A0A077Z4R9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4R9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 163 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	73.9	Confident	90.2	Very high	87 Å²	87	53.1 Å²	53.1	43%	0.429	28%	0.279	S	S	.	.				0	135.5	0	176.9	147.8	-68.2	0	0	108	W3 F96	M1-W3 HydrophobicContact SD-CZ2 4.32Å; M1-F96 HydrophobicContact CE-CD2 3.11Å; M1-F96 HydrophobicContact CE-CE2 3.1Å; M1-F96 HydrophobicContact CE-CG 4.19Å; M1-F96 HydrophobicContact CE-CZ 4.23Å; M1-F96 HydrophobicContact SD-CB 3.91Å; M1-F96 HydrophobicContact SD-CD1 4.37Å; M1-F96 HydrophobicContact SD-CD2 3.06Å; M1-F96 WeakPolarHBondContact SD-CD2 3.43Å; M1-F96 HydrophobicContact SD-CE2 3.45Å; M1-F96 WeakPolarHBondContact SD-CE2 3.08Å; M1-F96 HydrophobicContact SD-CG 3.56Å; M1-F96 VanDerWaalsContact SD-CG 3.56Å; M1-F96 HydrophobicContact SD-CZ 4.28Å
2	V	83	Confident	90.3	Very high	65 Å²	65	51.8 Å²	51.8	39%	0.394	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.6	176.1	-175.2	0	0	0	0	107.9	G77 F78 K79	V2-G77 CarbonylContact O-C 3.54Å; V2-G77 WeakPolarHBondContact O-CA 3.24Å; V2-F78 HydrophobicContact CB-CE1 4.39Å; V2-F78 HydrophobicContact CB-CE2 4.45Å; V2-F78 HydrophobicContact CB-CZ 4.28Å; V2-F78 HydrophobicContact CG1-CE1 3.85Å; V2-F78 HydrophobicContact CG1-CE2 4.13Å; V2-F78 HydrophobicContact CG1-CZ 3.6Å; V2-F78 PolarHBondContact N-O 2.94Å; V2-F78 VanDerWaalsContact N-O 3.15Å; V2-F78 WeakPolarHBondContact O-CD1 3.46Å; V2-F78 PolarHBondContact O-N 2.89Å; V2-K79 HydrophobicContact CG2-CD 4.17Å
3	W	86.7	Confident	90.3	Very high	120 Å²	120	51.5 Å²	51.5	46%	0.455	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143	178.3	-69	100.3	0	0	0	110.3	M1 G77 F78 F96 A98	M1-W3 HydrophobicContact SD-CZ2 4.32Å; W3-G77 VanDerWaalsContact CE3-N 3.33Å; W3-F78 VanDerWaalsContact C-CE1 3.47Å; W3-F78 WeakPolarHBondContact O-CE1 2.78Å; W3-F96 HydrophobicContact CH2-CB 3.33Å; W3-F96 HydrophobicContact CH2-CG 4.27Å; W3-F96 HydrophobicContact CZ2-CB 3.95Å; W3-F96 HydrophobicContact CZ3-CB 3.78Å; W3-A98 HydrophobicContact CE3-CB 4.41Å; W3-A98 HydrophobicContact CH2-CB 4Å; W3-A98 HydrophobicContact CZ3-CB 3.75Å
4	S	88.1	Confident	90.3	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.07	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-65.7	159.1	168.4	74.5	0	0	0	0	110	S75 C76	S4-S75 PolarHBondContact O-OG 2.01Å; S4-S75 PolarHBondContact OG-OG 3.04Å; S4-C76 PolarHBondContact N-O 3.08Å; S4-C76 PolarHBondContact OG-N 3.29Å
5	S	92.8	Very high	90.2	Very high	100 Å²	100	50.3 Å²	50.3	70%	0.699	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-54.4	153.7	158.2	57.8	0	0	0	0	109.5	G7	S5-G7 PolarHBondContact O-N 2.68Å
6	W	94.1	Very high	90.2	Very high	111 Å²	111	51.9 Å²	51.9	42%	0.42	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-56.6	131.4	171.4	-70.1	107.6	0	0	0	110.1	R73 A98 S100	W6-R73 HydrophobicContact CB-CG 4.46Å; W6-R73 HydrophobicContact CD2-CG 4.39Å; W6-R73 HydrophobicContact CE3-CG 3.83Å; W6-R73 HydrophobicContact CZ3-CG 4.47Å; W6-A98 HydrophobicContact CH2-CB 3.91Å; W6-A98 HydrophobicContact CZ3-CB 4.32Å; W6-A98 WeakPolarHBondContact CZ3-O 3.26Å; W6-S100 VanDerWaalsContact CH2-CB 3.48Å
7	G	93.8	Very high	90.2	Very high	10 Å²	10	55.6 Å²	55.6	10%	0.103	31%	0.31	C	S	.	.			trans	-70	175.9	172.3	0	0	0	0	0	112.5	S5 R73 Q74	S5-G7 PolarHBondContact O-N 2.68Å; G7-R73 WeakPolarHBondContact O-CB 3.42Å; G7-Q74 PolarHBondContact N-O 2.93Å
8	P	95.1	Very high	90.3	Very high	58 Å²	58	61.3 Å²	61.3	38%	0.377	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-69.4	156.2	172.2	32.4	-36.9	0	0	0	111.2	T10 R20 Q28	P8-T10 PolarHBondContact O-N 3.38Å; P8-R20 VanDerWaalsContact CB-CZ 3.49Å; P8-R20 VanDerWaalsContact CG-CZ 3.48Å; P8-R20 PolarHBondContact O-NH2 3.43Å; P8-Q28 WeakPolarHBondContact CG-O 3.05Å
9	C	95.8	Very high	90.4	Very high	7 Å²	7	60.9 Å²	60.9	5%	0.047	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-64.3	123.1	178.3	-66.4	0	0	0	0	112.8	R20 W21 Y72 C102 D106 L107	C9-R20 VanDerWaalsContact C-NH2 3.29Å; C9-R20 PolarHBondContact O-NH2 3.12Å; C9-W21 PolarHBondContact O-NE1 2.69Å; C9-Y72 CarbonylContact C-O 3.55Å; C9-C102 WeakPolarHBondContact CA-SG 3.34Å; C9-C102 HydrophobicContact CB-CB 3.92Å; C9-C102 WeakPolarHBondContact CB-SG 3.06Å; C9-C102 WeakPolarHBondContact SG-CB 3.45Å; C9-C102 CovalentContact SG-SG 2.01Å; C9-C102 PolarHBondContact SG-SG 2.89Å; C9-D106 VanDerWaalsContact SG-CB 3.51Å; C9-L107 HydrophobicContact CB-CD2 3.58Å
10	T	94.8	Very high	90.5	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.043	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-83	137.8	174.5	-58.3	0	0	0	0	109.8	P8 Y25 Q28 A71 Y72	P8-T10 PolarHBondContact O-N 3.38Å; T10-Y25 HydrophobicContact CG2-CD2 3.74Å; T10-Y25 HydrophobicContact CG2-CE2 3.74Å; T10-Q28 HydrophobicContact CG2-CB 4.15Å; T10-A71 WeakPolarHBondContact O-CA 3.44Å; T10-A71 WeakPolarHBondContact O-CB 2.91Å; T10-Y72 PolarHBondContact N-O 3.28Å
11	W	93.9	Very high	90.7	Very high	9 Å²	9	59.9 Å²	59.9	3%	0.034	32%	0.321	C	S	.	.			trans	-151.8	159.8	178.4	-172.4	-123.5	0	0	0	110.6	K13 W21 Q28 K65 P66 C67 C70 A71	W11-K13 PolarHBondContact NE1-O 3.46Å; W11-W21 HydrophobicContact CB-CB 4.28Å; W11-W21 HydrophobicContact CB-CD2 3.59Å; W11-W21 HydrophobicContact CB-CE3 4.08Å; W11-W21 HydrophobicContact CB-CG 3.69Å; W11-W21 HydrophobicContact CB-CZ2 4.34Å; W11-W21 AromaticContact CD1-CE3 3.61Å; W11-W21 HydrophobicContact CG-CD2 4.2Å; W11-W21 HydrophobicContact CG-CE3 4.2Å; W11-Q28 VanDerWaalsContact N-OE1 3.11Å; W11-Q28 PolarHBondContact O-NE2 2.02Å; W11-Q28 PolarHBondContact O-OE1 3.07Å; W11-Q28 VanDerWaalsContact O-OE1 3.05Å; W11-K65 WeakPolarHBondContact CZ2-O 3.47Å; W11-P66 HydrophobicContact CD2-CB 4.32Å; W11-P66 HydrophobicContact CD2-CG 4.26Å; W11-P66 VanDerWaalsContact CE2-CA 3.48Å; W11-P66 HydrophobicContact CG-CG 4.17Å; W11-P66 VanDerWaalsContact CZ2-CA 3.5Å; W11-C67 VanDerWaalsContact CH2-N 3.33Å; W11-C67 VanDerWaalsContact CH2-O 3.29Å; W11-C67 WeakPolarHBondContact CH2-O 3.23Å; W11-C70 HydrophobicContact CH2-CB 3.86Å; W11-C70 VanDerWaalsContact CZ3-C 3.45Å; W11-C70 HydrophobicContact CZ3-CB 3.39Å; W11-A71 HydrophobicContact CB-CB 4.48Å; W11-A71 HydrophobicContact CD2-CB 4.21Å; W11-A71 HydrophobicContact CE3-CB 3.45Å; W11-A71 VanDerWaalsContact CE3-CB 3.45Å; W11-A71 HydrophobicContact CZ3-CB 3.99Å; W11-A71 VanDerWaalsContact CZ3-N 3.35Å
