A0A087YFA7_POEFO Loading...

Claudin

Claudins function as major constituents of the tight junction complexes that regulate the permeability of epithelia.

AlphaFold DB , UniProt , Accession A0A087YFA7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 184 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	78.1	Confident	77.2	Confident	145 Å²	145	52.5 Å²	52.5	71%	0.714	32%	0.318	S	S	*	.				0	144.3	0	-73.4	179.2	-83.4	0	0	110.2	W4 A138 V141	M1-W4 PolarHBondContact O-NE1 3.08Å; M1-A138 HydrophobicContact CB-CB 3.79Å; M1-A138 HydrophobicContact CE-CB 4.24Å; M1-A138 HydrophobicContact SD-CB 4.15Å; M1-V141 HydrophobicContact CE-CB 3.88Å; M1-V141 HydrophobicContact CE-CG1 3.73Å; M1-V141 HydrophobicContact CE-CG2 4.22Å; M1-V141 HydrophobicContact SD-CG2 4.34Å
2	V	82.3	Confident	75.1	Confident	30 Å²	30	54.8 Å²	54.8	18%	0.182	36%	0.36	C	S	.	.			trans	-99.1	-9.1	177.4	-65.5	0	0	0	0	113.8	W4 E22 G23 K26	V2-W4 VanDerWaalsContact C-N 3.31Å; V2-W4 PolarHBondContact O-N 2.98Å; V2-W4 VanDerWaalsContact O-N 3.12Å; V2-E22 CarbonylContact O-C 3.42Å; V2-G23 WeakPolarHBondContact O-CA 3.46Å; V2-G23 PolarHBondContact O-N 3.33Å; V2-K26 HydrophobicContact CG1-CD 3.77Å; V2-K26 HydrophobicContact CG1-CG 3.37Å
3	E	88.9	Confident	73.1	Confident	65 Å²	65	60.5 Å²	60.5	30%	0.304	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	66.1	-176.2	-56.8	-161.9	141.5	0	0	110.1	Y21 G136 S137 A138	E3-Y21 HydrophobicContact CG-CD1 3.9Å; E3-Y21 VanDerWaalsContact OE1-CD1 3.3Å; E3-Y21 WeakPolarHBondContact OE1-CD1 3.32Å; E3-Y21 WeakPolarHBondContact OE1-CE1 3.48Å; E3-G136 CarbonylContact O-C 3.55Å; E3-G136 WeakPolarHBondContact O-CA 3.09Å; E3-S137 WeakPolarHBondContact CB-OG 3.47Å; E3-S137 PolarHBondContact O-N 3.36Å; E3-S137 WeakPolarHBondContact OE2-CB 3.49Å; E3-S137 PolarHBondContact OE2-OG 3.1Å; E3-A138 WeakPolarHBondContact O-CB 3.43Å; E3-A138 PolarHBondContact O-N 3.15Å
4	W	89.7	Confident	71.7	Confident	28 Å²	28	68.7 Å²	68.7	11%	0.106	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-36.5	169.3	-75.1	69	0	0	0	110.6	M1 V2 E22 L24 T54 M58 T111 Y114 G136 A138 L139	M1-W4 PolarHBondContact O-NE1 3.08Å; V2-W4 VanDerWaalsContact C-N 3.31Å; V2-W4 PolarHBondContact O-N 2.98Å; V2-W4 VanDerWaalsContact O-N 3.12Å; W4-E22 WeakPolarHBondContact CB-O 3.3Å; W4-E22 PolarHBondContact N-O 3.25Å; W4-E22 VanDerWaalsContact N-O 3.15Å; W4-L24 HydrophobicContact CD2-CB 4.48Å; W4-L24 HydrophobicContact CD2-CD1 3.76Å; W4-L24 HydrophobicContact CE3-CD1 3.76Å; W4-L24 HydrophobicContact CG-CD1 4.34Å; W4-L24 HydrophobicContact CH2-CD1 4.12Å; W4-L24 HydrophobicContact CH2-CD2 4.1Å; W4-L24 HydrophobicContact CZ2-CB 4.34Å; W4-L24 HydrophobicContact CZ2-CD1 4.16Å; W4-L24 HydrophobicContact CZ2-CD2 3.99Å; W4-L24 HydrophobicContact CZ2-CG 4.4Å; W4-L24 HydrophobicContact CZ3-CD1 3.95Å; W4-T54 HydrophobicContact CH2-CG2 4.07Å; W4-T54 HydrophobicContact CZ3-CG2 3.76Å; W4-M58 HydrophobicContact CH2-CE 3.67Å; W4-M58 HydrophobicContact CH2-CG 4.03Å; W4-M58 HydrophobicContact CH2-SD 4.32Å; W4-M58 HydrophobicContact CZ3-CE 4.23Å; W4-T111 HydrophobicContact CH2-CG2 4.4Å; W4-T111 HydrophobicContact CZ3-CG2 4.22Å; W4-Y114 HydrophobicContact CB-CE1 3.76Å; W4-Y114 AromaticContact CE3-CD1 3.97Å; W4-Y114 HydrophobicContact CE3-CD1 3.97Å; W4-Y114 HydrophobicContact CE3-CE1 4.22Å; W4-Y114 HydrophobicContact CE3-CG 4.13Å; W4-G136 PolarHBondContact O-N 3.42Å; W4-G136 VanDerWaalsContact O-N 3.14Å; W4-A138 HydrophobicContact CD2-CB 4.33Å; W4-A138 HydrophobicContact CG-CB 4.13Å; W4-L139 HydrophobicContact CE3-CD2 3.98Å; W4-L139 HydrophobicContact CE3-CG 4.45Å; W4-L139 HydrophobicContact CZ3-CD2 4.18Å; W4-L139 VanDerWaalsContact O-CD1 3.28Å; W4-L139 WeakPolarHBondContact O-CD1 3.35Å
5	K	88.7	Confident	70.8	Confident	31 Å²	31	73.2 Å²	73.2	14%	0.135	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151.5	164.5	66.1	178.5	-175.7	161.9	0	109.8	E22 V118 Y133 E134	K5-E22 HydrophobicContact CD-CB 4.37Å; K5-E22 VanDerWaalsContact CE-CB 3.48Å; K5-E22 WeakPolarHBondContact CE-OE2 3.16Å; K5-E22 HydrophobicContact CG-CB 3.82Å; K5-E22 PolarHBondContact N-O 3.13Å; K5-E22 VanDerWaalsContact N-O 3.14Å; K5-E22 IonicContact NZ-OE1 3.75Å; K5-E22 IonicContact NZ-OE2 2.74Å; K5-E22 PolarHBondContact NZ-OE2 2.8Å; K5-E22 PolarHBondContact O-N 3.45Å; K5-V118 HydrophobicContact CB-CG1 4.39Å; K5-V118 HydrophobicContact CB-CG2 4.2Å; K5-V118 HydrophobicContact CD-CG2 4.28Å; K5-Y133 HydrophobicContact CB-CD1 4.16Å; K5-Y133 HydrophobicContact CD-CD1 3.53Å; K5-Y133 HydrophobicContact CD-CD2 4.39Å; K5-Y133 HydrophobicContact CD-CE1 4.06Å; K5-Y133 HydrophobicContact CD-CG 3.71Å; K5-Y133 HydrophobicContact CG-CD1 3.62Å; K5-Y133 HydrophobicContact CG-CE1 4.22Å; K5-Y133 HydrophobicContact CG-CG 4.2Å; K5-E134 VanDerWaalsContact CA-O 3.25Å; K5-E134 WeakPolarHBondContact CA-O 3.36Å; K5-E134 WeakPolarHBondContact CB-O 3.34Å
6	A	87.6	Confident	70.2	Confident	19 Å²	19	72.7 Å²	72.7	16%	0.157	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.9	-179.6	0	0	0	0	0	110.1	M20 Y21 Y133 E134	A6-M20 CarbonylContact C-O 3.54Å; A6-M20 WeakPolarHBondContact CA-O 3.34Å; A6-Y21 HydrophobicContact CB-CD1 3.81Å; A6-Y21 HydrophobicContact CB-CE1 4Å; A6-Y133 CarbonylContact O-C 3.54Å; A6-Y133 WeakPolarHBondContact O-CA 3.25Å; A6-E134 PolarHBondContact N-O 3.12Å; A6-E134 PolarHBondContact O-N 3.18Å
7	S	84.3	Confident	69.9	Low	8 Å²	8	72.4 Å²	72.4	6%	0.056	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.9	169.8	68.5	0	0	0	0	110	N9 A19 M20 R132	S7-N9 VanDerWaalsContact C-N 3.35Å; S7-A19 CarbonylContact O-C 3.04Å; S7-A19 WeakPolarHBondContact O-CA 3.41Å; S7-M20 PolarHBondContact N-O 2.92Å; S7-M20 PolarHBondContact O-N 2.93Å; S7-M20 WeakPolarHBondContact OG-CB 3.22Å; S7-R132 WeakPolarHBondContact CB-O 3.48Å
8	S	73.5	Confident	70.2	Confident	105 Å²	105	70.4 Å²	70.4	73%	0.734	44%	0.437	S	S	*	.	S	Bend	trans	-86.3	-5.2	-178.4	179.6	0	0	0	0	113.5	Q18	S8-Q18 CarbonylContact C-O 3.51Å
9	N	64.9	Low	70.8	Confident	69 Å²	69	67.5 Å²	67.5	37%	0.369	42%	0.421	S	S	.	.			trans	-138.2	132.5	-171.8	-148.9	0.9	0	0	0	110.3	S7 N130	S7-N9 VanDerWaalsContact C-N 3.35Å; N9-N130 CarbonylContact C-O 3.55Å; N9-N130 WeakPolarHBondContact CB-O 3.48Å; N9-N130 PolarHBondContact ND2-OD1 2.98Å
10	A	57	Low	71.5	Confident	25 Å²	25	66.2 Å²	66.2	21%	0.207	41%	0.41	C	S	.	.			trans	-139.3	98.7	179.7	0	0	0	0	0	110.7	Q18 M20	A10-Q18 HydrophobicContact CB-CB 4.18Å; A10-M20 HydrophobicContact CB-CE 3.43Å; A10-M20 VanDerWaalsContact CB-CE 3.43Å; A10-M20 HydrophobicContact CB-CG 3.91Å
11	G	53.7	Low	72.3	Confident	52 Å²	52	66.2 Å²	66.2	54%	0.536	40%	0.403	S	S	.	.			trans	99.4	148.9	158.9	0	0	0	0	0	116.2	N13	G11-N13 PolarHBondContact O-N 2.88Å
12	G	51.9	Low	72.7	Confident	80 Å²	80	61 Å²	61	83%	0.825	38%	0.377	S	S	*	.	S	Bend	trans	-66.1	11.6	-177	0	0	0	0	0	116.5
13	N	49.4	Very low	73.1	Confident	130 Å²	130	59.7 Å²	59.7	70%	0.695	37%	0.369	S	S	*	.			trans	-106.4	98.5	172.2	-75.3	-26.8	0	0	0	108.7	G11 V15	G11-N13 PolarHBondContact O-N 2.88Å; N13-V15 PolarHBondContact O-N 3.4Å
14	I	53.7	Low	73	Confident	175 Å²	175	56.7 Å²	56.7	90%	0.897	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-7.5	-178.5	-67	158.6	0	0	0	113.5
15	V	58.3	Low	72.9	Confident	136 Å²	136	62.2 Å²	62.2	82%	0.824	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.6	-171.7	-175.6	0	0	0	0	113.7	N13	N13-V15 PolarHBondContact O-N 3.4Å
16	T	60.7	Low	72.9	Confident	65 Å²	65	65 Å²	65	40%	0.399	39%	0.388	S	S	.	.			trans	-130.7	104.7	176.8	56.7	0	0	0	0	112.2	Q18	T16-Q18 PolarHBondContact O-N 3.44Å
17	A	65.8	Low	73	Confident	68 Å²	68	65.6 Å²	65.6	56%	0.562	39%	0.391	S	S	*	.			trans	-66	122.4	166.8	0	0	0	0	0	109.4	S32	A17-S32 PolarHBondContact O-N 3.21Å
18	Q	75.2	Confident	73.2	Confident	36 Å²	36	65.4 Å²	65.4	17%	0.168	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.8	179.2	-61.5	-179.4	-29.1	0	0	109.4	S8 A10 T16 M20 V29 W30 Q31	S8-Q18 CarbonylContact C-O 3.51Å; A10-Q18 HydrophobicContact CB-CB 4.18Å; T16-Q18 PolarHBondContact O-N 3.44Å; Q18-M20 HydrophobicContact CB-CE 4.3Å; Q18-V29 HydrophobicContact CB-CG1 4.26Å; Q18-W30 CarbonylContact C-O 3.54Å; Q18-W30 VanDerWaalsContact CA-O 3.28Å; Q18-W30 WeakPolarHBondContact CA-O 3.46Å; Q18-Q31 HydrophobicContact CG-CG 4.12Å
19	A	81.7	Confident	73.8	Confident	15 Å²	15	61.8 Å²	61.8	12%	0.124	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.2	171.4	0	0	0	0	0	109.4	S7 Y21 V29 W30	S7-A19 CarbonylContact O-C 3.04Å; S7-A19 WeakPolarHBondContact O-CA 3.41Å; A19-Y21 HydrophobicContact CB-CE2 3.91Å; A19-V29 WeakPolarHBondContact O-CA 3.41Å; A19-W30 HydrophobicContact CB-CB 4.33Å; A19-W30 PolarHBondContact N-O 3.07Å; A19-W30 PolarHBondContact O-N 3.19Å
20	M	84.1	Confident	74.8	Confident	41 Å²	41	64.5 Å²	64.5	20%	0.202	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.2	-179.1	-58.7	-80.6	176.9	0	0	109.2	A6 S7 A10 Q18 V29	A6-M20 CarbonylContact C-O 3.54Å; A6-M20 WeakPolarHBondContact CA-O 3.34Å; S7-M20 PolarHBondContact N-O 2.92Å; S7-M20 PolarHBondContact O-N 2.93Å; S7-M20 WeakPolarHBondContact OG-CB 3.22Å; A10-M20 HydrophobicContact CB-CE 3.43Å; A10-M20 VanDerWaalsContact CB-CE 3.43Å; A10-M20 HydrophobicContact CB-CG 3.91Å; Q18-M20 HydrophobicContact CB-CE 4.3Å; M20-V29 HydrophobicContact CE-CB 4.31Å; M20-V29 HydrophobicContact CE-CG1 3.45Å; M20-V29 VanDerWaalsContact CE-CG1 3.45Å; M20-V29 HydrophobicContact CE-CG2 3.96Å; M20-V29 HydrophobicContact SD-CB 3.81Å; M20-V29 HydrophobicContact SD-CG1 3.47Å; M20-V29 WeakPolarHBondContact SD-CG1 3.39Å; M20-V29 HydrophobicContact SD-CG2 3.22Å; M20-V29 WeakPolarHBondContact SD-CG2 3.28Å
21	Y	87.9	Confident	76	Confident	67 Å²	67	65.2 Å²	65.2	26%	0.263	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.8	176.4	-57.5	-85.1	0	0	0	108.7	E3 A6 A19 S27 C28 W30	E3-Y21 HydrophobicContact CG-CD1 3.9Å; E3-Y21 VanDerWaalsContact OE1-CD1 3.3Å; E3-Y21 WeakPolarHBondContact OE1-CD1 3.32Å; E3-Y21 WeakPolarHBondContact OE1-CE1 3.48Å; A6-Y21 HydrophobicContact CB-CD1 3.81Å; A6-Y21 HydrophobicContact CB-CE1 4Å; A19-Y21 HydrophobicContact CB-CE2 3.91Å; Y21-S27 CarbonylContact O-C 3.56Å; Y21-S27 WeakPolarHBondContact O-CA 3.37Å; Y21-C28 PolarHBondContact N-O 3.17Å; Y21-C28 PolarHBondContact O-N 3.24Å; Y21-W30 HydrophobicContact CE2-CB 4.24Å
22	E	88.4	Confident	77.1	Confident	37 Å²	37	66 Å²	66	17%	0.173	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.1	179.7	-77.2	-177.3	-144	0	0	110.4	V2 W4 K5 Y133	V2-E22 CarbonylContact O-C 3.42Å; W4-E22 WeakPolarHBondContact CB-O 3.3Å; W4-E22 PolarHBondContact N-O 3.25Å; W4-E22 VanDerWaalsContact N-O 3.15Å; K5-E22 HydrophobicContact CD-CB 4.37Å; K5-E22 VanDerWaalsContact CE-CB 3.48Å; K5-E22 WeakPolarHBondContact CE-OE2 3.16Å; K5-E22 HydrophobicContact CG-CB 3.82Å; K5-E22 PolarHBondContact N-O 3.13Å; K5-E22 VanDerWaalsContact N-O 3.14Å; K5-E22 IonicContact NZ-OE1 3.75Å; K5-E22 IonicContact NZ-OE2 2.74Å; K5-E22 PolarHBondContact NZ-OE2 2.8Å; K5-E22 PolarHBondContact O-N 3.45Å; E22-Y133 HydrophobicContact CG-CE1 4.37Å; E22-Y133 WeakPolarHBondContact OE1-CE1 3.1Å; E22-Y133 VanDerWaalsContact OE1-CZ 3.32Å; E22-Y133 PolarHBondContact OE1-OH 2.96Å
