1	-33.3	0	0	0	111.2	S102 F103	S102-D105 WeakPolarHBondContact CB-OD2 3.49Å; S102-D105 PolarHBondContact O-N 3.2Å; F103-D105 VanDerWaalsContact C-N 3.26Å; F103-D105 PolarHBondContact O-N 3.38Å
106	L	87.3	Confident	88	Confident	5 Å²	5	64 Å²	64	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-78.4	-34.3	176.6	-70	162.4	0	0	0	112.2	R101 F103 I104 T181 P186 W189	R101-L106 HydrophobicContact CG-CD1 4Å; R101-L106 HydrophobicContact CG-CG 4.49Å; F103-L106 HydrophobicContact CD2-CD1 4.24Å; F103-L106 WeakPolarHBondContact O-CB 3.44Å; F103-L106 PolarHBondContact O-N 3.23Å; F103-L106 VanDerWaalsContact O-N 3.16Å; I104-L106 VanDerWaalsContact C-N 3.27Å; L106-T181 HydrophobicContact CB-CG2 4.16Å; L106-P186 HydrophobicContact CD2-CG 3.95Å; L106-W189 HydrophobicContact CD1-CD2 4.06Å; L106-W189 HydrophobicContact CD1-CG 4.11Å; L106-W189 HydrophobicContact CD1-CZ2 4.19Å; L106-W189 HydrophobicContact CD2-CB 3.39Å; L106-W189 VanDerWaalsContact CD2-CD1 3.5Å; L106-W189 HydrophobicContact CD2-CD2 3.63Å; L106-W189 HydrophobicContact CD2-CE3 4.31Å; L106-W189 HydrophobicContact CD2-CG 3.17Å; L106-W189 HydrophobicContact CG-CD2 4.29Å; L106-W189 HydrophobicContact CG-CG 4.2Å
107	A	87.5	Confident	89	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.017	36%	0.356	C	S	.	.	S	Bend	trans	-65.5	135.5	-179.5	0	0	0	0	0	111.7	F103 R112 L115	F103-A107 PolarHBondContact O-N 2.82Å; A107-R112 PolarHBondContact O-NE 3.41Å; A107-L115 HydrophobicContact CB-CD2 4.15Å
108	P	87.1	Confident	89.5	Confident	27 Å²	27	61.6 Å²	61.6	18%	0.175	33%	0.333	C	S	.	.			trans	-60	146.8	177.2	23.1	-30.8	0	0	0	111	S110 E111 R112 I180	P108-S110 PolarHBondContact O-N 3.01Å; P108-S110 VanDerWaalsContact O-N 3.09Å; P108-E111 HydrophobicContact CG-CB 4.2Å; P108-E111 HydrophobicContact CG-CG 3.97Å; P108-E111 PolarHBondContact O-N 2.96Å; P108-R112 PolarHBondContact O-N 3.24Å; P108-I180 HydrophobicContact CG-CG2 4.07Å
109	A	85	Confident	89.7	Confident	79 Å²	79	56.9 Å²	56.9	65%	0.653	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.6	-170.9	0	0	0	0	0	114.1
110	S	83.7	Confident	89.9	Confident	91 Å²	91	53.1 Å²	53.1	64%	0.636	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.4	176.6	57.7	0	0	0	0	113.2	P108	P108-S110 PolarHBondContact O-N 3.01Å; P108-S110 VanDerWaalsContact O-N 3.09Å
111	E	88.8	Confident	90.1	Very high	44 Å²	44	50.5 Å²	50.5	21%	0.206	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-6.2	-173.6	-60.1	-51.6	132.2	0	0	113.3	P108 G113 V114 L115 V177 I180	P108-E111 HydrophobicContact CG-CB 4.2Å; P108-E111 HydrophobicContact CG-CG 3.97Å; P108-E111 PolarHBondContact O-N 2.96Å; E111-G113 PolarHBondContact O-N 3.43Å; E111-V114 WeakPolarHBondContact O-CB 3.35Å; E111-V114 PolarHBondContact O-N 3.28Å; E111-L115 PolarHBondContact O-N 3.29Å; E111-V177 HydrophobicContact CB-CG1 4.26Å; E111-I180 HydrophobicContact CG-CD1 4.26Å; E111-I180 HydrophobicContact CG-CG2 3.92Å
112	R	87.9	Confident	90.2	Very high	108 Å²	108	47.9 Å²	47.9	41%	0.408	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-36.7	-180	-70	-179.5	-179	-178.8	-3.4	112.7	A107 P108 W116	A107-R112 PolarHBondContact O-NE 3.41Å; P108-R112 PolarHBondContact O-N 3.24Å; R112-W116 PolarHBondContact O-N 2.86Å; R112-W116 VanDerWaalsContact O-N 3.12Å
113	G	88.8	Confident	90.4	Very high	46 Å²	46	48.7 Å²	48.7	47%	0.474	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-44.1	175.4	0	0	0	0	0	112.1	E111 L115 W116 L117	E111-G113 PolarHBondContact O-N 3.43Å; G113-L115 VanDerWaalsContact C-N 3.35Å; G113-W116 PolarHBondContact O-N 3.05Å; G113-L117 WeakPolarHBondContact O-CG 3.27Å; G113-L117 PolarHBondContact O-N 3.47Å
114	V	90.4	Very high	90.6	Very high	48 Å²	48	52.3 Å²	52.3	29%	0.291	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-39.7	178.4	-175.5	0	0	0	0	111	E111 W116 L117 S118 M173 V177	E111-V114 WeakPolarHBondContact O-CB 3.35Å; E111-V114 PolarHBondContact O-N 3.28Å; V114-W116 PolarHBondContact O-N 3.49Å; V114-L117 PolarHBondContact O-N 2.72Å; V114-S118 PolarHBondContact O-N 2.98Å; V114-M173 HydrophobicContact CG1-CG 3.42Å; V114-M173 VanDerWaalsContact CG1-CG 3.42Å; V114-M173 HydrophobicContact CG1-SD 3.56Å; V114-M173 VanDerWaalsContact CG1-SD 3.56Å; V114-V177 HydrophobicContact CB-CG2 4Å; V114-V177 HydrophobicContact CG1-CG2 3.61Å
115	L	91.1	Very high	91	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-45.7	173.7	-172.8	64.9	0	0	0	111.7	F103 I104 A107 E111 G113 L117 S118 V119 Y174 V177	F103-L115 HydrophobicContact CD1-CD1 4.14Å; F103-L115 HydrophobicContact CD1-CD2 4.02Å; F103-L115 HydrophobicContact CE1-CD1 3.9Å; F103-L115 HydrophobicContact CE1-CD2 4.24Å; I104-L115 HydrophobicContact CB-CD2 4.17Å; I104-L115 HydrophobicContact CD1-CD2 4.39Å; I104-L115 HydrophobicContact CG1-CD2 4Å; A107-L115 HydrophobicContact CB-CD2 4.15Å; E111-L115 PolarHBondContact O-N 3.29Å; G113-L115 VanDerWaalsContact C-N 3.35Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 2.94Å; L115-S118 WeakPolarHBondContact O-CA 3.3Å; L115-S118 WeakPolarHBondContact O-CB 3.42Å; L115-S118 PolarHBondContact O-N 3.44Å; L115-S118 VanDerWaalsContact O-N 3.07Å; L115-V119 WeakPolarHBondContact O-CG2 3.4Å; L115-V119 PolarHBondContact O-N 3.26Å; L115-Y174 HydrophobicContact CD1-CD2 4Å; L115-Y174 HydrophobicContact CD1-CE2 4.15Å; L115-V177 HydrophobicContact CB-CG1 4.15Å; L115-V177 HydrophobicContact CD1-CG1 3.94Å
116	W	92.4	Very high	91.4	Very high	145 Å²	145	46.1 Å²	46.1	55%	0.549	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-42.2	176.5	-92.3	109.6	0	0	0	112.4	I104 R112 G113 V114 S118 V119 V120	I104-W116 HydrophobicContact CD1-CZ2 4.32Å; R112-W116 PolarHBondContact O-N 2.86Å; R112-W116 VanDerWaalsContact O-N 3.12Å; G113-W116 PolarHBondContact O-N 3.05Å; V114-W116 PolarHBondContact O-N 3.49Å; W116-S118 PolarHBondContact O-N 3.45Å; W116-V119 PolarHBondContact O-N 2.88Å; W116-V120 WeakPolarHBondContact O-CB 3.25Å; W116-V120 VanDerWaalsContact O-CG2 3.27Å; W116-V120 WeakPolarHBondContact O-CG2 3.43Å; W116-V120 PolarHBondContact O-N 3.36Å
117	L	92.1	Very high	91.8	Very high	105 Å²	105	50.5 Å²	50.5	55%	0.55	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-35.5	174.5	-66.4	176.3	0	0	0	111.3	G113 V114 L115 S121 M173	G113-L117 WeakPolarHBondContact O-CG 3.27Å; G113-L117 PolarHBondContact O-N 3.47Å; V114-L117 PolarHBondContact O-N 2.72Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 2.94Å; L117-S121 VanDerWaalsContact O-CB 3.23Å; L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.3Å; L117-S121 PolarHBondContact O-OG 2.87Å; L117-M173 VanDerWaalsContact C-CE 3.43Å; L117-M173 HydrophobicContact CB-CE 3.75Å; L117-M173 HydrophobicContact CB-SD 4.22Å
118	S	93.4	Very high	92.2	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-48.8	176.4	178.2	0	0	0	0	111.3	V114 L115 W116 V120 S121 E122 A170 Y174	V114-S118 PolarHBondContact O-N 2.98Å; L115-S118 WeakPolarHBondContact O-CA 3.3Å; L115-S118 WeakPolarHBondContact O-CB 3.42Å; L115-S118 PolarHBondContact O-N 3.44Å; L115-S118 VanDerWaalsContact O-N 3.07Å; W116-S118 PolarHBondContact O-N 3.45Å; S118-V120 VanDerWaalsContact C-N 3.35Å; S118-V120 PolarHBondContact O-N 3.18Å; S118-S121 PolarHBondContact O-N 3.43Å; S118-E122 WeakPolarHBondContact O-CB 3.27Å; S118-E122 PolarHBondContact O-N 3.34Å; S118-A170 PolarHBondContact OG-O 3.28Å; S118-Y174 WeakPolarHBondContact OG-CB 3.49Å; S118-Y174 PolarHBondContact OG-N 2.83Å
119	V	93.9	Very high	92.6	Very high	13 Å²	13	50.6 Å²	50.6	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-46.1	176.7	175.5	0	0	0	0	111.1	F27 I85 W86 L115 W116 S121 E122 V123	F27-V119 HydrophobicContact CZ-CG1 4.34Å; I85-V119 HydrophobicContact CG2-CG2 3.78Å; W86-V119 HydrophobicContact CH2-CG1 3.75Å; W86-V119 HydrophobicContact CZ2-CG1 4.07Å; W86-V119 HydrophobicContact CZ3-CG1 4.39Å; L115-V119 WeakPolarHBondContact O-CG2 3.4Å; L115-V119 PolarHBondContact O-N 3.26Å; W116-V119 PolarHBondContact O-N 2.88Å; V119-S121 PolarHBondContact O-N 3.48Å; V119-E122 PolarHBondContact O-N 2.95Å; V119-V123 VanDerWaalsContact O-CG2 3.32Å; V119-V123 WeakPolarHBondContact O-CG2 3.18Å; V119-V123 PolarHBondContact O-N 3.29Å
120	V	95.1	Very high	93.2	Very high	72 Å²	72	49.7 Å²	49.7	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-42.2	178.1	171.7	0	0	0	0	111	W116 S118 E122 V123 L124	W116-V120 WeakPolarHBondContact O-CB 3.25Å; W116-V120 VanDerWaalsContact O-CG2 3.27Å; W116-V120 WeakPolarHBondContact O-CG2 3.43Å; W116-V120 PolarHBondContact O-N 3.36Å; S118-V120 VanDerWaalsContact C-N 3.35Å; S118-V120 PolarHBondContact O-N 3.18Å; V120-E122 VanDerWaalsContact C-N 3.34Å; V120-E122 PolarHBondContact O-N 3.06Å; V120-V123 PolarHBondContact O-N 3.36Å; V120-L124 HydrophobicContact CG1-CD1 4.08Å; V120-L124 HydrophobicContact CG1-CG 4.43Å; V120-L124 WeakPolarHBondContact O-CB 3.35Å; V120-L124 VanDerWaalsContact O-CG 3.31Å; V120-L124 WeakPolarHBondContact O-CG 3.37Å; V120-L124 PolarHBondContact O-N 2.81Å
121	S	94.6	Very high	93.7	Very high	19 Å²	19	48.2 Å²	48.2	13%	0.133	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-38.5	177.8	-59.5	0	0	0	0	111.9	L117 S118 V119 L124 Y125	L117-S121 VanDerWaalsContact O-CB 3.23Å; L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.3Å; L117-S121 PolarHBondContact O-OG 2.87Å; S118-S121 PolarHBondContact O-N 3.43Å; V119-S121 PolarHBondContact O-N 3.48Å; S121-L124 PolarHBondContact O-N 2.97Å; S121-Y125 WeakPolarHBondContact O-CB 3.31Å; S121-Y125 PolarHBondContact O-N 3.26Å
122	E	94.7	Very high	94	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-41.4	175.9	-167.1	65.2	-152.4	0	0	111.5	S23 F27 I85 S118 V119 V120 Y125 I126 A170 H171	S23-E122 PolarHBondContact OG-OE1 2.95Å; F27-E122 HydrophobicContact CD2-CB 4.25Å; F27-E122 HydrophobicContact CD2-CG 3.44Å; F27-E122 VanDerWaalsContact CD2-CG 3.44Å; F27-E122 HydrophobicContact CE2-CB 4.02Å; F27-E122 HydrophobicContact CE2-CG 3.73Å; F27-E122 HydrophobicContact CG-CG 4.43Å; I85-E122 HydrophobicContact CD1-CG 4.49Å; S118-E122 WeakPolarHBondContact O-CB 3.27Å; S118-E122 PolarHBondContact O-N 3.34Å; V119-E122 PolarHBondContact O-N 2.95Å; V120-E122 VanDerWaalsContact C-N 3.34Å; V120-E122 PolarHBondContact O-N 3.06Å; E122-Y125 WeakPolarHBondContact O-CB 3.48Å; E122-Y125 PolarHBondContact O-N 2.89Å; E122-I126 WeakPolarHBondContact O-CG1 3.42Å; E122-I126 PolarHBondContact O-N 3.44Å; E122-A170 HydrophobicContact CB-CB 4.22Å; E122-A170 VanDerWaalsContact OE2-CB 3.32Å; E122-A170 WeakPolarHBondContact OE2-CB 3.43Å; E122-H171 IonicContact OE1-CE1 2.77Å; E122-H171 PolarHBondContact OE1-CE1 2.65Å; E122-H171 VanDerWaalsContact OE1-CE1 3.25Å; E122-H171 IonicContact OE1-ND1 3.55Å; E122-H171 IonicContact OE2-CE1 2.65Å; E122-H171 PolarHBondContact OE2-CE1 3Å; E122-H171 IonicContact OE2-ND1 3.61Å; E122-H171 PolarHBondContact OE2-ND1 2.94Å
123	V	95.8	Very high	94.2	Very high	54 Å²	54	43.2 Å²	43.2	33%	0.327	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-45.6	173.5	172	0	0	0	0	110.8	F27 V119 V120 Y125 I126 L127	F27-V123 HydrophobicContact CE1-CG2 4.12Å; F27-V123 HydrophobicContact CE2-CG2 4.3Å; F27-V123 HydrophobicContact CZ-CG2 3.54Å; V119-V123 VanDerWaalsContact O-CG2 3.32Å; V119-V123 WeakPolarHBondContact O-CG2 3.18Å; V119-V123 PolarHBondContact O-N 3.29Å; V120-V123 PolarHBondContact O-N 3.36Å; V123-Y125 VanDerWaalsContact C-N 3.29Å; V123-Y125 PolarHBondContact O-N 3.41Å; V123-I126 PolarHBondContact O-N 3.35Å; V123-L127 HydrophobicContact CG1-CD1 3.93Å; V123-L127 HydrophobicContact CG1-CG 4.31Å; V123-L127 WeakPolarHBondContact O-CB 3.32Å; V123-L127 VanDerWaalsContact O-CG 3.27Å; V123-L127 WeakPolarHBondContact O-CG 3.34Å; V123-L127 PolarHBondContact O-N 3.5Å
124	L	96.2	Very high	94.4	Very high	77 Å²	77	43.6 Å²	43.6	40%	0.403	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-38.9	175.6	-73.2	173.3	0	0	0	111.7	V120 S121 L127 L128 L166	V120-L124 HydrophobicContact CG1-CD1 4.08Å; V120-L124 HydrophobicContact CG1-CG 4.43Å; V120-L124 WeakPolarHBondContact O-CB 3.35Å; V120-L124 VanDerWaalsContact O-CG 3.31Å; V120-L124 WeakPolarHBondContact O-CG 3.37Å; V120-L124 PolarHBondContact O-N 2.81Å; S121-L124 PolarHBondContact O-N 2.97Å; L124-L127 PolarHBondContact O-N 2.9Å; L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 WeakPolarHBondContact O-CD1 3.37Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 3.2Å; L124-L166 HydrophobicContact CB-CD1 4.16Å
125	Y	96.2	Very high	94.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-50.5	174.2	164	-129.7	0	0	0	111.7	S23 S121 E122 V123 L128 L129 S163 H171 S206 F207 C210	S23-Y125 VanDerWaalsContact OG-CE1 3.22Å; S23-Y125 WeakPolarHBondContact OG-CE1 3.43Å; S121-Y125 WeakPolarHBondContact O-CB 3.31Å; S121-Y125 PolarHBondContact O-N 3.26Å; E122-Y125 WeakPolarHBondContact O-CB 3.48Å; E122-Y125 PolarHBondContact O-N 2.89Å; V123-Y125 VanDerWaalsContact C-N 3.29Å; V123-Y125 PolarHBondContact O-N 3.41Å; Y125-L128 PolarHBondContact O-N 3.47Å; Y125-L129 HydrophobicContact CD2-CD1 3.98Å; Y125-L129 HydrophobicContact CD2-CG 4.07Å; Y125-L129 HydrophobicContact CE1-CD1 4.18Å; Y125-L129 HydrophobicContact CE2-CD1 3.38Å; Y125-L129 HydrophobicContact CE2-CD2 4.32Å; Y125-L129 HydrophobicContact CE2-CG 3.73Å; Y125-L129 WeakPolarHBondContact O-CG 3.32Å; Y125-L129 PolarHBondContact O-N 3.48Å; Y125-S163 WeakPolarHBondContact CD2-O 3.16Å; Y125-H171 AromaticContact CE1-CE1 3.83Å; Y125-H171 AromaticContact CE1-NE2 3.98Å; Y125-S206 VanDerWaalsContact OH-C 3.31Å; Y125-S206 WeakPolarHBondContact OH-CB 3.14Å; Y125-S206 PolarHBondContact OH-O 2.8Å; Y125-S206 PolarHBondContact OH-OG 3.08Å; Y125-F207 PolarHBondContact OH-N 3.5Å; Y125-C210 HydrophobicContact CE2-CB 4.39Å