12	I	92.2	Very high	91.5	Very high	38 Å²	38	57.9 Å²	57.9	20%	0.195	31%	0.312	C	S	.	.	S	Bend	trans	-85.9	-22.1	-171	57.7	174.2	0	0	0	114.3	K58 T61	I12-K58 WeakPolarHBondContact O-CD 3.14Å; I12-K58 WeakPolarHBondContact O-CG 3.46Å; I12-T61 HydrophobicContact CD1-CG2 4Å; I12-T61 WeakPolarHBondContact CD1-OG1 3.48Å
13	K	90.3	Very high	92	Very high	48 Å²	48	60.6 Å²	60.6	21%	0.209	32%	0.318	C	S	.	.			trans	-146.7	123.6	-173.7	-167.1	171.7	-178.7	-172.3	0	112.4	W11 K58 T61 Q62	W11-K13 PolarHBondContact NE1-O 3.46Å; K13-K58 HydrophobicContact CB-CG 4.14Å; K13-K58 HydrophobicContact CD-CG 4.25Å; K13-K58 HydrophobicContact CG-CG 4.12Å; K13-T61 PolarHBondContact NZ-O 2.67Å; K13-Q62 PolarHBondContact NZ-O 3.14Å; K13-Q62 VanDerWaalsContact NZ-O 3.14Å
14	G	90	Very high	92.3	Very high	8 Å²	8	57.7 Å²	57.7	8%	0.082	32%	0.315	C	S	.	.			trans	-89.8	155.9	175.4	0	0	0	0	0	114	T16 N22	G14-T16 VanDerWaalsContact C-N 3.28Å; G14-T16 PolarHBondContact O-N 3.13Å; G14-N22 PolarHBondContact N-OD1 3.36Å
15	P	88.6	Confident	92.5	Very high	77 Å²	77	58.4 Å²	58.4	50%	0.5	32%	0.316	S	S	.	.	S	Bend	trans	-68.2	-24.3	178.2	27.5	-36.6	0	0	0	113.9
16	T	90.4	Very high	92.4	Very high	75 Å²	75	54 Å²	54	46%	0.46	28%	0.284	S	S	.	.	S	Bend	trans	-131.3	152.7	179.9	64.2	0	0	0	0	110.2	G14 N18 H19 N22	G14-T16 VanDerWaalsContact C-N 3.28Å; G14-T16 PolarHBondContact O-N 3.13Å; T16-N18 PolarHBondContact O-N 3.29Å; T16-N18 VanDerWaalsContact O-N 3.13Å; T16-H19 WeakPolarHBondContact O-CB 3.49Å; T16-H19 PolarHBondContact O-N 2.84Å; T16-N22 PolarHBondContact O-ND2 3.2Å
17	P	89.2	Confident	92.3	Very high	115 Å²	115	55.3 Å²	55.3	75%	0.747	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-39.9	-177.5	-30	36.1	0	0	0	114.2	H19 N22	P17-H19 VanDerWaalsContact C-N 3.32Å; P17-H19 PolarHBondContact O-N 2.97Å; P17-N22 PolarHBondContact O-ND2 3.39Å
18	N	92.5	Very high	92.3	Very high	158 Å²	158	55 Å²	55	85%	0.845	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	1.8	-176.7	-63.1	-24.4	0	0	0	114.5	T16	T16-N18 PolarHBondContact O-N 3.29Å; T16-N18 VanDerWaalsContact O-N 3.13Å
19	H	92.7	Very high	92.2	Very high	54 Å²	54	52.6 Å²	52.6	25%	0.25	27%	0.269	C	S	.	.	S	Bend	trans	-63.5	145.2	-178.8	-164.2	-94.6	0	0	0	112.2	T16 P17 W21 N22	T16-H19 WeakPolarHBondContact O-CB 3.49Å; T16-H19 PolarHBondContact O-N 2.84Å; P17-H19 VanDerWaalsContact C-N 3.32Å; P17-H19 PolarHBondContact O-N 2.97Å; H19-W21 AromaticContact CE1-CD2 3.25Å; H19-W21 AromaticContact CE1-CE2 3.76Å; H19-W21 AromaticContact CE1-CE3 3.31Å; H19-W21 AromaticContact CE1-CG 3.68Å; H19-W21 AromaticContact CE1-CZ3 3.81Å; H19-W21 AromaticContact ND1-CD2 3.48Å; H19-W21 AromaticContact ND1-CE3 3.55Å; H19-W21 AromaticContact ND1-CG 3.48Å; H19-W21 PolarHBondContact ND1-N 3.25Å; H19-W21 PolarHBondContact O-N 3.11Å; H19-W21 VanDerWaalsContact O-N 3.07Å; H19-N22 WeakPolarHBondContact O-CB 3.45Å; H19-N22 PolarHBondContact O-N 3.19Å
20	R	92.7	Very high	91.9	Very high	73 Å²	73	53 Å²	53	28%	0.275	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-54.9	-32.8	-178.1	65.4	170.2	-113.4	102.7	2.8	113.9	P8 C9 N22 K23 Q28	P8-R20 VanDerWaalsContact CB-CZ 3.49Å; P8-R20 VanDerWaalsContact CG-CZ 3.48Å; P8-R20 PolarHBondContact O-NH2 3.43Å; C9-R20 VanDerWaalsContact C-NH2 3.29Å; C9-R20 PolarHBondContact O-NH2 3.12Å; R20-N22 PolarHBondContact O-N 3.09Å; R20-K23 VanDerWaalsContact O-CB 3.28Å; R20-K23 WeakPolarHBondContact O-CB 3.36Å; R20-K23 WeakPolarHBondContact O-CG 3.46Å; R20-K23 PolarHBondContact O-N 3.16Å; R20-Q28 PolarHBondContact NH1-O 3.37Å; R20-Q28 PolarHBondContact NH2-O 2.96Å; R20-Q28 VanDerWaalsContact NH2-O 3.13Å
21	W	93.3	Very high	91.6	Very high	28 Å²	28	56.9 Å²	56.9	11%	0.106	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-68.9	-13.1	178.8	-62.2	-31.7	0	0	0	113.7	C9 W11 H19 K23 Q28 P66 L107	C9-W21 PolarHBondContact O-NE1 2.69Å; W11-W21 HydrophobicContact CB-CB 4.28Å; W11-W21 HydrophobicContact CB-CD2 3.59Å; W11-W21 HydrophobicContact CB-CE3 4.08Å; W11-W21 HydrophobicContact CB-CG 3.69Å; W11-W21 HydrophobicContact CB-CZ2 4.34Å; W11-W21 AromaticContact CD1-CE3 3.61Å; W11-W21 HydrophobicContact CG-CD2 4.2Å; W11-W21 HydrophobicContact CG-CE3 4.2Å; H19-W21 AromaticContact CE1-CD2 3.25Å; H19-W21 AromaticContact CE1-CE2 3.76Å; H19-W21 AromaticContact CE1-CE3 3.31Å; H19-W21 AromaticContact CE1-CG 3.68Å; H19-W21 AromaticContact CE1-CZ3 3.81Å; H19-W21 AromaticContact ND1-CD2 3.48Å; H19-W21 AromaticContact ND1-CE3 3.55Å; H19-W21 AromaticContact ND1-CG 3.48Å; H19-W21 PolarHBondContact ND1-N 3.25Å; H19-W21 PolarHBondContact O-N 3.11Å; H19-W21 VanDerWaalsContact O-N 3.07Å; W21-K23 VanDerWaalsContact C-N 3.33Å; W21-Q28 PolarHBondContact O-NE2 3.45Å; W21-P66 HydrophobicContact CH2-CG 3.52Å; W21-P66 HydrophobicContact CZ2-CG 4.15Å; W21-P66 HydrophobicContact CZ3-CG 3.91Å; W21-L107 HydrophobicContact CH2-CD2 4.16Å; W21-L107 HydrophobicContact CZ2-CD2 3.81Å
22	N	92.2	Very high	91.3	Very high	44 Å²	44	60.5 Å²	60.5	24%	0.235	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-87.8	-4.8	172.1	-64.7	-32.4	0	0	0	112.9	G14 T16 P17 H19 R20 K58	G14-N22 PolarHBondContact N-OD1 3.36Å; T16-N22 PolarHBondContact O-ND2 3.2Å; P17-N22 PolarHBondContact O-ND2 3.39Å; H19-N22 WeakPolarHBondContact O-CB 3.45Å; H19-N22 PolarHBondContact O-N 3.19Å; R20-N22 PolarHBondContact O-N 3.09Å; N22-K58 WeakPolarHBondContact OD1-CE 3.32Å; N22-K58 PolarHBondContact OD1-NZ 2.93Å
23	K	93.2	Very high	91.1	Very high	122 Å²	122	58.8 Å²	58.8	53%	0.53	31%	0.307	S	S	.	.	S	Bend	trans	-74.6	154.9	171.8	-62.1	-172	177.3	-174.8	0	110.4	R20 W21 R27 Q28	R20-K23 VanDerWaalsContact O-CB 3.28Å; R20-K23 WeakPolarHBondContact O-CB 3.36Å; R20-K23 WeakPolarHBondContact O-CG 3.46Å; R20-K23 PolarHBondContact O-N 3.16Å; W21-K23 VanDerWaalsContact C-N 3.33Å; K23-R27 HydrophobicContact CB-CB 4.13Å; K23-Q28 PolarHBondContact O-NE2 3.49Å