23	G	89.5	Confident	78.4	Confident	1 Å²	1	67 Å²	67	1%	0.01	36%	0.355	C	S	.	.			trans	-99.1	178.1	174.7	0	0	0	0	0	111.5	V2 K26 Y41	V2-G23 WeakPolarHBondContact O-CA 3.46Å; V2-G23 PolarHBondContact O-N 3.33Å; G23-K26 VanDerWaalsContact CA-O 3.3Å; G23-K26 WeakPolarHBondContact CA-O 3.35Å; G23-K26 PolarHBondContact N-O 3.44Å; G23-Y41 WeakPolarHBondContact O-CE2 3.41Å; G23-Y41 PolarHBondContact O-OH 3.3Å
24	L	86.4	Confident	79.9	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.016	35%	0.348	C	S	.	.	S	Bend	trans	-65.9	-38.7	174.5	-130.4	69.6	0	0	0	112	W4 I51 T54 R55 M58 Y114	W4-L24 HydrophobicContact CD2-CB 4.48Å; W4-L24 HydrophobicContact CD2-CD1 3.76Å; W4-L24 HydrophobicContact CE3-CD1 3.76Å; W4-L24 HydrophobicContact CG-CD1 4.34Å; W4-L24 HydrophobicContact CH2-CD1 4.12Å; W4-L24 HydrophobicContact CH2-CD2 4.1Å; W4-L24 HydrophobicContact CZ2-CB 4.34Å; W4-L24 HydrophobicContact CZ2-CD1 4.16Å; W4-L24 HydrophobicContact CZ2-CD2 3.99Å; W4-L24 HydrophobicContact CZ2-CG 4.4Å; W4-L24 HydrophobicContact CZ3-CD1 3.95Å; L24-I51 HydrophobicContact CD1-CG2 4.27Å; L24-I51 HydrophobicContact CG-CG2 4.2Å; L24-T54 HydrophobicContact CD1-CG2 3.81Å; L24-T54 HydrophobicContact CD2-CG2 4.04Å; L24-R55 HydrophobicContact CB-CG 4.41Å; L24-R55 HydrophobicContact CD2-CB 4.17Å; L24-R55 HydrophobicContact CD2-CG 3.53Å; L24-R55 HydrophobicContact CG-CG 3.65Å; L24-R55 PolarHBondContact O-NE 3.28Å; L24-R55 PolarHBondContact O-NH2 3.25Å; L24-M58 HydrophobicContact CD2-CG 4.38Å; L24-Y114 HydrophobicContact CD1-CD2 4.21Å; L24-Y114 HydrophobicContact CD1-CE2 4.12Å
25	W	88.5	Confident	81.2	Confident	143 Å²	143	60.4 Å²	60.4	54%	0.542	33%	0.33	S	S	.	.	S	Bend	trans	-112.7	-19	-170.4	-61	96.5	0	0	0	115.3	Y41 R55	W25-Y41 WeakPolarHBondContact O-CD2 3.31Å; W25-Y41 PolarHBondContact O-N 2.99Å; W25-R55 HydrophobicContact CH2-CB 4.34Å; W25-R55 HydrophobicContact CH2-CG 4.2Å; W25-R55 HydrophobicContact CZ2-CB 4.08Å; W25-R55 HydrophobicContact CZ2-CG 3.85Å
26	K	88.8	Confident	82.6	Confident	91 Å²	91	59.2 Å²	59.2	40%	0.396	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	154	179.5	67.3	-175.9	-173.3	177.4	0	110	V2 G23 K39 I40	V2-K26 HydrophobicContact CG1-CD 3.77Å; V2-K26 HydrophobicContact CG1-CG 3.37Å; G23-K26 VanDerWaalsContact CA-O 3.3Å; G23-K26 WeakPolarHBondContact CA-O 3.35Å; G23-K26 PolarHBondContact N-O 3.44Å; K26-K39 CarbonylContact C-O 2.88Å; K26-K39 WeakPolarHBondContact CA-O 2.83Å; K26-K39 WeakPolarHBondContact CB-O 3.47Å; K26-I40 HydrophobicContact CB-CG1 4.19Å
27	S	88.3	Confident	83.8	Confident	30 Å²	30	61.3 Å²	61.3	21%	0.21	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.7	171.3	58.2	0	0	0	0	109.5	Y21 C38 K39	Y21-S27 CarbonylContact O-C 3.56Å; Y21-S27 WeakPolarHBondContact O-CA 3.37Å; S27-C38 CarbonylContact O-C 3.57Å; S27-C38 WeakPolarHBondContact O-CA 3.5Å; S27-K39 PolarHBondContact N-O 3.14Å; S27-K39 PolarHBondContact O-N 3.39Å
28	C	88.9	Confident	84.9	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.034	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.4	177.6	-64.5	0	0	0	0	110.2	Y21 Q37 C38	Y21-C28 PolarHBondContact N-O 3.17Å; Y21-C28 PolarHBondContact O-N 3.24Å; C28-Q37 CarbonylContact C-O 3.55Å; C28-Q37 WeakPolarHBondContact CA-O 3.42Å; C28-C38 HydrophobicContact CB-CB 4.17Å; C28-C38 WeakPolarHBondContact CB-SG 3.48Å; C28-C38 WeakPolarHBondContact SG-CB 3.39Å; C28-C38 CovalentContact SG-SG 2.05Å; C28-C38 PolarHBondContact SG-SG 3.18Å
29	V	87.6	Confident	85.5	Confident	29 Å²	29	65.7 Å²	65.7	18%	0.176	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.8	178	-172.8	0	0	0	0	108.4	Q18 A19 M20 Q31 I36 Q37	Q18-V29 HydrophobicContact CB-CG1 4.26Å; A19-V29 WeakPolarHBondContact O-CA 3.41Å; M20-V29 HydrophobicContact CE-CB 4.31Å; M20-V29 HydrophobicContact CE-CG1 3.45Å; M20-V29 VanDerWaalsContact CE-CG1 3.45Å; M20-V29 HydrophobicContact CE-CG2 3.96Å; M20-V29 HydrophobicContact SD-CB 3.81Å; M20-V29 HydrophobicContact SD-CG1 3.47Å; M20-V29 WeakPolarHBondContact SD-CG1 3.39Å; M20-V29 HydrophobicContact SD-CG2 3.22Å; M20-V29 WeakPolarHBondContact SD-CG2 3.28Å; V29-Q31 HydrophobicContact CG1-CG 4.21Å; V29-I36 WeakPolarHBondContact O-CA 3.44Å; V29-Q37 PolarHBondContact N-O 3.12Å; V29-Q37 PolarHBondContact O-N 3.41Å
30	W	84.9	Confident	85.7	Confident	125 Å²	125	70.6 Å²	70.6	47%	0.473	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.1	172.9	-169.8	86.2	0	0	0	109.1	Q18 A19 Y21	Q18-W30 CarbonylContact C-O 3.54Å; Q18-W30 VanDerWaalsContact CA-O 3.28Å; Q18-W30 WeakPolarHBondContact CA-O 3.46Å; A19-W30 HydrophobicContact CB-CB 4.33Å; A19-W30 PolarHBondContact N-O 3.07Å; A19-W30 PolarHBondContact O-N 3.19Å; Y21-W30 HydrophobicContact CE2-CB 4.24Å
31	Q	82.5	Confident	85.7	Confident	40 Å²	40	70.9 Å²	70.9	19%	0.187	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	149.7	-178	-58.8	-177.1	-41	0	0	110.4	Q18 V29 T33 G34 Q35	Q18-Q31 HydrophobicContact CG-CG 4.12Å; V29-Q31 HydrophobicContact CG1-CG 4.21Å; Q31-T33 PolarHBondContact O-N 3.46Å; Q31-G34 PolarHBondContact O-N 3.47Å; Q31-Q35 PolarHBondContact N-O 3.12Å
32	S	77.1	Confident	84.8	Confident	70 Å²	70	73.5 Å²	73.5	49%	0.49	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-17.4	176.4	58.1	0	0	0	0	114.6	A17 G34	A17-S32 PolarHBondContact O-N 3.21Å; S32-G34 PolarHBondContact O-N 3.42Å
33	T	79.2	Confident	83.8	Confident	101 Å²	101	74.8 Å²	74.8	62%	0.62	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.6	170.8	52.7	0	0	0	0	113.6	Q31 Q35	Q31-T33 PolarHBondContact O-N 3.46Å; T33-Q35 VanDerWaalsContact C-N 3.26Å; T33-Q35 PolarHBondContact O-N 3.27Å
34	G	79.8	Confident	82.4	Confident	52 Å²	52	79.8 Å²	79.8	54%	0.536	42%	0.417	S	S	.	.	S	Bend	trans	80.6	2.9	-178.2	0	0	0	0	0	113.9	Q31 S32	Q31-G34 PolarHBondContact O-N 3.47Å; S32-G34 PolarHBondContact O-N 3.42Å
35	Q	82.6	Confident	81.1	Confident	114 Å²	114	88 Å²	88	53%	0.533	46%	0.46	S	S	.	.			trans	-85.5	135.1	178.1	-65.5	-174.7	-50.5	0	0	111.1	Q31 T33	Q31-Q35 PolarHBondContact N-O 3.12Å; T33-Q35 VanDerWaalsContact C-N 3.26Å; T33-Q35 PolarHBondContact O-N 3.27Å
36	I	85.9	Confident	79.6	Confident	110 Å²	110	89.3 Å²	89.3	56%	0.564	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.4	169.3	-166.9	165.9	0	0	0	109.7	V29	V29-I36 WeakPolarHBondContact O-CA 3.44Å
37	Q	86.1	Confident	78.7	Confident	109 Å²	109	86.1 Å²	86.1	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.9	177.6	-63.8	-172.8	8.4	0	0	109	C28 V29	C28-Q37 CarbonylContact C-O 3.55Å; C28-Q37 WeakPolarHBondContact CA-O 3.42Å; V29-Q37 PolarHBondContact N-O 3.12Å; V29-Q37 PolarHBondContact O-N 3.41Å
38	C	89.7	Confident	78.2	Confident	71 Å²	71	88 Å²	88	48%	0.48	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.3	176.3	-69.3	0	0	0	0	110.2	S27 C28	S27-C38 CarbonylContact O-C 3.57Å; S27-C38 WeakPolarHBondContact O-CA 3.5Å; C28-C38 HydrophobicContact CB-CB 4.17Å; C28-C38 WeakPolarHBondContact CB-SG 3.48Å; C28-C38 WeakPolarHBondContact SG-CB 3.39Å; C28-C38 CovalentContact SG-SG 2.05Å; C28-C38 PolarHBondContact SG-SG 3.18Å
39	K	87.4	Confident	77.7	Confident	126 Å²	126	92.6 Å²	92.6	55%	0.548	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.2	176.7	-171	175.1	178	-176.7	0	110.3	K26 S27 D42	K26-K39 CarbonylContact C-O 2.88Å; K26-K39 WeakPolarHBondContact CA-O 2.83Å; K26-K39 WeakPolarHBondContact CB-O 3.47Å; S27-K39 PolarHBondContact N-O 3.14Å; S27-K39 PolarHBondContact O-N 3.39Å; K39-D42 WeakPolarHBondContact CE-OD2 3.23Å; K39-D42 IonicContact NZ-OD2 2.87Å; K39-D42 PolarHBondContact NZ-OD2 2.92Å
40	I	87.1	Confident	77.4	Confident	118 Å²	118	93 Å²	93	61%	0.605	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	144.7	172.3	-61.5	163.1	0	0	0	107.8	K26 D42	K26-I40 HydrophobicContact CB-CG1 4.19Å; I40-D42 PolarHBondContact O-N 3.34Å; I40-D42 VanDerWaalsContact O-N 3.07Å
41	Y	82.9	Confident	77.4	Confident	47 Å²	47	87.3 Å²	87.3	18%	0.184	48%	0.483	C	S	.	.			trans	-69.5	108.4	176.6	-61.2	-69.5	0	0	0	110.1	G23 W25 S43 L47 R55	G23-Y41 WeakPolarHBondContact O-CE2 3.41Å; G23-Y41 PolarHBondContact O-OH 3.3Å; W25-Y41 WeakPolarHBondContact O-CD2 3.31Å; W25-Y41 PolarHBondContact O-N 2.99Å; Y41-S43 VanDerWaalsContact C-N 3.31Å; Y41-S43 PolarHBondContact O-N 3.49Å; Y41-L47 HydrophobicContact CD1-CD1 3.44Å; Y41-L47 VanDerWaalsContact CD1-CD1 3.44Å; Y41-L47 HydrophobicContact CD2-CD1 4.19Å; Y41-L47 HydrophobicContact CD2-CD2 4.19Å; Y41-L47 HydrophobicContact CE1-CD1 3.72Å; Y41-L47 HydrophobicContact CE2-CD1 4.41Å; Y41-L47 HydrophobicContact CG-CD1 3.69Å; Y41-L47 HydrophobicContact CG-CD2 4.25Å; Y41-R55 VanDerWaalsContact CD2-NH2 3.26Å
42	D	68.6	Low	77.7	Confident	122 Å²	122	90.3 Å²	90.3	65%	0.652	50%	0.497	S	S	*	.	S	Bend	trans	-68.8	-23.6	-173.5	-67.3	-41.6	0	0	0	113.9	K39 I40	K39-D42 WeakPolarHBondContact CE-OD2 3.23Å; K39-D42 IonicContact NZ-OD2 2.87Å; K39-D42 PolarHBondContact NZ-OD2 2.92Å; I40-D42 PolarHBondContact O-N 3.34Å; I40-D42 VanDerWaalsContact O-N 3.07Å
43	S	67.1	Low	78.2	Confident	63 Å²	63	88 Å²	88	44%	0.441	48%	0.484	S	S	.	.			trans	-136.4	119.6	-176.1	-71.2	0	0	0	0	111.7	Y41 L45	Y41-S43 VanDerWaalsContact C-N 3.31Å; Y41-S43 PolarHBondContact O-N 3.49Å; S43-L45 PolarHBondContact O-N 2.98Å
44	L	61.4	Low	78.8	Confident	106 Å²	106	83.2 Å²	83.2	56%	0.555	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-64	-28.1	174.7	-65.5	175.2	0	0	0	112.3
45	L	58	Low	79.3	Confident	176 Å²	176	81.5 Å²	81.5	92%	0.921	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-77.6	-21.7	-175	-157.6	70.8	0	0	0	113.7	S43	S43-L45 PolarHBondContact O-N 2.98Å
46	Q	57	Low	79.8	Confident	171 Å²	171	79 Å²	79	80%	0.799	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-94.7	-4.6	-179.2	-165.5	171.9	-12.1	0	0	112.4
47	L	70.8	Confident	80.1	Confident	24 Å²	24	75.6 Å²	75.6	13%	0.126	41%	0.414	C	S	.	.	S	Bend	trans	-87.7	140.6	-176	-149.8	65.9	0	0	0	110.2	Y41 I51	Y41-L47 HydrophobicContact CD1-CD1 3.44Å; Y41-L47 VanDerWaalsContact CD1-CD1 3.44Å; Y41-L47 HydrophobicContact CD2-CD1 4.19Å; Y41-L47 HydrophobicContact CD2-CD2 4.19Å; Y41-L47 HydrophobicContact CE1-CD1 3.72Å; Y41-L47 HydrophobicContact CE2-CD1 4.41Å; Y41-L47 HydrophobicContact CG-CD1 3.69Å; Y41-L47 HydrophobicContact CG-CD2 4.25Å; L47-I51 HydrophobicContact CD1-CD1 4.26Å; L47-I51 HydrophobicContact CD2-CB 3.99Å; L47-I51 HydrophobicContact CD2-CD1 4.41Å; L47-I51 HydrophobicContact CD2-CG2 3.52Å; L47-I51 HydrophobicContact CG-CB 4.16Å; L47-I51 HydrophobicContact CG-CD1 4.05Å; L47-I51 HydrophobicContact CG-CG2 4.2Å
48	P	77	Confident	80.5	Confident	69 Å²	69	71.9 Å²	71.9	45%	0.448	40%	0.397	S	S	.	.			trans	-61.6	142.6	-178.6	28.1	-39	0	0	0	111.2	N50 I51 Q52	P48-N50 WeakPolarHBondContact CB-OD1 3.28Å; P48-N50 VanDerWaalsContact CG-OD1 3.3Å; P48-N50 WeakPolarHBondContact CG-OD1 3.32Å; P48-N50 PolarHBondContact O-N 3.48Å; P48-N50 VanDerWaalsContact O-N 3.1Å; P48-N50 PolarHBondContact O-OD1 3.23Å; P48-I51 HydrophobicContact CG-CD1 3.6Å; P48-I51 HydrophobicContact CG-CG1 3.92Å; P48-I51 PolarHBondContact O-N 3.24Å; P48-Q52 PolarHBondContact O-N 2.92Å