126	I	96.5	Very high	94.4	Very high	24 Å²	24	42.6 Å²	42.6	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-45.1	177.1	-65.7	165.9	0	0	0	110.9	L20 S23 F27 E122 V123 L128 L129 V130	L20-I126 HydrophobicContact CD1-CG2 4.12Å; S23-I126 WeakPolarHBondContact OG-CG1 3.22Å; F27-I126 HydrophobicContact CB-CD1 3.83Å; F27-I126 HydrophobicContact CD1-CD1 4.08Å; F27-I126 HydrophobicContact CD2-CD1 4.41Å; F27-I126 HydrophobicContact CG-CD1 3.87Å; E122-I126 WeakPolarHBondContact O-CG1 3.42Å; E122-I126 PolarHBondContact O-N 3.44Å; V123-I126 PolarHBondContact O-N 3.35Å; I126-L128 PolarHBondContact O-N 3.16Å; I126-L129 WeakPolarHBondContact O-CB 3.23Å; I126-L129 PolarHBondContact O-N 2.89Å; I126-V130 WeakPolarHBondContact O-CG2 2.98Å; I126-V130 PolarHBondContact O-N 3.3Å
127	L	97.2	Very high	94.3	Very high	97 Å²	97	36.9 Å²	36.9	51%	0.508	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-44	179.4	-71.5	174.3	0	0	0	112	V123 L124 L129 V130 V131	V123-L127 HydrophobicContact CG1-CD1 3.93Å; V123-L127 HydrophobicContact CG1-CG 4.31Å; V123-L127 WeakPolarHBondContact O-CB 3.32Å; V123-L127 VanDerWaalsContact O-CG 3.27Å; V123-L127 WeakPolarHBondContact O-CG 3.34Å; V123-L127 PolarHBondContact O-N 3.5Å; L124-L127 PolarHBondContact O-N 2.9Å; L127-L129 VanDerWaalsContact C-N 3.35Å; L127-V130 PolarHBondContact O-N 2.66Å; L127-V131 WeakPolarHBondContact O-CG2 3.5Å; L127-V131 PolarHBondContact O-N 3.02Å
128	L	95.7	Very high	94	Very high	30 Å²	30	35.3 Å²	35.3	16%	0.157	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-34.8	177.4	-69.2	166.3	0	0	0	112	L124 Y125 I126 V131 G132 F159 L162 L166	L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 WeakPolarHBondContact O-CD1 3.37Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 3.2Å; Y125-L128 PolarHBondContact O-N 3.47Å; I126-L128 PolarHBondContact O-N 3.16Å; L128-V131 PolarHBondContact O-N 3.27Å; L128-G132 PolarHBondContact O-N 3.22Å; L128-F159 HydrophobicContact CD2-CD1 3.66Å; L128-F159 HydrophobicContact CD2-CE1 4.29Å; L128-L162 HydrophobicContact CD1-CB 4.36Å; L128-L166 HydrophobicContact CD1-CD1 3.45Å; L128-L166 VanDerWaalsContact CD1-CD1 3.45Å
129	L	95.6	Very high	93.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-45.7	170.2	-82.9	178.4	0	0	0	111.6	N16 A19 L20 Y125 I126 L127 V131 G132 F133 C210	N16-L129 PolarHBondContact OD1-O 2.81Å; A19-L129 HydrophobicContact CB-CD1 4.27Å; A19-L129 HydrophobicContact CB-CD2 4.29Å; L20-L129 HydrophobicContact CD1-CB 4.15Å; Y125-L129 HydrophobicContact CD2-CD1 3.98Å; Y125-L129 HydrophobicContact CD2-CG 4.07Å; Y125-L129 HydrophobicContact CE1-CD1 4.18Å; Y125-L129 HydrophobicContact CE2-CD1 3.38Å; Y125-L129 HydrophobicContact CE2-CD2 4.32Å; Y125-L129 HydrophobicContact CE2-CG 3.73Å; Y125-L129 WeakPolarHBondContact O-CG 3.32Å; Y125-L129 PolarHBondContact O-N 3.48Å; I126-L129 WeakPolarHBondContact O-CB 3.23Å; I126-L129 PolarHBondContact O-N 2.89Å; L127-L129 VanDerWaalsContact C-N 3.35Å; L129-V131 VanDerWaalsContact C-N 3.34Å; L129-V131 PolarHBondContact O-N 3.41Å; L129-G132 PolarHBondContact O-N 3.18Å; L129-F133 WeakPolarHBondContact O-CB 3.48Å; L129-F133 PolarHBondContact O-N 2.92Å; L129-C210 HydrophobicContact CD2-CB 4.07Å; L129-C210 VanDerWaalsContact CD2-SG 3.59Å
130	V	96.7	Very high	92.9	Very high	60 Å²	60	40.1 Å²	40.1	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-44.9	176.4	172.8	0	0	0	0	111.2	L20 I126 L127 S134	L20-V130 HydrophobicContact CD1-CG2 3.5Å; L20-V130 VanDerWaalsContact CD1-CG2 3.5Å; L20-V130 HydrophobicContact CD2-CG2 4.06Å; L20-V130 HydrophobicContact CG-CG2 4.44Å; I126-V130 WeakPolarHBondContact O-CG2 2.98Å; I126-V130 PolarHBondContact O-N 3.3Å; L127-V130 PolarHBondContact O-N 2.66Å; V130-S134 WeakPolarHBondContact O-CB 3.27Å; V130-S134 PolarHBondContact O-N 2.98Å; V130-S134 PolarHBondContact O-OG 2.74Å
131	V	95.3	Very high	92.1	Very high	61 Å²	61	44.6 Å²	44.6	37%	0.37	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-45.9	176.5	172.4	0	0	0	0	110.7	L127 L128 L129 S134 L135 F159	L127-V131 WeakPolarHBondContact O-CG2 3.5Å; L127-V131 PolarHBondContact O-N 3.02Å; L128-V131 PolarHBondContact O-N 3.27Å; L129-V131 VanDerWaalsContact C-N 3.34Å; L129-V131 PolarHBondContact O-N 3.41Å; V131-S134 PolarHBondContact O-N 2.92Å; V131-L135 HydrophobicContact CG1-CD1 4.06Å; V131-L135 WeakPolarHBondContact O-CG 3.33Å; V131-L135 PolarHBondContact O-N 2.85Å; V131-F159 HydrophobicContact CG1-CD1 4.42Å; V131-F159 HydrophobicContact CG1-CD2 3.95Å; V131-F159 HydrophobicContact CG1-CE2 4.17Å; V131-F159 HydrophobicContact CG1-CG 4.09Å
132	G	93.6	Very high	90.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-50.3	177	0	0	0	0	0	112.4	L128 L129 S134 L135 M136	L128-G132 PolarHBondContact O-N 3.22Å; L129-G132 PolarHBondContact O-N 3.18Å; G132-S134 VanDerWaalsContact C-N 3.35Å; G132-S134 PolarHBondContact O-N 2.95Å; G132-L135 PolarHBondContact O-N 2.95Å; G132-M136 WeakPolarHBondContact O-CG 3.27Å; G132-M136 PolarHBondContact O-N 2.87Å
133	F	93.6	Very high	89.3	Confident	46 Å²	46	54 Å²	54	20%	0.202	29%	0.291	C	S	.	.	H	α-helix	trans	-57.3	-46.3	174.8	177	-106.3	0	0	0	111.8	V13 N16 L17 L129 L135 M136 C137	V13-F133 HydrophobicContact CG1-CD2 4.38Å; V13-F133 HydrophobicContact CG1-CE2 3.79Å; N16-F133 HydrophobicContact CB-CD2 4.42Å; L17-F133 HydrophobicContact CB-CD2 4.32Å; L17-F133 HydrophobicContact CB-CE2 3.85Å; L17-F133 HydrophobicContact CD1-CE2 4.23Å; L17-F133 HydrophobicContact CD1-CZ 4.15Å; L129-F133 WeakPolarHBondContact O-CB 3.48Å; L129-F133 PolarHBondContact O-N 2.92Å; F133-L135 VanDerWaalsContact C-N 3.34Å; F133-L135 PolarHBondContact O-N 3.44Å; F133-M136 PolarHBondContact O-N 3.43Å; F133-C137 WeakPolarHBondContact CZ-SG 3.48Å; F133-C137 WeakPolarHBondContact O-CB 3.25Å; F133-C137 PolarHBondContact O-N 3.4Å; F133-C137 PolarHBondContact O-SG 3.23Å; F133-C137 VanDerWaalsContact O-SG 3.38Å
134	S	93.2	Very high	87.4	Confident	54 Å²	54	56 Å²	56	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-43.3	178.8	-59.5	0	0	0	0	111.8	V130 V131 G132 C137 L138	V130-S134 WeakPolarHBondContact O-CB 3.27Å; V130-S134 PolarHBondContact O-N 2.98Å; V130-S134 PolarHBondContact O-OG 2.74Å; V131-S134 PolarHBondContact O-N 2.92Å; G132-S134 VanDerWaalsContact C-N 3.35Å; G132-S134 PolarHBondContact O-N 2.95Å; S134-C137 PolarHBondContact O-N 3.39Å; S134-L138 VanDerWaalsContact O-CG 3.3Å; S134-L138 WeakPolarHBondContact O-CG 3.29Å; S134-L138 PolarHBondContact O-N 3.29Å
135	L	91.4	Very high	86.1	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.141	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-40.2	176.6	-68.2	170	0	0	0	112.2	V131 G132 F133 C137 L138 E139 L152 F155 A156 F159	V131-L135 HydrophobicContact CG1-CD1 4.06Å; V131-L135 WeakPolarHBondContact O-CG 3.33Å; V131-L135 PolarHBondContact O-N 2.85Å; G132-L135 PolarHBondContact O-N 2.95Å; F133-L135 VanDerWaalsContact C-N 3.34Å; F133-L135 PolarHBondContact O-N 3.44Å; L135-C137 VanDerWaalsContact C-N 3.35Å; L135-L138 PolarHBondContact O-N 3Å; L135-E139 PolarHBondContact O-N 3.42Å; L135-L152 HydrophobicContact CD2-CD2 3.81Å; L135-F155 HydrophobicContact CD1-CB 4.02Å; L135-A156 HydrophobicContact CB-CB 3.79Å; L135-A156 HydrophobicContact CD1-CB 4.47Å; L135-F159 HydrophobicContact CD1-CD2 3.48Å; L135-F159 VanDerWaalsContact CD1-CD2 3.48Å; L135-F159 HydrophobicContact CD1-CE2 3.87Å
136	M	89.9	Confident	84.7	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-36.7	175	-64.9	-178.1	-161.2	0	0	112	S12 V13 N16 G132 F133 E139 L140 A156 T160 T217	S12-M136 PolarHBondContact OG-SD 2.9Å; V13-M136 HydrophobicContact CG2-CB 3.66Å; N16-M136 HydrophobicContact CB-SD 4.15Å; N16-M136 WeakPolarHBondContact ND2-CE 3.47Å; G132-M136 WeakPolarHBondContact O-CG 3.27Å; G132-M136 PolarHBondContact O-N 2.87Å; F133-M136 PolarHBondContact O-N 3.43Å; M136-E139 PolarHBondContact O-N 3.37Å; M136-L140 PolarHBondContact O-N 2.9Å; M136-A156 HydrophobicContact CE-CB 4.36Å; M136-A156 HydrophobicContact CG-CB 3.91Å; M136-T160 HydrophobicContact CE-CG2 4.26Å; M136-T160 WeakPolarHBondContact CE-OG1 3.43Å; M136-T217 HydrophobicContact CE-CG2 4.17Å; M136-T217 VanDerWaalsContact CE-OG1 3.3Å; M136-T217 WeakPolarHBondContact CE-OG1 3.37Å
137	C	89.3	Confident	83.4	Confident	24 Å²	24	65.2 Å²	65.2	16%	0.162	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-45.9	172	-74.2	0	0	0	0	111.7	F133 S134 L135 E139 L140 F141	F133-C137 WeakPolarHBondContact CZ-SG 3.48Å; F133-C137 WeakPolarHBondContact O-CB 3.25Å; F133-C137 PolarHBondContact O-N 3.4Å; F133-C137 PolarHBondContact O-SG 3.23Å; F133-C137 VanDerWaalsContact O-SG 3.38Å; S134-C137 PolarHBondContact O-N 3.39Å; L135-C137 VanDerWaalsContact C-N 3.35Å; C137-E139 VanDerWaalsContact C-N 3.26Å; C137-E139 PolarHBondContact O-N 2.91Å; C137-L140 WeakPolarHBondContact O-CB 3.35Å; C137-L140 PolarHBondContact O-N 2.91Å; C137-F141 HydrophobicContact CB-CD2 4.32Å; C137-F141 HydrophobicContact CB-CE2 4.07Å; C137-F141 WeakPolarHBondContact O-CD2 3.45Å; C137-F141 PolarHBondContact O-N 3.46Å
138	L	86.6	Confident	82.3	Confident	72 Å²	72	64.2 Å²	64.2	38%	0.377	35%	0.354	S	S	.	.	H	α-helix	trans	-59.5	-37	176.7	-72.4	172	0	0	0	112	S134 L135 L140 F141 H142 L152	S134-L138 VanDerWaalsContact O-CG 3.3Å; S134-L138 WeakPolarHBondContact O-CG 3.29Å; S134-L138 PolarHBondContact O-N 3.29Å; L135-L138 PolarHBondContact O-N 3Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-F141 PolarHBondContact O-N 3.35Å; L138-H142 WeakPolarHBondContact O-CB 3.43Å; L138-H142 PolarHBondContact O-N 3.49Å; L138-L152 HydrophobicContact CB-CD1 4.45Å
139	E	83.1	Confident	81.2	Confident	54 Å²	54	63.6 Å²	63.6	25%	0.252	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-40.1	173	-172.3	-176.4	172.3	0	0	112.1	L135 M136 C137 N153	L135-E139 PolarHBondContact O-N 3.42Å; M136-E139 PolarHBondContact O-N 3.37Å; C137-E139 VanDerWaalsContact C-N 3.26Å; C137-E139 PolarHBondContact O-N 2.91Å; E139-N153 WeakPolarHBondContact OE2-CB 3.27Å
140	L	80.6	Confident	80.2	Confident	63 Å²	63	65.6 Å²	65.6	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-67.1	-39.5	176.7	-72.2	-179.5	0	0	0	112.6	A9 L10 V13 M136 C137 L138	A9-L140 HydrophobicContact CB-CD2 3.92Å; L10-L140 HydrophobicContact CD2-CD1 4.23Å; V13-L140 HydrophobicContact CB-CD1 4.31Å; V13-L140 HydrophobicContact CG1-CD1 4.25Å; V13-L140 HydrophobicContact CG2-CD1 3.71Å; V13-L140 HydrophobicContact CG2-CG 4.29Å; M136-L140 PolarHBondContact O-N 2.9Å; C137-L140 WeakPolarHBondContact O-CB 3.35Å; C137-L140 PolarHBondContact O-N 2.91Å; L138-L140 VanDerWaalsContact C-N 3.34Å
141	F	79.1	Confident	79.5	Confident	166 Å²	166	68.7 Å²	68.7	73%	0.728	37%	0.373	S	S	*	.	H	α-helix	trans	-81.2	-38.8	-176.9	-65.9	-64.1	0	0	0	113.3	C137 L138 S143	C137-F141 HydrophobicContact CB-CD2 4.32Å; C137-F141 HydrophobicContact CB-CE2 4.07Å; C137-F141 WeakPolarHBondContact O-CD2 3.45Å; C137-F141 PolarHBondContact O-N 3.46Å; L138-F141 PolarHBondContact O-N 3.35Å; F141-S143 PolarHBondContact O-N 2.94Å
142	H	69.5	Low	78.8	Confident	119 Å²	119	67.8 Å²	67.8	55%	0.551	37%	0.366	S	S	*	.			trans	-94.3	39.2	-175.8	-70.8	132.4	0	0	0	114.7	L138 S144	L138-H142 WeakPolarHBondContact O-CB 3.43Å; L138-H142 PolarHBondContact O-N 3.49Å; H142-S144 PolarHBondContact O-N 3.25Å
143	S	59.4	Low	78.4	Confident	101 Å²	101	68 Å²	68	71%	0.706	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	6.9	-174.6	62.6	0	0	0	0	117.2	F141	F141-S143 PolarHBondContact O-N 2.94Å
144	S	56.9	Low	78	Confident	96 Å²	96	67 Å²	67	67%	0.671	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-38.6	-179.7	53.4	0	0	0	0	113.3	H142	H142-S144 PolarHBondContact O-N 3.25Å
145	N	68.3	Low	77.8	Confident	93 Å²	93	70.1 Å²	70.1	50%	0.497	38%	0.375	S	S	.	.			trans	-108.6	107.6	-176.9	-70.8	-32.9	0	0	0	111.6	I147 D148 G149	N145-I147 VanDerWaalsContact C-N 3.27Å; N145-I147 PolarHBondContact O-N 3.23Å; N145-D148 HydrophobicContact CB-CB 4.19Å; N145-D148 WeakPolarHBondContact CB-OD2 3.44Å; N145-D148 PolarHBondContact O-N 3.48Å; N145-G149 PolarHBondContact O-N 3.39Å; N145-G149 VanDerWaalsContact O-N 3.07Å
146	V	67.8	Low	77.8	Confident	76 Å²	76	68.9 Å²	68.9	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-31.4	-176.1	173.7	0	0	0	0	113.4	L150 F228	V146-L150 PolarHBondContact O-N 3.16Å; V146-F228 HydrophobicContact CB-CZ 4.32Å; V146-F228 HydrophobicContact CG1-CE1 3.39Å; V146-F228 HydrophobicContact CG1-CE2 3.51Å; V146-F228 HydrophobicContact CG1-CZ 2.84Å
147	I	69.3	Low	77.8	Confident	126 Å²	126	68.7 Å²	68.7	65%	0.646	37%	0.367	S	S	*	.	H	α-helix	trans	-75.5	-40.7	-179.1	-68.5	153.3	0	0	0	111.2	N145 L150 K151	N145-I147 VanDerWaalsContact C-N 3.27Å; N145-I147 PolarHBondContact O-N 3.23Å; I147-L150 PolarHBondContact O-N 3.31Å; I147-K151 PolarHBondContact O-N 2.69Å
148	D	72.7	Confident	77.9	Confident	76 Å²	76	71.3 Å²	71.3	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-70.8	-37.4	177.3	-63.3	-30.2	0	0	0	111	N145 L150 K151 L152	N145-D148 HydrophobicContact CB-CB 4.19Å; N145-D148 WeakPolarHBondContact CB-OD2 3.44Å; N145-D148 PolarHBondContact O-N 3.48Å; D148-L150 VanDerWaalsContact C-N 3.3Å; D148-L150 PolarHBondContact O-N 2.82Å; D148-K151 PolarHBondContact O-N 3.33Å; D148-L152 WeakPolarHBondContact O-CB 3.46Å; D148-L152 WeakPolarHBondContact O-CG 3.24Å; D148-L152 PolarHBondContact O-N 3.43Å
149	G	73.6	Confident	78.2	Confident	17 Å²	17	71 Å²	71	18%	0.175	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-38.6	171.4	0	0	0	0	0	113	N145 N153	N145-G149 PolarHBondContact O-N 3.39Å; N145-G149 VanDerWaalsContact O-N 3.07Å; G149-N153 VanDerWaalsContact O-CB 3.25Å; G149-N153 WeakPolarHBondContact O-CB 3.3Å; G149-N153 PolarHBondContact O-N 2.95Å
150	L	73.4	Confident	78.6	Confident	41 Å²	41	68.5 Å²	68.5	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-66.5	-40.6	177.2	-175.3	66.6	0	0	0	112.5	V146 I147 D148 A154 Y221 T224 V225 F228	V146-L150 PolarHBondContact O-N 3.16Å; I147-L150 PolarHBondContact O-N 3.31Å; D148-L150 VanDerWaalsContact C-N 3.3Å; D148-L150 PolarHBondContact O-N 2.82Å; L150-A154 PolarHBondContact O-N 2.94Å; L150-Y221 HydrophobicContact CD1-CD2 3.59Å; L150-Y221 HydrophobicContact CD1-CE2 3.59Å; L150-Y221 HydrophobicContact CG-CD2 4.39Å; L150-Y221 HydrophobicContact CG-CE2 4Å; L150-T224 HydrophobicContact CD1-CG2 3.93Å; L150-V225 HydrophobicContact CD1-CG2 3.71Å; L150-V225 HydrophobicContact CD2-CG2 4.23Å; L150-V225 HydrophobicContact CG-CG2 4.47Å; L150-F228 HydrophobicContact CD2-CD2 4.46Å