24	P	92.2	Very high	91.1	Very high	59 Å²	59	58.5 Å²	58.5	38%	0.383	31%	0.306	S	S	.	.			trans	-47.8	145.7	169.7	-30.2	37.4	0	0	0	112.3	F26 R27 Q28 N51	P24-F26 PolarHBondContact O-N 3.38Å; P24-R27 HydrophobicContact CB-CG 4.32Å; P24-R27 WeakPolarHBondContact O-CA 3.31Å; P24-R27 WeakPolarHBondContact O-CB 3.36Å; P24-R27 PolarHBondContact O-N 3.27Å; P24-Q28 PolarHBondContact O-N 2.84Å; P24-N51 WeakPolarHBondContact CB-OD1 3.45Å
25	Y	91.8	Very high	90.8	Very high	26 Å²	26	65.9 Å²	65.9	10%	0.102	34%	0.336	C	S	.	.	H	α-helix	trans	-46.8	-53.1	-174.1	172.1	-103.4	0	0	0	114.2	T10 R27 Q28 L29 Y39 L50 I54 Y72 Q74	T10-Y25 HydrophobicContact CG2-CD2 3.74Å; T10-Y25 HydrophobicContact CG2-CE2 3.74Å; Y25-R27 PolarHBondContact O-N 3.37Å; Y25-R27 VanDerWaalsContact O-N 3.17Å; Y25-Q28 WeakPolarHBondContact O-CA 3.45Å; Y25-Q28 VanDerWaalsContact O-CB 3.3Å; Y25-Q28 WeakPolarHBondContact O-CB 3.4Å; Y25-Q28 PolarHBondContact O-N 3.11Å; Y25-L29 HydrophobicContact CE1-CD1 3.99Å; Y25-L29 HydrophobicContact CE1-CD2 4.29Å; Y25-L29 HydrophobicContact CE1-CG 4.43Å; Y25-L29 HydrophobicContact CE2-CD2 4.13Å; Y25-Y39 HydrophobicContact CE1-CE1 4.45Å; Y25-L50 HydrophobicContact CD1-CD2 3.35Å; Y25-L50 HydrophobicContact CE1-CD2 4.08Å; Y25-L50 HydrophobicContact CG-CD2 3.81Å; Y25-I54 VanDerWaalsContact CB-CD1 3.43Å; Y25-I54 HydrophobicContact CD2-CD1 4.1Å; Y25-I54 HydrophobicContact CG-CD1 3.98Å; Y25-Y72 WeakPolarHBondContact CE2-OH 3.4Å; Y25-Y72 PolarHBondContact OH-OH 2.83Å; Y25-Q74 PolarHBondContact OH-NE2 3.46Å
26	F	91.5	Very high	90.4	Very high	6 Å²	6	63.4 Å²	63.4	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-31.7	-177	-63.9	-64.3	0	0	0	111.9	P24 Q28 L29 Q34 Y39 L42 E43 L50	P24-F26 PolarHBondContact O-N 3.38Å; F26-Q28 PolarHBondContact O-N 3.4Å; F26-L29 HydrophobicContact CD1-CD1 4.12Å; F26-L29 WeakPolarHBondContact O-CB 3.5Å; F26-L29 PolarHBondContact O-N 2.98Å; F26-Q34 WeakPolarHBondContact O-CG 3.22Å; F26-Q34 PolarHBondContact O-NE2 3.01Å; F26-Y39 AromaticContact CD1-CD1 3.73Å; F26-Y39 HydrophobicContact CD1-CD1 3.73Å; F26-Y39 HydrophobicContact CD1-CE1 4.43Å; F26-Y39 AromaticContact CE1-CD1 3.58Å; F26-Y39 HydrophobicContact CE1-CD1 3.58Å; F26-Y39 HydrophobicContact CE1-CE1 4.15Å; F26-L42 HydrophobicContact CE1-CB 4.13Å; F26-L42 HydrophobicContact CZ-CB 3.85Å; F26-E43 HydrophobicContact CB-CB 4.32Å; F26-E43 HydrophobicContact CB-CG 4.18Å; F26-E43 HydrophobicContact CD1-CB 4.44Å; F26-E43 HydrophobicContact CD2-CB 3.49Å; F26-E43 VanDerWaalsContact CD2-CB 3.49Å; F26-E43 HydrophobicContact CD2-CG 3.58Å; F26-E43 VanDerWaalsContact CE2-CA 3.47Å; F26-E43 HydrophobicContact CE2-CB 3.81Å; F26-E43 HydrophobicContact CE2-CG 4.24Å; F26-E43 HydrophobicContact CG-CB 3.83Å; F26-E43 HydrophobicContact CG-CG 4.06Å; F26-E43 HydrophobicContact CZ-CB 4.43Å; F26-L50 HydrophobicContact CD2-CD2 4.21Å; F26-L50 HydrophobicContact CE1-CD2 4.1Å; F26-L50 HydrophobicContact CE2-CD2 3.45Å; F26-L50 VanDerWaalsContact CE2-CD2 3.45Å; F26-L50 HydrophobicContact CZ-CD2 3.39Å
27	R	92.6	Very high	89.9	Confident	139 Å²	139	64.1 Å²	64.1	53%	0.525	33%	0.329	S	S	.	.	H	α-helix	trans	-74.7	-11.8	176.4	-57.6	-58	-178.5	152.2	6.4	113.8	K23 P24 Y25 Q34 E43	K23-R27 HydrophobicContact CB-CB 4.13Å; P24-R27 HydrophobicContact CB-CG 4.32Å; P24-R27 WeakPolarHBondContact O-CA 3.31Å; P24-R27 WeakPolarHBondContact O-CB 3.36Å; P24-R27 PolarHBondContact O-N 3.27Å; Y25-R27 PolarHBondContact O-N 3.37Å; Y25-R27 VanDerWaalsContact O-N 3.17Å; R27-Q34 PolarHBondContact O-NE2 3.05Å; R27-E43 IonicContact NE-OE1 3.46Å; R27-E43 PolarHBondContact NE-OE1 2.95Å; R27-E43 IonicContact NH2-OE1 2.72Å
28	Q	93.9	Very high	89.5	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.019	31%	0.31	C	S	.	.	H	α-helix	trans	-83.6	-22.1	173	-55.6	-167.1	34.7	0	0	112.9	P8 T10 W11 R20 W21 K23 P24 Y25 F26	P8-Q28 WeakPolarHBondContact CG-O 3.05Å; T10-Q28 HydrophobicContact CG2-CB 4.15Å; W11-Q28 VanDerWaalsContact N-OE1 3.11Å; W11-Q28 PolarHBondContact O-NE2 2.02Å; W11-Q28 PolarHBondContact O-OE1 3.07Å; W11-Q28 VanDerWaalsContact O-OE1 3.05Å; R20-Q28 PolarHBondContact NH1-O 3.37Å; R20-Q28 PolarHBondContact NH2-O 2.96Å; R20-Q28 VanDerWaalsContact NH2-O 3.13Å; W21-Q28 PolarHBondContact O-NE2 3.45Å; K23-Q28 PolarHBondContact O-NE2 3.49Å; P24-Q28 PolarHBondContact O-N 2.84Å; Y25-Q28 WeakPolarHBondContact O-CA 3.45Å; Y25-Q28 VanDerWaalsContact O-CB 3.3Å; Y25-Q28 WeakPolarHBondContact O-CB 3.4Å; Y25-Q28 PolarHBondContact O-N 3.11Å; F26-Q28 PolarHBondContact O-N 3.4Å
29	L	91.4	Very high	89.2	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.037	27%	0.272	C	S	.	.	S	Bend	trans	-70.2	168.1	-176.6	-53.2	-172.6	0	0	0	112.2	Y25 F26 C33 Q34 Y39	Y25-L29 HydrophobicContact CE1-CD1 3.99Å; Y25-L29 HydrophobicContact CE1-CD2 4.29Å; Y25-L29 HydrophobicContact CE1-CG 4.43Å; Y25-L29 HydrophobicContact CE2-CD2 4.13Å; F26-L29 HydrophobicContact CD1-CD1 4.12Å; F26-L29 WeakPolarHBondContact O-CB 3.5Å; F26-L29 PolarHBondContact O-N 2.98Å; L29-C33 HydrophobicContact CB-CB 4.1Å; L29-C33 HydrophobicContact CD1-CB 4.49Å; L29-Q34 HydrophobicContact CB-CG 4.19Å; L29-Q34 PolarHBondContact O-NE2 3.08Å; L29-Y39 HydrophobicContact CD1-CD1 3.77Å; L29-Y39 HydrophobicContact CD1-CD2 4.3Å; L29-Y39 HydrophobicContact CD1-CE1 3.63Å; L29-Y39 HydrophobicContact CD1-CE2 4.17Å; L29-Y39 HydrophobicContact CD1-CG 4.1Å
30	S	89.8	Confident	88.9	Confident	17 Å²	17	55.1 Å²	55.1	12%	0.119	28%	0.275	C	S	.	.			trans	-64.7	150.9	173.7	80.8	0	0	0	0	111.3	L32 C33 Q34	S30-L32 PolarHBondContact O-N 2.76Å; S30-C33 WeakPolarHBondContact O-CB 3.29Å; S30-C33 PolarHBondContact O-N 3.49Å; S30-C33 PolarHBondContact OG-N 3.29Å; S30-C33 PolarHBondContact OG-SG 3.11Å; S30-Q34 WeakPolarHBondContact O-CG 3.34Å; S30-Q34 PolarHBondContact O-N 3.03Å
31	T	88.9	Confident	88.7	Confident	88 Å²	88	56 Å²	56	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-57.2	-34.5	179.5	-49.5	0	0	0	0	112.7	K35	T31-K35 HydrophobicContact CG2-CD 4.17Å; T31-K35 WeakPolarHBondContact O-CB 3.42Å; T31-K35 VanDerWaalsContact O-CG 3.31Å; T31-K35 WeakPolarHBondContact O-CG 3.5Å; T31-K35 PolarHBondContact O-N 2.9Å; T31-K35 VanDerWaalsContact O-N 3.13Å
32	L	87.9	Confident	88.5	Confident	85 Å²	85	56.9 Å²	56.9	45%	0.445	29%	0.287	S	S	.	.	H	α-helix	trans	-68.6	-41.4	176	-78.4	169.1	0	0	0	111.7	S30 K35 G36 F78	S30-L32 PolarHBondContact O-N 2.76Å; L32-K35 PolarHBondContact O-N 3.09Å; L32-G36 PolarHBondContact O-N 3.39Å; L32-F78 HydrophobicContact CD1-CD1 4.26Å; L32-F78 HydrophobicContact CD1-CE1 4.04Å; L32-F78 HydrophobicContact CD1-CZ 4.41Å