49	S	79.6	Confident	80.7	Confident	102 Å²	102	70.6 Å²	70.6	71%	0.713	39%	0.388	S	S	*	.	H	α-helix	trans	-59.2	-26.7	-170.7	56.8	0	0	0	0	113.7	Q52 G53	S49-Q52 PolarHBondContact O-N 3.27Å; S49-G53 PolarHBondContact O-N 3.46Å
50	N	81.3	Confident	81.1	Confident	36 Å²	36	66.6 Å²	66.6	19%	0.193	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-45.3	172.5	60.7	-16	0	0	0	112.2	P48 G53 T54	P48-N50 WeakPolarHBondContact CB-OD1 3.28Å; P48-N50 VanDerWaalsContact CG-OD1 3.3Å; P48-N50 WeakPolarHBondContact CG-OD1 3.32Å; P48-N50 PolarHBondContact O-N 3.48Å; P48-N50 VanDerWaalsContact O-N 3.1Å; P48-N50 PolarHBondContact O-OD1 3.23Å; N50-G53 PolarHBondContact O-N 2.95Å; N50-T54 PolarHBondContact O-N 2.92Å; N50-T54 PolarHBondContact O-OG1 3.45Å; N50-T54 VanDerWaalsContact O-OG1 3.07Å
51	I	85.4	Confident	81.5	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-66.4	-42.5	-180	-60.7	177.8	0	0	0	109.7	L24 L47 P48 T54 R55 Y114	L24-I51 HydrophobicContact CD1-CG2 4.27Å; L24-I51 HydrophobicContact CG-CG2 4.2Å; L47-I51 HydrophobicContact CD1-CD1 4.26Å; L47-I51 HydrophobicContact CD2-CB 3.99Å; L47-I51 HydrophobicContact CD2-CD1 4.41Å; L47-I51 HydrophobicContact CD2-CG2 3.52Å; L47-I51 HydrophobicContact CG-CB 4.16Å; L47-I51 HydrophobicContact CG-CD1 4.05Å; L47-I51 HydrophobicContact CG-CG2 4.2Å; P48-I51 HydrophobicContact CG-CD1 3.6Å; P48-I51 HydrophobicContact CG-CG1 3.92Å; P48-I51 PolarHBondContact O-N 3.24Å; I51-T54 PolarHBondContact O-N 2.97Å; I51-R55 HydrophobicContact CG2-CG 4.46Å; I51-R55 VanDerWaalsContact O-CG 3.3Å; I51-R55 WeakPolarHBondContact O-CG 3.48Å; I51-R55 PolarHBondContact O-N 2.65Å; I51-Y114 HydrophobicContact CG1-CE2 4.12Å
52	Q	87.8	Confident	82.1	Confident	103 Å²	103	64.6 Å²	64.6	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-43	178.2	-169	174	6.9	0	0	111.9	P48 S49 R55 A56	P48-Q52 PolarHBondContact O-N 2.92Å; S49-Q52 PolarHBondContact O-N 3.27Å; Q52-R55 PolarHBondContact O-N 3.32Å; Q52-A56 PolarHBondContact O-N 3.17Å
53	G	88.1	Confident	83.5	Confident	22 Å²	22	65.6 Å²	65.6	23%	0.227	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-47.8	174.3	0	0	0	0	0	112.2	S49 N50 R55 A56 L57	S49-G53 PolarHBondContact O-N 3.46Å; N50-G53 PolarHBondContact O-N 2.95Å; G53-R55 VanDerWaalsContact C-N 3.35Å; G53-R55 PolarHBondContact O-N 3.11Å; G53-A56 PolarHBondContact O-N 3.39Å; G53-L57 WeakPolarHBondContact O-CG 3.13Å; G53-L57 PolarHBondContact O-N 3.23Å
54	T	90.4	Very high	84.9	Confident	1 Å²	1	65 Å²	65	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-63.5	-38	176.7	-57.1	0	0	0	0	112.1	W4 L24 N50 I51 L57 M58 G110 Y114	W4-T54 HydrophobicContact CH2-CG2 4.07Å; W4-T54 HydrophobicContact CZ3-CG2 3.76Å; L24-T54 HydrophobicContact CD1-CG2 3.81Å; L24-T54 HydrophobicContact CD2-CG2 4.04Å; N50-T54 PolarHBondContact O-N 2.92Å; N50-T54 PolarHBondContact O-OG1 3.45Å; N50-T54 VanDerWaalsContact O-OG1 3.07Å; I51-T54 PolarHBondContact O-N 2.97Å; T54-L57 PolarHBondContact O-N 2.96Å; T54-M58 HydrophobicContact CG2-CG 4.27Å; T54-M58 WeakPolarHBondContact O-CB 3.24Å; T54-M58 VanDerWaalsContact O-CG 3.23Å; T54-M58 WeakPolarHBondContact O-CG 3.27Å; T54-M58 PolarHBondContact O-N 3.4Å; T54-G110 WeakPolarHBondContact CG2-O 3.37Å; T54-G110 PolarHBondContact OG1-O 2.98Å; T54-Y114 HydrophobicContact CG2-CD2 4.43Å
55	R	91.9	Very high	86.5	Confident	15 Å²	15	61 Å²	61	6%	0.057	34%	0.343	C	S	.	.	H	α-helix	trans	-59.9	-48.1	174.3	-75.3	177	-177.9	-168.1	7.5	111.4	L24 W25 Y41 I51 Q52 G53 L57 M58 C59	L24-R55 HydrophobicContact CB-CG 4.41Å; L24-R55 HydrophobicContact CD2-CB 4.17Å; L24-R55 HydrophobicContact CD2-CG 3.53Å; L24-R55 HydrophobicContact CG-CG 3.65Å; L24-R55 PolarHBondContact O-NE 3.28Å; L24-R55 PolarHBondContact O-NH2 3.25Å; W25-R55 HydrophobicContact CH2-CB 4.34Å; W25-R55 HydrophobicContact CH2-CG 4.2Å; W25-R55 HydrophobicContact CZ2-CB 4.08Å; W25-R55 HydrophobicContact CZ2-CG 3.85Å; Y41-R55 VanDerWaalsContact CD2-NH2 3.26Å; I51-R55 HydrophobicContact CG2-CG 4.46Å; I51-R55 VanDerWaalsContact O-CG 3.3Å; I51-R55 WeakPolarHBondContact O-CG 3.48Å; I51-R55 PolarHBondContact O-N 2.65Å; Q52-R55 PolarHBondContact O-N 3.32Å; G53-R55 VanDerWaalsContact C-N 3.35Å; G53-R55 PolarHBondContact O-N 3.11Å; R55-L57 PolarHBondContact O-N 3.42Å; R55-M58 PolarHBondContact O-N 2.98Å; R55-C59 WeakPolarHBondContact O-CB 3.27Å; R55-C59 PolarHBondContact O-N 3.34Å; R55-C59 PolarHBondContact O-SG 2.75Å; R55-C59 VanDerWaalsContact O-SG 3.36Å
56	A	91.8	Very high	88.3	Confident	63 Å²	63	58.4 Å²	58.4	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-46.3	-179.7	0	0	0	0	0	111.4	Q52 G53 M58 C59 A60	Q52-A56 PolarHBondContact O-N 3.17Å; G53-A56 PolarHBondContact O-N 3.39Å; A56-M58 PolarHBondContact O-N 2.88Å; A56-C59 PolarHBondContact O-N 3.23Å; A56-A60 VanDerWaalsContact O-CB 3.28Å; A56-A60 WeakPolarHBondContact O-CB 3.25Å; A56-A60 PolarHBondContact O-N 3.15Å
57	L	93.1	Very high	90.2	Very high	38 Å²	38	54.2 Å²	54.2	20%	0.199	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-43.1	176.9	-70.6	171.1	0	0	0	112.1	G53 T54 R55 A60 A61 L106 I109 W113	G53-L57 WeakPolarHBondContact O-CG 3.13Å; G53-L57 PolarHBondContact O-N 3.23Å; T54-L57 PolarHBondContact O-N 2.96Å; R55-L57 PolarHBondContact O-N 3.42Å; L57-A60 PolarHBondContact O-N 3.1Å; L57-A61 VanDerWaalsContact O-CB 3.32Å; L57-A61 WeakPolarHBondContact O-CB 3.44Å; L57-A61 PolarHBondContact O-N 2.95Å; L57-L106 HydrophobicContact CD2-CD2 4.07Å; L57-I109 HydrophobicContact CD1-CG2 4.34Å; L57-W113 HydrophobicContact CD1-CE3 4.28Å
58	M	93.7	Very high	91.3	Very high	30 Å²	30	53.1 Å²	53.1	15%	0.148	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-45.4	178.3	-73.7	-62.5	169.4	0	0	112.5	W4 L24 T54 R55 A56 A61 I62 A107 T111	W4-M58 HydrophobicContact CH2-CE 3.67Å; W4-M58 HydrophobicContact CH2-CG 4.03Å; W4-M58 HydrophobicContact CH2-SD 4.32Å; W4-M58 HydrophobicContact CZ3-CE 4.23Å; L24-M58 HydrophobicContact CD2-CG 4.38Å; T54-M58 HydrophobicContact CG2-CG 4.27Å; T54-M58 WeakPolarHBondContact O-CB 3.24Å; T54-M58 VanDerWaalsContact O-CG 3.23Å; T54-M58 WeakPolarHBondContact O-CG 3.27Å; T54-M58 PolarHBondContact O-N 3.4Å; R55-M58 PolarHBondContact O-N 2.98Å; A56-M58 PolarHBondContact O-N 2.88Å; M58-A61 PolarHBondContact O-N 3.46Å; M58-I62 WeakPolarHBondContact O-CD1 3.5Å; M58-I62 VanDerWaalsContact O-CG1 3.26Å; M58-I62 WeakPolarHBondContact O-CG1 3.44Å; M58-I62 PolarHBondContact O-N 3.21Å; M58-A107 WeakPolarHBondContact CE-O 2.72Å; M58-A107 HydrophobicContact SD-CB 4.44Å; M58-T111 HydrophobicContact CE-CG2 3.21Å
59	C	94.6	Very high	92.1	Very high	45 Å²	45	54.5 Å²	54.5	30%	0.304	30%	0.302	S	S	.	.	H	α-helix	trans	-60.8	-47.9	175.5	-71.8	0	0	0	0	110.7	R55 A56 A61 I62 F63	R55-C59 WeakPolarHBondContact O-CB 3.27Å; R55-C59 PolarHBondContact O-N 3.34Å; R55-C59 PolarHBondContact O-SG 2.75Å; R55-C59 VanDerWaalsContact O-SG 3.36Å; A56-C59 PolarHBondContact O-N 3.23Å; C59-A61 VanDerWaalsContact C-N 3.35Å; C59-A61 PolarHBondContact O-N 2.93Å; C59-I62 PolarHBondContact O-N 3.36Å; C59-F63 WeakPolarHBondContact O-CD2 3.19Å; C59-F63 PolarHBondContact O-N 3.24Å
60	A	95.6	Very high	92.7	Very high	41 Å²	41	54.3 Å²	54.3	34%	0.339	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-44.2	177.6	0	0	0	0	0	112.1	A56 L57 I62 F63 L64	A56-A60 VanDerWaalsContact O-CB 3.28Å; A56-A60 WeakPolarHBondContact O-CB 3.25Å; A56-A60 PolarHBondContact O-N 3.15Å; L57-A60 PolarHBondContact O-N 3.1Å; A60-I62 PolarHBondContact O-N 2.97Å; A60-F63 PolarHBondContact O-N 3.48Å; A60-L64 WeakPolarHBondContact O-CB 3.28Å; A60-L64 WeakPolarHBondContact O-CG 3.48Å; A60-L64 PolarHBondContact O-N 3.38Å
61	A	95.8	Very high	93.2	Very high	5 Å²	5	54.4 Å²	54.4	4%	0.041	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-44	175.8	0	0	0	0	0	112	L57 M58 C59 L64 C65 A103 L106 A107	L57-A61 VanDerWaalsContact O-CB 3.32Å; L57-A61 WeakPolarHBondContact O-CB 3.44Å; L57-A61 PolarHBondContact O-N 2.95Å; M58-A61 PolarHBondContact O-N 3.46Å; C59-A61 VanDerWaalsContact C-N 3.35Å; C59-A61 PolarHBondContact O-N 2.93Å; A61-L64 PolarHBondContact O-N 3.45Å; A61-C65 WeakPolarHBondContact O-CB 3.42Å; A61-C65 PolarHBondContact O-N 3Å; A61-C65 PolarHBondContact O-SG 3.38Å; A61-C65 VanDerWaalsContact O-SG 3.39Å; A61-A103 WeakPolarHBondContact CB-O 3.43Å; A61-L106 HydrophobicContact CB-CB 4.27Å; A61-A107 HydrophobicContact CB-CB 4.01Å
62	I	95.6	Very high	93.4	Very high	118 Å²	118	55 Å²	55	61%	0.605	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-45.5	177.2	-67.6	163.5	0	0	0	111.1	M58 C59 A60 L64 C65 F66	M58-I62 WeakPolarHBondContact O-CD1 3.5Å; M58-I62 VanDerWaalsContact O-CG1 3.26Å; M58-I62 WeakPolarHBondContact O-CG1 3.44Å; M58-I62 PolarHBondContact O-N 3.21Å; C59-I62 PolarHBondContact O-N 3.36Å; A60-I62 PolarHBondContact O-N 2.97Å; I62-L64 PolarHBondContact O-N 3.13Å; I62-C65 PolarHBondContact O-N 2.68Å; I62-F66 PolarHBondContact O-N 3.01Å
63	F	97.2	Very high	93.4	Very high	144 Å²	144	53.6 Å²	53.6	63%	0.632	30%	0.295	S	S	*	.	H	α-helix	trans	-61.3	-43.4	177.1	-82.5	-70.7	0	0	0	112	C59 A60 F66 I67	C59-F63 WeakPolarHBondContact O-CD2 3.19Å; C59-F63 PolarHBondContact O-N 3.24Å; A60-F63 PolarHBondContact O-N 3.48Å; F63-F66 PolarHBondContact O-N 2.98Å; F63-I67 WeakPolarHBondContact O-CG1 3.32Å; F63-I67 PolarHBondContact O-N 2.9Å
64	L	96.1	Very high	93.4	Very high	50 Å²	50	55.5 Å²	55.5	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-67.4	-38.8	177.4	-70.5	171.8	0	0	0	112.4	A60 A61 I62 F66 I67 S68 I99 I102 A103 L106	A60-L64 WeakPolarHBondContact O-CB 3.28Å; A60-L64 WeakPolarHBondContact O-CG 3.48Å; A60-L64 PolarHBondContact O-N 3.38Å; A61-L64 PolarHBondContact O-N 3.45Å; I62-L64 PolarHBondContact O-N 3.13Å; L64-F66 VanDerWaalsContact C-N 3.31Å; L64-F66 PolarHBondContact O-N 2.97Å; L64-I67 PolarHBondContact O-N 3.47Å; L64-S68 VanDerWaalsContact O-CB 3.24Å; L64-S68 WeakPolarHBondContact O-CB 3.48Å; L64-S68 PolarHBondContact O-N 3.36Å; L64-I99 HydrophobicContact CB-CG2 4.36Å; L64-I99 HydrophobicContact CD2-CG2 4.28Å; L64-I102 HydrophobicContact CD1-CG2 4.49Å; L64-A103 HydrophobicContact CB-CB 3.72Å; L64-L106 HydrophobicContact CD1-CD1 3.5Å; L64-L106 VanDerWaalsContact CD1-CD1 3.5Å
65	C	96.2	Very high	92.9	Very high	22 Å²	22	55.8 Å²	55.8	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-42	172.4	-78.3	0	0	0	0	111.6	A61 I62 S68 M69 F100 A103	A61-C65 WeakPolarHBondContact O-CB 3.42Å; A61-C65 PolarHBondContact O-N 3Å; A61-C65 PolarHBondContact O-SG 3.38Å; A61-C65 VanDerWaalsContact O-SG 3.39Å; I62-C65 PolarHBondContact O-N 2.68Å; C65-S68 PolarHBondContact O-N 3.48Å; C65-M69 WeakPolarHBondContact O-CG 3.49Å; C65-M69 PolarHBondContact O-N 3.48Å; C65-F100 HydrophobicContact CB-CE2 4.19Å; C65-A103 WeakPolarHBondContact SG-CB 3.5Å