151	K	82	Confident	79.2	Confident	126 Å²	126	67.5 Å²	67.5	55%	0.548	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-48	176.4	-71.4	179.8	178.6	174.5	0	111.3	I147 D148 N153 A154 F155	I147-K151 PolarHBondContact O-N 2.69Å; D148-K151 PolarHBondContact O-N 3.33Å; K151-N153 VanDerWaalsContact C-N 3.32Å; K151-N153 PolarHBondContact O-N 2.85Å; K151-A154 WeakPolarHBondContact O-CB 3.35Å; K151-A154 PolarHBondContact O-N 2.89Å; K151-F155 HydrophobicContact CB-CE2 4.48Å; K151-F155 WeakPolarHBondContact O-CD2 3.33Å; K151-F155 PolarHBondContact O-N 3.24Å
152	L	81.9	Confident	80	Confident	42 Å²	42	63.4 Å²	63.4	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-60.2	-41.9	179.3	-71.9	170.9	0	0	0	111.8	L135 L138 D148 A154 F155 A156	L135-L152 HydrophobicContact CD2-CD2 3.81Å; L138-L152 HydrophobicContact CB-CD1 4.45Å; D148-L152 WeakPolarHBondContact O-CB 3.46Å; D148-L152 WeakPolarHBondContact O-CG 3.24Å; D148-L152 PolarHBondContact O-N 3.43Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 3.37Å; L152-F155 PolarHBondContact O-N 3.27Å; L152-A156 VanDerWaalsContact O-CB 3.3Å; L152-A156 WeakPolarHBondContact O-CB 3.46Å; L152-A156 PolarHBondContact O-N 2.66Å
153	N	84.4	Confident	81.2	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-38.7	176.8	-168.8	4.5	0	0	0	112.3	E139 G149 K151 A156 A157 T217 Y221	E139-N153 WeakPolarHBondContact OE2-CB 3.27Å; G149-N153 VanDerWaalsContact O-CB 3.25Å; G149-N153 WeakPolarHBondContact O-CB 3.3Å; G149-N153 PolarHBondContact O-N 2.95Å; K151-N153 VanDerWaalsContact C-N 3.32Å; K151-N153 PolarHBondContact O-N 2.85Å; N153-A156 PolarHBondContact O-N 2.73Å; N153-A157 WeakPolarHBondContact O-CB 3.31Å; N153-A157 PolarHBondContact O-N 3.47Å; N153-T217 WeakPolarHBondContact OD1-CG2 3.4Å; N153-Y221 PolarHBondContact ND2-N 3.42Å
154	A	86.1	Confident	82.8	Confident	26 Å²	26	52.9 Å²	52.9	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-46.2	174.9	0	0	0	0	0	112.1	L150 K151 L152 A157 V158 Y221	L150-A154 PolarHBondContact O-N 2.94Å; K151-A154 WeakPolarHBondContact O-CB 3.35Å; K151-A154 PolarHBondContact O-N 2.89Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 3.37Å; A154-A157 WeakPolarHBondContact O-CB 3.47Å; A154-A157 PolarHBondContact O-N 2.96Å; A154-V158 WeakPolarHBondContact O-CG2 3.43Å; A154-V158 PolarHBondContact O-N 2.84Å; A154-Y221 HydrophobicContact CB-CD2 3.95Å; A154-Y221 HydrophobicContact CB-CE2 3.64Å
155	F	88.7	Confident	84.6	Confident	119 Å²	119	53.1 Å²	53.1	52%	0.522	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176	-72.2	-63.5	0	0	0	111.6	L135 K151 L152 A157 V158 F159	L135-F155 HydrophobicContact CD1-CB 4.02Å; K151-F155 HydrophobicContact CB-CE2 4.48Å; K151-F155 WeakPolarHBondContact O-CD2 3.33Å; K151-F155 PolarHBondContact O-N 3.24Å; L152-F155 PolarHBondContact O-N 3.27Å; F155-A157 VanDerWaalsContact C-N 3.29Å; F155-A157 PolarHBondContact O-N 2.86Å; F155-V158 PolarHBondContact O-N 2.96Å; F155-F159 HydrophobicContact CB-CD2 4.33Å; F155-F159 HydrophobicContact CB-CE2 4.2Å; F155-F159 WeakPolarHBondContact O-CD2 3.39Å; F155-F159 PolarHBondContact O-N 3.19Å
156	A	90.5	Very high	85.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.6	-44.1	176.1	0	0	0	0	0	111.4	L135 M136 L152 N153 T160 T217	L135-A156 HydrophobicContact CB-CB 3.79Å; L135-A156 HydrophobicContact CD1-CB 4.47Å; M136-A156 HydrophobicContact CE-CB 4.36Å; M136-A156 HydrophobicContact CG-CB 3.91Å; L152-A156 VanDerWaalsContact O-CB 3.3Å; L152-A156 WeakPolarHBondContact O-CB 3.46Å; L152-A156 PolarHBondContact O-N 2.66Å; N153-A156 PolarHBondContact O-N 2.73Å; A156-T160 WeakPolarHBondContact O-CB 3.41Å; A156-T160 PolarHBondContact O-N 2.78Å; A156-T160 PolarHBondContact O-OG1 2.83Å; A156-T217 HydrophobicContact CB-CG2 4.34Å
157	A	89.9	Confident	87.1	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-50.1	175.5	0	0	0	0	0	111.8	N153 A154 F155 F159 T160 V161 T217 L218	N153-A157 WeakPolarHBondContact O-CB 3.31Å; N153-A157 PolarHBondContact O-N 3.47Å; A154-A157 WeakPolarHBondContact O-CB 3.47Å; A154-A157 PolarHBondContact O-N 2.96Å; F155-A157 VanDerWaalsContact C-N 3.29Å; F155-A157 PolarHBondContact O-N 2.86Å; A157-F159 PolarHBondContact O-N 2.93Å; A157-T160 PolarHBondContact O-N 3.27Å; A157-V161 VanDerWaalsContact O-CG2 3.27Å; A157-V161 WeakPolarHBondContact O-CG2 3.46Å; A157-V161 PolarHBondContact O-N 2.94Å; A157-T217 HydrophobicContact CB-CG2 3.8Å; A157-L218 HydrophobicContact CB-CD2 3.66Å; A157-L218 HydrophobicContact CB-CG 3.94Å
158	V	91.9	Very high	88.3	Confident	79 Å²	79	45 Å²	45	48%	0.479	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-48.9	-179.2	172.6	0	0	0	0	111.3	A154 F155 T160 V161 L162	A154-V158 WeakPolarHBondContact O-CG2 3.43Å; A154-V158 PolarHBondContact O-N 2.84Å; F155-V158 PolarHBondContact O-N 2.96Å; V158-T160 VanDerWaalsContact C-N 3.31Å; V158-T160 PolarHBondContact O-N 3.37Å; V158-V161 PolarHBondContact O-N 3.23Å; V158-L162 HydrophobicContact CG1-CD1 3.86Å; V158-L162 HydrophobicContact CG1-CG 4.33Å; V158-L162 WeakPolarHBondContact O-CB 3.46Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.32Å; V158-L162 PolarHBondContact O-N 2.79Å
159	F	92.6	Very high	89.3	Confident	67 Å²	67	45.3 Å²	45.3	29%	0.294	24%	0.239	S	C	.	.	H	α-helix	trans	-62.7	-38	178.9	-71.8	-62.3	0	0	0	112.4	L128 V131 L135 F155 A157 L162 S163	L128-F159 HydrophobicContact CD2-CD1 3.66Å; L128-F159 HydrophobicContact CD2-CE1 4.29Å; V131-F159 HydrophobicContact CG1-CD1 4.42Å; V131-F159 HydrophobicContact CG1-CD2 3.95Å; V131-F159 HydrophobicContact CG1-CE2 4.17Å; V131-F159 HydrophobicContact CG1-CG 4.09Å; L135-F159 HydrophobicContact CD1-CD2 3.48Å; L135-F159 VanDerWaalsContact CD1-CD2 3.48Å; L135-F159 HydrophobicContact CD1-CE2 3.87Å; F155-F159 HydrophobicContact CB-CD2 4.33Å; F155-F159 HydrophobicContact CB-CE2 4.2Å; F155-F159 WeakPolarHBondContact O-CD2 3.39Å; F155-F159 PolarHBondContact O-N 3.19Å; A157-F159 PolarHBondContact O-N 2.93Å; F159-L162 PolarHBondContact O-N 2.89Å; F159-S163 WeakPolarHBondContact O-CB 3.32Å; F159-S163 PolarHBondContact O-N 3.37Å; F159-S163 PolarHBondContact O-OG 3.34Å
160	T	91.8	Very high	90.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-72.9	-30	178.1	-46.2	0	0	0	0	112.7	N16 M136 A156 A157 V158 S163 G164 C210 A213	N16-T160 VanDerWaalsContact ND2-CG2 3.32Å; N16-T160 WeakPolarHBondContact ND2-CG2 3.36Å; M136-T160 HydrophobicContact CE-CG2 4.26Å; M136-T160 WeakPolarHBondContact CE-OG1 3.43Å; A156-T160 WeakPolarHBondContact O-CB 3.41Å; A156-T160 PolarHBondContact O-N 2.78Å; A156-T160 PolarHBondContact O-OG1 2.83Å; A157-T160 PolarHBondContact O-N 3.27Å; V158-T160 VanDerWaalsContact C-N 3.31Å; V158-T160 PolarHBondContact O-N 3.37Å; T160-S163 WeakPolarHBondContact CA-OG 3.05Å; T160-S163 PolarHBondContact O-OG 3.44Å; T160-G164 PolarHBondContact O-N 3.45Å; T160-C210 PolarHBondContact O-SG 3.34Å; T160-C210 VanDerWaalsContact O-SG 3.37Å; T160-A213 HydrophobicContact CG2-CB 4.4Å
161	V	93.8	Very high	91.2	Very high	43 Å²	43	42.5 Å²	42.5	26%	0.261	22%	0.221	S	C	.	.	H	α-helix	trans	-68.7	-50.1	170.8	173.3	0	0	0	0	110	A157 V158 S163 G164 L165 S214 L218	A157-V161 VanDerWaalsContact O-CG2 3.27Å; A157-V161 WeakPolarHBondContact O-CG2 3.46Å; A157-V161 PolarHBondContact O-N 2.94Å; V158-V161 PolarHBondContact O-N 3.23Å; V161-S163 VanDerWaalsContact C-N 3.28Å; V161-S163 PolarHBondContact O-N 3.32Å; V161-G164 PolarHBondContact O-N 2.88Å; V161-G164 VanDerWaalsContact O-N 3.12Å; V161-L165 HydrophobicContact CG1-CD1 4.16Å; V161-L165 HydrophobicContact CG1-CG 4.44Å; V161-L165 WeakPolarHBondContact O-CG 3.46Å; V161-L165 PolarHBondContact O-N 3.5Å; V161-S214 WeakPolarHBondContact CG2-OG 3.32Å; V161-L218 HydrophobicContact CG2-CD1 3.93Å
162	L	95	Very high	91.7	Very high	79 Å²	79	40 Å²	40	41%	0.414	21%	0.212	S	C	.	.	H	α-helix	trans	-60.5	-39.9	-179.1	-69.9	174.6	0	0	0	111.4	L128 V158 F159 L165 L166	L128-L162 HydrophobicContact CD1-CB 4.36Å; V158-L162 HydrophobicContact CG1-CD1 3.86Å; V158-L162 HydrophobicContact CG1-CG 4.33Å; V158-L162 WeakPolarHBondContact O-CB 3.46Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.32Å; V158-L162 PolarHBondContact O-N 2.79Å; F159-L162 PolarHBondContact O-N 2.89Å; L162-L165 PolarHBondContact O-N 3.35Å; L162-L166 WeakPolarHBondContact O-CG 3.15Å; L162-L166 PolarHBondContact O-N 3.08Å
163	S	95.3	Very high	92.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-47.9	173.9	69.2	0	0	0	0	110.9	Y125 F159 T160 V161 L165 L166 G167 C210	Y125-S163 WeakPolarHBondContact CD2-O 3.16Å; F159-S163 WeakPolarHBondContact O-CB 3.32Å; F159-S163 PolarHBondContact O-N 3.37Å; F159-S163 PolarHBondContact O-OG 3.34Å; T160-S163 WeakPolarHBondContact CA-OG 3.05Å; T160-S163 PolarHBondContact O-OG 3.44Å; V161-S163 VanDerWaalsContact C-N 3.28Å; V161-S163 PolarHBondContact O-N 3.32Å; S163-L165 PolarHBondContact O-N 2.83Å; S163-L166 PolarHBondContact O-N 3.35Å; S163-G167 PolarHBondContact O-N 3.28Å; S163-C210 PolarHBondContact OG-SG 2.86Å
164	G	94	Very high	92.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-43.6	177.9	0	0	0	0	0	113.2	T160 V161 G167 M168 F207	T160-G164 PolarHBondContact O-N 3.45Å; V161-G164 PolarHBondContact O-N 2.88Å; V161-G164 VanDerWaalsContact O-N 3.12Å; G164-G167 PolarHBondContact O-N 2.94Å; G164-M168 PolarHBondContact O-N 2.88Å; G164-F207 VanDerWaalsContact O-CE2 3.25Å; G164-F207 WeakPolarHBondContact O-CE2 3.25Å
165	L	94.2	Very high	93	Very high	100 Å²	100	38.9 Å²	38.9	52%	0.524	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-44.6	177.6	-65.8	176	0	0	0	112	V161 L162 S163 M168 V169	V161-L165 HydrophobicContact CG1-CD1 4.16Å; V161-L165 HydrophobicContact CG1-CG 4.44Å; V161-L165 WeakPolarHBondContact O-CG 3.46Å; V161-L165 PolarHBondContact O-N 3.5Å; L162-L165 PolarHBondContact O-N 3.35Å; S163-L165 PolarHBondContact O-N 2.83Å; L165-M168 PolarHBondContact O-N 3.28Å; L165-V169 WeakPolarHBondContact O-CG2 3.11Å; L165-V169 PolarHBondContact O-N 3.39Å
166	L	94.1	Very high	93.2	Very high	56 Å²	56	38 Å²	38	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-66.8	-40	176.6	-72.1	170.4	0	0	0	112	L124 L128 L162 S163 V169 A170	L124-L166 HydrophobicContact CB-CD1 4.16Å; L128-L166 HydrophobicContact CD1-CD1 3.45Å; L128-L166 VanDerWaalsContact CD1-CD1 3.45Å; L162-L166 WeakPolarHBondContact O-CG 3.15Å; L162-L166 PolarHBondContact O-N 3.08Å; S163-L166 PolarHBondContact O-N 3.35Å; L166-V169 PolarHBondContact O-N 2.86Å; L166-A170 VanDerWaalsContact O-CB 3.24Å; L166-A170 WeakPolarHBondContact O-CB 3.33Å; L166-A170 PolarHBondContact O-N 3.05Å
167	G	94.1	Very high	93.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-43.6	176.1	0	0	0	0	0	112.4	S163 G164 V169 A170 H171	S163-G167 PolarHBondContact O-N 3.28Å; G164-G167 PolarHBondContact O-N 2.94Å; G167-V169 VanDerWaalsContact C-N 3.35Å; G167-V169 PolarHBondContact O-N 3.49Å; G167-A170 PolarHBondContact O-N 3.4Å; G167-H171 WeakPolarHBondContact O-CB 3.49Å; G167-H171 PolarHBondContact O-CD2 3.33Å; G167-H171 PolarHBondContact O-N 3.39Å; G167-H171 PolarHBondContact O-ND1 3.08Å
168	M	94.6	Very high	93.3	Very high	70 Å²	70	38.2 Å²	38.2	35%	0.345	20%	0.2	S	C	.	.	H	α-helix	trans	-57.5	-48.6	175.2	-175.3	63.2	-169.8	0	0	111.5	G164 L165 M172 W204 F207	G164-M168 PolarHBondContact O-N 2.88Å; L165-M168 PolarHBondContact O-N 3.28Å; M168-M172 HydrophobicContact CE-CG 3.71Å; M168-M172 HydrophobicContact CE-SD 3.83Å; M168-M172 WeakPolarHBondContact O-CB 3.46Å; M168-M172 WeakPolarHBondContact O-CG 3.27Å; M168-M172 PolarHBondContact O-N 2.83Å; M168-M172 VanDerWaalsContact O-N 3.08Å; M168-M172 HydrophobicContact SD-CG 4.34Å; M168-W204 HydrophobicContact CE-CH2 4.13Å; M168-W204 HydrophobicContact CE-CZ3 4.18Å; M168-W204 HydrophobicContact SD-CH2 3.92Å; M168-W204 HydrophobicContact SD-CZ3 3.65Å; M168-F207 HydrophobicContact CB-CD2 4.24Å; M168-F207 HydrophobicContact CB-CE2 3.66Å; M168-F207 HydrophobicContact CB-CZ 4.07Å; M168-F207 HydrophobicContact CG-CE2 4.39Å; M168-F207 HydrophobicContact CG-CZ 4.31Å; M168-F207 HydrophobicContact SD-CE1 4.02Å; M168-F207 HydrophobicContact SD-CE2 4.29Å; M168-F207 HydrophobicContact SD-CZ 3.85Å
169	V	94.1	Very high	93.3	Very high	81 Å²	81	37.9 Å²	37.9	49%	0.491	19%	0.193	S	C	.	.	H	α-helix	trans	-65.7	-43.2	179.2	175.9	0	0	0	0	110.7	L165 L166 G167 M173	L165-V169 WeakPolarHBondContact O-CG2 3.11Å; L165-V169 PolarHBondContact O-N 3.39Å; L166-V169 PolarHBondContact O-N 2.86Å; G167-V169 VanDerWaalsContact C-N 3.35Å; G167-V169 PolarHBondContact O-N 3.49Å; V169-M173 WeakPolarHBondContact O-CB 3.47Å; V169-M173 PolarHBondContact O-N 3.36Å
170	A	93.8	Very high	93.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-49.5	-179.5	0	0	0	0	0	111.9	S118 E122 L166 G167 M173 Y174	S118-A170 PolarHBondContact OG-O 3.28Å; E122-A170 HydrophobicContact CB-CB 4.22Å; E122-A170 VanDerWaalsContact OE2-CB 3.32Å; E122-A170 WeakPolarHBondContact OE2-CB 3.43Å; L166-A170 VanDerWaalsContact O-CB 3.24Å; L166-A170 WeakPolarHBondContact O-CB 3.33Å; L166-A170 PolarHBondContact O-N 3.05Å; G167-A170 PolarHBondContact O-N 3.4Å; A170-M173 PolarHBondContact O-N 3.45Å; A170-Y174 WeakPolarHBondContact O-CB 3.01Å; A170-Y174 PolarHBondContact O-N 3.38Å
171	H	92.6	Very high	93.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-43.4	-179.5	-59.2	-10.3	0	0	0	111.8	E122 Y125 G167 T175 A203 W204	E122-H171 IonicContact OE1-CE1 2.77Å; E122-H171 PolarHBondContact OE1-CE1 2.65Å; E122-H171 VanDerWaalsContact OE1-CE1 3.25Å; E122-H171 IonicContact OE1-ND1 3.55Å; E122-H171 IonicContact OE2-CE1 2.65Å; E122-H171 PolarHBondContact OE2-CE1 3Å; E122-H171 IonicContact OE2-ND1 3.61Å; E122-H171 PolarHBondContact OE2-ND1 2.94Å; Y125-H171 AromaticContact CE1-CE1 3.83Å; Y125-H171 AromaticContact CE1-NE2 3.98Å; G167-H171 WeakPolarHBondContact O-CB 3.49Å; G167-H171 PolarHBondContact O-CD2 3.33Å; G167-H171 PolarHBondContact O-N 3.39Å; G167-H171 PolarHBondContact O-ND1 3.08Å; H171-T175 WeakPolarHBondContact O-CB 2.89Å; H171-T175 PolarHBondContact O-N 3.11Å; H171-T175 PolarHBondContact O-OG1 2.89Å; H171-A203 PolarHBondContact NE2-O 3.05Å; H171-W204 HydrophobicContact CB-CH2 4.19Å; H171-W204 HydrophobicContact CB-CZ2 3.91Å