33	C	88.3	Confident	88.4	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-49	173.3	-68.5	0	0	0	0	111	L29 S30 K35 G36 Y39 C76	L29-C33 HydrophobicContact CB-CB 4.1Å; L29-C33 HydrophobicContact CD1-CB 4.49Å; S30-C33 WeakPolarHBondContact O-CB 3.29Å; S30-C33 PolarHBondContact O-N 3.49Å; S30-C33 PolarHBondContact OG-N 3.29Å; S30-C33 PolarHBondContact OG-SG 3.11Å; C33-K35 VanDerWaalsContact C-N 3.27Å; C33-K35 PolarHBondContact O-N 3.36Å; C33-G36 PolarHBondContact O-N 3.15Å; C33-Y39 HydrophobicContact CB-CD2 3.94Å; C33-Y39 HydrophobicContact CB-CE2 4Å; C33-Y39 WeakPolarHBondContact O-CB 3.06Å; C33-Y39 VanDerWaalsContact O-CD2 3.25Å; C33-Y39 WeakPolarHBondContact O-CD2 3.39Å; C33-C76 WeakPolarHBondContact CA-SG 3.36Å; C33-C76 HydrophobicContact CB-CB 4.06Å; C33-C76 WeakPolarHBondContact CB-SG 3.29Å; C33-C76 WeakPolarHBondContact SG-CB 3.47Å; C33-C76 CovalentContact SG-SG 2.03Å; C33-C76 PolarHBondContact SG-SG 3.04Å
34	Q	89.2	Confident	88.4	Confident	43 Å²	43	57.3 Å²	57.3	20%	0.201	29%	0.29	C	S	.	.	H	α-helix	trans	-55.4	-40.3	179.4	-70.6	-179.3	36.2	0	0	113.1	F26 R27 L29 S30 G36	F26-Q34 WeakPolarHBondContact O-CG 3.22Å; F26-Q34 PolarHBondContact O-NE2 3.01Å; R27-Q34 PolarHBondContact O-NE2 3.05Å; L29-Q34 HydrophobicContact CB-CG 4.19Å; L29-Q34 PolarHBondContact O-NE2 3.08Å; S30-Q34 WeakPolarHBondContact O-CG 3.34Å; S30-Q34 PolarHBondContact O-N 3.03Å; Q34-G36 VanDerWaalsContact C-N 3.29Å; Q34-G36 PolarHBondContact O-N 3.4Å
35	K	84.1	Confident	88.4	Confident	162 Å²	162	60.5 Å²	60.5	70%	0.704	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.1	179.8	-69.1	177	179.3	-176.9	0	113.5	T31 L32 C33	T31-K35 HydrophobicContact CG2-CD 4.17Å; T31-K35 WeakPolarHBondContact O-CB 3.42Å; T31-K35 VanDerWaalsContact O-CG 3.31Å; T31-K35 WeakPolarHBondContact O-CG 3.5Å; T31-K35 PolarHBondContact O-N 2.9Å; T31-K35 VanDerWaalsContact O-N 3.13Å; L32-K35 PolarHBondContact O-N 3.09Å; C33-K35 VanDerWaalsContact C-N 3.27Å; C33-K35 PolarHBondContact O-N 3.36Å
36	G	80.7	Confident	88.4	Confident	25 Å²	25	62.1 Å²	62.1	26%	0.258	30%	0.303	S	S	.	.	S	Bend	trans	-65.4	133.6	176.4	0	0	0	0	0	110.5	L32 C33 Q34 F38 Y39 S40	L32-G36 PolarHBondContact O-N 3.39Å; C33-G36 PolarHBondContact O-N 3.15Å; Q34-G36 VanDerWaalsContact C-N 3.29Å; Q34-G36 PolarHBondContact O-N 3.4Å; G36-F38 PolarHBondContact O-N 3.05Å; G36-Y39 PolarHBondContact O-N 2.03Å; G36-S40 PolarHBondContact O-N 2.9Å; G36-S40 PolarHBondContact O-OG 2.75Å
37	V	80.1	Confident	88.5	Confident	91 Å²	91	62.1 Å²	62.1	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-49.7	-35.7	-177.5	173.8	0	0	0	0	112.6	S40 K41	V37-S40 WeakPolarHBondContact CA-OG 3.42Å; V37-S40 PolarHBondContact O-OG 3.36Å; V37-K41 HydrophobicContact CG1-CG 4.29Å; V37-K41 WeakPolarHBondContact O-CB 3.34Å; V37-K41 WeakPolarHBondContact O-CG 3.34Å; V37-K41 PolarHBondContact O-N 3.18Å
38	F	81.5	Confident	88.6	Confident	79 Å²	79	58.1 Å²	58.1	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-66.9	-53.3	177	176.1	-108	0	0	0	113.4	G36 S40 K41 L42 L95	G36-F38 PolarHBondContact O-N 3.05Å; F38-S40 VanDerWaalsContact C-N 3.31Å; F38-S40 PolarHBondContact O-N 2.71Å; F38-K41 PolarHBondContact O-N 3.11Å; F38-L42 HydrophobicContact CD1-CD1 3.8Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CD2-CD1 4.28Å; F38-L42 HydrophobicContact CD2-CG 4.25Å; F38-L42 HydrophobicContact CE1-CD1 3.29Å; F38-L42 HydrophobicContact CE1-CG 4.24Å; F38-L42 HydrophobicContact CE2-CD1 3.83Å; F38-L42 HydrophobicContact CE2-CD2 4.38Å; F38-L42 HydrophobicContact CE2-CG 4.08Å; F38-L42 HydrophobicContact CG-CD1 4.28Å; F38-L42 HydrophobicContact CG-CG 4.42Å; F38-L42 HydrophobicContact CZ-CD1 3.32Å; F38-L42 HydrophobicContact CZ-CG 4.09Å; F38-L42 WeakPolarHBondContact O-CB 3.03Å; F38-L42 WeakPolarHBondContact O-CG 3.39Å; F38-L42 PolarHBondContact O-N 3.32Å; F38-L95 HydrophobicContact CB-CD1 3.57Å; F38-L95 HydrophobicContact CB-CD2 3.08Å; F38-L95 HydrophobicContact CB-CG 3.87Å; F38-L95 HydrophobicContact CD1-CD2 4.38Å; F38-L95 HydrophobicContact CD2-CD1 3.8Å; F38-L95 HydrophobicContact CG-CD1 3.96Å; F38-L95 HydrophobicContact CG-CD2 3.83Å; F38-L95 HydrophobicContact CG-CG 4.39Å
39	Y	86.4	Confident	88.7	Confident	15 Å²	15	58.1 Å²	58.1	6%	0.059	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-37.1	-179.6	-79.3	-59.4	0	0	0	111.4	Y25 F26 L29 C33 G36 K41 L42 E43 Q74 V97	Y25-Y39 HydrophobicContact CE1-CE1 4.45Å; F26-Y39 AromaticContact CD1-CD1 3.73Å; F26-Y39 HydrophobicContact CD1-CD1 3.73Å; F26-Y39 HydrophobicContact CD1-CE1 4.43Å; F26-Y39 AromaticContact CE1-CD1 3.58Å; F26-Y39 HydrophobicContact CE1-CD1 3.58Å; F26-Y39 HydrophobicContact CE1-CE1 4.15Å; L29-Y39 HydrophobicContact CD1-CD1 3.77Å; L29-Y39 HydrophobicContact CD1-CD2 4.3Å; L29-Y39 HydrophobicContact CD1-CE1 3.63Å; L29-Y39 HydrophobicContact CD1-CE2 4.17Å; L29-Y39 HydrophobicContact CD1-CG 4.1Å; C33-Y39 HydrophobicContact CB-CD2 3.94Å; C33-Y39 HydrophobicContact CB-CE2 4Å; C33-Y39 WeakPolarHBondContact O-CB 3.06Å; C33-Y39 VanDerWaalsContact O-CD2 3.25Å; C33-Y39 WeakPolarHBondContact O-CD2 3.39Å; G36-Y39 PolarHBondContact O-N 2.03Å; Y39-K41 VanDerWaalsContact C-N 3.32Å; Y39-K41 PolarHBondContact O-N 2.91Å; Y39-L42 HydrophobicContact CD1-CD1 4.43Å; Y39-L42 PolarHBondContact O-N 3.21Å; Y39-E43 VanDerWaalsContact O-CB 3.26Å; Y39-E43 WeakPolarHBondContact O-CB 3.43Å; Y39-E43 PolarHBondContact O-N 3.3Å; Y39-Q74 PolarHBondContact OH-NE2 3.17Å; Y39-Q74 PolarHBondContact OH-OE1 3.35Å; Y39-V97 HydrophobicContact CE2-CG1 4.49Å; Y39-V97 HydrophobicContact CE2-CG2 3.6Å; Y39-V97 VanDerWaalsContact OH-CG1 3.24Å; Y39-V97 WeakPolarHBondContact OH-CG1 3.39Å; Y39-V97 WeakPolarHBondContact OH-CG2 3.31Å
40	S	84.9	Confident	88.8	Confident	44 Å²	44	60.3 Å²	60.3	31%	0.308	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-41.4	174.4	68.4	0	0	0	0	111.5	G36 V37 F38 E44	G36-S40 PolarHBondContact O-N 2.9Å; G36-S40 PolarHBondContact O-OG 2.75Å; V37-S40 WeakPolarHBondContact CA-OG 3.42Å; V37-S40 PolarHBondContact O-OG 3.36Å; F38-S40 VanDerWaalsContact C-N 3.31Å; F38-S40 PolarHBondContact O-N 2.71Å; S40-E44 VanDerWaalsContact O-CB 3.29Å; S40-E44 WeakPolarHBondContact O-CB 3.33Å; S40-E44 PolarHBondContact O-N 3.02Å