66	F	96.4	Very high	92.4	Very high	121 Å²	121	58.9 Å²	58.9	53%	0.531	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-47.9	176.8	-179.2	-100.8	0	0	0	111.8	I62 F63 L64 S68 M69 M70	I62-F66 PolarHBondContact O-N 3.01Å; F63-F66 PolarHBondContact O-N 2.98Å; L64-F66 VanDerWaalsContact C-N 3.31Å; L64-F66 PolarHBondContact O-N 2.97Å; F66-S68 VanDerWaalsContact C-N 3.34Å; F66-S68 PolarHBondContact O-N 3.44Å; F66-M69 PolarHBondContact O-N 3.46Å; F66-M70 HydrophobicContact CE1-CG 4.22Å; F66-M70 HydrophobicContact CZ-CG 4.27Å; F66-M70 HydrophobicContact CZ-SD 4.42Å; F66-M70 WeakPolarHBondContact O-CG 3.46Å; F66-M70 PolarHBondContact O-N 2.86Å; F66-M70 VanDerWaalsContact O-N 3.11Å
67	I	95.6	Very high	91.4	Very high	84 Å²	84	62.8 Å²	62.8	43%	0.431	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-46	176.2	-66.3	166.4	0	0	0	110.4	F63 L64 M69 M70 V71	F63-I67 WeakPolarHBondContact O-CG1 3.32Å; F63-I67 PolarHBondContact O-N 2.9Å; L64-I67 PolarHBondContact O-N 3.47Å; I67-M69 VanDerWaalsContact C-N 3.34Å; I67-M69 PolarHBondContact O-N 3.32Å; I67-M70 PolarHBondContact O-N 3.34Å; I67-V71 HydrophobicContact CG2-CG2 4.24Å; I67-V71 VanDerWaalsContact O-CG2 3.28Å; I67-V71 WeakPolarHBondContact O-CG2 3.39Å; I67-V71 PolarHBondContact O-N 3.46Å
68	S	94.7	Very high	90.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.6	-41.8	177.9	168.8	0	0	0	0	112.3	L64 C65 F66 V71 T72 G96 F100	L64-S68 VanDerWaalsContact O-CB 3.24Å; L64-S68 WeakPolarHBondContact O-CB 3.48Å; L64-S68 PolarHBondContact O-N 3.36Å; C65-S68 PolarHBondContact O-N 3.48Å; F66-S68 VanDerWaalsContact C-N 3.34Å; F66-S68 PolarHBondContact O-N 3.44Å; S68-V71 PolarHBondContact O-N 3.48Å; S68-T72 VanDerWaalsContact O-CB 3.27Å; S68-T72 WeakPolarHBondContact O-CB 3.24Å; S68-T72 PolarHBondContact O-N 2.93Å; S68-T72 PolarHBondContact O-OG1 3.34Å; S68-G96 PolarHBondContact OG-O 3.1Å; S68-F100 VanDerWaalsContact OG-CB 3.23Å; S68-F100 WeakPolarHBondContact OG-CB 3.3Å; S68-F100 VanDerWaalsContact OG-CD2 3.27Å; S68-F100 WeakPolarHBondContact OG-CD2 3.22Å; S68-F100 PolarHBondContact OG-N 2.93Å
69	M	93.1	Very high	89.2	Confident	98 Å²	98	67.3 Å²	67.3	48%	0.483	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-45.8	175.5	-80.5	-169.9	-84.5	0	0	111.4	C65 F66 I67 V71 T72 V73	C65-M69 WeakPolarHBondContact O-CG 3.49Å; C65-M69 PolarHBondContact O-N 3.48Å; F66-M69 PolarHBondContact O-N 3.46Å; I67-M69 VanDerWaalsContact C-N 3.34Å; I67-M69 PolarHBondContact O-N 3.32Å; M69-V71 PolarHBondContact O-N 3.37Å; M69-T72 PolarHBondContact O-N 3.3Å; M69-V73 WeakPolarHBondContact O-CB 3.23Å; M69-V73 VanDerWaalsContact O-CG2 3.25Å; M69-V73 WeakPolarHBondContact O-CG2 3.41Å; M69-V73 PolarHBondContact O-N 2.71Å
70	M	92.6	Very high	87.9	Confident	98 Å²	98	71.4 Å²	71.4	48%	0.483	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-45.9	176.7	-64.9	-63.9	97.4	0	0	112	F66 I67 V73 V74	F66-M70 HydrophobicContact CE1-CG 4.22Å; F66-M70 HydrophobicContact CZ-CG 4.27Å; F66-M70 HydrophobicContact CZ-SD 4.42Å; F66-M70 WeakPolarHBondContact O-CG 3.46Å; F66-M70 PolarHBondContact O-N 2.86Å; F66-M70 VanDerWaalsContact O-N 3.11Å; I67-M70 PolarHBondContact O-N 3.34Å; M70-V73 PolarHBondContact O-N 2.82Å; M70-V74 WeakPolarHBondContact O-CG2 3.38Å; M70-V74 PolarHBondContact O-N 3.47Å
71	V	91.1	Very high	86.2	Confident	39 Å²	39	72.7 Å²	72.7	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-62.9	-44.4	178.1	173.5	0	0	0	0	111	I67 S68 M69 V74 G75 V92	I67-V71 HydrophobicContact CG2-CG2 4.24Å; I67-V71 VanDerWaalsContact O-CG2 3.28Å; I67-V71 WeakPolarHBondContact O-CG2 3.39Å; I67-V71 PolarHBondContact O-N 3.46Å; S68-V71 PolarHBondContact O-N 3.48Å; M69-V71 PolarHBondContact O-N 3.37Å; V71-V74 PolarHBondContact O-N 2.82Å; V71-G75 PolarHBondContact O-N 3.42Å; V71-G75 VanDerWaalsContact O-N 3.11Å; V71-V92 HydrophobicContact CG1-CG1 3.82Å; V71-V92 WeakPolarHBondContact CG1-O 3.13Å; V71-V92 WeakPolarHBondContact O-CG1 3.34Å
72	T	89.7	Confident	84.4	Confident	17 Å²	17	77.7 Å²	77.7	10%	0.104	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-45	179.6	-56.7	0	0	0	0	111.1	S68 M69 V74 G75 L76 L156	S68-T72 VanDerWaalsContact O-CB 3.27Å; S68-T72 WeakPolarHBondContact O-CB 3.24Å; S68-T72 PolarHBondContact O-N 2.93Å; S68-T72 PolarHBondContact O-OG1 3.34Å; M69-T72 PolarHBondContact O-N 3.3Å; T72-V74 VanDerWaalsContact C-N 3.27Å; T72-V74 PolarHBondContact O-N 2.9Å; T72-G75 WeakPolarHBondContact O-CA 3.48Å; T72-G75 PolarHBondContact O-N 3.41Å; T72-L76 WeakPolarHBondContact O-CG 3.43Å; T72-L76 PolarHBondContact O-N 3.37Å; T72-L156 HydrophobicContact CG2-CD1 3.82Å; T72-L156 HydrophobicContact CG2-CD2 3.77Å; T72-L156 HydrophobicContact CG2-CG 4.44Å
73	V	89.1	Confident	82.9	Confident	74 Å²	74	75.4 Å²	75.4	45%	0.448	42%	0.418	S	S	.	.	H	α-helix	trans	-59.3	-37.6	178.5	168.7	0	0	0	0	112.1	M69 M70 G75 T79	M69-V73 WeakPolarHBondContact O-CB 3.23Å; M69-V73 VanDerWaalsContact O-CG2 3.25Å; M69-V73 WeakPolarHBondContact O-CG2 3.41Å; M69-V73 PolarHBondContact O-N 2.71Å; M70-V73 PolarHBondContact O-N 2.82Å; V73-G75 VanDerWaalsContact C-N 3.33Å; V73-T79 WeakPolarHBondContact O-CB 3.26Å; V73-T79 PolarHBondContact O-OG1 3.25Å
74	V	86.5	Confident	81.5	Confident	62 Å²	62	77.4 Å²	77.4	38%	0.376	43%	0.429	S	S	.	.	H	α-helix	trans	-70.3	-30.6	175.3	175.8	0	0	0	0	111.9	M70 V71 T72 C81 V92	M70-V74 WeakPolarHBondContact O-CG2 3.38Å; M70-V74 PolarHBondContact O-N 3.47Å; V71-V74 PolarHBondContact O-N 2.82Å; T72-V74 VanDerWaalsContact C-N 3.27Å; T72-V74 PolarHBondContact O-N 2.9Å; V74-C81 HydrophobicContact CG1-CB 4.4Å; V74-V92 HydrophobicContact CG1-CG1 4.47Å
75	G	81.2	Confident	80.5	Confident	7 Å²	7	79.5 Å²	79.5	7%	0.072	44%	0.437	C	S	.	.	H	α-helix	trans	-80.1	-12.1	179.4	0	0	0	0	0	115.6	V71 T72 V73	V71-G75 PolarHBondContact O-N 3.42Å; V71-G75 VanDerWaalsContact O-N 3.11Å; T72-G75 WeakPolarHBondContact O-CA 3.48Å; T72-G75 PolarHBondContact O-N 3.41Å; V73-G75 VanDerWaalsContact C-N 3.33Å
76	L	81.6	Confident	79.5	Confident	81 Å²	81	82.8 Å²	82.8	42%	0.424	46%	0.458	S	S	.	.	S	Bend	trans	-72	145.5	-179.4	-69.3	172.1	0	0	0	112.3	T72 C78 T79	T72-L76 WeakPolarHBondContact O-CG 3.43Å; T72-L76 PolarHBondContact O-N 3.37Å; L76-C78 PolarHBondContact O-N 3.31Å; L76-T79 PolarHBondContact O-N 3.17Å; L76-T79 VanDerWaalsContact O-N 3.17Å
77	E	70.3	Confident	78.6	Confident	145 Å²	145	82.8 Å²	82.8	68%	0.678	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.3	180	-64.7	-167.4	136	0	0	112.8	T79 K163	E77-T79 PolarHBondContact O-N 3.36Å; E77-K163 IonicContact OE1-NZ 2.65Å; E77-K163 PolarHBondContact OE1-NZ 3.34Å; E77-K163 IonicContact OE2-NZ 3.93Å
78	C	65.5	Low	77.8	Confident	129 Å²	129	82.8 Å²	82.8	87%	0.872	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.6	177.5	-58.3	0	0	0	0	114.5	L76	L76-C78 PolarHBondContact O-N 3.31Å
79	T	74.1	Confident	77.2	Confident	34 Å²	34	84 Å²	84	21%	0.209	46%	0.463	C	S	.	.			trans	-98.1	124.6	-178	-59.9	0	0	0	0	110.3	V73 L76 E77 C81 K89	V73-T79 WeakPolarHBondContact O-CB 3.26Å; V73-T79 PolarHBondContact O-OG1 3.25Å; L76-T79 PolarHBondContact O-N 3.17Å; L76-T79 VanDerWaalsContact O-N 3.17Å; E77-T79 PolarHBondContact O-N 3.36Å; T79-C81 HydrophobicContact CG2-CB 3.84Å; T79-C81 PolarHBondContact O-N 3.17Å; T79-K89 PolarHBondContact O-NZ 3.47Å
80	T	68.1	Low	76.7	Confident	130 Å²	130	80.6 Å²	80.6	80%	0.798	45%	0.449	S	S	*	.			trans	-69.3	-14.2	-178.5	21.3	0	0	0	0	114.3	M82 A83	T80-M82 PolarHBondContact O-N 3.3Å; T80-A83 PolarHBondContact O-N 2.93Å
81	C	59.3	Low	76.4	Confident	68 Å²	68	83 Å²	83	46%	0.459	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	125.9	171.6	-56.7	0	0	0	0	109.9	V74 T79 K89	V74-C81 HydrophobicContact CG1-CB 4.4Å; T79-C81 HydrophobicContact CG2-CB 3.84Å; T79-C81 PolarHBondContact O-N 3.17Å; C81-K89 WeakPolarHBondContact O-CE 3.32Å; C81-K89 PolarHBondContact O-NZ 3.02Å
82	M	59.3	Low	76.2	Confident	111 Å²	111	83.4 Å²	83.4	55%	0.547	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	37.4	-179.4	-59.6	-142.6	172.4	0	0	116.5	T80 E84 Q85 K89	T80-M82 PolarHBondContact O-N 3.3Å; M82-E84 PolarHBondContact O-N 3.49Å; M82-E84 VanDerWaalsContact O-N 3.14Å; M82-Q85 PolarHBondContact O-N 3.22Å; M82-K89 VanDerWaalsContact C-CE 3.46Å; M82-K89 HydrophobicContact CB-CG 4.27Å; M82-K89 WeakPolarHBondContact O-CE 3.44Å
83	A	64.2	Low	76.2	Confident	70 Å²	70	83 Å²	83	58%	0.579	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.7	177.1	0	0	0	0	0	114.3	T80 Q85	T80-A83 PolarHBondContact O-N 2.93Å; A83-Q85 VanDerWaalsContact C-N 3.34Å; A83-Q85 PolarHBondContact O-N 3.11Å
84	E	66.6	Low	76.2	Confident	186 Å²	186	82.5 Å²	82.5	87%	0.869	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-12.7	-174.8	-62.4	178	126.2	0	0	114	M82	M82-E84 PolarHBondContact O-N 3.49Å; M82-E84 VanDerWaalsContact O-N 3.14Å
85	Q	74.9	Confident	76.5	Confident	94 Å²	94	81.7 Å²	81.7	44%	0.439	45%	0.452	S	S	.	.			trans	-136.6	81.6	-173.7	-60.3	-167.9	24.5	0	0	113.4	M82 A83 Q87 Q88 K89	M82-Q85 PolarHBondContact O-N 3.22Å; A83-Q85 VanDerWaalsContact C-N 3.34Å; A83-Q85 PolarHBondContact O-N 3.11Å; Q85-Q87 PolarHBondContact O-N 2.95Å; Q85-Q88 HydrophobicContact CB-CB 4.16Å; Q85-Q88 HydrophobicContact CB-CG 4.22Å; Q85-Q88 PolarHBondContact O-N 2.78Å; Q85-K89 PolarHBondContact O-N 3.33Å
86	P	74.7	Confident	77.1	Confident	90 Å²	90	81.3 Å²	81.3	58%	0.584	45%	0.448	S	S	*	.	H	α-helix	trans	-62.6	-28.6	-177.1	24.7	-34.3	0	0	0	113.5	K89 S90	P86-K89 PolarHBondContact O-N 3.25Å; P86-S90 PolarHBondContact O-N 3.45Å
87	Q	77.8	Confident	77.7	Confident	121 Å²	121	77.5 Å²	77.5	57%	0.565	43%	0.428	S	S	*	.	H	α-helix	trans	-66.8	-36.4	176	-66.5	-73	-57	0	0	112.3	Q85 K91	Q85-Q87 PolarHBondContact O-N 2.95Å; Q87-K91 WeakPolarHBondContact O-CG 3.45Å; Q87-K91 PolarHBondContact O-N 3.42Å
88	Q	80.3	Confident	78.9	Confident	85 Å²	85	73.7 Å²	73.7	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-73.4	-39.1	176.2	-72	-168.3	-2.2	0	0	111.2	Q85 S90 K91 V92	Q85-Q88 HydrophobicContact CB-CB 4.16Å; Q85-Q88 HydrophobicContact CB-CG 4.22Å; Q85-Q88 PolarHBondContact O-N 2.78Å; Q88-S90 VanDerWaalsContact C-N 3.35Å; Q88-S90 PolarHBondContact O-N 2.86Å; Q88-K91 PolarHBondContact O-N 2.87Å; Q88-V92 VanDerWaalsContact O-CG2 3.3Å; Q88-V92 WeakPolarHBondContact O-CG2 3.27Å; Q88-V92 PolarHBondContact O-N 2.91Å
89	K	80.9	Confident	80.3	Confident	25 Å²	25	69.8 Å²	69.8	11%	0.109	39%	0.385	C	S	.	.	H	α-helix	trans	-55.7	-46.9	174.8	-73.6	-174.7	153.5	-172.3	0	112.8	T79 C81 M82 Q85 P86 K91 V92 A93	T79-K89 PolarHBondContact O-NZ 3.47Å; C81-K89 WeakPolarHBondContact O-CE 3.32Å; C81-K89 PolarHBondContact O-NZ 3.02Å; M82-K89 VanDerWaalsContact C-CE 3.46Å; M82-K89 HydrophobicContact CB-CG 4.27Å; M82-K89 WeakPolarHBondContact O-CE 3.44Å; Q85-K89 PolarHBondContact O-N 3.33Å; P86-K89 PolarHBondContact O-N 3.25Å; K89-K91 PolarHBondContact O-N 3.22Å; K89-V92 PolarHBondContact O-N 3.49Å; K89-A93 PolarHBondContact O-N 3.3Å
90	S	82.9	Confident	81.3	Confident	27 Å²	27	70 Å²	70	19%	0.189	38%	0.383	C	S	.	.	H	α-helix	trans	-62.5	-40.4	178.4	-178.7	0	0	0	0	112.5	P86 Q88 A93 L94	P86-S90 PolarHBondContact O-N 3.45Å; Q88-S90 VanDerWaalsContact C-N 3.35Å; Q88-S90 PolarHBondContact O-N 2.86Å; S90-A93 PolarHBondContact O-N 3.34Å; S90-L94 WeakPolarHBondContact O-CB 3.38Å; S90-L94 PolarHBondContact O-N 3.29Å