172	M	93.5	Very high	93.1	Very high	74 Å²	74	35.8 Å²	35.8	37%	0.365	18%	0.184	S	C	.	.	H	α-helix	trans	-61.9	-50.7	174.8	-69	-79.6	85.1	0	0	110.4	M168 Y174 T175 Q176 W204	M168-M172 HydrophobicContact CE-CG 3.71Å; M168-M172 HydrophobicContact CE-SD 3.83Å; M168-M172 WeakPolarHBondContact O-CB 3.46Å; M168-M172 WeakPolarHBondContact O-CG 3.27Å; M168-M172 PolarHBondContact O-N 2.83Å; M168-M172 VanDerWaalsContact O-N 3.08Å; M168-M172 HydrophobicContact SD-CG 4.34Å; M172-Y174 PolarHBondContact O-N 2.95Å; M172-T175 PolarHBondContact O-N 3.12Å; M172-Q176 VanDerWaalsContact O-CG 3.27Å; M172-Q176 WeakPolarHBondContact O-CG 3.45Å; M172-Q176 PolarHBondContact O-N 3.25Å; M172-W204 HydrophobicContact CE-CH2 3.16Å; M172-W204 HydrophobicContact CE-CZ2 3.15Å; M172-W204 HydrophobicContact CE-CZ3 4.45Å; M172-W204 HydrophobicContact CG-CH2 4.19Å; M172-W204 HydrophobicContact SD-CH2 4.12Å
173	M	93.1	Very high	92.8	Very high	37 Å²	37	35 Å²	35	18%	0.182	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-41.4	-178.6	-170.5	161.9	52.9	0	0	112.2	V114 L117 V169 A170 Q176 V177	V114-M173 HydrophobicContact CG1-CG 3.42Å; V114-M173 VanDerWaalsContact CG1-CG 3.42Å; V114-M173 HydrophobicContact CG1-SD 3.56Å; V114-M173 VanDerWaalsContact CG1-SD 3.56Å; L117-M173 VanDerWaalsContact C-CE 3.43Å; L117-M173 HydrophobicContact CB-CE 3.75Å; L117-M173 HydrophobicContact CB-SD 4.22Å; V169-M173 WeakPolarHBondContact O-CB 3.47Å; V169-M173 PolarHBondContact O-N 3.36Å; A170-M173 PolarHBondContact O-N 3.45Å; M173-Q176 PolarHBondContact O-N 2.83Å; M173-V177 WeakPolarHBondContact O-CG2 3.39Å; M173-V177 PolarHBondContact O-N 3.28Å
174	Y	92.7	Very high	92.5	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-48.2	173.9	-178.5	-107.8	0	0	0	111.4	W32 G84 I85 F103 L115 S118 A170 M172 Q176 V177 F178	W32-Y174 HydrophobicContact CB-CE1 4.26Å; W32-Y174 HydrophobicContact CD2-CD1 4.19Å; W32-Y174 AromaticContact CD2-CE1 3.73Å; W32-Y174 HydrophobicContact CD2-CE1 3.73Å; W32-Y174 AromaticContact CE3-CD1 3.63Å; W32-Y174 HydrophobicContact CE3-CD1 3.63Å; W32-Y174 AromaticContact CE3-CE1 3.53Å; W32-Y174 HydrophobicContact CE3-CE1 3.53Å; W32-Y174 HydrophobicContact CG-CE1 4.07Å; W32-Y174 HydrophobicContact CH2-CD1 4.4Å; W32-Y174 AromaticContact CZ3-CD1 3.75Å; W32-Y174 HydrophobicContact CZ3-CD1 3.75Å; W32-Y174 HydrophobicContact CZ3-CE1 4.13Å; G84-Y174 PolarHBondContact O-OH 2.92Å; G84-Y174 VanDerWaalsContact O-OH 3.05Å; I85-Y174 WeakPolarHBondContact CA-OH 3.47Å; I85-Y174 HydrophobicContact CB-CE2 4.14Å; I85-Y174 HydrophobicContact CG1-CD2 4.16Å; I85-Y174 HydrophobicContact CG1-CE1 4.14Å; I85-Y174 HydrophobicContact CG1-CE2 3.77Å; I85-Y174 HydrophobicContact CG2-CE2 4.3Å; I85-Y174 PolarHBondContact N-OH 2.97Å; F103-Y174 HydrophobicContact CD1-CE2 4.27Å; F103-Y174 HydrophobicContact CE1-CE2 4.01Å; L115-Y174 HydrophobicContact CD1-CD2 4Å; L115-Y174 HydrophobicContact CD1-CE2 4.15Å; S118-Y174 WeakPolarHBondContact OG-CB 3.49Å; S118-Y174 PolarHBondContact OG-N 2.83Å; A170-Y174 WeakPolarHBondContact O-CB 3.01Å; A170-Y174 PolarHBondContact O-N 3.38Å; M172-Y174 PolarHBondContact O-N 2.95Å; Y174-Q176 VanDerWaalsContact C-N 3.3Å; Y174-Q176 PolarHBondContact O-N 3.12Å; Y174-V177 PolarHBondContact O-N 3.4Å; Y174-F178 VanDerWaalsContact O-CB 3.29Å; Y174-F178 WeakPolarHBondContact O-CB 3.31Å; Y174-F178 PolarHBondContact O-N 3.01Å
175	T	92	Very high	92.2	Very high	8 Å²	8	40.8 Å²	40.8	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-41.4	179.5	-53.9	0	0	0	0	111.1	H171 M172 F178 Q179 Y196 F200	H171-T175 WeakPolarHBondContact O-CB 2.89Å; H171-T175 PolarHBondContact O-N 3.11Å; H171-T175 PolarHBondContact O-OG1 2.89Å; M172-T175 PolarHBondContact O-N 3.12Å; T175-F178 WeakPolarHBondContact O-CB 3.38Å; T175-F178 PolarHBondContact O-N 3.12Å; T175-Q179 VanDerWaalsContact O-CG 3.31Å; T175-Q179 WeakPolarHBondContact O-CG 3.44Å; T175-Q179 PolarHBondContact O-N 3.29Å; T175-Y196 HydrophobicContact CG2-CE1 4.14Å; T175-F200 HydrophobicContact CG2-CE2 4.34Å
176	Q	92.9	Very high	91.8	Very high	101 Å²	101	38.4 Å²	38.4	47%	0.472	21%	0.206	S	C	.	.	H	α-helix	trans	-64.1	-49.7	176.5	-66	-53.1	90.1	0	0	111.8	M172 M173 Y174 F178 Q179 I180	M172-Q176 VanDerWaalsContact O-CG 3.27Å; M172-Q176 WeakPolarHBondContact O-CG 3.45Å; M172-Q176 PolarHBondContact O-N 3.25Å; M173-Q176 PolarHBondContact O-N 2.83Å; Y174-Q176 VanDerWaalsContact C-N 3.3Å; Y174-Q176 PolarHBondContact O-N 3.12Å; Q176-F178 PolarHBondContact O-N 2.95Å; Q176-Q179 PolarHBondContact O-N 3.18Å; Q176-I180 WeakPolarHBondContact O-CG1 3.47Å; Q176-I180 PolarHBondContact O-N 3.41Å
177	V	91.9	Very high	91.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-38.3	177.1	173.1	0	0	0	0	110.5	E111 V114 L115 M173 Y174 I180 T181	E111-V177 HydrophobicContact CB-CG1 4.26Å; V114-V177 HydrophobicContact CB-CG2 4Å; V114-V177 HydrophobicContact CG1-CG2 3.61Å; L115-V177 HydrophobicContact CB-CG1 4.15Å; L115-V177 HydrophobicContact CD1-CG1 3.94Å; M173-V177 WeakPolarHBondContact O-CG2 3.39Å; M173-V177 PolarHBondContact O-N 3.28Å; Y174-V177 PolarHBondContact O-N 3.4Å; V177-I180 PolarHBondContact O-N 3.1Å; V177-T181 VanDerWaalsContact O-CB 3.31Å; V177-T181 WeakPolarHBondContact O-CB 3.44Å; V177-T181 PolarHBondContact O-N 2.65Å; V177-T181 PolarHBondContact O-OG1 3.46Å
178	F	91.3	Very high	90.8	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.013	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-47.5	176	-174.3	-96.1	0	0	0	112	C33 T83 F103 Y174 T175 Q176 I180 T181 V182 W189 W194	C33-F178 HydrophobicContact CB-CE1 3.87Å; C33-F178 HydrophobicContact CB-CE2 4.4Å; C33-F178 HydrophobicContact CB-CZ 3.64Å; C33-F178 WeakPolarHBondContact SG-CE1 3.04Å; T83-F178 HydrophobicContact CG2-CD2 4.35Å; T83-F178 HydrophobicContact CG2-CE2 3.28Å; T83-F178 HydrophobicContact CG2-CZ 3.57Å; F103-F178 AromaticContact CE2-CD2 3.66Å; F103-F178 HydrophobicContact CE2-CD2 3.66Å; F103-F178 AromaticContact CE2-CE2 3.84Å; F103-F178 HydrophobicContact CE2-CE2 3.84Å; F103-F178 AromaticContact CZ-CD2 3.56Å; F103-F178 HydrophobicContact CZ-CD2 3.56Å; F103-F178 HydrophobicContact CZ-CE2 4.22Å; Y174-F178 VanDerWaalsContact O-CB 3.29Å; Y174-F178 WeakPolarHBondContact O-CB 3.31Å; Y174-F178 PolarHBondContact O-N 3.01Å; T175-F178 WeakPolarHBondContact O-CB 3.38Å; T175-F178 PolarHBondContact O-N 3.12Å; Q176-F178 PolarHBondContact O-N 2.95Å; F178-I180 VanDerWaalsContact C-N 3.31Å; F178-I180 PolarHBondContact O-N 2.93Å; F178-T181 CarbonylContact O-C 3Å; F178-T181 WeakPolarHBondContact O-CB 3.27Å; F178-T181 PolarHBondContact O-N 3.29Å; F178-T181 VanDerWaalsContact O-N 3.11Å; F178-V182 HydrophobicContact CD1-CG2 4.01Å; F178-V182 HydrophobicContact CE1-CG2 3.47Å; F178-V182 VanDerWaalsContact CE1-CG2 3.47Å; F178-V182 HydrophobicContact CE2-CG2 4.24Å; F178-V182 HydrophobicContact CZ-CG2 3.59Å; F178-V182 WeakPolarHBondContact O-CG2 3.49Å; F178-V182 PolarHBondContact O-N 3.42Å; F178-W189 AromaticContact CE2-CH2 3.84Å; F178-W189 HydrophobicContact CE2-CH2 3.84Å; F178-W189 HydrophobicContact CE2-CZ2 4.32Å; F178-W189 HydrophobicContact CZ-CH2 4.19Å; F178-W194 HydrophobicContact CD1-CH2 4.43Å; F178-W194 HydrophobicContact CD1-CZ3 4.3Å; F178-W194 HydrophobicContact CE1-CD2 4.23Å; F178-W194 AromaticContact CE1-CE3 3.86Å; F178-W194 HydrophobicContact CE1-CE3 3.86Å; F178-W194 HydrophobicContact CE1-CH2 4.31Å; F178-W194 AromaticContact CE1-CZ3 3.9Å; F178-W194 HydrophobicContact CE1-CZ3 3.9Å
179	Q	92.3	Very high	90.4	Very high	72 Å²	72	45.3 Å²	45.3	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-60.2	-40.7	176.2	-72.3	174.4	4.1	0	0	112.3	T175 Q176 V182 S183 W194	T175-Q179 VanDerWaalsContact O-CG 3.31Å; T175-Q179 WeakPolarHBondContact O-CG 3.44Å; T175-Q179 PolarHBondContact O-N 3.29Å; Q176-Q179 PolarHBondContact O-N 3.18Å; Q179-V182 PolarHBondContact O-N 2.86Å; Q179-S183 PolarHBondContact O-N 3.05Å; Q179-S183 VanDerWaalsContact O-N 3.12Å; Q179-S183 PolarHBondContact O-OG 3.32Å; Q179-W194 HydrophobicContact CG-CH2 4.44Å
180	I	91.9	Very high	90.1	Very high	51 Å²	51	46.8 Å²	46.8	26%	0.262	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-42	174.7	-63.1	167.3	0	0	0	110.2	P108 E111 Q176 V177 F178 V182 S183 L184	P108-I180 HydrophobicContact CG-CG2 4.07Å; E111-I180 HydrophobicContact CG-CD1 4.26Å; E111-I180 HydrophobicContact CG-CG2 3.92Å; Q176-I180 WeakPolarHBondContact O-CG1 3.47Å; Q176-I180 PolarHBondContact O-N 3.41Å; V177-I180 PolarHBondContact O-N 3.1Å; F178-I180 VanDerWaalsContact C-N 3.31Å; F178-I180 PolarHBondContact O-N 2.93Å; I180-V182 VanDerWaalsContact C-N 3.33Å; I180-V182 PolarHBondContact O-N 3.28Å; I180-S183 WeakPolarHBondContact CA-OG 3.43Å; I180-S183 PolarHBondContact O-N 2.76Å; I180-S183 PolarHBondContact O-OG 3.3Å; I180-S183 VanDerWaalsContact O-OG 3.05Å; I180-L184 HydrophobicContact CG2-CD1 3.96Å; I180-L184 HydrophobicContact CG2-CG 4.46Å; I180-L184 WeakPolarHBondContact O-CB 3.23Å; I180-L184 PolarHBondContact O-N 3.33Å
181	T	90.6	Very high	89.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-36.1	178.4	-56.5	0	0	0	0	111.6	F103 L106 V177 F178 G185 W189	F103-T181 HydrophobicContact CE2-CG2 4.02Å; F103-T181 HydrophobicContact CZ-CG2 3.97Å; L106-T181 HydrophobicContact CB-CG2 4.16Å; V177-T181 VanDerWaalsContact O-CB 3.31Å; V177-T181 WeakPolarHBondContact O-CB 3.44Å; V177-T181 PolarHBondContact O-N 2.65Å; V177-T181 PolarHBondContact O-OG1 3.46Å; F178-T181 CarbonylContact O-C 3Å; F178-T181 WeakPolarHBondContact O-CB 3.27Å; F178-T181 PolarHBondContact O-N 3.29Å; F178-T181 VanDerWaalsContact O-N 3.11Å; T181-G185 WeakPolarHBondContact O-CA 3.47Å; T181-G185 PolarHBondContact O-N 2.83Å; T181-W189 HydrophobicContact CG2-CE3 4.35Å; T181-W189 HydrophobicContact CG2-CH2 4.15Å; T181-W189 HydrophobicContact CG2-CZ3 3.73Å
182	V	90.6	Very high	89.6	Confident	16 Å²	16	52.8 Å²	52.8	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-37	175.1	165.8	0	0	0	0	112.2	F178 Q179 I180 W189 P191	F178-V182 HydrophobicContact CD1-CG2 4.01Å; F178-V182 HydrophobicContact CE1-CG2 3.47Å; F178-V182 VanDerWaalsContact CE1-CG2 3.47Å; F178-V182 HydrophobicContact CE2-CG2 4.24Å; F178-V182 HydrophobicContact CZ-CG2 3.59Å; F178-V182 WeakPolarHBondContact O-CG2 3.49Å; F178-V182 PolarHBondContact O-N 3.42Å; Q179-V182 PolarHBondContact O-N 2.86Å; I180-V182 VanDerWaalsContact C-N 3.33Å; I180-V182 PolarHBondContact O-N 3.28Å; V182-W189 HydrophobicContact CG2-CH2 3.95Å; V182-W189 HydrophobicContact CG2-CZ3 3.94Å; V182-P191 HydrophobicContact CB-CG 4.2Å; V182-P191 HydrophobicContact CG1-CG 3.45Å; V182-P191 VanDerWaalsContact CG1-CG 3.45Å; V182-P191 HydrophobicContact CG2-CG 3.93Å
183	S	89.7	Confident	89.4	Confident	63 Å²	63	52 Å²	52	44%	0.441	27%	0.266	S	S	.	.	H	α-helix	trans	-84.8	-36.9	-177.1	53.1	0	0	0	0	113.9	Q179 I180 R190	Q179-S183 PolarHBondContact O-N 3.05Å; Q179-S183 VanDerWaalsContact O-N 3.12Å; Q179-S183 PolarHBondContact O-OG 3.32Å; I180-S183 WeakPolarHBondContact CA-OG 3.43Å; I180-S183 PolarHBondContact O-N 2.76Å; I180-S183 PolarHBondContact O-OG 3.3Å; I180-S183 VanDerWaalsContact O-OG 3.05Å; S183-R190 PolarHBondContact O-NH1 3.3Å; S183-R190 PolarHBondContact O-NH2 3.34Å
184	L	89.6	Confident	89.4	Confident	118 Å²	118	53.4 Å²	53.4	62%	0.618	27%	0.27	S	S	*	.	H	α-helix	trans	-112.6	-2	-175	-58.5	-178	0	0	0	113.6	I180	I180-L184 HydrophobicContact CG2-CD1 3.96Å; I180-L184 HydrophobicContact CG2-CG 4.46Å; I180-L184 WeakPolarHBondContact O-CB 3.23Å; I180-L184 PolarHBondContact O-N 3.33Å
185	G	85.8	Confident	89.4	Confident	3 Å²	3	59.2 Å²	59.2	3%	0.031	30%	0.301	C	S	.	.	S	Bend	trans	-63.8	171.4	177.3	0	0	0	0	0	113.1	T181 R190	T181-G185 WeakPolarHBondContact O-CA 3.47Å; T181-G185 PolarHBondContact O-N 2.83Å; G185-R190 PolarHBondContact O-NH2 3.29Å
186	P	87.4	Confident	89.5	Confident	49 Å²	49	63.4 Å²	63.4	32%	0.318	32%	0.317	S	S	.	.			trans	-66	147.9	-172.7	32.2	-37.5	0	0	0	111	L106 D188 W189 R190	L106-P186 HydrophobicContact CD2-CG 3.95Å; P186-D188 VanDerWaalsContact CB-OD1 3.3Å; P186-D188 WeakPolarHBondContact CB-OD1 3.43Å; P186-D188 PolarHBondContact O-N 2.83Å; P186-D188 VanDerWaalsContact O-N 3.16Å; P186-W189 HydrophobicContact CG-CB 3.99Å; P186-W189 PolarHBondContact O-N 3.13Å; P186-R190 PolarHBondContact O-N 3.42Å
187	E	84.3	Confident	89.6	Confident	177 Å²	177	58.9 Å²	58.9	83%	0.827	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.3	-172.4	-63.5	-170.9	164.7	0	0	112.8	W189	E187-W189 VanDerWaalsContact C-N 3.29Å; E187-W189 PolarHBondContact O-N 2.87Å
188	D	82.9	Confident	89.7	Confident	93 Å²	93	64.4 Å²	64.4	50%	0.497	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-2.3	178.7	73.5	-60.8	0	0	0	114.1	Q37 R101 P186	Q37-D188 PolarHBondContact NE2-O 2.95Å; R101-D188 IonicContact CZ-OD2 3.08Å; R101-D188 IonicContact NH1-OD2 3.19Å; R101-D188 PolarHBondContact NH1-OD2 3.01Å; R101-D188 PolarHBondContact NH2-O 3.32Å; R101-D188 VanDerWaalsContact NH2-O 3.09Å; R101-D188 IonicContact NH2-OD2 3.25Å; P186-D188 VanDerWaalsContact CB-OD1 3.3Å; P186-D188 WeakPolarHBondContact CB-OD1 3.43Å; P186-D188 PolarHBondContact O-N 2.83Å; P186-D188 VanDerWaalsContact O-N 3.16Å