41	K	88	Confident	89	Confident	91 Å²	91	62.3 Å²	62.3	40%	0.396	32%	0.322	S	S	.	.	H	α-helix	trans	-73.5	-39	177.6	-71.3	-76.2	164.2	-158.1	0	112.3	V37 F38 Y39 E43 E44 Y45	V37-K41 HydrophobicContact CG1-CG 4.29Å; V37-K41 WeakPolarHBondContact O-CB 3.34Å; V37-K41 WeakPolarHBondContact O-CG 3.34Å; V37-K41 PolarHBondContact O-N 3.18Å; F38-K41 PolarHBondContact O-N 3.11Å; Y39-K41 VanDerWaalsContact C-N 3.32Å; Y39-K41 PolarHBondContact O-N 2.91Å; K41-E43 VanDerWaalsContact C-N 3.34Å; K41-E44 WeakPolarHBondContact CD-OE2 3.1Å; K41-E44 WeakPolarHBondContact CE-OE2 3.43Å; K41-E44 IonicContact NZ-OE1 3.46Å; K41-E44 PolarHBondContact NZ-OE1 3.45Å; K41-E44 IonicContact NZ-OE2 3.44Å; K41-E44 PolarHBondContact NZ-OE2 3.34Å; K41-E44 PolarHBondContact O-N 3.07Å; K41-Y45 HydrophobicContact CB-CD2 4.43Å; K41-Y45 HydrophobicContact CD-CD2 4.31Å; K41-Y45 HydrophobicContact CD-CE2 3.83Å; K41-Y45 WeakPolarHBondContact O-CB 3.35Å; K41-Y45 VanDerWaalsContact O-CD2 3.25Å; K41-Y45 WeakPolarHBondContact O-CD2 3.25Å; K41-Y45 PolarHBondContact O-N 3.03Å
42	L	89	Confident	89.3	Confident	47 Å²	47	61.1 Å²	61.1	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-41.6	173.3	-76.2	-174	0	0	0	111.5	F26 F38 Y39 F46 G47	F26-L42 HydrophobicContact CE1-CB 4.13Å; F26-L42 HydrophobicContact CZ-CB 3.85Å; F38-L42 HydrophobicContact CD1-CD1 3.8Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CD2-CD1 4.28Å; F38-L42 HydrophobicContact CD2-CG 4.25Å; F38-L42 HydrophobicContact CE1-CD1 3.29Å; F38-L42 HydrophobicContact CE1-CG 4.24Å; F38-L42 HydrophobicContact CE2-CD1 3.83Å; F38-L42 HydrophobicContact CE2-CD2 4.38Å; F38-L42 HydrophobicContact CE2-CG 4.08Å; F38-L42 HydrophobicContact CG-CD1 4.28Å; F38-L42 HydrophobicContact CG-CG 4.42Å; F38-L42 HydrophobicContact CZ-CD1 3.32Å; F38-L42 HydrophobicContact CZ-CG 4.09Å; F38-L42 WeakPolarHBondContact O-CB 3.03Å; F38-L42 WeakPolarHBondContact O-CG 3.39Å; F38-L42 PolarHBondContact O-N 3.32Å; Y39-L42 HydrophobicContact CD1-CD1 4.43Å; Y39-L42 PolarHBondContact O-N 3.21Å; L42-F46 HydrophobicContact CD2-CD2 3.67Å; L42-F46 HydrophobicContact CD2-CE2 4.09Å; L42-F46 CarbonylContact O-C 3.58Å; L42-F46 VanDerWaalsContact O-CA 3.31Å; L42-F46 WeakPolarHBondContact O-CA 3.04Å; L42-F46 WeakPolarHBondContact O-CB 3.4Å; L42-F46 PolarHBondContact O-N 2.93Å; L42-G47 PolarHBondContact O-N 3.41Å
43	E	91.8	Very high	89.6	Confident	55 Å²	55	57.8 Å²	57.8	26%	0.257	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-45	174.8	-174.8	172.4	-164.5	0	0	110.8	F26 R27 Y39 K41 G47	F26-E43 HydrophobicContact CB-CB 4.32Å; F26-E43 HydrophobicContact CB-CG 4.18Å; F26-E43 HydrophobicContact CD1-CB 4.44Å; F26-E43 HydrophobicContact CD2-CB 3.49Å; F26-E43 VanDerWaalsContact CD2-CB 3.49Å; F26-E43 HydrophobicContact CD2-CG 3.58Å; F26-E43 VanDerWaalsContact CE2-CA 3.47Å; F26-E43 HydrophobicContact CE2-CB 3.81Å; F26-E43 HydrophobicContact CE2-CG 4.24Å; F26-E43 HydrophobicContact CG-CB 3.83Å; F26-E43 HydrophobicContact CG-CG 4.06Å; F26-E43 HydrophobicContact CZ-CB 4.43Å; R27-E43 IonicContact NE-OE1 3.46Å; R27-E43 PolarHBondContact NE-OE1 2.95Å; R27-E43 IonicContact NH2-OE1 2.72Å; Y39-E43 VanDerWaalsContact O-CB 3.26Å; Y39-E43 WeakPolarHBondContact O-CB 3.43Å; Y39-E43 PolarHBondContact O-N 3.3Å; K41-E43 VanDerWaalsContact C-N 3.34Å; E43-G47 WeakPolarHBondContact O-CA 3.45Å; E43-G47 PolarHBondContact O-N 3.4Å
44	E	91.7	Very high	89.8	Confident	119 Å²	119	59.2 Å²	59.2	56%	0.556	31%	0.305	S	S	*	.	H	α-helix	trans	-61.1	-50.5	177.9	-175.2	-175.9	165.9	0	0	112.5	S40 K41	S40-E44 VanDerWaalsContact O-CB 3.29Å; S40-E44 WeakPolarHBondContact O-CB 3.33Å; S40-E44 PolarHBondContact O-N 3.02Å; K41-E44 WeakPolarHBondContact CD-OE2 3.1Å; K41-E44 WeakPolarHBondContact CE-OE2 3.43Å; K41-E44 IonicContact NZ-OE1 3.46Å; K41-E44 PolarHBondContact NZ-OE1 3.45Å; K41-E44 IonicContact NZ-OE2 3.44Å; K41-E44 PolarHBondContact NZ-OE2 3.34Å; K41-E44 PolarHBondContact O-N 3.07Å
45	Y	92.1	Very high	90	Very high	126 Å²	126	59.9 Å²	59.9	49%	0.494	32%	0.317	S	S	.	.	H	α-helix	trans	-84.7	-40.2	-174	-76.5	-75.2	0	0	0	113.6	K41 N142	K41-Y45 HydrophobicContact CB-CD2 4.43Å; K41-Y45 HydrophobicContact CD-CD2 4.31Å; K41-Y45 HydrophobicContact CD-CE2 3.83Å; K41-Y45 WeakPolarHBondContact O-CB 3.35Å; K41-Y45 VanDerWaalsContact O-CD2 3.25Å; K41-Y45 WeakPolarHBondContact O-CD2 3.25Å; K41-Y45 PolarHBondContact O-N 3.03Å; Y45-N142 WeakPolarHBondContact O-CB 3.49Å; Y45-N142 PolarHBondContact O-ND2 2.82Å
46	F	93.3	Very high	90.5	Very high	61 Å²	61	52.8 Å²	52.8	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-118.9	1.1	-170.1	-57.1	-66.6	0	0	0	113.8	L42 A48 A49 L50 N142 V143	L42-F46 HydrophobicContact CD2-CD2 3.67Å; L42-F46 HydrophobicContact CD2-CE2 4.09Å; L42-F46 CarbonylContact O-C 3.58Å; L42-F46 VanDerWaalsContact O-CA 3.31Å; L42-F46 WeakPolarHBondContact O-CA 3.04Å; L42-F46 WeakPolarHBondContact O-CB 3.4Å; L42-F46 PolarHBondContact O-N 2.93Å; F46-A48 VanDerWaalsContact C-N 3.29Å; F46-A48 PolarHBondContact O-N 3.3Å; F46-A49 WeakPolarHBondContact O-CB 3.11Å; F46-A49 PolarHBondContact O-N 3.17Å; F46-L50 PolarHBondContact O-N 3.32Å; F46-N142 HydrophobicContact CD1-CB 4.45Å; F46-N142 HydrophobicContact CE1-CB 4.47Å; F46-N142 WeakPolarHBondContact CE1-O 3.25Å; F46-V143 HydrophobicContact CD1-CG2 3.63Å; F46-V143 HydrophobicContact CE1-CG2 4.04Å
47	G	93.1	Very high	91.1	Very high	5 Å²	5	52.9 Å²	52.9	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-55.6	-41.4	-176.5	0	0	0	0	0	113.6	L42 E43 L50 N51	L42-G47 PolarHBondContact O-N 3.41Å; E43-G47 WeakPolarHBondContact O-CA 3.45Å; E43-G47 PolarHBondContact O-N 3.4Å; G47-L50 PolarHBondContact O-N 3.38Å; G47-N51 VanDerWaalsContact O-CB 3.28Å; G47-N51 WeakPolarHBondContact O-CB 3.46Å; G47-N51 PolarHBondContact O-N 2.71Å; G47-N51 PolarHBondContact O-ND2 3.05Å; G47-N51 VanDerWaalsContact O-ND2 3.16Å