91	K	85.9	Confident	82.7	Confident	148 Å²	148	66.1 Å²	66.1	64%	0.643	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-39.4	175.2	-70	179.2	-179.6	-174	0	112.5	Q87 Q88 K89 L94 A95	Q87-K91 WeakPolarHBondContact O-CG 3.45Å; Q87-K91 PolarHBondContact O-N 3.42Å; Q88-K91 PolarHBondContact O-N 2.87Å; K89-K91 PolarHBondContact O-N 3.22Å; K91-L94 PolarHBondContact O-N 2.98Å; K91-A95 WeakPolarHBondContact O-CB 3.11Å; K91-A95 PolarHBondContact O-N 2.93Å
92	V	88.3	Confident	84.5	Confident	48 Å²	48	67 Å²	67	29%	0.291	36%	0.356	S	S	.	.	H	α-helix	trans	-66.5	-44.5	177.2	173	0	0	0	0	110.8	V71 V74 Q88 K89 L94 A95 G96	V71-V92 HydrophobicContact CG1-CG1 3.82Å; V71-V92 WeakPolarHBondContact CG1-O 3.13Å; V71-V92 WeakPolarHBondContact O-CG1 3.34Å; V74-V92 HydrophobicContact CG1-CG1 4.47Å; Q88-V92 VanDerWaalsContact O-CG2 3.3Å; Q88-V92 WeakPolarHBondContact O-CG2 3.27Å; Q88-V92 PolarHBondContact O-N 2.91Å; K89-V92 PolarHBondContact O-N 3.49Å; V92-L94 PolarHBondContact O-N 3.17Å; V92-A95 PolarHBondContact O-N 3.41Å; V92-G96 PolarHBondContact O-N 3.41Å
93	A	88.6	Confident	86.3	Confident	8 Å²	8	61.7 Å²	61.7	7%	0.066	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-43.3	174.6	0	0	0	0	0	112.2	K89 S90 G96 G97	K89-A93 PolarHBondContact O-N 3.3Å; S90-A93 PolarHBondContact O-N 3.34Å; A93-G96 PolarHBondContact O-N 3.07Å; A93-G97 PolarHBondContact O-N 2.92Å
94	L	90.3	Very high	87.8	Confident	64 Å²	64	58.4 Å²	58.4	34%	0.335	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-45.7	174.6	179.5	65.1	0	0	0	111.6	S90 K91 V92 G96 G97 V98 C157	S90-L94 WeakPolarHBondContact O-CB 3.38Å; S90-L94 PolarHBondContact O-N 3.29Å; K91-L94 PolarHBondContact O-N 2.98Å; V92-L94 PolarHBondContact O-N 3.17Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 2.95Å; L94-G97 PolarHBondContact O-N 2.87Å; L94-V98 WeakPolarHBondContact O-CG2 3.26Å; L94-V98 PolarHBondContact O-N 3.44Å; L94-C157 HydrophobicContact CD1-CB 3.79Å
95	A	92.2	Very high	89.3	Confident	44 Å²	44	52.4 Å²	52.4	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-41.7	176.7	0	0	0	0	0	111.6	K91 V92 G97 V98 I99	K91-A95 WeakPolarHBondContact O-CB 3.11Å; K91-A95 PolarHBondContact O-N 2.93Å; V92-A95 PolarHBondContact O-N 3.41Å; A95-G97 PolarHBondContact O-N 3.42Å; A95-V98 PolarHBondContact O-N 3.14Å; A95-I99 WeakPolarHBondContact O-CD1 3.33Å; A95-I99 WeakPolarHBondContact O-CG1 3.42Å; A95-I99 PolarHBondContact O-N 3.41Å
96	G	93.3	Very high	90.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-48.2	173.4	0	0	0	0	0	112.2	S68 V92 A93 L94 I99 F100	S68-G96 PolarHBondContact OG-O 3.1Å; V92-G96 PolarHBondContact O-N 3.41Å; A93-G96 PolarHBondContact O-N 3.07Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 2.95Å; G96-I99 PolarHBondContact O-N 3.45Å; G96-F100 PolarHBondContact O-N 3.42Å
97	G	93.8	Very high	91.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-45.4	176	0	0	0	0	0	113.3	A93 L94 A95 I99 F100 I101	A93-G97 PolarHBondContact O-N 2.92Å; L94-G97 PolarHBondContact O-N 2.87Å; A95-G97 PolarHBondContact O-N 3.42Å; G97-I99 PolarHBondContact O-N 3.41Å; G97-F100 VanDerWaalsContact O-CB 3.31Å; G97-F100 WeakPolarHBondContact O-CB 3.14Å; G97-F100 PolarHBondContact O-N 3.05Å; G97-F100 VanDerWaalsContact O-N 3.13Å; G97-I101 WeakPolarHBondContact O-CG1 3.41Å; G97-I101 PolarHBondContact O-N 2.96Å
98	V	95.2	Very high	92.1	Very high	66 Å²	66	43.3 Å²	43.3	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-44.5	177.4	173.1	0	0	0	0	111.4	L94 A95 F100 I101 I102	L94-V98 WeakPolarHBondContact O-CG2 3.26Å; L94-V98 PolarHBondContact O-N 3.44Å; A95-V98 PolarHBondContact O-N 3.14Å; V98-F100 VanDerWaalsContact C-N 3.25Å; V98-F100 PolarHBondContact O-N 3.36Å; V98-I101 PolarHBondContact O-N 2.88Å; V98-I102 HydrophobicContact CG1-CD1 3.97Å; V98-I102 WeakPolarHBondContact O-CG1 3.43Å; V98-I102 PolarHBondContact O-N 3.46Å
99	I	95.4	Very high	92.9	Very high	46 Å²	46	43.3 Å²	43.3	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-36.6	176.4	-62.5	163.1	0	0	0	110.4	L64 A95 G96 G97 I102 A103	L64-I99 HydrophobicContact CB-CG2 4.36Å; L64-I99 HydrophobicContact CD2-CG2 4.28Å; A95-I99 WeakPolarHBondContact O-CD1 3.33Å; A95-I99 WeakPolarHBondContact O-CG1 3.42Å; A95-I99 PolarHBondContact O-N 3.41Å; G96-I99 PolarHBondContact O-N 3.45Å; G97-I99 PolarHBondContact O-N 3.41Å; I99-I102 PolarHBondContact O-N 3.02Å; I99-A103 WeakPolarHBondContact O-CB 3.3Å; I99-A103 PolarHBondContact O-N 3.36Å
100	F	96	Very high	93.5	Very high	38 Å²	38	42.1 Å²	42.1	17%	0.167	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-41.5	176.7	-149.3	-123	0	0	0	112.2	C65 S68 G96 G97 V98 A103 G104 C149	C65-F100 HydrophobicContact CB-CE2 4.19Å; S68-F100 VanDerWaalsContact OG-CB 3.23Å; S68-F100 WeakPolarHBondContact OG-CB 3.3Å; S68-F100 VanDerWaalsContact OG-CD2 3.27Å; S68-F100 WeakPolarHBondContact OG-CD2 3.22Å; S68-F100 PolarHBondContact OG-N 2.93Å; G96-F100 PolarHBondContact O-N 3.42Å; G97-F100 VanDerWaalsContact O-CB 3.31Å; G97-F100 WeakPolarHBondContact O-CB 3.14Å; G97-F100 PolarHBondContact O-N 3.05Å; G97-F100 VanDerWaalsContact O-N 3.13Å; V98-F100 VanDerWaalsContact C-N 3.25Å; V98-F100 PolarHBondContact O-N 3.36Å; F100-A103 PolarHBondContact O-N 2.89Å; F100-G104 PolarHBondContact O-N 3.32Å; F100-C149 HydrophobicContact CD1-CB 4.34Å; F100-C149 WeakPolarHBondContact CD1-O 3.47Å; F100-C149 HydrophobicContact CE1-CB 4.03Å; F100-C149 HydrophobicContact CZ-CB 4.36Å
101	I	96.9	Very high	94	Very high	50 Å²	50	40.9 Å²	40.9	26%	0.256	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-47.2	174.8	-64.8	171.1	0	0	0	110.1	G97 V98 A103 G104 V105	G97-I101 WeakPolarHBondContact O-CG1 3.41Å; G97-I101 PolarHBondContact O-N 2.96Å; V98-I101 PolarHBondContact O-N 2.88Å; I101-A103 VanDerWaalsContact C-N 3.3Å; I101-A103 PolarHBondContact O-N 2.97Å; I101-G104 PolarHBondContact O-N 3.45Å; I101-V105 HydrophobicContact CG2-CG2 4.34Å; I101-V105 WeakPolarHBondContact O-CG2 3.49Å; I101-V105 PolarHBondContact O-N 3.5Å
102	I	96.8	Very high	94.4	Very high	85 Å²	85	36 Å²	36	44%	0.436	21%	0.207	S	C	.	.	H	α-helix	trans	-58.9	-44.2	178.5	-66.4	166	0	0	0	110.5	L64 V98 I99 G104 V105 L106	L64-I102 HydrophobicContact CD1-CG2 4.49Å; V98-I102 HydrophobicContact CG1-CD1 3.97Å; V98-I102 WeakPolarHBondContact O-CG1 3.43Å; V98-I102 PolarHBondContact O-N 3.46Å; I99-I102 PolarHBondContact O-N 3.02Å; I102-G104 PolarHBondContact O-N 3.28Å; I102-V105 PolarHBondContact O-N 3.3Å; I102-L106 HydrophobicContact CG2-CD1 4.19Å; I102-L106 WeakPolarHBondContact O-CG 3.32Å; I102-L106 PolarHBondContact O-N 3.02Å
103	A	97	Very high	94.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-44.1	176.6	0	0	0	0	0	112.1	A61 L64 C65 I99 F100 I101 L106 A107	A61-A103 WeakPolarHBondContact CB-O 3.43Å; L64-A103 HydrophobicContact CB-CB 3.72Å; C65-A103 WeakPolarHBondContact SG-CB 3.5Å; I99-A103 WeakPolarHBondContact O-CB 3.3Å; I99-A103 PolarHBondContact O-N 3.36Å; F100-A103 PolarHBondContact O-N 2.89Å; I101-A103 VanDerWaalsContact C-N 3.3Å; I101-A103 PolarHBondContact O-N 2.97Å; A103-L106 PolarHBondContact O-N 2.94Å; A103-A107 PolarHBondContact O-N 3Å
104	G	96.8	Very high	94.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-42.8	174.9	0	0	0	0	0	113	F100 I101 I102 A107 L108 A146	F100-G104 PolarHBondContact O-N 3.32Å; I101-G104 PolarHBondContact O-N 3.45Å; I102-G104 PolarHBondContact O-N 3.28Å; G104-A107 PolarHBondContact O-N 3.43Å; G104-L108 WeakPolarHBondContact O-CB 3.28Å; G104-L108 PolarHBondContact O-N 3.39Å; G104-A146 WeakPolarHBondContact O-CB 3.49Å
105	V	97.2	Very high	94.9	Very high	60 Å²	60	36.3 Å²	36.3	36%	0.364	20%	0.197	S	C	.	.	H	α-helix	trans	-64.3	-41.6	176.7	171.7	0	0	0	0	111.4	I101 I102 A107 L108 I109 I150	I101-V105 HydrophobicContact CG2-CG2 4.34Å; I101-V105 WeakPolarHBondContact O-CG2 3.49Å; I101-V105 PolarHBondContact O-N 3.5Å; I102-V105 PolarHBondContact O-N 3.3Å; V105-A107 PolarHBondContact O-N 2.9Å; V105-L108 WeakPolarHBondContact O-CB 3.27Å; V105-L108 PolarHBondContact O-N 2.89Å; V105-I109 HydrophobicContact CG1-CD1 3.77Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 VanDerWaalsContact O-CG1 3.28Å; V105-I109 WeakPolarHBondContact O-CG1 3.33Å; V105-I109 PolarHBondContact O-N 3.2Å; V105-I150 HydrophobicContact CG2-CD1 4.05Å; V105-I150 HydrophobicContact CG2-CG1 4.28Å
106	L	95.8	Very high	94.9	Very high	43 Å²	43	39.2 Å²	39.2	23%	0.225	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-42.1	175.8	-72.7	170.7	0	0	0	112.1	L57 A61 L64 I102 A103 L108 I109 G110	L57-L106 HydrophobicContact CD2-CD2 4.07Å; A61-L106 HydrophobicContact CB-CB 4.27Å; L64-L106 HydrophobicContact CD1-CD1 3.5Å; L64-L106 VanDerWaalsContact CD1-CD1 3.5Å; I102-L106 HydrophobicContact CG2-CD1 4.19Å; I102-L106 WeakPolarHBondContact O-CG 3.32Å; I102-L106 PolarHBondContact O-N 3.02Å; A103-L106 PolarHBondContact O-N 2.94Å; L106-L108 VanDerWaalsContact C-N 3.34Å; L106-I109 PolarHBondContact O-N 3.39Å; L106-G110 PolarHBondContact O-N 2.97Å
107	A	95.4	Very high	94.7	Very high	17 Å²	17	44.1 Å²	44.1	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-39.9	174	0	0	0	0	0	111.8	M58 A61 A103 G104 V105 G110 T111 A146	M58-A107 WeakPolarHBondContact CE-O 2.72Å; M58-A107 HydrophobicContact SD-CB 4.44Å; A61-A107 HydrophobicContact CB-CB 4.01Å; A103-A107 PolarHBondContact O-N 3Å; G104-A107 PolarHBondContact O-N 3.43Å; V105-A107 PolarHBondContact O-N 2.9Å; A107-G110 PolarHBondContact O-N 2.98Å; A107-T111 PolarHBondContact O-N 3.2Å; A107-T111 PolarHBondContact O-OG1 3.12Å; A107-A146 HydrophobicContact CB-CB 4.25Å
108	L	96.3	Very high	94.5	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.288	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-45	176.2	-169.6	63.5	0	0	0	111.6	G104 V105 L106 T111 S112 A146 I150	G104-L108 WeakPolarHBondContact O-CB 3.28Å; G104-L108 PolarHBondContact O-N 3.39Å; V105-L108 WeakPolarHBondContact O-CB 3.27Å; V105-L108 PolarHBondContact O-N 2.89Å; L106-L108 VanDerWaalsContact C-N 3.34Å; L108-T111 PolarHBondContact O-OG1 3.32Å; L108-T111 VanDerWaalsContact O-OG1 3.07Å; L108-S112 WeakPolarHBondContact O-CB 3.3Å; L108-S112 PolarHBondContact O-N 2.82Å; L108-S112 PolarHBondContact O-OG 3.35Å; L108-A146 HydrophobicContact CB-CB 3.89Å; L108-A146 HydrophobicContact CD1-CB 4.13Å; L108-I150 HydrophobicContact CD2-CD1 4.36Å
109	I	95.4	Very high	94.2	Very high	85 Å²	85	42.6 Å²	42.6	44%	0.436	22%	0.215	S	C	.	.	H	α-helix	trans	-62.1	-45.9	176.6	-68.3	166.3	0	0	0	110	L57 V105 L106 S112 W113	L57-I109 HydrophobicContact CD1-CG2 4.34Å; V105-I109 HydrophobicContact CG1-CD1 3.77Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 VanDerWaalsContact O-CG1 3.28Å; V105-I109 WeakPolarHBondContact O-CG1 3.33Å; V105-I109 PolarHBondContact O-N 3.2Å; L106-I109 PolarHBondContact O-N 3.39Å; I109-S112 PolarHBondContact O-N 3.42Å; I109-W113 WeakPolarHBondContact O-CB 3.36Å; I109-W113 PolarHBondContact O-N 3.37Å