189	W	85.4	Confident	89.9	Confident	1 Å²	1	64.2 Å²	64.2	0%	0.004	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-25.1	171.9	-174.2	76.1	0	0	0	113.7	Q37 F81 S88 R101 F103 L106 F178 T181 V182 P186 E187 P191	Q37-W189 VanDerWaalsContact NE2-C 3.28Å; Q37-W189 VanDerWaalsContact NE2-CA 3.27Å; F81-W189 HydrophobicContact CE2-CZ2 4.4Å; S88-W189 PolarHBondContact OG-NE1 3.06Å; R101-W189 VanDerWaalsContact CZ-CD1 3.49Å; R101-W189 VanDerWaalsContact NH2-CD1 3.32Å; F103-W189 HydrophobicContact CE2-CH2 4.02Å; F103-W189 HydrophobicContact CE2-CZ2 4.18Å; L106-W189 HydrophobicContact CD1-CD2 4.06Å; L106-W189 HydrophobicContact CD1-CG 4.11Å; L106-W189 HydrophobicContact CD1-CZ2 4.19Å; L106-W189 HydrophobicContact CD2-CB 3.39Å; L106-W189 VanDerWaalsContact CD2-CD1 3.5Å; L106-W189 HydrophobicContact CD2-CD2 3.63Å; L106-W189 HydrophobicContact CD2-CE3 4.31Å; L106-W189 HydrophobicContact CD2-CG 3.17Å; L106-W189 HydrophobicContact CG-CD2 4.29Å; L106-W189 HydrophobicContact CG-CG 4.2Å; F178-W189 AromaticContact CE2-CH2 3.84Å; F178-W189 HydrophobicContact CE2-CH2 3.84Å; F178-W189 HydrophobicContact CE2-CZ2 4.32Å; F178-W189 HydrophobicContact CZ-CH2 4.19Å; T181-W189 HydrophobicContact CG2-CE3 4.35Å; T181-W189 HydrophobicContact CG2-CH2 4.15Å; T181-W189 HydrophobicContact CG2-CZ3 3.73Å; V182-W189 HydrophobicContact CG2-CH2 3.95Å; V182-W189 HydrophobicContact CG2-CZ3 3.94Å; P186-W189 HydrophobicContact CG-CB 3.99Å; P186-W189 PolarHBondContact O-N 3.13Å; E187-W189 VanDerWaalsContact C-N 3.29Å; E187-W189 PolarHBondContact O-N 2.87Å; W189-P191 WeakPolarHBondContact O-CD 3.33Å; W189-P191 VanDerWaalsContact O-N 3.09Å
190	R	88.1	Confident	90	Very high	113 Å²	113	62.4 Å²	62.4	43%	0.426	31%	0.308	S	S	.	.			trans	-48.4	117.2	-173.6	-173.2	172.7	-59.5	-163.1	1.5	112	S183 G185 P186	S183-R190 PolarHBondContact O-NH1 3.3Å; S183-R190 PolarHBondContact O-NH2 3.34Å; G185-R190 PolarHBondContact O-NH2 3.29Å; P186-R190 PolarHBondContact O-N 3.42Å
191	P	89	Confident	90.1	Very high	15 Å²	15	63.9 Å²	63.9	10%	0.097	32%	0.322	C	S	.	.			trans	-75.6	149.8	-175.7	32	-37.1	0	0	0	111.7	F81 V182 W189 W194	F81-P191 HydrophobicContact CE1-CB 3.39Å; F81-P191 HydrophobicContact CZ-CB 3.4Å; F81-P191 VanDerWaalsContact CZ-CB 3.4Å; F81-P191 HydrophobicContact CZ-CG 4.12Å; V182-P191 HydrophobicContact CB-CG 4.2Å; V182-P191 HydrophobicContact CG1-CG 3.45Å; V182-P191 VanDerWaalsContact CG1-CG 3.45Å; V182-P191 HydrophobicContact CG2-CG 3.93Å; W189-P191 WeakPolarHBondContact O-CD 3.33Å; W189-P191 VanDerWaalsContact O-N 3.09Å; P191-W194 HydrophobicContact CB-CB 4.39Å; P191-W194 HydrophobicContact CG-CG 4.41Å
192	H	87.5	Confident	90.4	Very high	111 Å²	111	65.5 Å²	65.5	51%	0.514	33%	0.33	S	S	.	.	S	Bend	trans	-86.1	-45.6	175.6	175	-88.5	0	0	0	111.1	T36 R38 F78	T36-H192 PolarHBondContact O-N 2.95Å; R38-H192 HydrophobicContact CB-CB 4.06Å; F78-H192 AromaticContact CE1-ND1 3.85Å
193	S	88.9	Confident	90.6	Very high	56 Å²	56	64.7 Å²	64.7	39%	0.392	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.2	170.4	60.2	0	0	0	0	109	G35 T36	G35-S193 CarbonylContact C-O 3.57Å; G35-S193 VanDerWaalsContact CA-O 3.22Å; G35-S193 WeakPolarHBondContact CA-O 3.48Å; T36-S193 PolarHBondContact N-O 3.49Å; T36-S193 PolarHBondContact O-N 3.4Å; T36-S193 PolarHBondContact OG1-OG 2.91Å
194	W	92.3	Very high	90.9	Very high	68 Å²	68	64.4 Å²	64.4	26%	0.258	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	148.5	179.2	66.4	-84.4	0	0	0	109.7	C33 E34 F81 F178 Q179 P191 Y196	C33-W194 HydrophobicContact CB-CE3 4.37Å; E34-W194 WeakPolarHBondContact O-CA 3.45Å; F81-W194 HydrophobicContact CZ-CB 4.2Å; F178-W194 HydrophobicContact CD1-CH2 4.43Å; F178-W194 HydrophobicContact CD1-CZ3 4.3Å; F178-W194 HydrophobicContact CE1-CD2 4.23Å; F178-W194 AromaticContact CE1-CE3 3.86Å; F178-W194 HydrophobicContact CE1-CE3 3.86Å; F178-W194 HydrophobicContact CE1-CH2 4.31Å; F178-W194 AromaticContact CE1-CZ3 3.9Å; F178-W194 HydrophobicContact CE1-CZ3 3.9Å; Q179-W194 HydrophobicContact CG-CH2 4.44Å; P191-W194 HydrophobicContact CB-CB 4.39Å; P191-W194 HydrophobicContact CG-CG 4.41Å; W194-Y196 HydrophobicContact CH2-CE1 4.15Å; W194-Y196 AromaticContact CH2-CZ 3.94Å; W194-Y196 HydrophobicContact CZ3-CD1 4.12Å; W194-Y196 AromaticContact CZ3-CE1 3.75Å; W194-Y196 HydrophobicContact CZ3-CE1 3.75Å; W194-Y196 HydrophobicContact CZ3-CE2 4.3Å; W194-Y196 AromaticContact CZ3-CZ 3.85Å
195	D	93.5	Very high	91.2	Very high	124 Å²	124	59.9 Å²	59.9	66%	0.663	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	160.1	176.5	-70.3	-58.9	0	0	0	109.7	C33 E34	C33-D195 VanDerWaalsContact CA-O 3.32Å; C33-D195 WeakPolarHBondContact CA-O 3.43Å; E34-D195 PolarHBondContact N-O 2.78Å; E34-D195 PolarHBondContact O-N 2.99Å
196	Y	93.8	Very high	91.7	Very high	97 Å²	97	59.8 Å²	59.8	38%	0.38	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	131.5	173.1	-60.8	-75.1	0	0	0	110.1	T175 W194 F200	T175-Y196 HydrophobicContact CG2-CE1 4.14Å; W194-Y196 HydrophobicContact CH2-CE1 4.15Å; W194-Y196 AromaticContact CH2-CZ 3.94Å; W194-Y196 HydrophobicContact CZ3-CD1 4.12Å; W194-Y196 AromaticContact CZ3-CE1 3.75Å; W194-Y196 HydrophobicContact CZ3-CE1 3.75Å; W194-Y196 HydrophobicContact CZ3-CE2 4.3Å; W194-Y196 AromaticContact CZ3-CZ 3.85Å; Y196-F200 HydrophobicContact CD1-CB 4.44Å; Y196-F200 AromaticContact CD1-CD1 3.86Å; Y196-F200 HydrophobicContact CD1-CD1 3.86Å; Y196-F200 AromaticContact CD1-CD2 3.62Å; Y196-F200 HydrophobicContact CD1-CD2 3.62Å; Y196-F200 AromaticContact CD1-CE1 3.87Å; Y196-F200 HydrophobicContact CD1-CE1 3.87Å; Y196-F200 AromaticContact CD1-CE2 3.62Å; Y196-F200 HydrophobicContact CD1-CE2 3.62Å; Y196-F200 AromaticContact CD1-CG 3.73Å; Y196-F200 HydrophobicContact CD1-CG 3.73Å; Y196-F200 AromaticContact CD1-CZ 3.72Å; Y196-F200 HydrophobicContact CD1-CZ 3.72Å; Y196-F200 HydrophobicContact CD2-CE1 4.33Å; Y196-F200 HydrophobicContact CE1-CD2 4.12Å; Y196-F200 HydrophobicContact CE1-CE1 4.31Å; Y196-F200 AromaticContact CE1-CE2 3.67Å; Y196-F200 HydrophobicContact CE1-CE2 3.67Å; Y196-F200 AromaticContact CE1-CZ 3.76Å; Y196-F200 HydrophobicContact CE1-CZ 3.76Å; Y196-F200 AromaticContact CG-CD1 3.82Å; Y196-F200 HydrophobicContact CG-CD1 3.82Å; Y196-F200 HydrophobicContact CG-CD2 4.41Å; Y196-F200 AromaticContact CG-CE1 3.87Å; Y196-F200 HydrophobicContact CG-CE1 3.87Å; Y196-F200 HydrophobicContact CG-CE2 4.45Å; Y196-F200 HydrophobicContact CG-CG 4.09Å; Y196-F200 HydrophobicContact CG-CZ 4.17Å
197	G	93.9	Very high	92	Very high	5 Å²	5	59.1 Å²	59.1	5%	0.052	29%	0.287	C	S	.	.			trans	-82.5	175.9	177.7	0	0	0	0	0	112.7	Y31 W32 S199 F200	Y31-G197 CarbonylContact O-C 3.55Å; Y31-G197 WeakPolarHBondContact O-CA 3.08Å; W32-G197 PolarHBondContact O-N 3.43Å; G197-S199 PolarHBondContact O-N 2.91Å; G197-S199 VanDerWaalsContact O-N 3.17Å; G197-F200 WeakPolarHBondContact O-CB 3.07Å; G197-F200 PolarHBondContact O-N 3.4Å
198	W	94.9	Very high	92.6	Very high	117 Å²	117	54.8 Å²	54.8	44%	0.443	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-27.6	-179.6	59.8	-86.5	0	0	0	113.1	T25 T29 Y31 C201 M202	T25-W198 HydrophobicContact CG2-CH2 4.1Å; T25-W198 HydrophobicContact CG2-CZ3 4.01Å; T29-W198 HydrophobicContact CG2-CH2 4.31Å; T29-W198 HydrophobicContact CG2-CZ2 4.49Å; T29-W198 WeakPolarHBondContact OG1-CH2 3.43Å; T29-W198 WeakPolarHBondContact OG1-CZ2 3.43Å; Y31-W198 AromaticContact CD2-CZ2 3.82Å; Y31-W198 HydrophobicContact CD2-CZ2 3.82Å; Y31-W198 AromaticContact CD2-NE1 3.71Å; Y31-W198 HydrophobicContact CG-CZ2 4.27Å; Y31-W198 AromaticContact CG-NE1 3.35Å; Y31-W198 VanDerWaalsContact CG-NE1 3.35Å; W198-C201 WeakPolarHBondContact O-CB 3.4Å; W198-C201 PolarHBondContact O-N 2.68Å; W198-M202 HydrophobicContact CE3-CE 3.34Å; W198-M202 HydrophobicContact CE3-CG 4.35Å; W198-M202 HydrophobicContact CE3-SD 3.73Å; W198-M202 HydrophobicContact CH2-CE 3.97Å; W198-M202 HydrophobicContact CZ3-CE 3Å; W198-M202 HydrophobicContact CZ3-SD 3.6Å; W198-M202 PolarHBondContact O-N 2.9Å
199	S	95.1	Very high	93.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72	-33.1	-177.9	-44.3	0	0	0	0	112.8	A26 T29 Y31 G197 M202 A203	A26-S199 WeakPolarHBondContact CB-O 3.47Å; T29-S199 WeakPolarHBondContact CG2-OG 3.34Å; T29-S199 PolarHBondContact OG1-OG 3.39Å; Y31-S199 VanDerWaalsContact C-OG 3.25Å; Y31-S199 WeakPolarHBondContact CB-OG 3.37Å; Y31-S199 WeakPolarHBondContact O-CB 3.49Å; Y31-S199 PolarHBondContact O-N 3.44Å; Y31-S199 PolarHBondContact O-OG 2.93Å; G197-S199 PolarHBondContact O-N 2.91Å; G197-S199 VanDerWaalsContact O-N 3.17Å; S199-M202 PolarHBondContact O-N 3.2Å; S199-A203 PolarHBondContact O-N 2.87Å
200	F	94.2	Very high	93.7	Very high	33 Å²	33	51.5 Å²	51.5	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-47.3	171	177.5	-94.6	0	0	0	110.4	W32 T175 Y196 G197 M202 A203 W204	W32-F200 HydrophobicContact CE3-CB 4.27Å; W32-F200 AromaticContact CE3-CD2 3.94Å; W32-F200 HydrophobicContact CE3-CD2 3.94Å; W32-F200 HydrophobicContact CZ3-CD2 4Å; W32-F200 WeakPolarHBondContact O-CB 3.25Å; T175-F200 HydrophobicContact CG2-CE2 4.34Å; Y196-F200 HydrophobicContact CD1-CB 4.44Å; Y196-F200 AromaticContact CD1-CD1 3.86Å; Y196-F200 HydrophobicContact CD1-CD1 3.86Å; Y196-F200 AromaticContact CD1-CD2 3.62Å; Y196-F200 HydrophobicContact CD1-CD2 3.62Å; Y196-F200 AromaticContact CD1-CE1 3.87Å; Y196-F200 HydrophobicContact CD1-CE1 3.87Å; Y196-F200 AromaticContact CD1-CE2 3.62Å; Y196-F200 HydrophobicContact CD1-CE2 3.62Å; Y196-F200 AromaticContact CD1-CG 3.73Å; Y196-F200 HydrophobicContact CD1-CG 3.73Å; Y196-F200 AromaticContact CD1-CZ 3.72Å; Y196-F200 HydrophobicContact CD1-CZ 3.72Å; Y196-F200 HydrophobicContact CD2-CE1 4.33Å; Y196-F200 HydrophobicContact CE1-CD2 4.12Å; Y196-F200 HydrophobicContact CE1-CE1 4.31Å; Y196-F200 AromaticContact CE1-CE2 3.67Å; Y196-F200 HydrophobicContact CE1-CE2 3.67Å; Y196-F200 AromaticContact CE1-CZ 3.76Å; Y196-F200 HydrophobicContact CE1-CZ 3.76Å; Y196-F200 AromaticContact CG-CD1 3.82Å; Y196-F200 HydrophobicContact CG-CD1 3.82Å; Y196-F200 HydrophobicContact CG-CD2 4.41Å; Y196-F200 AromaticContact CG-CE1 3.87Å; Y196-F200 HydrophobicContact CG-CE1 3.87Å; Y196-F200 HydrophobicContact CG-CE2 4.45Å; Y196-F200 HydrophobicContact CG-CG 4.09Å; Y196-F200 HydrophobicContact CG-CZ 4.17Å; G197-F200 WeakPolarHBondContact O-CB 3.07Å; G197-F200 PolarHBondContact O-N 3.4Å; F200-M202 VanDerWaalsContact C-N 3.28Å; F200-M202 PolarHBondContact O-N 3.07Å; F200-A203 WeakPolarHBondContact O-CB 3.24Å; F200-A203 PolarHBondContact O-N 3.42Å; F200-A203 VanDerWaalsContact O-N 3.12Å; F200-W204 AromaticContact CD1-CD1 3.66Å; F200-W204 AromaticContact CD1-NE1 3.95Å; F200-W204 AromaticContact CD2-NE1 3.75Å; F200-W204 AromaticContact CE1-CD1 3.41Å; F200-W204 VanDerWaalsContact CE1-CD1 3.41Å; F200-W204 AromaticContact CE1-NE1 3.39Å; F200-W204 AromaticContact CE2-CD1 3.88Å; F200-W204 AromaticContact CE2-NE1 3.16Å; F200-W204 AromaticContact CZ-CD1 3.55Å; F200-W204 AromaticContact CZ-NE1 2.97Å; F200-W204 PolarHBondContact O-N 2.91Å; F200-W204 VanDerWaalsContact O-N 3.13Å
201	C	95.3	Very high	94	Very high	83 Å²	83	49.3 Å²	49.3	56%	0.561	25%	0.253	S	S	*	.	H	α-helix	trans	-59.3	-39.3	176	-64.2	0	0	0	0	112.3	W198 G205	W198-C201 WeakPolarHBondContact O-CB 3.4Å; W198-C201 PolarHBondContact O-N 2.68Å; C201-G205 PolarHBondContact O-N 3.01Å
202	M	95.4	Very high	94.2	Very high	33 Å²	33	50.4 Å²	50.4	16%	0.163	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-37.1	174.7	-70.8	-165.7	-49.1	0	0	113.2	F22 T25 A26 W198 S199 F200 G205 S206	F22-M202 HydrophobicContact CB-CB 4.27Å; F22-M202 HydrophobicContact CD1-SD 4.32Å; T25-M202 HydrophobicContact CG2-CE 3.57Å; T25-M202 HydrophobicContact CG2-SD 4.25Å; A26-M202 HydrophobicContact CB-CB 4.42Å; A26-M202 HydrophobicContact CB-CE 4.38Å; W198-M202 HydrophobicContact CE3-CE 3.34Å; W198-M202 HydrophobicContact CE3-CG 4.35Å; W198-M202 HydrophobicContact CE3-SD 3.73Å; W198-M202 HydrophobicContact CH2-CE 3.97Å; W198-M202 HydrophobicContact CZ3-CE 3Å; W198-M202 HydrophobicContact CZ3-SD 3.6Å; W198-M202 PolarHBondContact O-N 2.9Å; S199-M202 PolarHBondContact O-N 3.2Å; F200-M202 VanDerWaalsContact C-N 3.28Å; F200-M202 PolarHBondContact O-N 3.07Å; M202-G205 PolarHBondContact O-N 2.99Å; M202-S206 WeakPolarHBondContact O-CB 3.35Å; M202-S206 PolarHBondContact O-N 2.04Å
203	A	95.2	Very high	94.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-49	175.5	0	0	0	0	0	111	A26 W32 H171 S199 F200 G205 S206 F207	A26-A203 HydrophobicContact CB-CB 4.03Å; W32-A203 HydrophobicContact CH2-CB 3.36Å; W32-A203 HydrophobicContact CZ2-CB 3.82Å; W32-A203 HydrophobicContact CZ3-CB 4.03Å; H171-A203 PolarHBondContact NE2-O 3.05Å; S199-A203 PolarHBondContact O-N 2.87Å; F200-A203 WeakPolarHBondContact O-CB 3.24Å; F200-A203 PolarHBondContact O-N 3.42Å; F200-A203 VanDerWaalsContact O-N 3.12Å; A203-G205 PolarHBondContact O-N 3.4Å; A203-S206 VanDerWaalsContact O-CB 3.31Å; A203-S206 WeakPolarHBondContact O-CB 3.2Å; A203-S206 PolarHBondContact O-N 3.35Å; A203-F207 PolarHBondContact O-N 2.88Å
204	W	95.4	Very high	94.6	Very high	56 Å²	56	42.7 Å²	42.7	21%	0.212	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-36.8	174.8	-71.5	105.1	0	0	0	113.6	M168 H171 M172 F200 S206 F207 T208	M168-W204 HydrophobicContact CE-CH2 4.13Å; M168-W204 HydrophobicContact CE-CZ3 4.18Å; M168-W204 HydrophobicContact SD-CH2 3.92Å; M168-W204 HydrophobicContact SD-CZ3 3.65Å; H171-W204 HydrophobicContact CB-CH2 4.19Å; H171-W204 HydrophobicContact CB-CZ2 3.91Å; M172-W204 HydrophobicContact CE-CH2 3.16Å; M172-W204 HydrophobicContact CE-CZ2 3.15Å; M172-W204 HydrophobicContact CE-CZ3 4.45Å; M172-W204 HydrophobicContact CG-CH2 4.19Å; M172-W204 HydrophobicContact SD-CH2 4.12Å; F200-W204 AromaticContact CD1-CD1 3.66Å; F200-W204 AromaticContact CD1-NE1 3.95Å; F200-W204 AromaticContact CD2-NE1 3.75Å; F200-W204 AromaticContact CE1-CD1 3.41Å; F200-W204 VanDerWaalsContact CE1-CD1 3.41Å; F200-W204 AromaticContact CE1-NE1 3.39Å; F200-W204 AromaticContact CE2-CD1 3.88Å; F200-W204 AromaticContact CE2-NE1 3.16Å; F200-W204 AromaticContact CZ-CD1 3.55Å; F200-W204 AromaticContact CZ-NE1 2.97Å; F200-W204 PolarHBondContact O-N 2.91Å; F200-W204 VanDerWaalsContact O-N 3.13Å; W204-S206 VanDerWaalsContact C-N 3.33Å; W204-F207 HydrophobicContact CE3-CD1 4.17Å; W204-F207 HydrophobicContact CZ3-CD1 4.29Å; W204-F207 PolarHBondContact O-N 2.78Å; W204-T208 WeakPolarHBondContact O-CB 3.43Å; W204-T208 PolarHBondContact O-N 3.41Å; W204-T208 PolarHBondContact O-OG1 2.85Å
205	G	96.2	Very high	94.6	Very high	24 Å²	24	43 Å²	43	25%	0.247	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-45.3	171.4	0	0	0	0	0	111.3	C201 M202 A203 T208 C209	C201-G205 PolarHBondContact O-N 3.01Å; M202-G205 PolarHBondContact O-N 2.99Å; A203-G205 PolarHBondContact O-N 3.4Å; G205-T208 PolarHBondContact O-N 3.28Å; G205-C209 WeakPolarHBondContact O-CB 3.3Å; G205-C209 PolarHBondContact O-N 2.96Å; G205-C209 PolarHBondContact O-SG 2.87Å; G205-C209 VanDerWaalsContact O-SG 3.32Å