48	A	94.8	Very high	91.7	Very high	55 Å²	55	51.7 Å²	51.7	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-64.2	-43.4	176.2	0	0	0	0	0	112.4	F46 N51 N52 P141	F46-A48 VanDerWaalsContact C-N 3.29Å; F46-A48 PolarHBondContact O-N 3.3Å; A48-N51 PolarHBondContact O-N 2.95Å; A48-N52 WeakPolarHBondContact O-CB 3.22Å; A48-N52 PolarHBondContact O-N 3.42Å; A48-N52 PolarHBondContact O-ND2 3.14Å; A48-N52 PolarHBondContact O-OD1 2.84Å; A48-P141 HydrophobicContact CB-CG 3.69Å
49	A	95.3	Very high	92.2	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-44.9	176.9	0	0	0	0	0	111.8	F46 N52 A53 L140 P141 V143	F46-A49 WeakPolarHBondContact O-CB 3.11Å; F46-A49 PolarHBondContact O-N 3.17Å; A49-N52 PolarHBondContact O-N 3.38Å; A49-A53 PolarHBondContact O-N 3.25Å; A49-L140 HydrophobicContact CB-CB 3.92Å; A49-L140 HydrophobicContact CB-CD2 4.03Å; A49-L140 WeakPolarHBondContact O-CD2 3.44Å; A49-P141 HydrophobicContact CB-CG 4.39Å; A49-V143 HydrophobicContact CB-CG2 3.72Å
50	L	93.3	Very high	92.5	Very high	53 Å²	53	50.1 Å²	50.1	28%	0.277	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-42.5	179	-173.9	63.4	0	0	0	111.7	Y25 F26 F46 G47 N52 A53 I54	Y25-L50 HydrophobicContact CD1-CD2 3.35Å; Y25-L50 HydrophobicContact CE1-CD2 4.08Å; Y25-L50 HydrophobicContact CG-CD2 3.81Å; F26-L50 HydrophobicContact CD2-CD2 4.21Å; F26-L50 HydrophobicContact CE1-CD2 4.1Å; F26-L50 HydrophobicContact CE2-CD2 3.45Å; F26-L50 VanDerWaalsContact CE2-CD2 3.45Å; F26-L50 HydrophobicContact CZ-CD2 3.39Å; F46-L50 PolarHBondContact O-N 3.32Å; G47-L50 PolarHBondContact O-N 3.38Å; L50-N52 VanDerWaalsContact C-N 3.31Å; L50-N52 PolarHBondContact O-N 3.34Å; L50-A53 PolarHBondContact O-N 3.46Å; L50-I54 HydrophobicContact CD1-CD1 4.02Å; L50-I54 HydrophobicContact CD1-CG1 4.4Å; L50-I54 HydrophobicContact CD2-CD1 4.5Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.37Å; L50-I54 WeakPolarHBondContact O-CG1 3.48Å; L50-I54 PolarHBondContact O-N 2.9Å
51	N	94.2	Very high	92.8	Very high	59 Å²	59	48.6 Å²	48.6	32%	0.316	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-39.3	176.5	-72.8	-23.5	0	0	0	111.7	P24 G47 A48 I54 A55	P24-N51 WeakPolarHBondContact CB-OD1 3.45Å; G47-N51 VanDerWaalsContact O-CB 3.28Å; G47-N51 WeakPolarHBondContact O-CB 3.46Å; G47-N51 PolarHBondContact O-N 2.71Å; G47-N51 PolarHBondContact O-ND2 3.05Å; G47-N51 VanDerWaalsContact O-ND2 3.16Å; A48-N51 PolarHBondContact O-N 2.95Å; N51-I54 PolarHBondContact O-N 3.45Å; N51-A55 VanDerWaalsContact O-CB 3.22Å; N51-A55 WeakPolarHBondContact O-CB 3.46Å; N51-A55 PolarHBondContact O-N 2.9Å
52	N	95.7	Very high	93	Very high	63 Å²	63	49.4 Å²	49.4	34%	0.337	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-44.1	175.7	-69.2	-9.9	0	0	0	111.9	A48 A49 L50 A55 Y56 I138 R139	A48-N52 WeakPolarHBondContact O-CB 3.22Å; A48-N52 PolarHBondContact O-N 3.42Å; A48-N52 PolarHBondContact O-ND2 3.14Å; A48-N52 PolarHBondContact O-OD1 2.84Å; A49-N52 PolarHBondContact O-N 3.38Å; L50-N52 VanDerWaalsContact C-N 3.31Å; L50-N52 PolarHBondContact O-N 3.34Å; N52-A55 PolarHBondContact O-N 3.46Å; N52-Y56 PolarHBondContact O-N 3.3Å; N52-I138 HydrophobicContact CB-CG2 3.95Å; N52-R139 WeakPolarHBondContact CB-O 3.21Å; N52-R139 PolarHBondContact ND2-O 3Å
53	A	94	Very high	93.1	Very high	15 Å²	15	49.1 Å²	49.1	12%	0.124	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-45.1	176.1	0	0	0	0	0	111.5	A49 L50 Y56 L57 W133 L140	A49-A53 PolarHBondContact O-N 3.25Å; L50-A53 PolarHBondContact O-N 3.46Å; A53-Y56 WeakPolarHBondContact O-CB 3.25Å; A53-Y56 PolarHBondContact O-N 2.99Å; A53-L57 WeakPolarHBondContact O-CG 3.22Å; A53-L57 PolarHBondContact O-N 3.06Å; A53-W133 HydrophobicContact CB-CH2 4.2Å; A53-W133 HydrophobicContact CB-CZ3 4.29Å; A53-L140 HydrophobicContact CB-CD2 4.35Å
54	I	92.7	Very high	92.9	Very high	31 Å²	31	49.6 Å²	49.6	16%	0.159	27%	0.269	C	S	.	.	H	α-helix	trans	-69.9	-36.6	179.5	-69.6	173	0	0	0	111.9	Y25 L50 N51 Y56 L57 K58	Y25-I54 VanDerWaalsContact CB-CD1 3.43Å; Y25-I54 HydrophobicContact CD2-CD1 4.1Å; Y25-I54 HydrophobicContact CG-CD1 3.98Å; L50-I54 HydrophobicContact CD1-CD1 4.02Å; L50-I54 HydrophobicContact CD1-CG1 4.4Å; L50-I54 HydrophobicContact CD2-CD1 4.5Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.37Å; L50-I54 WeakPolarHBondContact O-CG1 3.48Å; L50-I54 PolarHBondContact O-N 2.9Å; N51-I54 PolarHBondContact O-N 3.45Å; I54-Y56 VanDerWaalsContact C-N 3.26Å; I54-Y56 PolarHBondContact O-N 3.44Å; I54-L57 PolarHBondContact O-N 3.42Å; I54-K58 VanDerWaalsContact O-CB 3.25Å; I54-K58 WeakPolarHBondContact O-CB 3.5Å; I54-K58 PolarHBondContact O-N 2.84Å
55	A	93.6	Very high	92.9	Very high	57 Å²	57	50.1 Å²	50.1	47%	0.471	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-40.2	173.8	0	0	0	0	0	111.3	N51 N52 K58 S59	N51-A55 VanDerWaalsContact O-CB 3.22Å; N51-A55 WeakPolarHBondContact O-CB 3.46Å; N51-A55 PolarHBondContact O-N 2.9Å; N52-A55 PolarHBondContact O-N 3.46Å; A55-K58 PolarHBondContact O-N 2.97Å; A55-S59 PolarHBondContact O-N 2.81Å
56	Y	94.3	Very high	93	Very high	13 Å²	13	44.3 Å²	44.3	5%	0.051	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-48.8	172.9	166.3	-109.9	0	0	0	112.6	N52 A53 I54 K58 S59 I60 P124 I132 W133 N135 I138	N52-Y56 PolarHBondContact O-N 3.3Å; A53-Y56 WeakPolarHBondContact O-CB 3.25Å; A53-Y56 PolarHBondContact O-N 2.99Å; I54-Y56 VanDerWaalsContact C-N 3.26Å; I54-Y56 PolarHBondContact O-N 3.44Å; Y56-K58 PolarHBondContact O-N 3.43Å; Y56-S59 PolarHBondContact O-N 3.31Å; Y56-S59 PolarHBondContact O-OG 3.42Å; Y56-I60 HydrophobicContact CD2-CG2 3.98Å; Y56-I60 HydrophobicContact CE1-CD1 4.02Å; Y56-I60 HydrophobicContact CE2-CD1 4.44Å; Y56-I60 HydrophobicContact CE2-CG2 3.38Å; Y56-I60 PolarHBondContact O-N 3.28Å; Y56-P124 WeakPolarHBondContact OH-CD 3.37Å; Y56-I132 WeakPolarHBondContact CE1-O 3.39Å; Y56-I132 PolarHBondContact OH-O 3.22Å; Y56-I132 VanDerWaalsContact OH-O 3.09Å; Y56-W133 HydrophobicContact CD1-CE3 4.43Å; Y56-W133 HydrophobicContact CD1-CZ3 4.48Å; Y56-W133 HydrophobicContact CE1-CE3 4.43Å; Y56-N135 HydrophobicContact CD1-CB 4.44Å; Y56-N135 HydrophobicContact CE1-CB 3.98Å; Y56-N135 HydrophobicContact CE2-CB 4.41Å; Y56-N135 WeakPolarHBondContact CE2-ND2 3.4Å; Y56-I138 HydrophobicContact CD1-CG1 4.23Å; Y56-I138 HydrophobicContact CD2-CD1 3.92Å; Y56-I138 HydrophobicContact CD2-CG1 4.25Å; Y56-I138 HydrophobicContact CG-CD1 3.81Å; Y56-I138 HydrophobicContact CG-CG1 3.84Å