110	G	93.5	Very high	93.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-46.8	-179.6	0	0	0	0	0	113.5	T54 L106 A107 Y114	T54-G110 WeakPolarHBondContact CG2-O 3.37Å; T54-G110 PolarHBondContact OG1-O 2.98Å; L106-G110 PolarHBondContact O-N 2.97Å; A107-G110 PolarHBondContact O-N 2.98Å; G110-Y114 WeakPolarHBondContact O-CB 3.33Å; G110-Y114 PolarHBondContact O-N 3.46Å
111	T	93.8	Very high	93.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-44.7	176	41.7	0	0	0	0	112.4	W4 M58 A107 L108 Y114 G115 L139 W143	W4-T111 HydrophobicContact CH2-CG2 4.4Å; W4-T111 HydrophobicContact CZ3-CG2 4.22Å; M58-T111 HydrophobicContact CE-CG2 3.21Å; A107-T111 PolarHBondContact O-N 3.2Å; A107-T111 PolarHBondContact O-OG1 3.12Å; L108-T111 PolarHBondContact O-OG1 3.32Å; L108-T111 VanDerWaalsContact O-OG1 3.07Å; T111-Y114 PolarHBondContact O-N 2.87Å; T111-G115 PolarHBondContact O-N 3.29Å; T111-L139 HydrophobicContact CG2-CD2 4.29Å; T111-L139 WeakPolarHBondContact O-CD2 3.13Å; T111-W143 VanDerWaalsContact OG1-CD1 3.24Å
112	S	94.4	Very high	92.8	Very high	47 Å²	47	47.3 Å²	47.3	33%	0.329	24%	0.237	S	C	.	.	H	α-helix	trans	-69.3	-37.1	-177	-56	0	0	0	0	112	L108 I109 G115 H116 W143	L108-S112 WeakPolarHBondContact O-CB 3.3Å; L108-S112 PolarHBondContact O-N 2.82Å; L108-S112 PolarHBondContact O-OG 3.35Å; I109-S112 PolarHBondContact O-N 3.42Å; S112-G115 PolarHBondContact O-N 3.44Å; S112-H116 VanDerWaalsContact O-CB 3.27Å; S112-H116 WeakPolarHBondContact O-CB 3.32Å; S112-H116 PolarHBondContact O-N 2.68Å; S112-W143 PolarHBondContact OG-NE1 3.22Å
113	W	94	Very high	92.3	Very high	118 Å²	118	52.3 Å²	52.3	45%	0.447	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-45.9	173.5	-174.4	8.4	0	0	0	111.1	L57 I109 G115 H116 R117	L57-W113 HydrophobicContact CD1-CE3 4.28Å; I109-W113 WeakPolarHBondContact O-CB 3.36Å; I109-W113 PolarHBondContact O-N 3.37Å; W113-G115 PolarHBondContact O-N 3.48Å; W113-H116 PolarHBondContact O-N 3.31Å; W113-R117 PolarHBondContact O-N 2.78Å; W113-R117 VanDerWaalsContact O-N 3.12Å
114	Y	91.6	Very high	91.7	Very high	5 Å²	5	54 Å²	54	2%	0.02	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-49.6	175.6	-172.7	-85.6	0	0	0	111.3	W4 L24 I51 T54 G110 T111 H116 R117 V118 L139	W4-Y114 HydrophobicContact CB-CE1 3.76Å; W4-Y114 AromaticContact CE3-CD1 3.97Å; W4-Y114 HydrophobicContact CE3-CD1 3.97Å; W4-Y114 HydrophobicContact CE3-CE1 4.22Å; W4-Y114 HydrophobicContact CE3-CG 4.13Å; L24-Y114 HydrophobicContact CD1-CD2 4.21Å; L24-Y114 HydrophobicContact CD1-CE2 4.12Å; I51-Y114 HydrophobicContact CG1-CE2 4.12Å; T54-Y114 HydrophobicContact CG2-CD2 4.43Å; G110-Y114 WeakPolarHBondContact O-CB 3.33Å; G110-Y114 PolarHBondContact O-N 3.46Å; T111-Y114 PolarHBondContact O-N 2.87Å; Y114-H116 PolarHBondContact O-N 2.87Å; Y114-R117 PolarHBondContact O-N 3.47Å; Y114-V118 HydrophobicContact CD1-CG2 3.96Å; Y114-V118 HydrophobicContact CE1-CG2 3.63Å; Y114-V118 WeakPolarHBondContact O-CG2 2.88Å; Y114-V118 PolarHBondContact O-N 3.37Å; Y114-V118 VanDerWaalsContact O-N 3.1Å; Y114-L139 HydrophobicContact CD1-CD1 4.13Å; Y114-L139 HydrophobicContact CD1-CD2 3.95Å; Y114-L139 HydrophobicContact CD1-CG 4.39Å; Y114-L139 HydrophobicContact CE1-CD1 4.5Å
115	G	91.4	Very high	90.9	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-59.6	-43.4	177.2	0	0	0	0	0	112.6	T111 S112 W113 R117 V118 A119 F135	T111-G115 PolarHBondContact O-N 3.29Å; S112-G115 PolarHBondContact O-N 3.44Å; W113-G115 PolarHBondContact O-N 3.48Å; G115-R117 VanDerWaalsContact C-N 3.27Å; G115-R117 PolarHBondContact O-N 2.97Å; G115-V118 PolarHBondContact O-N 3.32Å; G115-V118 VanDerWaalsContact O-N 3.15Å; G115-A119 PolarHBondContact O-N 3.45Å; G115-F135 VanDerWaalsContact O-CE1 3.32Å; G115-F135 WeakPolarHBondContact O-CE1 3.42Å
116	H	92.2	Very high	89.9	Confident	105 Å²	105	62.2 Å²	62.2	49%	0.486	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-39	177.4	-176.1	71	0	0	0	112.2	S112 W113 Y114 A119 Q120	S112-H116 VanDerWaalsContact O-CB 3.27Å; S112-H116 WeakPolarHBondContact O-CB 3.32Å; S112-H116 PolarHBondContact O-N 2.68Å; W113-H116 PolarHBondContact O-N 3.31Å; Y114-H116 PolarHBondContact O-N 2.87Å; H116-A119 PolarHBondContact O-N 3.07Å; H116-Q120 PolarHBondContact NE2-NE2 2.98Å; H116-Q120 WeakPolarHBondContact O-CG 3.14Å; H116-Q120 PolarHBondContact O-N 3.24Å
117	R	90.1	Very high	88.9	Confident	104 Å²	104	61.5 Å²	61.5	39%	0.392	32%	0.318	S	S	.	.	H	α-helix	trans	-66.5	-44.3	174.9	-68.3	-56.4	-167	-176	2.5	112.4	W113 Y114 G115 A119 Q120 D121	W113-R117 PolarHBondContact O-N 2.78Å; W113-R117 VanDerWaalsContact O-N 3.12Å; Y114-R117 PolarHBondContact O-N 3.47Å; G115-R117 VanDerWaalsContact C-N 3.27Å; G115-R117 PolarHBondContact O-N 2.97Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.91Å; R117-Q120 PolarHBondContact O-N 2.83Å; R117-D121 VanDerWaalsContact O-CG 3.31Å; R117-D121 PolarHBondContact O-N 2.94Å
118	V	88.7	Confident	87.9	Confident	9 Å²	9	64.6 Å²	64.6	6%	0.055	34%	0.336	C	S	.	.	H	α-helix	trans	-59.1	-41.5	175.4	176.2	0	0	0	0	111	K5 Y114 G115 D121 F122 F135	K5-V118 HydrophobicContact CB-CG1 4.39Å; K5-V118 HydrophobicContact CB-CG2 4.2Å; K5-V118 HydrophobicContact CD-CG2 4.28Å; Y114-V118 HydrophobicContact CD1-CG2 3.96Å; Y114-V118 HydrophobicContact CE1-CG2 3.63Å; Y114-V118 WeakPolarHBondContact O-CG2 2.88Å; Y114-V118 PolarHBondContact O-N 3.37Å; Y114-V118 VanDerWaalsContact O-N 3.1Å; G115-V118 PolarHBondContact O-N 3.32Å; G115-V118 VanDerWaalsContact O-N 3.15Å; V118-D121 PolarHBondContact O-N 3.48Å; V118-F122 WeakPolarHBondContact O-CB 3.49Å; V118-F122 PolarHBondContact O-N 2.92Å; V118-F135 HydrophobicContact CB-CD1 4.38Å; V118-F135 HydrophobicContact CB-CE1 4.15Å; V118-F135 HydrophobicContact CG1-CD1 4.14Å; V118-F135 HydrophobicContact CG1-CE1 4.21Å
119	A	89.6	Confident	86.6	Confident	25 Å²	25	66.5 Å²	66.5	21%	0.207	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-46.6	175.5	0	0	0	0	0	111.9	G115 H116 R117 D121 F122 Y123 F135	G115-A119 PolarHBondContact O-N 3.45Å; H116-A119 PolarHBondContact O-N 3.07Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.91Å; A119-D121 VanDerWaalsContact C-N 3.31Å; A119-D121 PolarHBondContact O-N 3.14Å; A119-F122 WeakPolarHBondContact O-CB 3.38Å; A119-F122 PolarHBondContact O-N 3.39Å; A119-Y123 WeakPolarHBondContact O-CD2 3.39Å; A119-Y123 PolarHBondContact O-N 2.95Å; A119-Y123 VanDerWaalsContact O-N 3.12Å; A119-F135 HydrophobicContact CB-CZ 4.01Å
120	Q	89.3	Confident	85.2	Confident	79 Å²	79	66.6 Å²	66.6	37%	0.369	35%	0.352	S	S	.	.	H	α-helix	trans	-58.3	-44.6	176.9	-76.4	-179.2	-29.2	0	0	111.8	H116 R117 F122 Y123 S124	H116-Q120 PolarHBondContact NE2-NE2 2.98Å; H116-Q120 WeakPolarHBondContact O-CG 3.14Å; H116-Q120 PolarHBondContact O-N 3.24Å; R117-Q120 PolarHBondContact O-N 2.83Å; Q120-F122 VanDerWaalsContact C-N 3.28Å; Q120-F122 PolarHBondContact O-N 3.47Å; Q120-Y123 PolarHBondContact O-N 3.23Å; Q120-S124 PolarHBondContact O-N 3.45Å
121	D	85.5	Confident	84	Confident	87 Å²	87	68.7 Å²	68.7	47%	0.465	37%	0.366	S	S	.	.	H	α-helix	trans	-65	-33.8	178.9	-67.7	-20	0	0	0	111.6	R117 V118 A119 T127	R117-D121 VanDerWaalsContact O-CG 3.31Å; R117-D121 PolarHBondContact O-N 2.94Å; V118-D121 PolarHBondContact O-N 3.48Å; A119-D121 VanDerWaalsContact C-N 3.31Å; A119-D121 PolarHBondContact O-N 3.14Å; D121-T127 VanDerWaalsContact O-CB 3.28Å; D121-T127 WeakPolarHBondContact O-CB 3.28Å; D121-T127 PolarHBondContact O-OG1 3.41Å
122	F	85.3	Confident	83.3	Confident	66 Å²	66	73.1 Å²	73.1	29%	0.289	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-41.3	176.2	-170.2	-86.8	0	0	0	112.8	V118 A119 Q120 R132 Y133 E134	V118-F122 WeakPolarHBondContact O-CB 3.49Å; V118-F122 PolarHBondContact O-N 2.92Å; A119-F122 WeakPolarHBondContact O-CB 3.38Å; A119-F122 PolarHBondContact O-N 3.39Å; Q120-F122 VanDerWaalsContact C-N 3.28Å; Q120-F122 PolarHBondContact O-N 3.47Å; F122-R132 HydrophobicContact CD2-CB 3.74Å; F122-R132 HydrophobicContact CD2-CG 4.28Å; F122-R132 HydrophobicContact CE2-CB 3.8Å; F122-R132 HydrophobicContact CE2-CG 4.42Å; F122-Y133 WeakPolarHBondContact CD2-O 3.11Å; F122-E134 HydrophobicContact CE2-CG 4.45Å
123	Y	84.9	Confident	82.8	Confident	191 Å²	191	73.7 Å²	73.7	75%	0.749	38%	0.379	S	S	*	.	H	α-helix	trans	-86.8	-9.9	-179	-69.8	-70.8	0	0	0	114.1	A119 Q120	A119-Y123 WeakPolarHBondContact O-CD2 3.39Å; A119-Y123 PolarHBondContact O-N 2.95Å; A119-Y123 VanDerWaalsContact O-N 3.12Å; Q120-Y123 PolarHBondContact O-N 3.23Å
124	S	84.5	Confident	82.6	Confident	34 Å²	34	74.1 Å²	74.1	24%	0.238	39%	0.386	C	S	.	.			trans	-67.6	130.7	-179.9	-172.4	0	0	0	0	111.5	Q120 S126 T127	Q120-S124 PolarHBondContact O-N 3.45Å; S124-S126 PolarHBondContact O-N 3.38Å; S124-S126 PolarHBondContact OG-N 2.64Å; S124-S126 PolarHBondContact OG-OG 3.07Å; S124-T127 PolarHBondContact O-N 2.78Å; S124-T127 VanDerWaalsContact O-N 3.13Å
125	P	79.4	Confident	82.5	Confident	136 Å²	136	77.7 Å²	77.7	88%	0.883	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.1	175.9	26.9	-33.5	0	0	0	112.9	T127	P125-T127 VanDerWaalsContact C-N 3.28Å; P125-T127 PolarHBondContact O-N 2.74Å
126	S	77.2	Confident	82.4	Confident	99 Å²	99	77.8 Å²	77.8	69%	0.692	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.4	175.4	64.3	0	0	0	0	113.8	S124 P128	S124-S126 PolarHBondContact O-N 3.38Å; S124-S126 PolarHBondContact OG-N 2.64Å; S124-S126 PolarHBondContact OG-OG 3.07Å; S126-P128 WeakPolarHBondContact O-CD 3.33Å
127	T	75.2	Confident	82.3	Confident	28 Å²	28	75 Å²	75	17%	0.172	40%	0.395	C	S	.	.	S	Bend	trans	-93.5	115.5	-176.9	-52.7	0	0	0	0	109.9	D121 S124 P125 T129 R132	D121-T127 VanDerWaalsContact O-CB 3.28Å; D121-T127 WeakPolarHBondContact O-CB 3.28Å; D121-T127 PolarHBondContact O-OG1 3.41Å; S124-T127 PolarHBondContact O-N 2.78Å; S124-T127 VanDerWaalsContact O-N 3.13Å; P125-T127 VanDerWaalsContact C-N 3.28Å; P125-T127 PolarHBondContact O-N 2.74Å; T127-T129 PolarHBondContact O-N 3.43Å; T127-R132 HydrophobicContact CG2-CG 4.08Å
128	P	73.1	Confident	82.4	Confident	81 Å²	81	70.3 Å²	70.3	53%	0.526	38%	0.378	S	S	.	.			trans	-53.5	140.2	174.3	-23.1	30.7	0	0	0	111.3	S126 N130 S131	S126-P128 WeakPolarHBondContact O-CD 3.33Å; P128-N130 PolarHBondContact O-N 3.42Å; P128-N130 VanDerWaalsContact O-N 3.09Å; P128-S131 WeakPolarHBondContact CB-OG 3.44Å; P128-S131 WeakPolarHBondContact CD-OG 3.38Å; P128-S131 PolarHBondContact O-N 3.31Å; P128-S131 PolarHBondContact O-OG 2.92Å; P128-S131 VanDerWaalsContact O-OG 3.14Å
129	T	68.9	Low	82.5	Confident	95 Å²	95	69.9 Å²	69.9	58%	0.583	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-55	-31.6	178.7	47.3	0	0	0	0	112.5	T127 S131	T127-T129 PolarHBondContact O-N 3.43Å; T129-S131 VanDerWaalsContact C-N 3.31Å; T129-S131 PolarHBondContact O-N 3.4Å
130	N	66.4	Low	82.7	Confident	87 Å²	87	74.9 Å²	74.9	47%	0.465	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-83	3.7	180	-63.1	-42.9	0	0	0	114.6	N9 P128	N9-N130 CarbonylContact C-O 3.55Å; N9-N130 WeakPolarHBondContact CB-O 3.48Å; N9-N130 PolarHBondContact ND2-OD1 2.98Å; P128-N130 PolarHBondContact O-N 3.42Å; P128-N130 VanDerWaalsContact O-N 3.09Å