206	S	96.6	Very high	94.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-49.2	175.7	-175.7	0	0	0	0	111.9	A19 S23 Y125 M202 A203 W204 T208 C209 C210	A19-S206 VanDerWaalsContact C-OG 3.28Å; A19-S206 WeakPolarHBondContact CA-OG 3.37Å; A19-S206 WeakPolarHBondContact CB-O 3.31Å; A19-S206 PolarHBondContact O-OG 3.24Å; S23-S206 VanDerWaalsContact CB-OG 3.27Å; S23-S206 WeakPolarHBondContact CB-OG 3.41Å; Y125-S206 VanDerWaalsContact OH-C 3.31Å; Y125-S206 WeakPolarHBondContact OH-CB 3.14Å; Y125-S206 PolarHBondContact OH-O 2.8Å; Y125-S206 PolarHBondContact OH-OG 3.08Å; M202-S206 WeakPolarHBondContact O-CB 3.35Å; M202-S206 PolarHBondContact O-N 2.04Å; A203-S206 VanDerWaalsContact O-CB 3.31Å; A203-S206 WeakPolarHBondContact O-CB 3.2Å; A203-S206 PolarHBondContact O-N 3.35Å; W204-S206 VanDerWaalsContact C-N 3.33Å; S206-T208 VanDerWaalsContact C-N 3.27Å; S206-T208 PolarHBondContact O-N 3.4Å; S206-C209 PolarHBondContact O-N 3.42Å; S206-C210 VanDerWaalsContact O-CB 3.29Å; S206-C210 WeakPolarHBondContact O-CB 3.4Å; S206-C210 PolarHBondContact O-N 3.32Å
207	F	94.9	Very high	94.1	Very high	35 Å²	35	33.8 Å²	33.8	15%	0.154	19%	0.189	C	C	.	.	H	α-helix	trans	-55.8	-45.7	176.7	167.6	-103.6	0	0	0	111.1	Y125 G164 M168 A203 W204 C210 M211	Y125-F207 PolarHBondContact OH-N 3.5Å; G164-F207 VanDerWaalsContact O-CE2 3.25Å; G164-F207 WeakPolarHBondContact O-CE2 3.25Å; M168-F207 HydrophobicContact CB-CD2 4.24Å; M168-F207 HydrophobicContact CB-CE2 3.66Å; M168-F207 HydrophobicContact CB-CZ 4.07Å; M168-F207 HydrophobicContact CG-CE2 4.39Å; M168-F207 HydrophobicContact CG-CZ 4.31Å; M168-F207 HydrophobicContact SD-CE1 4.02Å; M168-F207 HydrophobicContact SD-CE2 4.29Å; M168-F207 HydrophobicContact SD-CZ 3.85Å; A203-F207 PolarHBondContact O-N 2.88Å; W204-F207 HydrophobicContact CE3-CD1 4.17Å; W204-F207 HydrophobicContact CZ3-CD1 4.29Å; W204-F207 PolarHBondContact O-N 2.78Å; F207-C210 WeakPolarHBondContact O-CB 3.44Å; F207-C210 PolarHBondContact O-N 3Å; F207-M211 HydrophobicContact CD2-CG 4.14Å; F207-M211 HydrophobicContact CE1-CG 4.19Å; F207-M211 HydrophobicContact CE2-CG 3.6Å; F207-M211 HydrophobicContact CE2-SD 4.1Å; F207-M211 HydrophobicContact CZ-CG 3.65Å; F207-M211 HydrophobicContact CZ-SD 4.37Å; F207-M211 WeakPolarHBondContact O-CG 3.33Å; F207-M211 PolarHBondContact O-N 3.2Å
208	T	96.3	Very high	93.8	Very high	86 Å²	86	36.9 Å²	36.9	53%	0.528	20%	0.204	S	C	.	.	H	α-helix	trans	-63.1	-46.3	178.1	-56.4	0	0	0	0	111.6	W204 G205 S206 C210 M211 A212	W204-T208 WeakPolarHBondContact O-CB 3.43Å; W204-T208 PolarHBondContact O-N 3.41Å; W204-T208 PolarHBondContact O-OG1 2.85Å; G205-T208 PolarHBondContact O-N 3.28Å; S206-T208 VanDerWaalsContact C-N 3.27Å; S206-T208 PolarHBondContact O-N 3.4Å; T208-C210 VanDerWaalsContact C-N 3.32Å; T208-C210 PolarHBondContact O-N 3.23Å; T208-M211 PolarHBondContact O-N 2.78Å; T208-A212 WeakPolarHBondContact O-CB 3.49Å; T208-A212 PolarHBondContact O-N 3.19Å
209	C	95.9	Very high	93.4	Very high	25 Å²	25	35.3 Å²	35.3	17%	0.169	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-40.6	175.7	-73.3	0	0	0	0	111.8	A19 G205 S206 A212 A213	A19-C209 HydrophobicContact CB-CB 3.86Å; G205-C209 WeakPolarHBondContact O-CB 3.3Å; G205-C209 PolarHBondContact O-N 2.96Å; G205-C209 PolarHBondContact O-SG 2.87Å; G205-C209 VanDerWaalsContact O-SG 3.32Å; S206-C209 PolarHBondContact O-N 3.42Å; C209-A212 PolarHBondContact O-N 3.34Å; C209-A213 VanDerWaalsContact O-CB 3.27Å; C209-A213 WeakPolarHBondContact O-CB 3.17Å; C209-A213 PolarHBondContact O-N 3.1Å
210	C	95.4	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-47.5	175.9	179.1	0	0	0	0	111.5	A19 Y125 L129 T160 S163 S206 F207 T208 A213 S214	A19-C210 HydrophobicContact CB-CB 4.2Å; Y125-C210 HydrophobicContact CE2-CB 4.39Å; L129-C210 HydrophobicContact CD2-CB 4.07Å; L129-C210 VanDerWaalsContact CD2-SG 3.59Å; T160-C210 PolarHBondContact O-SG 3.34Å; T160-C210 VanDerWaalsContact O-SG 3.37Å; S163-C210 PolarHBondContact OG-SG 2.86Å; S206-C210 VanDerWaalsContact O-CB 3.29Å; S206-C210 WeakPolarHBondContact O-CB 3.4Å; S206-C210 PolarHBondContact O-N 3.32Å; F207-C210 WeakPolarHBondContact O-CB 3.44Å; F207-C210 PolarHBondContact O-N 3Å; T208-C210 VanDerWaalsContact C-N 3.32Å; T208-C210 PolarHBondContact O-N 3.23Å; C210-A213 PolarHBondContact O-N 3.17Å; C210-S214 VanDerWaalsContact O-CB 3.3Å; C210-S214 WeakPolarHBondContact O-CB 3.41Å; C210-S214 PolarHBondContact O-N 3.47Å
211	M	94.1	Very high	92.2	Very high	67 Å²	67	38 Å²	38	33%	0.33	22%	0.216	S	C	.	.	H	α-helix	trans	-64.4	-41.9	177.3	-71.1	-60.6	-70.4	0	0	111.7	F207 T208 S214 V215	F207-M211 HydrophobicContact CD2-CG 4.14Å; F207-M211 HydrophobicContact CE1-CG 4.19Å; F207-M211 HydrophobicContact CE2-CG 3.6Å; F207-M211 HydrophobicContact CE2-SD 4.1Å; F207-M211 HydrophobicContact CZ-CG 3.65Å; F207-M211 HydrophobicContact CZ-SD 4.37Å; F207-M211 WeakPolarHBondContact O-CG 3.33Å; F207-M211 PolarHBondContact O-N 3.2Å; T208-M211 PolarHBondContact O-N 2.78Å; M211-S214 WeakPolarHBondContact O-CB 3.49Å; M211-S214 PolarHBondContact O-N 3.31Å; M211-V215 WeakPolarHBondContact O-CG2 3.4Å; M211-V215 PolarHBondContact O-N 3.12Å
212	A	94.1	Very high	91.7	Very high	39 Å²	39	37.2 Å²	37.2	32%	0.322	21%	0.209	S	C	.	.	H	α-helix	trans	-63.6	-42.4	175.2	0	0	0	0	0	112.2	L15 T208 C209 T216	L15-A212 HydrophobicContact CD1-CB 4.11Å; T208-A212 WeakPolarHBondContact O-CB 3.49Å; T208-A212 PolarHBondContact O-N 3.19Å; C209-A212 PolarHBondContact O-N 3.34Å; A212-T216 VanDerWaalsContact O-CB 3.31Å; A212-T216 WeakPolarHBondContact O-CB 3.39Å; A212-T216 PolarHBondContact O-N 3.32Å; A212-T216 PolarHBondContact O-OG1 3.2Å
213	A	93	Very high	91.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-47.2	174.1	0	0	0	0	0	110.7	S12 L15 N16 T160 C209 C210 V215 T216 T217	S12-A213 PolarHBondContact OG-O 3.06Å; L15-A213 HydrophobicContact CB-CB 3.8Å; N16-A213 HydrophobicContact CB-CB 4.31Å; T160-A213 HydrophobicContact CG2-CB 4.4Å; C209-A213 VanDerWaalsContact O-CB 3.27Å; C209-A213 WeakPolarHBondContact O-CB 3.17Å; C209-A213 PolarHBondContact O-N 3.1Å; C210-A213 PolarHBondContact O-N 3.17Å; A213-V215 PolarHBondContact O-N 3.46Å; A213-T216 WeakPolarHBondContact O-CB 3.43Å; A213-T216 PolarHBondContact O-N 3.26Å; A213-T216 VanDerWaalsContact O-N 3.16Å; A213-T217 WeakPolarHBondContact O-CB 3.42Å; A213-T217 PolarHBondContact O-N 3.26Å; A213-T217 PolarHBondContact O-OG1 2.82Å
214	S	91	Very high	90.3	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.028	23%	0.232	C	C	.	.	H	α-helix	trans	-55.2	-52.3	176.7	170.6	0	0	0	0	112.4	V161 C210 M211 T216 T217 L218	V161-S214 WeakPolarHBondContact CG2-OG 3.32Å; C210-S214 VanDerWaalsContact O-CB 3.3Å; C210-S214 WeakPolarHBondContact O-CB 3.41Å; C210-S214 PolarHBondContact O-N 3.47Å; M211-S214 WeakPolarHBondContact O-CB 3.49Å; M211-S214 PolarHBondContact O-N 3.31Å; S214-T216 VanDerWaalsContact C-N 3.29Å; S214-T216 PolarHBondContact O-N 3.34Å; S214-T217 PolarHBondContact O-N 3.16Å; S214-L218 WeakPolarHBondContact O-CB 3.34Å; S214-L218 WeakPolarHBondContact O-CG 3.32Å; S214-L218 PolarHBondContact O-N 2.84Å
215	V	91.9	Very high	89.6	Confident	74 Å²	74	40.7 Å²	40.7	45%	0.448	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-39.3	177.4	172.2	0	0	0	0	111	M211 A213 N219	M211-V215 WeakPolarHBondContact O-CG2 3.4Å; M211-V215 PolarHBondContact O-N 3.12Å; A213-V215 PolarHBondContact O-N 3.46Å; V215-N219 WeakPolarHBondContact CG1-ND2 3.11Å; V215-N219 VanDerWaalsContact O-CB 3.24Å; V215-N219 WeakPolarHBondContact O-CB 3.46Å; V215-N219 VanDerWaalsContact O-CG 3.24Å; V215-N219 PolarHBondContact O-N 2.92Å; V215-N219 PolarHBondContact O-ND2 2.84Å; V215-N219 VanDerWaalsContact O-ND2 3.08Å
216	T	90.1	Very high	89	Confident	25 Å²	25	44.5 Å²	44.5	15%	0.153	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-41.9	177.5	-59.6	0	0	0	0	111.8	A212 A213 S214 S220	A212-T216 VanDerWaalsContact O-CB 3.31Å; A212-T216 WeakPolarHBondContact O-CB 3.39Å; A212-T216 PolarHBondContact O-N 3.32Å; A212-T216 PolarHBondContact O-OG1 3.2Å; A213-T216 WeakPolarHBondContact O-CB 3.43Å; A213-T216 PolarHBondContact O-N 3.26Å; A213-T216 VanDerWaalsContact O-N 3.16Å; S214-T216 VanDerWaalsContact C-N 3.29Å; S214-T216 PolarHBondContact O-N 3.34Å; T216-S220 WeakPolarHBondContact O-CB 3.47Å; T216-S220 PolarHBondContact O-N 2.99Å; T216-S220 PolarHBondContact O-OG 2.96Å
217	T	87.6	Confident	88.2	Confident	4 Å²	4	46.9 Å²	46.9	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-49.3	176.7	-58.1	0	0	0	0	110.7	S12 M136 N153 A156 A157 A213 S214 N219 S220 Y221	S12-T217 PolarHBondContact OG-OG1 2.94Å; M136-T217 HydrophobicContact CE-CG2 4.17Å; M136-T217 VanDerWaalsContact CE-OG1 3.3Å; M136-T217 WeakPolarHBondContact CE-OG1 3.37Å; N153-T217 WeakPolarHBondContact OD1-CG2 3.4Å; A156-T217 HydrophobicContact CB-CG2 4.34Å; A157-T217 HydrophobicContact CB-CG2 3.8Å; A213-T217 WeakPolarHBondContact O-CB 3.42Å; A213-T217 PolarHBondContact O-N 3.26Å; A213-T217 PolarHBondContact O-OG1 2.82Å; S214-T217 PolarHBondContact O-N 3.16Å; T217-N219 PolarHBondContact O-N 3.17Å; T217-S220 CarbonylContact O-C 3.57Å; T217-S220 WeakPolarHBondContact O-CA 3.46Å; T217-S220 WeakPolarHBondContact O-CB 3.48Å; T217-S220 PolarHBondContact O-N 2.82Å; T217-Y221 PolarHBondContact O-N 3.38Å
218	L	86.9	Confident	87.5	Confident	69 Å²	69	48.5 Å²	48.5	36%	0.361	26%	0.259	S	S	.	.	H	α-helix	trans	-58.2	-46.5	175.8	-77.5	170.4	0	0	0	112.3	A157 V161 S214 S220 Y221 T222	A157-L218 HydrophobicContact CB-CD2 3.66Å; A157-L218 HydrophobicContact CB-CG 3.94Å; V161-L218 HydrophobicContact CG2-CD1 3.93Å; S214-L218 WeakPolarHBondContact O-CB 3.34Å; S214-L218 WeakPolarHBondContact O-CG 3.32Å; S214-L218 PolarHBondContact O-N 2.84Å; L218-S220 PolarHBondContact O-N 3.29Å; L218-Y221 WeakPolarHBondContact O-CB 3.45Å; L218-Y221 PolarHBondContact O-N 2.84Å; L218-T222 PolarHBondContact O-N 2.7Å; L218-T222 PolarHBondContact O-OG1 2.89Å
219	N	87	Confident	86.8	Confident	85 Å²	85	52.7 Å²	52.7	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-30.5	175.8	-78.9	-36	0	0	0	112	R8 V215 T217 K223	R8-N219 PolarHBondContact NH2-O 2.92Å; V215-N219 WeakPolarHBondContact CG1-ND2 3.11Å; V215-N219 VanDerWaalsContact O-CB 3.24Å; V215-N219 WeakPolarHBondContact O-CB 3.46Å; V215-N219 VanDerWaalsContact O-CG 3.24Å; V215-N219 PolarHBondContact O-N 2.92Å; V215-N219 PolarHBondContact O-ND2 2.84Å; V215-N219 VanDerWaalsContact O-ND2 3.08Å; T217-N219 PolarHBondContact O-N 3.17Å; N219-K223 WeakPolarHBondContact O-CB 3.27Å; N219-K223 WeakPolarHBondContact O-CG 3.36Å; N219-K223 PolarHBondContact O-N 3.26Å
220	S	81.7	Confident	86.3	Confident	13 Å²	13	57 Å²	57	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-73.2	-42.6	175.9	-58.9	0	0	0	0	111.8	R8 T216 T217 L218 T224	R8-S220 VanDerWaalsContact CZ-OG 3.26Å; R8-S220 PolarHBondContact NE-OG 3.38Å; R8-S220 PolarHBondContact NH2-OG 3.39Å; T216-S220 WeakPolarHBondContact O-CB 3.47Å; T216-S220 PolarHBondContact O-N 2.99Å; T216-S220 PolarHBondContact O-OG 2.96Å; T217-S220 CarbonylContact O-C 3.57Å; T217-S220 WeakPolarHBondContact O-CA 3.46Å; T217-S220 WeakPolarHBondContact O-CB 3.48Å; T217-S220 PolarHBondContact O-N 2.82Å; L218-S220 PolarHBondContact O-N 3.29Å; S220-T224 VanDerWaalsContact O-CB 3.27Å; S220-T224 WeakPolarHBondContact O-CB 3.48Å; S220-T224 PolarHBondContact O-N 2.93Å; S220-T224 VanDerWaalsContact O-N 3.09Å; S220-T224 PolarHBondContact O-OG1 2.96Å
221	Y	82.6	Confident	85.7	Confident	76 Å²	76	62.7 Å²	62.7	30%	0.298	31%	0.308	S	S	.	.	H	α-helix	trans	-58.5	-56.8	171.8	172.5	-104.9	0	0	0	111.4	L150 N153 A154 T217 L218 K223 T224 V225	L150-Y221 HydrophobicContact CD1-CD2 3.59Å; L150-Y221 HydrophobicContact CD1-CE2 3.59Å; L150-Y221 HydrophobicContact CG-CD2 4.39Å; L150-Y221 HydrophobicContact CG-CE2 4Å; N153-Y221 PolarHBondContact ND2-N 3.42Å; A154-Y221 HydrophobicContact CB-CD2 3.95Å; A154-Y221 HydrophobicContact CB-CE2 3.64Å; T217-Y221 PolarHBondContact O-N 3.38Å; L218-Y221 WeakPolarHBondContact O-CB 3.45Å; L218-Y221 PolarHBondContact O-N 2.84Å; Y221-K223 PolarHBondContact O-N 3.38Å; Y221-T224 WeakPolarHBondContact O-CA 3.02Å; Y221-T224 WeakPolarHBondContact O-CB 3.27Å; Y221-T224 PolarHBondContact O-N 2.91Å; Y221-V225 HydrophobicContact CD1-CG2 4.39Å; Y221-V225 HydrophobicContact CD2-CG2 4.12Å; Y221-V225 HydrophobicContact CE1-CG2 3.98Å; Y221-V225 HydrophobicContact CE2-CG2 3.66Å; Y221-V225 HydrophobicContact CG-CG2 4.45Å; Y221-V225 WeakPolarHBondContact O-CG2 3.37Å; Y221-V225 PolarHBondContact O-N 2.88Å
222	T	84.9	Confident	85.2	Confident	66 Å²	66	67.4 Å²	67.4	41%	0.405	32%	0.322	S	S	.	.	H	α-helix	trans	-58.6	-46.8	-177.1	-59.6	0	0	0	0	112.4	L218 T224 V225 I226	L218-T222 PolarHBondContact O-N 2.7Å; L218-T222 PolarHBondContact O-OG1 2.89Å; T222-T224 VanDerWaalsContact C-N 3.25Å; T222-T224 PolarHBondContact O-N 2.94Å; T222-V225 PolarHBondContact O-N 3.34Å; T222-I226 HydrophobicContact CG2-CD1 3.73Å; T222-I226 HydrophobicContact CG2-CG1 4.42Å; T222-I226 VanDerWaalsContact O-CG1 3.29Å; T222-I226 WeakPolarHBondContact O-CG1 3.29Å; T222-I226 PolarHBondContact O-N 2.84Å
223	K	82.3	Confident	84.8	Confident	128 Å²	128	72 Å²	72	56%	0.557	33%	0.334	S	S	*	.	H	α-helix	trans	-60.3	-37.5	176.3	-76.7	-176.3	-179.6	174.6	0	112	N219 Y221 E227	N219-K223 WeakPolarHBondContact O-CB 3.27Å; N219-K223 WeakPolarHBondContact O-CG 3.36Å; N219-K223 PolarHBondContact O-N 3.26Å; Y221-K223 PolarHBondContact O-N 3.38Å; K223-E227 WeakPolarHBondContact O-CB 3.41Å; K223-E227 PolarHBondContact O-N 2.96Å