57	L	92.7	Very high	93.1	Very high	28 Å²	28	41.7 Å²	41.7	15%	0.147	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-38.8	176.5	-66.6	173.9	0	0	0	111.7	A53 I54 I60 T61 I132 L156	A53-L57 WeakPolarHBondContact O-CG 3.22Å; A53-L57 PolarHBondContact O-N 3.06Å; I54-L57 PolarHBondContact O-N 3.42Å; L57-I60 HydrophobicContact CD2-CD1 4.26Å; L57-I60 WeakPolarHBondContact O-CG1 3.15Å; L57-T61 WeakPolarHBondContact O-CB 3.39Å; L57-T61 PolarHBondContact O-N 3.01Å; L57-T61 PolarHBondContact O-OG1 3.46Å; L57-I132 HydrophobicContact CD2-CD1 4.1Å; L57-L156 HydrophobicContact CD1-CD1 4.05Å; L57-L156 HydrophobicContact CD2-CD1 3.91Å; L57-L156 HydrophobicContact CG-CD1 4.48Å
58	K	92.5	Very high	93.2	Very high	65 Å²	65	43 Å²	43	28%	0.283	25%	0.25	S	C	.	.	H	α-helix	trans	-65.6	-37	175.2	-176.6	-179.3	-174.6	177.5	0	112.6	I12 K13 N22 I54 A55 Y56	I12-K58 WeakPolarHBondContact O-CD 3.14Å; I12-K58 WeakPolarHBondContact O-CG 3.46Å; K13-K58 HydrophobicContact CB-CG 4.14Å; K13-K58 HydrophobicContact CD-CG 4.25Å; K13-K58 HydrophobicContact CG-CG 4.12Å; N22-K58 WeakPolarHBondContact OD1-CE 3.32Å; N22-K58 PolarHBondContact OD1-NZ 2.93Å; I54-K58 VanDerWaalsContact O-CB 3.25Å; I54-K58 WeakPolarHBondContact O-CB 3.5Å; I54-K58 PolarHBondContact O-N 2.84Å; A55-K58 PolarHBondContact O-N 2.97Å; Y56-K58 PolarHBondContact O-N 3.43Å
59	S	92.4	Very high	93.2	Very high	60 Å²	60	45 Å²	45	42%	0.42	25%	0.251	S	S	.	.	H	α-helix	trans	-70.4	-38.6	179.8	69.4	0	0	0	0	111.7	A55 Y56 M122	A55-S59 PolarHBondContact O-N 2.81Å; Y56-S59 PolarHBondContact O-N 3.31Å; Y56-S59 PolarHBondContact O-OG 3.42Å; S59-M122 WeakPolarHBondContact O-CE 3.49Å
60	I	92.5	Very high	93.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-79.3	-26.3	179.7	69.2	175.7	0	0	0	112.7	Y56 L57 Q62 T118 S119 M122 L123 I132	Y56-I60 HydrophobicContact CD2-CG2 3.98Å; Y56-I60 HydrophobicContact CE1-CD1 4.02Å; Y56-I60 HydrophobicContact CE2-CD1 4.44Å; Y56-I60 HydrophobicContact CE2-CG2 3.38Å; Y56-I60 PolarHBondContact O-N 3.28Å; L57-I60 HydrophobicContact CD2-CD1 4.26Å; L57-I60 WeakPolarHBondContact O-CG1 3.15Å; I60-Q62 PolarHBondContact O-N 3.44Å; I60-T118 HydrophobicContact CB-CG2 3.83Å; I60-T118 HydrophobicContact CD1-CG2 3.97Å; I60-T118 HydrophobicContact CG1-CG2 3.93Å; I60-T118 CarbonylContact O-C 3.44Å; I60-T118 VanDerWaalsContact O-CA 3.31Å; I60-T118 WeakPolarHBondContact O-CA 3.28Å; I60-S119 PolarHBondContact O-N 3.33Å; I60-M122 HydrophobicContact CG2-CB 3.89Å; I60-L123 HydrophobicContact CB-CD2 4.46Å; I60-L123 HydrophobicContact CD1-CD2 3.97Å; I60-L123 HydrophobicContact CG2-CD2 4.4Å; I60-I132 HydrophobicContact CD1-CB 3.96Å; I60-I132 HydrophobicContact CD1-CG2 4.15Å
61	T	92	Very high	93.2	Very high	12 Å²	12	45.3 Å²	45.3	7%	0.074	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-78.2	119.9	179.9	-55	0	0	0	0	111.3	I12 K13 L57 D63	I12-T61 HydrophobicContact CD1-CG2 4Å; I12-T61 WeakPolarHBondContact CD1-OG1 3.48Å; K13-T61 PolarHBondContact NZ-O 2.67Å; L57-T61 WeakPolarHBondContact O-CB 3.39Å; L57-T61 PolarHBondContact O-N 3.01Å; L57-T61 PolarHBondContact O-OG1 3.46Å; T61-D63 HydrophobicContact CG2-CB 4.47Å
62	Q	91.8	Very high	93.2	Very high	108 Å²	108	45.3 Å²	45.3	51%	0.505	25%	0.253	S	S	.	.			trans	-76.8	-44	-179.8	-65.9	179.1	-29.1	0	0	110.9	K13 I60 H117	K13-Q62 PolarHBondContact NZ-O 3.14Å; K13-Q62 VanDerWaalsContact NZ-O 3.14Å; I60-Q62 PolarHBondContact O-N 3.44Å; Q62-H117 HydrophobicContact CB-CB 4.18Å; Q62-H117 PolarHBondContact N-O 3.27Å
63	D	92	Very high	93.2	Very high	41 Å²	41	44.1 Å²	44.1	22%	0.219	24%	0.243	C	C	.	.			trans	-62.4	136.4	-176	-55.1	-89.3	0	0	0	113.3	T61 H117	T61-D63 HydrophobicContact CG2-CB 4.47Å; D63-H117 IonicContact OD1-ND1 3.17Å; D63-H117 PolarHBondContact OD1-ND1 3.13Å; D63-H117 VanDerWaalsContact OD1-ND1 3.17Å; D63-H117 WeakPolarHBondContact OD2-CA 3.5Å; D63-H117 WeakPolarHBondContact OD2-CB 3.48Å; D63-H117 IonicContact OD2-CG 3.79Å; D63-H117 PolarHBondContact OD2-N 2.03Å; D63-H117 IonicContact OD2-ND1 3.35Å; D63-H117 PolarHBondContact OD2-ND1 2.94Å
64	T	87.3	Confident	93.2	Very high	64 Å²	64	43.6 Å²	43.6	39%	0.393	24%	0.238	S	C	.	.	S	Bend	trans	-94.3	-9.2	174.3	55.1	0	0	0	0	112.8
65	K	91.8	Very high	93.1	Very high	130 Å²	130	42.4 Å²	42.4	57%	0.565	23%	0.233	S	C	*	.	S	Bend	trans	-107	152.7	177.6	-65.5	-178.6	-177.9	177.8	0	110.1	W11 I110	W11-K65 WeakPolarHBondContact CZ2-O 3.47Å; K65-I110 HydrophobicContact CB-CG2 4.32Å; K65-I110 HydrophobicContact CD-CD1 4.5Å; K65-I110 HydrophobicContact CD-CG2 4.45Å
66	P	94.6	Very high	92.9	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.032	21%	0.214	C	C	.	.			trans	-49.6	136	168.1	-30.9	38.9	0	0	0	112.9	W11 W21 A71 L107 Q112	W11-P66 HydrophobicContact CD2-CB 4.32Å; W11-P66 HydrophobicContact CD2-CG 4.26Å; W11-P66 VanDerWaalsContact CE2-CA 3.48Å; W11-P66 HydrophobicContact CG-CG 4.17Å; W11-P66 VanDerWaalsContact CZ2-CA 3.5Å; W21-P66 HydrophobicContact CH2-CG 3.52Å; W21-P66 HydrophobicContact CZ2-CG 4.15Å; W21-P66 HydrophobicContact CZ3-CG 3.91Å; P66-A71 HydrophobicContact CB-CB 4.06Å; P66-A71 HydrophobicContact CG-CB 4.45Å; P66-L107 HydrophobicContact CB-CD1 3.76Å; P66-L107 HydrophobicContact CG-CD1 3.97Å; P66-L107 HydrophobicContact CG-CD2 4.01Å; P66-Q112 HydrophobicContact CB-CG 3.83Å
67	C	94.7	Very high	92.4	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.034	22%	0.22	C	C	.	.			trans	-154	167	-177.1	53.6	0	0	0	0	110.2	W11 M69 C70 K114 C116	W11-C67 VanDerWaalsContact CH2-N 3.33Å; W11-C67 VanDerWaalsContact CH2-O 3.29Å; W11-C67 WeakPolarHBondContact CH2-O 3.23Å; C67-M69 PolarHBondContact O-N 3.08Å; C67-M69 VanDerWaalsContact O-N 3.11Å; C67-C70 WeakPolarHBondContact O-CB 3.42Å; C67-C70 PolarHBondContact O-N 3.31Å; C67-K114 WeakPolarHBondContact CB-O 3.42Å; C67-C116 HydrophobicContact CB-CB 4.07Å; C67-C116 WeakPolarHBondContact CB-SG 3.3Å; C67-C116 PolarHBondContact O-SG 3.3Å; C67-C116 VanDerWaalsContact O-SG 3.32Å; C67-C116 WeakPolarHBondContact SG-CA 3.46Å; C67-C116 WeakPolarHBondContact SG-CB 3.36Å; C67-C116 CovalentContact SG-SG 2.03Å; C67-C116 PolarHBondContact SG-SG 3.34Å