131	S	69	Low	83	Confident	44 Å²	44	74.8 Å²	74.8	31%	0.308	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-133.6	24.2	178.8	60	0	0	0	0	112.4	P128 T129	P128-S131 WeakPolarHBondContact CB-OG 3.44Å; P128-S131 WeakPolarHBondContact CD-OG 3.38Å; P128-S131 PolarHBondContact O-N 3.31Å; P128-S131 PolarHBondContact O-OG 2.92Å; P128-S131 VanDerWaalsContact O-OG 3.14Å; T129-S131 VanDerWaalsContact C-N 3.31Å; T129-S131 PolarHBondContact O-N 3.4Å
132	R	79.1	Confident	83.4	Confident	93 Å²	93	71.4 Å²	71.4	35%	0.351	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-77.1	133.5	175.4	-69.4	-173.8	-178	154.6	-0.3	110	S7 F122 T127	S7-R132 WeakPolarHBondContact CB-O 3.48Å; F122-R132 HydrophobicContact CD2-CB 3.74Å; F122-R132 HydrophobicContact CD2-CG 4.28Å; F122-R132 HydrophobicContact CE2-CB 3.8Å; F122-R132 HydrophobicContact CE2-CG 4.42Å; T127-R132 HydrophobicContact CG2-CG 4.08Å
133	Y	83.9	Confident	83.9	Confident	59 Å²	59	71.8 Å²	71.8	23%	0.231	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-100.6	136.1	176	-72.1	-92.5	0	0	0	110.4	K5 A6 E22 F122	K5-Y133 HydrophobicContact CB-CD1 4.16Å; K5-Y133 HydrophobicContact CD-CD1 3.53Å; K5-Y133 HydrophobicContact CD-CD2 4.39Å; K5-Y133 HydrophobicContact CD-CE1 4.06Å; K5-Y133 HydrophobicContact CD-CG 3.71Å; K5-Y133 HydrophobicContact CG-CD1 3.62Å; K5-Y133 HydrophobicContact CG-CE1 4.22Å; K5-Y133 HydrophobicContact CG-CG 4.2Å; A6-Y133 CarbonylContact O-C 3.54Å; A6-Y133 WeakPolarHBondContact O-CA 3.25Å; E22-Y133 HydrophobicContact CG-CE1 4.37Å; E22-Y133 WeakPolarHBondContact OE1-CE1 3.1Å; E22-Y133 VanDerWaalsContact OE1-CZ 3.32Å; E22-Y133 PolarHBondContact OE1-OH 2.96Å; F122-Y133 WeakPolarHBondContact CD2-O 3.11Å
134	E	88.8	Confident	84.4	Confident	128 Å²	128	64.3 Å²	64.3	60%	0.598	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	164.5	174.1	-60.8	-178	159.6	0	0	110.7	K5 A6 F122 G136	K5-E134 VanDerWaalsContact CA-O 3.25Å; K5-E134 WeakPolarHBondContact CA-O 3.36Å; K5-E134 WeakPolarHBondContact CB-O 3.34Å; A6-E134 PolarHBondContact N-O 3.12Å; A6-E134 PolarHBondContact O-N 3.18Å; F122-E134 HydrophobicContact CE2-CG 4.45Å; E134-G136 PolarHBondContact O-N 3.18Å
135	F	89.8	Confident	84.9	Confident	80 Å²	80	64.9 Å²	64.9	35%	0.351	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	121.9	174.5	-63.6	-53.4	0	0	0	110.9	G115 V118 A119 L139 Y140	G115-F135 VanDerWaalsContact O-CE1 3.32Å; G115-F135 WeakPolarHBondContact O-CE1 3.42Å; V118-F135 HydrophobicContact CB-CD1 4.38Å; V118-F135 HydrophobicContact CB-CE1 4.15Å; V118-F135 HydrophobicContact CG1-CD1 4.14Å; V118-F135 HydrophobicContact CG1-CE1 4.21Å; A119-F135 HydrophobicContact CB-CZ 4.01Å; F135-L139 HydrophobicContact CB-CD1 4.3Å; F135-L139 HydrophobicContact CD1-CD1 3.58Å; F135-L139 HydrophobicContact CE1-CD1 4.37Å; F135-L139 HydrophobicContact CG-CD1 4.36Å; F135-Y140 HydrophobicContact CB-CE2 4.11Å
136	G	89.3	Confident	85.7	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.031	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-79.9	161.7	174.2	0	0	0	0	0	112.4	E3 W4 E134 A138 L139	E3-G136 CarbonylContact O-C 3.55Å; E3-G136 WeakPolarHBondContact O-CA 3.09Å; W4-G136 PolarHBondContact O-N 3.42Å; W4-G136 VanDerWaalsContact O-N 3.14Å; E134-G136 PolarHBondContact O-N 3.18Å; G136-A138 PolarHBondContact O-N 3.38Å; G136-A138 VanDerWaalsContact O-N 3.13Å; G136-L139 PolarHBondContact O-N 3.29Å
137	S	90.9	Very high	86.6	Confident	48 Å²	48	56.7 Å²	56.7	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-55.7	-30.6	-178.3	60.7	0	0	0	0	113.9	E3 L139 Y140 V141	E3-S137 WeakPolarHBondContact CB-OG 3.47Å; E3-S137 PolarHBondContact O-N 3.36Å; E3-S137 WeakPolarHBondContact OE2-CB 3.49Å; E3-S137 PolarHBondContact OE2-OG 3.1Å; S137-L139 VanDerWaalsContact C-N 3.29Å; S137-L139 PolarHBondContact O-N 3.47Å; S137-Y140 PolarHBondContact O-N 3.18Å; S137-V141 PolarHBondContact O-N 2.89Å
138	A	91.4	Very high	87.6	Confident	4 Å²	4	61.3 Å²	61.3	3%	0.033	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-28.7	-177.9	0	0	0	0	0	113.4	M1 E3 W4 G136 G142	M1-A138 HydrophobicContact CB-CB 3.79Å; M1-A138 HydrophobicContact CE-CB 4.24Å; M1-A138 HydrophobicContact SD-CB 4.15Å; E3-A138 WeakPolarHBondContact O-CB 3.43Å; E3-A138 PolarHBondContact O-N 3.15Å; W4-A138 HydrophobicContact CD2-CB 4.33Å; W4-A138 HydrophobicContact CG-CB 4.13Å; G136-A138 PolarHBondContact O-N 3.38Å; G136-A138 VanDerWaalsContact O-N 3.13Å; A138-G142 PolarHBondContact O-N 2.93Å
139	L	91.8	Very high	88.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-44.3	177.3	-79.1	171	0	0	0	111.5	W4 T111 Y114 F135 G136 S137 V141 G142 W143	W4-L139 HydrophobicContact CE3-CD2 3.98Å; W4-L139 HydrophobicContact CE3-CG 4.45Å; W4-L139 HydrophobicContact CZ3-CD2 4.18Å; W4-L139 VanDerWaalsContact O-CD1 3.28Å; W4-L139 WeakPolarHBondContact O-CD1 3.35Å; T111-L139 HydrophobicContact CG2-CD2 4.29Å; T111-L139 WeakPolarHBondContact O-CD2 3.13Å; Y114-L139 HydrophobicContact CD1-CD1 4.13Å; Y114-L139 HydrophobicContact CD1-CD2 3.95Å; Y114-L139 HydrophobicContact CD1-CG 4.39Å; Y114-L139 HydrophobicContact CE1-CD1 4.5Å; F135-L139 HydrophobicContact CB-CD1 4.3Å; F135-L139 HydrophobicContact CD1-CD1 3.58Å; F135-L139 HydrophobicContact CE1-CD1 4.37Å; F135-L139 HydrophobicContact CG-CD1 4.36Å; G136-L139 PolarHBondContact O-N 3.29Å; S137-L139 VanDerWaalsContact C-N 3.29Å; S137-L139 PolarHBondContact O-N 3.47Å; L139-V141 VanDerWaalsContact C-N 3.35Å; L139-V141 PolarHBondContact O-N 2.74Å; L139-G142 PolarHBondContact O-N 3.48Å; L139-W143 PolarHBondContact O-N 2.91Å
140	Y	93.4	Very high	90	Very high	130 Å²	130	56.6 Å²	56.6	51%	0.51	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176.5	-60.8	-74.4	0	0	0	111.7	F135 S137 G142 W143 G144	F135-Y140 HydrophobicContact CB-CE2 4.11Å; S137-Y140 PolarHBondContact O-N 3.18Å; Y140-G142 VanDerWaalsContact C-N 3.32Å; Y140-G142 PolarHBondContact O-N 3.19Å; Y140-W143 HydrophobicContact CD1-CE3 4.02Å; Y140-W143 AromaticContact CD1-CZ3 3.9Å; Y140-W143 HydrophobicContact CD1-CZ3 3.9Å; Y140-W143 AromaticContact CE1-CZ3 3.95Å; Y140-W143 HydrophobicContact CE1-CZ3 3.95Å; Y140-W143 PolarHBondContact O-N 2.92Å; Y140-G144 PolarHBondContact O-N 2.83Å
141	V	94.3	Very high	91.4	Very high	77 Å²	77	56.8 Å²	56.8	47%	0.467	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-40.3	175.2	178.7	0	0	0	0	110.9	M1 S137 L139 G144 A145	M1-V141 HydrophobicContact CE-CB 3.88Å; M1-V141 HydrophobicContact CE-CG1 3.73Å; M1-V141 HydrophobicContact CE-CG2 4.22Å; M1-V141 HydrophobicContact SD-CG2 4.34Å; S137-V141 PolarHBondContact O-N 2.89Å; L139-V141 VanDerWaalsContact C-N 3.35Å; L139-V141 PolarHBondContact O-N 2.74Å; V141-G144 PolarHBondContact O-N 3.35Å; V141-A145 VanDerWaalsContact O-CB 3.27Å; V141-A145 WeakPolarHBondContact O-CB 3.43Å; V141-A145 PolarHBondContact O-N 3.3Å
142	G	94.2	Very high	92.6	Very high	17 Å²	17	55.9 Å²	55.9	18%	0.175	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-41.3	177.6	0	0	0	0	0	113.2	A138 L139 Y140 A146	A138-G142 PolarHBondContact O-N 2.93Å; L139-G142 PolarHBondContact O-N 3.48Å; Y140-G142 VanDerWaalsContact C-N 3.32Å; Y140-G142 PolarHBondContact O-N 3.19Å; G142-A146 WeakPolarHBondContact O-CB 3.38Å; G142-A146 PolarHBondContact O-N 2.94Å
143	W	95.6	Very high	93.2	Very high	73 Å²	73	51.5 Å²	51.5	28%	0.277	29%	0.285	S	S	.	.	H	α-helix	trans	-64.1	-45.7	172.5	-67.9	-29	0	0	0	112.1	T111 S112 L139 Y140 A145 A146 C147	T111-W143 VanDerWaalsContact OG1-CD1 3.24Å; S112-W143 PolarHBondContact OG-NE1 3.22Å; L139-W143 PolarHBondContact O-N 2.91Å; Y140-W143 HydrophobicContact CD1-CE3 4.02Å; Y140-W143 AromaticContact CD1-CZ3 3.9Å; Y140-W143 HydrophobicContact CD1-CZ3 3.9Å; Y140-W143 AromaticContact CE1-CZ3 3.95Å; Y140-W143 HydrophobicContact CE1-CZ3 3.95Å; Y140-W143 PolarHBondContact O-N 2.92Å; W143-A145 PolarHBondContact O-N 3.4Å; W143-A146 PolarHBondContact O-N 3.47Å; W143-C147 PolarHBondContact O-N 2.87Å; W143-C147 PolarHBondContact O-SG 3.13Å; W143-C147 VanDerWaalsContact O-SG 3.32Å
144	G	96.2	Very high	93.6	Very high	35 Å²	35	49.7 Å²	49.7	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-47.1	175.7	0	0	0	0	0	112.1	Y140 V141 A146 C147 L148	Y140-G144 PolarHBondContact O-N 2.83Å; V141-G144 PolarHBondContact O-N 3.35Å; G144-A146 PolarHBondContact O-N 2.91Å; G144-C147 PolarHBondContact O-N 3.39Å; G144-L148 WeakPolarHBondContact O-CB 3.22Å; G144-L148 WeakPolarHBondContact O-CG 3.48Å; G144-L148 PolarHBondContact O-N 3.18Å
145	A	95	Very high	93.7	Very high	46 Å²	46	49.9 Å²	49.9	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-42.5	177.3	0	0	0	0	0	112.2	V141 W143 L148 C149	V141-A145 VanDerWaalsContact O-CB 3.27Å; V141-A145 WeakPolarHBondContact O-CB 3.43Å; V141-A145 PolarHBondContact O-N 3.3Å; W143-A145 PolarHBondContact O-N 3.4Å; A145-L148 PolarHBondContact O-N 3.01Å; A145-C149 PolarHBondContact O-N 2.77Å; A145-C149 PolarHBondContact O-SG 3.06Å
146	A	96.1	Very high	93.6	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-45.4	177.4	0	0	0	0	0	112	G104 A107 L108 G142 W143 G144 L148 C149 I150	G104-A146 WeakPolarHBondContact O-CB 3.49Å; A107-A146 HydrophobicContact CB-CB 4.25Å; L108-A146 HydrophobicContact CB-CB 3.89Å; L108-A146 HydrophobicContact CD1-CB 4.13Å; G142-A146 WeakPolarHBondContact O-CB 3.38Å; G142-A146 PolarHBondContact O-N 2.94Å; W143-A146 PolarHBondContact O-N 3.47Å; G144-A146 PolarHBondContact O-N 2.91Å; A146-L148 PolarHBondContact O-N 2.71Å; A146-C149 PolarHBondContact O-N 3.48Å; A146-I150 WeakPolarHBondContact O-CG1 3.49Å; A146-I150 PolarHBondContact O-N 3.29Å
147	C	96.4	Very high	93.5	Very high	62 Å²	62	49.3 Å²	49.3	42%	0.419	29%	0.285	S	S	.	.	H	α-helix	trans	-59.5	-45.4	175	-70.7	0	0	0	0	111.7	W143 G144 C149 I150 I151	W143-C147 PolarHBondContact O-N 2.87Å; W143-C147 PolarHBondContact O-SG 3.13Å; W143-C147 VanDerWaalsContact O-SG 3.32Å; G144-C147 PolarHBondContact O-N 3.39Å; C147-C149 VanDerWaalsContact C-N 3.33Å; C147-C149 PolarHBondContact O-N 3.5Å; C147-I150 PolarHBondContact O-N 3.14Å; C147-I151 WeakPolarHBondContact O-CB 3.35Å; C147-I151 VanDerWaalsContact O-CG1 3.26Å; C147-I151 WeakPolarHBondContact O-CG1 3.46Å; C147-I151 PolarHBondContact O-N 3.46Å
148	L	96.1	Very high	93	Very high	124 Å²	124	50.9 Å²	50.9	65%	0.649	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-39	176.8	-72.8	171.6	0	0	0	112.2	G144 A145 A146 G152	G144-L148 WeakPolarHBondContact O-CB 3.22Å; G144-L148 WeakPolarHBondContact O-CG 3.48Å; G144-L148 PolarHBondContact O-N 3.18Å; A145-L148 PolarHBondContact O-N 3.01Å; A146-L148 PolarHBondContact O-N 2.71Å; L148-G152 PolarHBondContact O-N 2.86Å
149	C	95.6	Very high	92.1	Very high	26 Å²	26	57.5 Å²	57.5	18%	0.176	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-44.1	175.7	-67.1	0	0	0	0	111.7	F100 A145 A146 C147 G152 G153	F100-C149 HydrophobicContact CD1-CB 4.34Å; F100-C149 WeakPolarHBondContact CD1-O 3.47Å; F100-C149 HydrophobicContact CE1-CB 4.03Å; F100-C149 HydrophobicContact CZ-CB 4.36Å; A145-C149 PolarHBondContact O-N 2.77Å; A145-C149 PolarHBondContact O-SG 3.06Å; A146-C149 PolarHBondContact O-N 3.48Å; C147-C149 VanDerWaalsContact C-N 3.33Å; C147-C149 PolarHBondContact O-N 3.5Å; C149-G152 PolarHBondContact O-N 3.23Å; C149-G153 PolarHBondContact O-N 3.19Å