224	T	78.4	Confident	84.5	Confident	13 Å²	13	76.9 Å²	76.9	8%	0.08	36%	0.36	C	S	.	.	H	α-helix	trans	-70	-43	179.2	-58.7	0	0	0	0	111.4	L150 S220 Y221 T222 E227 F228	L150-T224 HydrophobicContact CD1-CG2 3.93Å; S220-T224 VanDerWaalsContact O-CB 3.27Å; S220-T224 WeakPolarHBondContact O-CB 3.48Å; S220-T224 PolarHBondContact O-N 2.93Å; S220-T224 VanDerWaalsContact O-N 3.09Å; S220-T224 PolarHBondContact O-OG1 2.96Å; Y221-T224 WeakPolarHBondContact O-CA 3.02Å; Y221-T224 WeakPolarHBondContact O-CB 3.27Å; Y221-T224 PolarHBondContact O-N 2.91Å; T222-T224 VanDerWaalsContact C-N 3.25Å; T222-T224 PolarHBondContact O-N 2.94Å; T224-E227 PolarHBondContact O-N 3.46Å; T224-F228 HydrophobicContact CG2-CD2 3.79Å; T224-F228 HydrophobicContact CG2-CE2 3.33Å; T224-F228 HydrophobicContact CG2-CZ 4.4Å; T224-F228 WeakPolarHBondContact O-CD2 3.4Å; T224-F228 PolarHBondContact O-N 3.38Å
225	V	80.9	Confident	84.2	Confident	21 Å²	21	83.5 Å²	83.5	13%	0.127	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-47	174.5	176.2	0	0	0	0	111.5	L150 Y221 T222 E227 F228 R229	L150-V225 HydrophobicContact CD1-CG2 3.71Å; L150-V225 HydrophobicContact CD2-CG2 4.23Å; L150-V225 HydrophobicContact CG-CG2 4.47Å; Y221-V225 HydrophobicContact CD1-CG2 4.39Å; Y221-V225 HydrophobicContact CD2-CG2 4.12Å; Y221-V225 HydrophobicContact CE1-CG2 3.98Å; Y221-V225 HydrophobicContact CE2-CG2 3.66Å; Y221-V225 HydrophobicContact CG-CG2 4.45Å; Y221-V225 WeakPolarHBondContact O-CG2 3.37Å; Y221-V225 PolarHBondContact O-N 2.88Å; T222-V225 PolarHBondContact O-N 3.34Å; V225-E227 VanDerWaalsContact C-N 3.34Å; V225-E227 PolarHBondContact O-N 2.99Å; V225-F228 PolarHBondContact O-N 2.96Å; V225-R229 HydrophobicContact CG1-CG 4.44Å; V225-R229 WeakPolarHBondContact O-CG 3.42Å; V225-R229 PolarHBondContact O-N 3.23Å
226	I	82.8	Confident	84	Confident	104 Å²	104	84.5 Å²	84.5	53%	0.533	39%	0.388	S	S	.	.	H	α-helix	trans	-63	-43.2	179.9	-66.6	168.2	0	0	0	110.2	T222 F228 R229 H230	T222-I226 HydrophobicContact CG2-CD1 3.73Å; T222-I226 HydrophobicContact CG2-CG1 4.42Å; T222-I226 VanDerWaalsContact O-CG1 3.29Å; T222-I226 WeakPolarHBondContact O-CG1 3.29Å; T222-I226 PolarHBondContact O-N 2.84Å; I226-F228 VanDerWaalsContact C-N 3.33Å; I226-F228 PolarHBondContact O-N 3.09Å; I226-R229 PolarHBondContact O-N 2.88Å; I226-H230 WeakPolarHBondContact O-CB 3.32Å; I226-H230 PolarHBondContact O-N 2.69Å
227	E	80.6	Confident	83.8	Confident	51 Å²	51	89 Å²	89	24%	0.238	41%	0.408	C	S	.	.	H	α-helix	trans	-60.8	-41.3	176	-168.1	-171.5	149.9	0	0	111.6	R5 K223 T224 V225 H230 K231	R5-E227 IonicContact CZ-OE2 3.69Å; R5-E227 IonicContact NH2-OE1 3.82Å; R5-E227 IonicContact NH2-OE2 2.94Å; R5-E227 PolarHBondContact NH2-OE2 3.3Å; K223-E227 WeakPolarHBondContact O-CB 3.41Å; K223-E227 PolarHBondContact O-N 2.96Å; T224-E227 PolarHBondContact O-N 3.46Å; V225-E227 VanDerWaalsContact C-N 3.34Å; V225-E227 PolarHBondContact O-N 2.99Å; E227-H230 PolarHBondContact O-N 3.27Å; E227-K231 HydrophobicContact CG-CD 4.46Å; E227-K231 WeakPolarHBondContact O-CB 3.49Å; E227-K231 WeakPolarHBondContact O-CG 3.34Å; E227-K231 PolarHBondContact O-N 3.17Å; E227-K231 IonicContact OE1-NZ 2.88Å; E227-K231 PolarHBondContact OE1-NZ 3.09Å
228	F	80.2	Confident	83.6	Confident	68 Å²	68	90.3 Å²	90.3	30%	0.298	42%	0.423	S	S	.	.	H	α-helix	trans	-63.7	-46.3	175.2	-81.3	-57.3	0	0	0	112.8	V146 L150 T224 V225 I226 H230 K231 R232	V146-F228 HydrophobicContact CB-CZ 4.32Å; V146-F228 HydrophobicContact CG1-CE1 3.39Å; V146-F228 HydrophobicContact CG1-CE2 3.51Å; V146-F228 HydrophobicContact CG1-CZ 2.84Å; L150-F228 HydrophobicContact CD2-CD2 4.46Å; T224-F228 HydrophobicContact CG2-CD2 3.79Å; T224-F228 HydrophobicContact CG2-CE2 3.33Å; T224-F228 HydrophobicContact CG2-CZ 4.4Å; T224-F228 WeakPolarHBondContact O-CD2 3.4Å; T224-F228 PolarHBondContact O-N 3.38Å; V225-F228 PolarHBondContact O-N 2.96Å; I226-F228 VanDerWaalsContact C-N 3.33Å; I226-F228 PolarHBondContact O-N 3.09Å; F228-H230 VanDerWaalsContact C-N 3.33Å; F228-H230 PolarHBondContact O-N 2.97Å; F228-K231 PolarHBondContact O-N 3.05Å; F228-R232 WeakPolarHBondContact O-CB 3.49Å; F228-R232 PolarHBondContact O-N 2.77Å
229	R	82	Confident	83.3	Confident	174 Å²	174	91.1 Å²	91.1	66%	0.657	43%	0.427	S	S	*	.	H	α-helix	trans	-62	-42.4	176.9	-71.3	-177.7	-174.7	-174.9	2.2	111.3	V225 I226 R232 K233	V225-R229 HydrophobicContact CG1-CG 4.44Å; V225-R229 WeakPolarHBondContact O-CG 3.42Å; V225-R229 PolarHBondContact O-N 3.23Å; I226-R229 PolarHBondContact O-N 2.88Å; R229-R232 PolarHBondContact O-N 2.67Å; R229-K233 WeakPolarHBondContact O-CG 3.39Å; R229-K233 PolarHBondContact O-N 2.81Å
230	H	84.3	Confident	82.9	Confident	117 Å²	117	96.1 Å²	96.1	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-47.7	178.2	-174.7	-88.7	0	0	0	111.7	I226 E227 F228 R232 K233 L234	I226-H230 WeakPolarHBondContact O-CB 3.32Å; I226-H230 PolarHBondContact O-N 2.69Å; E227-H230 PolarHBondContact O-N 3.27Å; F228-H230 VanDerWaalsContact C-N 3.33Å; F228-H230 PolarHBondContact O-N 2.97Å; H230-R232 VanDerWaalsContact C-N 3.3Å; H230-R232 PolarHBondContact O-N 2.69Å; H230-K233 PolarHBondContact O-N 3.37Å; H230-L234 VanDerWaalsContact CE1-CD1 3.48Å; H230-L234 WeakPolarHBondContact CE1-CD1 3.35Å; H230-L234 WeakPolarHBondContact O-CB 3.48Å; H230-L234 PolarHBondContact O-N 3.19Å
231	K	83.7	Confident	83	Confident	118 Å²	118	102.3 Å²	102.3	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-60.5	-39.3	175.8	-79.3	179.7	170.2	162.9	0	112.5	E227 F228 L234 F235	E227-K231 HydrophobicContact CG-CD 4.46Å; E227-K231 WeakPolarHBondContact O-CB 3.49Å; E227-K231 WeakPolarHBondContact O-CG 3.34Å; E227-K231 PolarHBondContact O-N 3.17Å; E227-K231 IonicContact OE1-NZ 2.88Å; E227-K231 PolarHBondContact OE1-NZ 3.09Å; F228-K231 PolarHBondContact O-N 3.05Å; K231-L234 PolarHBondContact O-N 2.65Å; K231-F235 WeakPolarHBondContact O-CB 3.46Å; K231-F235 PolarHBondContact O-N 3.31Å
232	R	83.6	Confident	82.7	Confident	167 Å²	167	104.5 Å²	104.5	63%	0.63	48%	0.48	S	S	*	.	H	α-helix	trans	-63.9	-45.9	175.6	-160.1	-176.2	87.5	-172.2	0.7	111.7	F228 R229 H230 L234 F235 E236	F228-R232 WeakPolarHBondContact O-CB 3.49Å; F228-R232 PolarHBondContact O-N 2.77Å; R229-R232 PolarHBondContact O-N 2.67Å; H230-R232 VanDerWaalsContact C-N 3.3Å; H230-R232 PolarHBondContact O-N 2.69Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.82Å; R232-F235 PolarHBondContact O-N 3.11Å; R232-E236 IonicContact CZ-OE1 3.53Å; R232-E236 IonicContact NE-OE1 3.68Å; R232-E236 PolarHBondContact NE-OE1 3.39Å; R232-E236 IonicContact NH2-OE1 2.78Å; R232-E236 WeakPolarHBondContact O-CG 3.31Å; R232-E236 PolarHBondContact O-N 3.27Å
233	K	86.3	Confident	82.4	Confident	134 Å²	134	108.1 Å²	108.1	58%	0.583	49%	0.492	S	S	*	.	H	α-helix	trans	-60.5	-41.5	175.3	-73.9	-173.9	179.3	-170.7	0	112.2	R229 H230 F235 E236 Q237	R229-K233 WeakPolarHBondContact O-CG 3.39Å; R229-K233 PolarHBondContact O-N 2.81Å; H230-K233 PolarHBondContact O-N 3.37Å; K233-F235 VanDerWaalsContact C-N 3.32Å; K233-F235 PolarHBondContact O-N 3.36Å; K233-E236 PolarHBondContact O-N 3.27Å; K233-Q237 WeakPolarHBondContact O-CB 3.36Å; K233-Q237 WeakPolarHBondContact O-CG 3.31Å; K233-Q237 PolarHBondContact O-N 2.59Å
234	L	86.5	Confident	82.2	Confident	103 Å²	103	105.1 Å²	105.1	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-65	-38.8	178.7	-142.4	114.5	0	0	0	111.5	H230 K231 R232 G238	H230-L234 VanDerWaalsContact CE1-CD1 3.48Å; H230-L234 WeakPolarHBondContact CE1-CD1 3.35Å; H230-L234 WeakPolarHBondContact O-CB 3.48Å; H230-L234 PolarHBondContact O-N 3.19Å; K231-L234 PolarHBondContact O-N 2.65Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.82Å; L234-G238 PolarHBondContact O-N 2.93Å
235	F	84.8	Confident	82.1	Confident	144 Å²	144	111.9 Å²	111.9	63%	0.632	51%	0.512	S	S	*	.	H	α-helix	trans	-69.2	-42.3	175.4	-171.6	-102.1	0	0	0	112.3	K231 R232 K233 Q237 G238 L239	K231-F235 WeakPolarHBondContact O-CB 3.46Å; K231-F235 PolarHBondContact O-N 3.31Å; R232-F235 PolarHBondContact O-N 3.11Å; K233-F235 VanDerWaalsContact C-N 3.32Å; K233-F235 PolarHBondContact O-N 3.36Å; F235-Q237 VanDerWaalsContact C-N 3.34Å; F235-Q237 PolarHBondContact O-N 2.98Å; F235-G238 PolarHBondContact O-N 3.03Å; F235-L239 HydrophobicContact CD1-CD1 3.79Å; F235-L239 HydrophobicContact CE1-CD1 3.45Å; F235-L239 VanDerWaalsContact CE1-CD1 3.45Å; F235-L239 HydrophobicContact CE1-CG 4.23Å; F235-L239 HydrophobicContact CZ-CD1 4.08Å; F235-L239 HydrophobicContact CZ-CG 4.45Å; F235-L239 WeakPolarHBondContact O-CG 3.43Å; F235-L239 PolarHBondContact O-N 2.87Å
236	E	86.3	Confident	81.9	Confident	94 Å²	94	115.4 Å²	115.4	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-62	-39.5	173.5	-75.5	170.3	-163.8	0	0	111.9	R232 K233 R240	R232-E236 IonicContact CZ-OE1 3.53Å; R232-E236 IonicContact NE-OE1 3.68Å; R232-E236 PolarHBondContact NE-OE1 3.39Å; R232-E236 IonicContact NH2-OE1 2.78Å; R232-E236 WeakPolarHBondContact O-CG 3.31Å; R232-E236 PolarHBondContact O-N 3.27Å; K233-E236 PolarHBondContact O-N 3.27Å; E236-R240 WeakPolarHBondContact O-CB 3.42Å; E236-R240 PolarHBondContact O-N 3.44Å; E236-R240 VanDerWaalsContact O-N 3.09Å
237	Q	86.5	Confident	81.5	Confident	119 Å²	119	115 Å²	115	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-67	-44.9	174.8	-77.1	175.3	-25.3	0	0	112.3	K233 F235 L239 R240 E241	K233-Q237 WeakPolarHBondContact O-CB 3.36Å; K233-Q237 WeakPolarHBondContact O-CG 3.31Å; K233-Q237 PolarHBondContact O-N 2.59Å; F235-Q237 VanDerWaalsContact C-N 3.34Å; F235-Q237 PolarHBondContact O-N 2.98Å; Q237-L239 PolarHBondContact O-N 3.27Å; Q237-R240 PolarHBondContact O-N 2.93Å; Q237-R240 VanDerWaalsContact O-N 3.12Å; Q237-E241 PolarHBondContact O-N 3.14Å
238	G	82.7	Confident	81.4	Confident	33 Å²	33	119.5 Å²	119.5	34%	0.34	55%	0.55	S	S	.	.	H	α-helix	trans	-60	-43.5	176.6	0	0	0	0	0	112.5	L234 F235 R240 E241 E242	L234-G238 PolarHBondContact O-N 2.93Å; F235-G238 PolarHBondContact O-N 3.03Å; G238-R240 VanDerWaalsContact C-N 3.32Å; G238-R240 PolarHBondContact O-N 2.75Å; G238-E241 PolarHBondContact O-N 2.79Å; G238-E242 WeakPolarHBondContact O-CB 3.33Å; G238-E242 PolarHBondContact O-N 2.83Å
239	L	81.9	Confident	81.1	Confident	86 Å²	86	121.4 Å²	121.4	45%	0.45	56%	0.559	S	S	.	*	H	α-helix	trans	-61.1	-39.9	173.3	-79.1	169.5	0	0	0	112.3	F235 Q237 E242 Q243	F235-L239 HydrophobicContact CD1-CD1 3.79Å; F235-L239 HydrophobicContact CE1-CD1 3.45Å; F235-L239 VanDerWaalsContact CE1-CD1 3.45Å; F235-L239 HydrophobicContact CE1-CG 4.23Å; F235-L239 HydrophobicContact CZ-CD1 4.08Å; F235-L239 HydrophobicContact CZ-CG 4.45Å; F235-L239 WeakPolarHBondContact O-CG 3.43Å; F235-L239 PolarHBondContact O-N 2.87Å; Q237-L239 PolarHBondContact O-N 3.27Å; L239-E242 PolarHBondContact O-N 2.83Å; L239-Q243 WeakPolarHBondContact O-CB 3.02Å; L239-Q243 PolarHBondContact O-N 2.81Å
240	R	78.9	Confident	80.5	Confident	189 Å²	189	115 Å²	115	71%	0.713	54%	0.544	S	S	*	.	H	α-helix	trans	-67.9	-38.4	178.3	-172.9	174.6	179.1	-97.4	-0.3	112.1	E236 Q237 G238 S244	E236-R240 WeakPolarHBondContact O-CB 3.42Å; E236-R240 PolarHBondContact O-N 3.44Å; E236-R240 VanDerWaalsContact O-N 3.09Å; Q237-R240 PolarHBondContact O-N 2.93Å; Q237-R240 VanDerWaalsContact O-N 3.12Å; G238-R240 VanDerWaalsContact C-N 3.32Å; G238-R240 PolarHBondContact O-N 2.75Å; R240-S244 WeakPolarHBondContact O-CB 3.22Å; R240-S244 PolarHBondContact O-N 3.05Å; R240-S244 PolarHBondContact O-OG 3.01Å
241	E	81.9	Confident	79.9	Confident	143 Å²	143	116.2 Å²	116.2	67%	0.668	55%	0.548	S	S	*	.	H	α-helix	trans	-66.6	-44.1	174.4	-77.2	-179.7	174.5	0	0	111.6	Q237 G238 Q243 S244 Y245	Q237-E241 PolarHBondContact O-N 3.14Å; G238-E241 PolarHBondContact O-N 2.79Å; E241-Q243 VanDerWaalsContact C-N 3.35Å; E241-Q243 PolarHBondContact O-N 2.83Å; E241-S244 WeakPolarHBondContact O-CB 3.3Å; E241-S244 PolarHBondContact O-N 2.96Å; E241-S244 VanDerWaalsContact O-N 3.15Å; E241-Y245 PolarHBondContact O-N 3.43Å
242	E	78	Confident	79.2	Confident	122 Å²	122	115.8 Å²	115.8	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-60.4	-44	176.7	-165.3	-174.7	135.6	0	0	111.7	G238 L239 S244 Y245 L246	G238-E242 WeakPolarHBondContact O-CB 3.33Å; G238-E242 PolarHBondContact O-N 2.83Å; L239-E242 PolarHBondContact O-N 2.83Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 2.99Å; E242-Y245 PolarHBondContact O-N 3.16Å; E242-L246 PolarHBondContact O-N 3.06Å
243	Q	78.1	Confident	78.4	Confident	143 Å²	143	114.4 Å²	114.4	67%	0.668	54%	0.543	S	S	*	.	H	α-helix	trans	-61.7	-41.2	174.6	-166.3	88.4	25.5	0	0	111.7	L239 E241 Y245 D247	L239-Q243 WeakPolarHBondContact O-CB 3.02Å; L239-Q243 PolarHBondContact O-N 2.81Å; E241-Q243 VanDerWaalsContact C-N 3.35Å; E241-Q243 PolarHBondContact O-N 2.83Å; Q243-Y245 VanDerWaalsContact C-N 3.34Å; Q243-D247 WeakPolarHBondContact O-CB 3.04Å; Q243-D247 PolarHBondContact O-N 3.44Å
244	S	76.9	Confident	77.5	Confident	64 Å²	64	115 Å²	115	45%	0.448	55%	0.546	S	S	.	.	H	α-helix	trans	-67.9	-36.1	179.5	-54.3	0	0	0	0	111.7	R240 E241 E242 Q248	R240-S244 WeakPolarHBondContact O-CB 3.22Å; R240-S244 PolarHBondContact O-N 3.05Å; R240-S244 PolarHBondContact O-OG 3.01Å; E241-S244 WeakPolarHBondContact O-CB 3.3Å; E241-S244 PolarHBondContact O-N 2.96Å; E241-S244 VanDerWaalsContact O-N 3.15Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 2.99Å; S244-Q248 WeakPolarHBondContact O-CB 3.49Å; S244-Q248 PolarHBondContact O-N 2.97Å
245	Y	77.4	Confident	76.5	Confident	155 Å²	155	118.4 Å²	118.4	61%	0.608	55%	0.552	S	S	*	*	H	α-helix	trans	-67.3	-46.8	176.6	-167.6	-92.4	0	0	0	111.6	E241 E242 Q243 D247 Q248 E249	E241-Y245 PolarHBondContact O-N 3.43Å; E242-Y245 PolarHBondContact O-N 3.16Å; Q243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-D247 VanDerWaalsContact C-N 3.33Å; Y245-D247 PolarHBondContact O-N 3.43Å; Y245-Q248 PolarHBondContact O-N 2.93Å; Y245-E249 HydrophobicContact CE1-CG 4.13Å; Y245-E249 PolarHBondContact O-N 3.24Å
246	L	77.6	Confident	75.3	Confident	96 Å²	96	115 Å²	115	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-39.4	176.4	-76	169.1	0	0	0	112.3	E242 A250	E242-L246 PolarHBondContact O-N 3.06Å; L246-A250 WeakPolarHBondContact O-CB 3.35Å; L246-A250 PolarHBondContact O-N 3.12Å
247	D	73.5	Confident	73.9	Confident	96 Å²	96	117.7 Å²	117.7	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-41	176.3	-161.9	43	0	0	0	111.1	Q243 Y245 A250 F251	Q243-D247 WeakPolarHBondContact O-CB 3.04Å; Q243-D247 PolarHBondContact O-N 3.44Å; Y245-D247 VanDerWaalsContact C-N 3.33Å; Y245-D247 PolarHBondContact O-N 3.43Å; D247-A250 PolarHBondContact O-N 2.04Å; D247-F251 WeakPolarHBondContact O-CB 3.31Å; D247-F251 WeakPolarHBondContact O-CD2 3.08Å; D247-F251 PolarHBondContact O-N 2.78Å
248	Q	78	Confident	72.4	Confident	144 Å²	144	114.9 Å²	114.9	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-67.9	-39.5	176.9	-171.7	159.7	-21.2	0	0	113.1	S244 Y245 F251 H252	S244-Q248 WeakPolarHBondContact O-CB 3.49Å; S244-Q248 PolarHBondContact O-N 2.97Å; Y245-Q248 PolarHBondContact O-N 2.93Å; Q248-F251 PolarHBondContact O-N 2.64Å; Q248-H252 WeakPolarHBondContact O-CB 3.4Å; Q248-H252 PolarHBondContact O-N 2.83Å
249	E	75	Confident	70.9	Confident	108 Å²	108	118.3 Å²	118.3	51%	0.505	55%	0.55	S	S	.	.	H	α-helix	trans	-63.3	-42.8	171.2	-92.3	-168.3	158.1	0	0	111.9	Y245 H252 Y253	Y245-E249 HydrophobicContact CE1-CG 4.13Å; Y245-E249 PolarHBondContact O-N 3.24Å; E249-H252 PolarHBondContact O-N 2.92Å; E249-Y253 WeakPolarHBondContact O-CB 3.34Å; E249-Y253 PolarHBondContact O-N 2.96Å
250	A	69.6	Low	69.4	Low	39 Å²	39	121.1 Å²	121.1	32%	0.322	56%	0.56	S	S	.	*	H	α-helix	trans	-60.7	-46.9	175.4	0	0	0	0	0	110.9	L246 D247 H252 Y253 F254	L246-A250 WeakPolarHBondContact O-CB 3.35Å; L246-A250 PolarHBondContact O-N 3.12Å; D247-A250 PolarHBondContact O-N 2.04Å; A250-H252 VanDerWaalsContact C-N 3.32Å; A250-H252 PolarHBondContact O-N 3.4Å; A250-Y253 PolarHBondContact O-N 3.47Å; A250-F254 WeakPolarHBondContact O-CD2 3.34Å; A250-F254 PolarHBondContact O-N 3.13Å
251	F	69.7	Low	67.9	Low	143 Å²	143	116 Å²	116	63%	0.627	55%	0.554	S	S	*	*	H	α-helix	trans	-58.4	-41.8	174.6	-97.5	-78.6	0	0	0	112.5	D247 Q248 R255	D247-F251 WeakPolarHBondContact O-CB 3.31Å; D247-F251 WeakPolarHBondContact O-CD2 3.08Å; D247-F251 PolarHBondContact O-N 2.78Å; Q248-F251 PolarHBondContact O-N 2.64Å; F251-R255 WeakPolarHBondContact O-CB 3.22Å; F251-R255 PolarHBondContact O-N 2.93Å
252	H	69.4	Low	66.3	Low	109 Å²	109	114.8 Å²	114.8	51%	0.505	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-43	177.8	-138.5	-74	0	0	0	111.7	Q248 E249 A250 F254 R255 D256	Q248-H252 WeakPolarHBondContact O-CB 3.4Å; Q248-H252 PolarHBondContact O-N 2.83Å; E249-H252 PolarHBondContact O-N 2.92Å; A250-H252 VanDerWaalsContact C-N 3.32Å; A250-H252 PolarHBondContact O-N 3.4Å; H252-F254 PolarHBondContact O-N 3.46Å; H252-R255 PolarHBondContact O-N 3.42Å; H252-D256 IonicContact CE1-OD2 3.04Å; H252-D256 IonicContact ND1-OD2 3.17Å; H252-D256 PolarHBondContact ND1-OD2 2.84Å; H252-D256 WeakPolarHBondContact O-CB 2.99Å; H252-D256 PolarHBondContact O-N 3.21Å
253	Y	67.1	Low	64.9	Low	139 Å²	139	114.1 Å²	114.1	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-60.9	-45.6	176.7	-175.8	-93.7	0	0	0	112.4	E249 A250 R257	E249-Y253 WeakPolarHBondContact O-CB 3.34Å; E249-Y253 PolarHBondContact O-N 2.96Å; A250-Y253 PolarHBondContact O-N 3.47Å; Y253-R257 WeakPolarHBondContact O-CB 3.44Å; Y253-R257 PolarHBondContact O-N 3.28Å; Y253-R257 VanDerWaalsContact O-N 3.1Å; Y253-R257 PolarHBondContact OH-NH1 3.08Å
254	F	66.7	Low	63.5	Low	147 Å²	147	110.6 Å²	110.6	65%	0.645	57%	0.567	S	S	*	*	H	α-helix	trans	-67.3	-37.7	175.6	-77	-67.3	0	0	0	112.1	A250 H252 S258	A250-F254 WeakPolarHBondContact O-CD2 3.34Å; A250-F254 PolarHBondContact O-N 3.13Å; H252-F254 PolarHBondContact O-N 3.46Å; F254-S258 VanDerWaalsContact O-CB 3.3Å; F254-S258 WeakPolarHBondContact O-CB 3.38Å; F254-S258 PolarHBondContact O-N 3.19Å; F254-S258 PolarHBondContact O-OG 2.86Å
255	R	66.2	Low	61.9	Low	174 Å²	174	111.8 Å²	111.8	66%	0.657	58%	0.575	S	S	*	*	H	α-helix	trans	-65.9	-47.1	177.8	-171.7	170.8	-172.4	166	0.6	112.1	F251 H252 R257 S258 L259	F251-R255 WeakPolarHBondContact O-CB 3.22Å; F251-R255 PolarHBondContact O-N 2.93Å; H252-R255 PolarHBondContact O-N 3.42Å; R255-R257 VanDerWaalsContact C-N 3.35Å; R255-R257 PolarHBondContact O-N 3.36Å; R255-S258 PolarHBondContact O-N 3.06Å; R255-S258 PolarHBondContact O-OG 3.33Å; R255-L259 HydrophobicContact CG-CD1 4.32Å; R255-L259 WeakPolarHBondContact O-CG 3.36Å; R255-L259 PolarHBondContact O-N 3.26Å
256	D	59.1	Low	60.2	Low	72 Å²	72	110.7 Å²	110.7	39%	0.385	58%	0.584	S	S	.	*	H	α-helix	trans	-65.9	-37.7	179.4	-74.3	-32.1	0	0	0	111.8	H252 L259 Q260	H252-D256 IonicContact CE1-OD2 3.04Å; H252-D256 IonicContact ND1-OD2 3.17Å; H252-D256 PolarHBondContact ND1-OD2 2.84Å; H252-D256 WeakPolarHBondContact O-CB 2.99Å; H252-D256 PolarHBondContact O-N 3.21Å; D256-L259 PolarHBondContact O-N 3.15Å; D256-Q260 WeakPolarHBondContact O-CB 3.42Å; D256-Q260 WeakPolarHBondContact O-CG 3.42Å; D256-Q260 PolarHBondContact O-N 3.39Å
257	R	57.4	Low	58.2	Low	151 Å²	151	115.3 Å²	115.3	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-71.2	-34.1	175.2	-162.1	161.3	-178	165.9	-2	112.6	Y253 R255 Q260 S261	Y253-R257 WeakPolarHBondContact O-CB 3.44Å; Y253-R257 PolarHBondContact O-N 3.28Å; Y253-R257 VanDerWaalsContact O-N 3.1Å; Y253-R257 PolarHBondContact OH-NH1 3.08Å; R255-R257 VanDerWaalsContact C-N 3.35Å; R255-R257 PolarHBondContact O-N 3.36Å; R257-Q260 PolarHBondContact O-N 2.63Å; R257-S261 WeakPolarHBondContact O-CB 3.21Å; R257-S261 PolarHBondContact O-N 3.37Å
258	S	54.4	Low	56.5	Low	59 Å²	59	116.8 Å²	116.8	41%	0.413	62%	0.615	S	S	.	*	H	α-helix	trans	-66.1	-42.4	174	76.2	0	0	0	0	111.6	F254 R255 S261 V262	F254-S258 VanDerWaalsContact O-CB 3.3Å; F254-S258 WeakPolarHBondContact O-CB 3.38Å; F254-S258 PolarHBondContact O-N 3.19Å; F254-S258 PolarHBondContact O-OG 2.86Å; R255-S258 PolarHBondContact O-N 3.06Å; R255-S258 PolarHBondContact O-OG 3.33Å; S258-S261 PolarHBondContact O-N 3.36Å; S258-S261 PolarHBondContact O-OG 3.43Å; S258-V262 WeakPolarHBondContact O-CG2 3.47Å; S258-V262 PolarHBondContact O-N 3.42Å; S258-V262 VanDerWaalsContact O-N 3.12Å
259	L	51.3	Low	54.2	Low	106 Å²	106	120.6 Å²	120.6	56%	0.555	63%	0.625	S	S	*	*	H	α-helix	trans	-66.4	-37.7	175.3	-70.3	172.1	0	0	0	112.8	R255 D256 S263	R255-L259 HydrophobicContact CG-CD1 4.32Å; R255-L259 WeakPolarHBondContact O-CG 3.36Å; R255-L259 PolarHBondContact O-N 3.26Å; D256-L259 PolarHBondContact O-N 3.15Å; L259-S263 PolarHBondContact O-N 3.08Å
260	Q	51	Low	53	Low	144 Å²	144	121 Å²	121	67%	0.673	64%	0.637	S	S	*	*	H	α-helix	trans	-68.4	-34.7	173.8	-76.2	172.3	-8.6	0	0	112.7	D256 R257 S263 G264	D256-Q260 WeakPolarHBondContact O-CB 3.42Å; D256-Q260 WeakPolarHBondContact O-CG 3.42Å; D256-Q260 PolarHBondContact O-N 3.39Å; R257-Q260 PolarHBondContact O-N 2.63Å; Q260-S263 PolarHBondContact O-N 3.07Å; Q260-G264 PolarHBondContact O-N 3.45Å
261	S	47	Very low	51	Low	82 Å²	82	123 Å²	123	57%	0.573	66%	0.661	S	S	*	*	H	α-helix	trans	-71.6	-31	177.2	80.4	0	0	0	0	113.2	R257 S258	R257-S261 WeakPolarHBondContact O-CB 3.21Å; R257-S261 PolarHBondContact O-N 3.37Å; S258-S261 PolarHBondContact O-N 3.36Å; S258-S261 PolarHBondContact O-OG 3.43Å
262	V	48.3	Very low	49	Very low	117 Å²	117	125.2 Å²	125.2	71%	0.709	67%	0.673	S	S	*	*	H	α-helix	trans	-77	-24	176.7	171.9	0	0	0	0	111.9	S258	S258-V262 WeakPolarHBondContact O-CG2 3.47Å; S258-V262 PolarHBondContact O-N 3.42Å; S258-V262 VanDerWaalsContact O-N 3.12Å
263	S	49.3	Very low	48.6	Very low	109 Å²	109	124.8 Å²	124.8	76%	0.762	68%	0.68	S	S	*	*	S	Bend	trans	-84.9	-9.9	176.6	-157.1	0	0	0	0	113.8	L259 Q260	L259-S263 PolarHBondContact O-N 3.08Å; Q260-S263 PolarHBondContact O-N 3.07Å
264	G	47.9	Very low	46.9	Very low	69 Å²	69	130 Å²	130	71%	0.711	70%	0.699	S	S	*	*	S	Bend	trans	-93.3	-4.3	-172.5	0	0	0	0	0	116.5	Q260	Q260-G264 PolarHBondContact O-N 3.45Å
265	S	44.3	Very low	45.3	Very low	88 Å²	88	127.7 Å²	127.7	62%	0.615	71%	0.707	S	S	*	*			trans	-131.8	103.8	176.9	72	0	0	0	0	111.3
266	V	40.9	Very low	43.7	Very low	133 Å²	133	122.6 Å²	122.6	81%	0.806	71%	0.709	S	S	*	*				171	106	117.9	160.5	0	0	0	0	107.6
267	E	35.1	Very low	42.5	Very low	193 Å²	193	126.5 Å²	126.5	90%	0.902	73%	0.729	S	S	*	*			trans	-62.1	144.7	162.9	-87.7	-174.5	132.2	0	0	111
268	V	37.9	Very low	41.4	Very low	127 Å²	127	126.5 Å²	126.5	77%	0.77	74%	0.738	S	S	*	*			trans	-85.2	131.8	172.8	168.9	0	0	0	0	110
269	Y	30.3	Very low	40.5	Very low	223 Å²	223	126.9 Å²	126.9	88%	0.875	75%	0.751	S	S	*	*			trans	-174.4	162.2	139.8	-101.9	-65.8	0	0	0	110
270	P	50.4	Low	40.3	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	77%	0.766	S	S	*	*				-122.2	163.3	-127.9	22.2	3.6	0	0	0	113.6
271	G	26.5	Very low	39.5	Very low	79 Å²	79	124.5 Å²	124.5	81%	0.814	77%	0.767	S	S	*	*			trans	169.1	132.8	170.9	0	0	0	0	0	113.5
272	H	29.2	Very low	39.6	Very low	190 Å²	190	127.1 Å²	127.1	88%	0.88	78%	0.782	S	S	*	*			trans	-91.8	-175.2	-165.3	-131.1	51	0	0	0	112.2
273	P	60	Low	39	Very low	101 Å²	101	125.7 Å²	125.7	66%	0.656	78%	0.782	S	S	*	*				-117.3	165.1	-116.6	38.6	-22.6	0	0	0	115.4
274	R	31.9	Very low	39.4	Very low	248 Å²	248	126.8 Å²	126.8	94%	0.936	79%	0.787	S	S	*	*			trans	-177.9	126.3	147.5	-111.7	170.9	165.3	171.5	-4.4	116.9
275	A	32.3	Very low	38.7	Very low	98 Å²	98	126.8 Å²	126.8	81%	0.81	79%	0.787	S	S	*	*				62.3	126.2	125.7	0	0	0	0	0	124.8
276	G	32.7	Very low	38.4	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	80%	0.8	S	S	*	*			trans	80.6	150.1	142.1	0	0	0	0	0	117.2
277	L	35.2	Very low	37.9	Very low	154 Å²	154	128.9 Å²	128.9	81%	0.806	80%	0.797	S	S	*	*			cis	-172	142.6	11.7	-127.2	77.6	0	0	0	107.8
278	I	33.3	Very low	37.8	Very low	151 Å²	151	126 Å²	126	77%	0.774	79%	0.788	S	S	*	*			trans	74	127.8	138.8	-59.3	172.3	0	0	0	122.3
279	G	34.8	Very low	37.7	Very low	66 Å²	66	126.6 Å²	126.6	68%	0.68	78%	0.784	S	S	*	*			trans	-79.2	-147.5	170.8	0	0	0	0	0	114.8
280	P	48	Very low	37.8	Very low	134 Å²	134	127.2 Å²	127.2	87%	0.87	79%	0.785	S	S	*	*			cis	-137.5	179.3	17.6	37.9	-16.2	0	0	0	116.5
281	G	33.8	Very low	36.9	Very low	67 Å²	67	124.5 Å²	124.5	69%	0.691	78%	0.778	S	S	*	*			trans	-74.3	-161.6	164.2	0	0	0	0	0	113.4
282	P	49	Very low	37	Very low	137 Å²	137	127.4 Å²	127.4	89%	0.89	78%	0.781	S	S	*	*			cis	-142.6	-176.1	26.4	38.2	-15.2	0	0	0	117.5
283	A	36.9	Very low	37.1	Very low	86 Å²	86	124 Å²	124	71%	0.711	78%	0.778	S	S	*	*			trans	-74.5	-157.5	176	0	0	0	0	0	113.1
284	P	56.3	Low	35.7	Very low	132 Å²	132	123.7 Å²	123.7	86%	0.857	78%	0.784	S	S	*	*			cis	-150.5	-176.2	3.8	41.6	-19	0	0	0	118.5
285	G	34	Very low	35.8	Very low	70 Å²	70	117.2 Å²	117.2	72%	0.722	78%	0.777	S	S	*	*			trans	130.8	142.2	142.1	0	0	0	0	0	115.1
286	H	37	Very low	35.8	Very low	193 Å²	193	120.9 Å²	120.9	89%	0.894	78%	0.781	S	S	*	*			cis	-173.6	140.6	-8.8	-158.6	-90.8	0	0	0	105.4
287	G	32.1	Very low	35.7	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	79%	0.786	S	S	*	*			trans	162.4	63.3	175.3	0	0	0	0	0	117.7
288	N	33.3	Very low	35.7	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	79%	0.793	S	S	*	*			trans	-45.8	160.8	158.1	-89.4	-21	0	0	0	112.8
289	M	35.7	Very low	35.5	Very low	139 Å²	139	122 Å²	122	69%	0.685	79%	0.787	S	S	*	*			cis	-172.5	152.1	18.6	-128.6	174.9	-158.3	0	0	110.2
290	R	32.2	Very low	35.3	Very low	235 Å²	235	127.3 Å²	127.3	89%	0.887	80%	0.795	S	S	*	*			trans	50.7	138.1	138.3	-84.2	170.8	166.9	-160.4	-4.5	120.2
291	G	30.4	Very low	34.4	Very low	61 Å²	61	126.6 Å²	126.6	63%	0.629	78%	0.784	S	S	*	*			cis	156.7	128.3	7.5	0	0	0	0	0	110.9
292	T	29.5	Very low	34.3	Very low	141 Å²	141	130.6 Å²	130.6	87%	0.865	80%	0.795	S	S	*	*			trans	55.4	115.2	140.4	49.4	0	0	0	0	123.2
293	S	31.3	Very low	33.4	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	79%	0.788	S	S	*	*				72.5	117.8	117.6	-162.7	0	0	0	0	121.3
294	A	29.8	Very low	33.2	Very low	95 Å²	95	131.9 Å²	131.9	79%	0.785	79%	0.791	S	S	*	*				-174.4	135.6	124.1	0	0	0	0	0	111.8
295	S	33.5	Very low	32.3	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	79%	0.793	S	S	*	*			trans	-69.1	155.8	169.3	-36.3	0	0	0	0	111.9
296	I	33.9	Very low	32.1	Very low	174 Å²	174	133.3 Å²	133.3	89%	0.892	79%	0.788	S	S	*	*			trans	-163.3	136.2	146.5	-92.7	143.4	0	0	0	109.6
297	D	30.5	Very low	31.9	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	78%	0.784	S	S	*	*			trans	-50.3	153.6	172.3	-84.3	-57.2	0	0	0	115.4
298	L	35.4	Very low	32.1	Very low	182 Å²	182	137 Å²	137	95%	0.953	79%	0.786	S	S	*	*			trans	-139.6	100.7	151.8	-151.7	80.2	0	0	0	110.4
299	G	28.5	Very low	32.2	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	79%	0.794	S	S	*	*			trans	-111.2	146.1	164	0	0	0	0	0	111
300	E	29.6	Very low	32.4	Very low	179 Å²	179	142.7 Å²	142.7	84%	0.836	83%	0.827	S	S	*	*			trans	81.9	137.8	150.4	-104.1	172.5	100.2	0	0	123.6
301	N	29.3	Very low	32.4	Very low	119 Å²	119	138.1 Å²	138.1	64%	0.636	82%	0.824	S	S	*	*			trans	81.7	113.8	152.2	-72.7	-9.7	0	0	0	121.7
302	T	31.3	Very low	32.5	Very low	150 Å²	150	142.2 Å²	142.2	92%	0.92	84%	0.835	S	S	*	*			trans	-138.3	105.3	133.1	4.8	0	0	0	0	108.8
303	D	31.8	Very low	32.7	Very low	140 Å²	140	142.2 Å²	142.2	75%	0.749	83%	0.833	S	S	*	*			trans	-68.3	143.3	162.8	-93.2	-44.2	0	0	0	110.9
304	S	31.6	Very low	32.8	Very low	110 Å²	110	143.7 Å²	143.7	77%	0.769	83%	0.834	S	S	*	*			trans	31.6	122.7	133.8	-158.9	0	0	0	0	120.7
305	L	38.3	Very low	32.9	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	84%	0.837	S	S	*	*			trans	-169.2	128.2	140.4	-90.3	165.6	0	0	0	104.3
306	G	29.5	Very low	32.9	Very low	60 Å²	60	149 Å²	149	62%	0.619	84%	0.84	S	S	*	*			cis	116.1	119.5	33.2	0	0	0	0	0	108.4
307	E	33.4	Very low	32.8	Very low	174 Å²	174	147.2 Å²	147.2	81%	0.813	84%	0.836	S	S	*	*			trans	76.8	112.9	156.7	-61.3	177.4	121.5	0	0	118.6
308	E	36.3	Very low	33	Very low	167 Å²	167	147 Å²	147	78%	0.78	84%	0.839	S	S	*	*				89.4	117.4	93.3	-72.9	-152.1	136.3	0	0	113.2
309	Q	35.1	Very low	32.8	Very low	188 Å²	188	144.1 Å²	144.1	88%	0.879	83%	0.829	S	S	*	*			trans	-176.1	118.9	136.8	-102.8	160.8	23.9	0	0	112.2
310	C	39.1	Very low	33.2	Very low	205 Å²	205	151.4 Å²	151.4	100%	1.385	85%	0.845	S	S	*	*			trans	47.8	0	151.9	-60.4	0	0	0	0	121

Retrieved 310 of 310 residues in 685.6 ms (Link to these results)

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