150	I	96.3	Very high	90.6	Very high	51 Å²	51	58.8 Å²	58.8	26%	0.262	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-46.8	178.7	-66.9	165.6	0	0	0	110.7	V105 L108 A146 C147 G153 G154	V105-I150 HydrophobicContact CG2-CD1 4.05Å; V105-I150 HydrophobicContact CG2-CG1 4.28Å; L108-I150 HydrophobicContact CD2-CD1 4.36Å; A146-I150 WeakPolarHBondContact O-CG1 3.49Å; A146-I150 PolarHBondContact O-N 3.29Å; C147-I150 PolarHBondContact O-N 3.14Å; I150-G153 PolarHBondContact O-N 3.14Å; I150-G154 PolarHBondContact O-N 2.95Å
151	I	95.9	Very high	88.7	Confident	92 Å²	92	56.4 Å²	56.4	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-46.2	178.4	-68.5	167.5	0	0	0	110.5	C147 G153 G154 F155	C147-I151 WeakPolarHBondContact O-CB 3.35Å; C147-I151 VanDerWaalsContact O-CG1 3.26Å; C147-I151 WeakPolarHBondContact O-CG1 3.46Å; C147-I151 PolarHBondContact O-N 3.46Å; I151-G153 VanDerWaalsContact C-N 3.34Å; I151-G153 PolarHBondContact O-N 3.31Å; I151-G154 PolarHBondContact O-N 3.12Å; I151-F155 HydrophobicContact CG2-CD2 3.69Å; I151-F155 HydrophobicContact CG2-CE2 3.32Å; I151-F155 HydrophobicContact CG2-CZ 4.32Å; I151-F155 VanDerWaalsContact O-CD2 3.24Å; I151-F155 WeakPolarHBondContact O-CD2 3.17Å; I151-F155 PolarHBondContact O-N 3.13Å
152	G	93.8	Very high	86.7	Confident	25 Å²	25	60.1 Å²	60.1	26%	0.258	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-42.9	177.3	0	0	0	0	0	112.4	L148 C149 F155 L156	L148-G152 PolarHBondContact O-N 2.86Å; C149-G152 PolarHBondContact O-N 3.23Å; G152-F155 PolarHBondContact O-N 2.63Å; G152-L156 WeakPolarHBondContact O-CG 3.08Å; G152-L156 PolarHBondContact O-N 2.79Å; G152-L156 VanDerWaalsContact O-N 3.14Å
153	G	92.9	Very high	84.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-39.9	174.7	0	0	0	0	0	112.2	C149 I150 I151 L156 C157	C149-G153 PolarHBondContact O-N 3.19Å; I150-G153 PolarHBondContact O-N 3.14Å; I151-G153 VanDerWaalsContact C-N 3.34Å; I151-G153 PolarHBondContact O-N 3.31Å; G153-L156 WeakPolarHBondContact O-CB 3.3Å; G153-L156 PolarHBondContact O-N 2.61Å; G153-C157 PolarHBondContact O-N 3.15Å; G153-C157 PolarHBondContact O-SG 2.97Å
154	G	92.6	Very high	81.8	Confident	22 Å²	22	63.6 Å²	63.6	23%	0.227	38%	0.381	C	S	.	.	H	α-helix	trans	-58.8	-46.4	173.8	0	0	0	0	0	112.6	I150 I151 L156 C157 C158	I150-G154 PolarHBondContact O-N 2.95Å; I151-G154 PolarHBondContact O-N 3.12Å; G154-L156 VanDerWaalsContact C-N 3.33Å; G154-L156 PolarHBondContact O-N 2.81Å; G154-C157 PolarHBondContact O-N 2.88Å; G154-C158 PolarHBondContact O-N 3.44Å; G154-C158 PolarHBondContact O-SG 3.14Å
155	F	90.9	Very high	79.6	Confident	132 Å²	132	68.1 Å²	68.1	58%	0.579	40%	0.404	S	S	*	.	H	α-helix	trans	-59.8	-42.4	175	-77.2	-58.5	0	0	0	112.3	I151 G152 C157 C158 M159	I151-F155 HydrophobicContact CG2-CD2 3.69Å; I151-F155 HydrophobicContact CG2-CE2 3.32Å; I151-F155 HydrophobicContact CG2-CZ 4.32Å; I151-F155 VanDerWaalsContact O-CD2 3.24Å; I151-F155 WeakPolarHBondContact O-CD2 3.17Å; I151-F155 PolarHBondContact O-N 3.13Å; G152-F155 PolarHBondContact O-N 2.63Å; F155-C157 VanDerWaalsContact C-N 3.34Å; F155-C157 PolarHBondContact O-N 2.05Å; F155-C158 PolarHBondContact O-N 3.09Å; F155-M159 WeakPolarHBondContact O-CB 3.35Å; F155-M159 VanDerWaalsContact O-CG 3.22Å; F155-M159 WeakPolarHBondContact O-CG 3.37Å; F155-M159 PolarHBondContact O-N 2.83Å; F155-M159 VanDerWaalsContact O-N 3.1Å
156	L	87.3	Confident	77.1	Confident	51 Å²	51	71.2 Å²	71.2	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-63	-38.4	176.4	-69.8	169.7	0	0	0	112.4	T72 G152 G153 G154	T72-L156 HydrophobicContact CG2-CD1 3.82Å; T72-L156 HydrophobicContact CG2-CD2 3.77Å; T72-L156 HydrophobicContact CG2-CG 4.44Å; G152-L156 WeakPolarHBondContact O-CG 3.08Å; G152-L156 PolarHBondContact O-N 2.79Å; G152-L156 VanDerWaalsContact O-N 3.14Å; G153-L156 WeakPolarHBondContact O-CB 3.3Å; G153-L156 PolarHBondContact O-N 2.61Å; G154-L156 VanDerWaalsContact C-N 3.33Å; G154-L156 PolarHBondContact O-N 2.81Å
157	C	86.6	Confident	74.6	Confident	19 Å²	19	74.8 Å²	74.8	13%	0.128	46%	0.46	C	S	.	.	H	α-helix	trans	-70.5	-40.8	177.4	-65.5	0	0	0	0	112.9	L94 G153 G154 F155 S161	L94-C157 HydrophobicContact CD1-CB 3.79Å; G153-C157 PolarHBondContact O-N 3.15Å; G153-C157 PolarHBondContact O-SG 2.97Å; G154-C157 PolarHBondContact O-N 2.88Å; F155-C157 VanDerWaalsContact C-N 3.34Å; F155-C157 PolarHBondContact O-N 2.05Å; C157-S161 PolarHBondContact O-N 2.79Å; C157-S161 PolarHBondContact O-OG 2.89Å
158	C	81.6	Confident	71.9	Confident	81 Å²	81	81 Å²	81	55%	0.547	48%	0.48	S	S	.	.	H	α-helix	trans	-70.4	-41.9	-177.8	-67.4	0	0	0	0	112.4	G154 F155 C160 S161	G154-C158 PolarHBondContact O-N 3.44Å; G154-C158 PolarHBondContact O-SG 3.14Å; F155-C158 PolarHBondContact O-N 3.09Å; C158-C160 PolarHBondContact O-N 2.86Å; C158-C160 VanDerWaalsContact O-N 3.15Å; C158-S161 PolarHBondContact O-N 2.91Å; C158-S161 VanDerWaalsContact O-N 3.12Å
159	M	71.6	Confident	69.4	Low	143 Å²	143	77.9 Å²	77.9	70%	0.704	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-22.3	-179.3	-70.7	-71.7	139.6	0	0	113.6	F155	F155-M159 WeakPolarHBondContact O-CB 3.35Å; F155-M159 VanDerWaalsContact O-CG 3.22Å; F155-M159 WeakPolarHBondContact O-CG 3.37Å; F155-M159 PolarHBondContact O-N 2.83Å; F155-M159 VanDerWaalsContact O-N 3.1Å
160	C	60.6	Low	67.2	Low	27 Å²	27	81.8 Å²	81.8	18%	0.182	50%	0.502	C	S	.	.	H	α-helix	trans	-92.3	-20.3	177.6	-68.3	0	0	0	0	113.6	C158 K163	C158-C160 PolarHBondContact O-N 2.86Å; C158-C160 VanDerWaalsContact O-N 3.15Å; C160-K163 PolarHBondContact O-N 2.79Å
161	S	53.5	Low	65	Low	80 Å²	80	91 Å²	91	56%	0.559	53%	0.534	S	S	*	.	H	α-helix	trans	-78.2	-22.1	-178.2	-67.8	0	0	0	0	113.5	C157 C158 K163 G164	C157-S161 PolarHBondContact O-N 2.79Å; C157-S161 PolarHBondContact O-OG 2.89Å; C158-S161 PolarHBondContact O-N 2.91Å; C158-S161 VanDerWaalsContact O-N 3.12Å; S161-K163 PolarHBondContact O-N 2.83Å; S161-G164 PolarHBondContact O-N 2.91Å; S161-G164 VanDerWaalsContact O-N 3.12Å
162	D	51.4	Low	63.1	Low	156 Å²	156	96 Å²	96	83%	0.834	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.5	172.2	-104	-48.3	0	0	0	113.1	G164	D162-G164 VanDerWaalsContact C-N 3.27Å; D162-G164 PolarHBondContact O-N 2.88Å
163	K	49	Very low	61.4	Low	116 Å²	116	99.9 Å²	99.9	50%	0.504	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	45.3	166.6	-71.8	177.1	177.7	158.1	0	111.1	E77 C160 S161	E77-K163 IonicContact OE1-NZ 2.65Å; E77-K163 PolarHBondContact OE1-NZ 3.34Å; E77-K163 IonicContact OE2-NZ 3.93Å; C160-K163 PolarHBondContact O-N 2.79Å; S161-K163 PolarHBondContact O-N 2.83Å
164	G	38.9	Very low	59.7	Low	46 Å²	46	105.8 Å²	105.8	47%	0.474	61%	0.607	S	S	.	*			trans	-57	150.2	174.4	0	0	0	0	0	112.3	S161 D162 S166	S161-G164 PolarHBondContact O-N 2.91Å; S161-G164 VanDerWaalsContact O-N 3.12Å; D162-G164 VanDerWaalsContact C-N 3.27Å; D162-G164 PolarHBondContact O-N 2.88Å; G164-S166 VanDerWaalsContact C-N 3.32Å; G164-S166 PolarHBondContact O-N 3.01Å
165	P	48.8	Very low	57.9	Low	131 Å²	131	109.6 Å²	109.6	85%	0.851	63%	0.63	S	S	*	*			trans	-76.7	79.8	-177.7	33.2	-33.4	0	0	0	110
166	S	42.6	Very low	56.3	Low	111 Å²	111	109.2 Å²	109.2	78%	0.776	64%	0.644	S	S	*	*			trans	-98.4	85.1	163.6	-164.1	0	0	0	0	109.1	G164 K168	G164-S166 VanDerWaalsContact C-N 3.32Å; G164-S166 PolarHBondContact O-N 3.01Å; S166-K168 VanDerWaalsContact C-N 3.29Å; S166-K168 PolarHBondContact O-N 2.88Å
167	G	45	Very low	54.5	Low	76 Å²	76	111.4 Å²	111.4	78%	0.784	66%	0.663	S	S	*	*			trans	-59.9	94.1	158.7	0	0	0	0	0	109.9
168	K	38.2	Very low	52.7	Low	193 Å²	193	115.5 Å²	115.5	84%	0.839	70%	0.698	S	S	*	*			trans	-142.5	75.8	141.8	-71.7	-169.6	-176.3	174.5	0	107.2	S166	S166-K168 VanDerWaalsContact C-N 3.29Å; S166-K168 PolarHBondContact O-N 2.88Å
169	G	44.7	Very low	50.9	Low	57 Å²	57	115.4 Å²	115.4	59%	0.588	71%	0.711	S	S	*	*			trans	-54.1	149.4	152.5	0	0	0	0	0	108.3	R171	G169-R171 PolarHBondContact O-N 3.19Å
170	P	50.3	Low	50	Low	109 Å²	109	112 Å²	112	71%	0.708	71%	0.713	S	S	*	*			trans	-51.5	116.4	175.8	-20.4	29.9	0	0	0	107.9	Y172	P170-Y172 HydrophobicContact CB-CD2 4.38Å; P170-Y172 HydrophobicContact CB-CE2 4.24Å; P170-Y172 PolarHBondContact O-N 3.02Å
171	R	49.9	Very low	49.2	Very low	245 Å²	245	121.8 Å²	121.8	93%	0.925	75%	0.746	S	S	*	*			trans	-69	87.4	172.2	-164.5	-179.7	-152.3	163.1	5.3	105.2	G169 P173	G169-R171 PolarHBondContact O-N 3.19Å; R171-P173 WeakPolarHBondContact O-CD 3.28Å
172	Y	54.8	Low	49	Very low	196 Å²	196	125.6 Å²	125.6	77%	0.769	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-55.8	123.5	169.2	-83.7	-88.6	0	0	0	106.5	P170	P170-Y172 HydrophobicContact CB-CD2 4.38Å; P170-Y172 HydrophobicContact CB-CE2 4.24Å; P170-Y172 PolarHBondContact O-N 3.02Å
173	P	58.9	Low	48.8	Very low	106 Å²	106	128.7 Å²	128.7	69%	0.688	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-58	139.9	172.7	24	-30.9	0	0	0	107.7	R171 S175	R171-P173 WeakPolarHBondContact O-CD 3.28Å; P173-S175 PolarHBondContact O-N 3.24Å; P173-S175 VanDerWaalsContact O-N 3.13Å
174	P	57.1	Low	48.6	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-56.5	125.3	175.7	23.3	-31.3	0	0	0	108.5	S176	P174-S176 PolarHBondContact O-N 3.45Å
175	S	54.3	Low	49.1	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	82%	0.816	S	S	*	*			trans	-57.8	103.1	166.4	159	0	0	0	0	108	P173 S177	P173-S175 PolarHBondContact O-N 3.24Å; P173-S175 VanDerWaalsContact O-N 3.13Å; S175-S177 VanDerWaalsContact C-N 3.34Å; S175-S177 PolarHBondContact O-N 2.89Å; S175-S177 VanDerWaalsContact O-N 3.08Å
176	S	56.8	Low	49.1	Very low	124 Å²	124	138.2 Å²	138.2	87%	0.867	81%	0.814	S	S	*	*			trans	-76.3	91.2	166.6	71.3	0	0	0	0	108.2	P174	P174-S176 PolarHBondContact O-N 3.45Å
177	S	50.4	Low	49.5	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	82%	0.816	S	S	*	*			trans	-107.1	123.5	168.3	51.6	0	0	0	0	110	S175	S175-S177 VanDerWaalsContact C-N 3.34Å; S175-S177 PolarHBondContact O-N 2.89Å; S175-S177 VanDerWaalsContact O-N 3.08Å
178	A	48.2	Very low	49.8	Very low	105 Å²	105	143.4 Å²	143.4	87%	0.868	82%	0.818	S	S	*	*			trans	86.8	88.2	161.7	0	0	0	0	0	118.4
179	G	44.1	Very low	50.5	Low	79 Å²	79	140.3 Å²	140.3	81%	0.814	82%	0.817	S	S	*	*			trans	-114.9	94.9	141.1	0	0	0	0	0	107.9
180	G	53	Low	50.9	Low	72 Å²	72	145.9 Å²	145.9	74%	0.742	83%	0.832	S	S	*	*			trans	-60.3	140	174.5	0	0	0	0	0	111.1
181	R	44.1	Very low	50.9	Low	232 Å²	232	148.5 Å²	148.5	88%	0.875	84%	0.841	S	S	*	*			trans	-135.1	115.2	161	-76.1	-169.9	174.3	148.4	-0.5	108.8
182	D	48.9	Very low	51	Low	161 Å²	161	141.1 Å²	141.1	86%	0.861	84%	0.835	S	S	*	*			trans	-48.9	139	168.3	-57.6	-78.5	0	0	0	111.5
183	Y	46.9	Very low	50.7	Low	221 Å²	221	136.5 Å²	136.5	87%	0.867	84%	0.84	S	S	*	*			trans	-115.9	117.3	159.8	39.5	-92	0	0	0	107.6
184	V	45.5	Very low	49.9	Very low	215 Å²	215	139.3 Å²	139.3	100%	1.303	85%	0.854	S	S	*	*			trans	-86.3	0	160.8	179	0	0	0	0	107.7

Retrieved 184 of 184 residues in 104 ms (Link to these results)

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