68	G	94.2	Very high	91.7	Very high	33 Å²	33	42.9 Å²	42.9	34%	0.34	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	20.5	170.9	0	0	0	0	0	114.6	C70 Q112 K114	G68-C70 PolarHBondContact O-N 2.79Å; G68-C70 PolarHBondContact O-SG 3.43Å; G68-C70 VanDerWaalsContact O-SG 3.36Å; G68-Q112 PolarHBondContact N-O 3.48Å; G68-Q112 VanDerWaalsContact N-O 3.08Å; G68-K114 PolarHBondContact N-O 3.22Å
69	M	94.8	Very high	90.6	Very high	96 Å²	96	47.2 Å²	47.2	47%	0.473	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.3	-170.1	-56	-64.7	-172.5	0	0	113.6	C67 L101 Q112 D113	C67-M69 PolarHBondContact O-N 3.08Å; C67-M69 VanDerWaalsContact O-N 3.11Å; M69-L101 HydrophobicContact CB-CD1 4.36Å; M69-L101 HydrophobicContact CB-CD2 4.28Å; M69-L101 WeakPolarHBondContact O-CD2 3.45Å; M69-Q112 PolarHBondContact N-O 2.77Å; M69-Q112 HydrophobicContact SD-CB 3.86Å; M69-D113 HydrophobicContact CE-CB 4.34Å
70	C	93.2	Very high	89.3	Confident	64 Å²	64	47 Å²	47	43%	0.432	25%	0.246	S	C	.	.			trans	-90.9	-13.6	-174.3	-72	0	0	0	0	113.1	W11 C67 G68 Y72	W11-C70 HydrophobicContact CH2-CB 3.86Å; W11-C70 VanDerWaalsContact CZ3-C 3.45Å; W11-C70 HydrophobicContact CZ3-CB 3.39Å; C67-C70 WeakPolarHBondContact O-CB 3.42Å; C67-C70 PolarHBondContact O-N 3.31Å; G68-C70 PolarHBondContact O-N 2.79Å; G68-C70 PolarHBondContact O-SG 3.43Å; G68-C70 VanDerWaalsContact O-SG 3.36Å; C70-Y72 WeakPolarHBondContact O-CD1 2.93Å
71	A	95.2	Very high	87.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.			trans	-85.8	130	175.3	0	0	0	0	0	110.2	T10 W11 P66 C102 Q112	T10-A71 WeakPolarHBondContact O-CA 3.44Å; T10-A71 WeakPolarHBondContact O-CB 2.91Å; W11-A71 HydrophobicContact CB-CB 4.48Å; W11-A71 HydrophobicContact CD2-CB 4.21Å; W11-A71 HydrophobicContact CE3-CB 3.45Å; W11-A71 VanDerWaalsContact CE3-CB 3.45Å; W11-A71 HydrophobicContact CZ3-CB 3.99Å; W11-A71 VanDerWaalsContact CZ3-N 3.35Å; P66-A71 HydrophobicContact CB-CB 4.06Å; P66-A71 HydrophobicContact CG-CB 4.45Å; A71-C102 HydrophobicContact CB-CB 4.45Å; A71-C102 PolarHBondContact O-N 3.23Å; A71-Q112 VanDerWaalsContact CA-OE1 3.31Å; A71-Q112 PolarHBondContact O-NE2 3.21Å
72	Y	95.6	Very high	86.1	Confident	60 Å²	60	56.8 Å²	56.8	24%	0.235	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.1	-176.5	63.8	-91.2	0	0	0	110.6	C9 T10 Y25 C70 Q74 E99 S100 C102	C9-Y72 CarbonylContact C-O 3.55Å; T10-Y72 PolarHBondContact N-O 3.28Å; Y25-Y72 WeakPolarHBondContact CE2-OH 3.4Å; Y25-Y72 PolarHBondContact OH-OH 2.83Å; C70-Y72 WeakPolarHBondContact O-CD1 2.93Å; Y72-Q74 HydrophobicContact CD2-CG 4.16Å; Y72-Q74 HydrophobicContact CE2-CG 4.05Å; Y72-E99 HydrophobicContact CD2-CG 4.21Å; Y72-E99 HydrophobicContact CE2-CG 4.45Å; Y72-S100 CarbonylContact C-O 3.38Å; Y72-S100 VanDerWaalsContact CA-O 3.23Å; Y72-S100 WeakPolarHBondContact CA-O 3.47Å; Y72-S100 WeakPolarHBondContact CB-O 3.28Å; Y72-C102 VanDerWaalsContact C-SG 3.52Å
73	R	95.2	Very high	84.3	Confident	38 Å²	38	58.2 Å²	58.2	14%	0.143	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	154.6	173.1	58.7	-174.5	-172.2	-171.8	-17.1	109.7	W6 G7 E99 S100 D106	W6-R73 HydrophobicContact CB-CG 4.46Å; W6-R73 HydrophobicContact CD2-CG 4.39Å; W6-R73 HydrophobicContact CE3-CG 3.83Å; W6-R73 HydrophobicContact CZ3-CG 4.47Å; G7-R73 WeakPolarHBondContact O-CB 3.42Å; R73-E99 WeakPolarHBondContact O-CA 3.48Å; R73-S100 PolarHBondContact N-O 3.04Å; R73-S100 PolarHBondContact O-N 3.18Å; R73-D106 IonicContact CZ-OD1 4Å; R73-D106 IonicContact CZ-OD2 3.46Å; R73-D106 VanDerWaalsContact NH1-CG 3.25Å; R73-D106 IonicContact NH1-OD1 3.36Å; R73-D106 PolarHBondContact NH1-OD1 2.67Å; R73-D106 IonicContact NH1-OD2 2.7Å; R73-D106 PolarHBondContact NH1-OD2 3.38Å; R73-D106 IonicContact NH2-OD1 3.73Å; R73-D106 IonicContact NH2-OD2 3.46Å; R73-D106 PolarHBondContact NH2-OD2 2.95Å
74	Q	93.4	Very high	82.5	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.019	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	143	-178.1	-78.7	170.3	-17.9	0	0	111.4	G7 Y25 Y39 Y72 V97 A98 E99	G7-Q74 PolarHBondContact N-O 2.93Å; Y25-Q74 PolarHBondContact OH-NE2 3.46Å; Y39-Q74 PolarHBondContact OH-NE2 3.17Å; Y39-Q74 PolarHBondContact OH-OE1 3.35Å; Y72-Q74 HydrophobicContact CD2-CG 4.16Å; Y72-Q74 HydrophobicContact CE2-CG 4.05Å; Q74-V97 HydrophobicContact CB-CG1 4.12Å; Q74-V97 HydrophobicContact CG-CG1 3.74Å; Q74-A98 CarbonylContact C-O 3.51Å; Q74-A98 VanDerWaalsContact CA-O 3.24Å; Q74-A98 WeakPolarHBondContact CA-O 3.15Å; Q74-E99 HydrophobicContact CG-CG 3.6Å; Q74-E99 PolarHBondContact NE2-OE1 2.81Å
75	S	91.6	Very high	80.8	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.042	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.7	162	173.3	0	0	0	0	108.4	S4 V97 A98	S4-S75 PolarHBondContact O-OG 2.01Å; S4-S75 PolarHBondContact OG-OG 3.04Å; S75-V97 WeakPolarHBondContact O-CA 3.46Å; S75-A98 PolarHBondContact N-O 2.81Å; S75-A98 PolarHBondContact O-N 2.98Å
76	C	88.8	Confident	78.6	Confident	11 Å²	11	68.8 Å²	68.8	7%	0.074	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.9	-178.7	-68	0	0	0	0	110.6	S4 C33 F78	S4-C76 PolarHBondContact N-O 3.08Å; S4-C76 PolarHBondContact OG-N 3.29Å; C33-C76 WeakPolarHBondContact CA-SG 3.36Å; C33-C76 HydrophobicContact CB-CB 4.06Å; C33-C76 WeakPolarHBondContact CB-SG 3.29Å; C33-C76 WeakPolarHBondContact SG-CB 3.47Å; C33-C76 CovalentContact SG-SG 2.03Å; C33-C76 PolarHBondContact SG-SG 3.04Å; C76-F78 PolarHBondContact O-N 2.83Å
77	G	84.5	Confident	76.8	Confident	18 Å²	18	76.8 Å²	76.8	19%	0.186	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	121.6	170.1	0	0	0	0	0	109.8	V2 W3 F96	V2-G77 CarbonylContact O-C 3.54Å; V2-G77 WeakPolarHBondContact O-CA 3.24Å; W3-G77 VanDerWaalsContact CE3-N 3.33Å; G77-F96 PolarHBondContact N-O 3Å
78	F	77	Confident	74.8	Confident	78 Å²	78	79.3 Å²	79.3	34%	0.342	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.8	173.6	69.4	-80.3	0	0	0	109.9	V2 W3 L32 C76	V2-F78 HydrophobicContact CB-CE1 4.39Å; V2-F78 HydrophobicContact CB-CE2 4.45Å; V2-F78 HydrophobicContact CB-CZ 4.28Å; V2-F78 HydrophobicContact CG1-CE1 3.85Å; V2-F78 HydrophobicContact CG1-CE2 4.13Å; V2-F78 HydrophobicContact CG1-CZ 3.6Å; V2-F78 PolarHBondContact N-O 2.94Å; V2-F78 VanDerWaalsContact N-O 3.15Å; V2-F78 WeakPolarHBondContact O-CD1 3.46Å; V2-F78 PolarHBondContact O-N 2.89Å; W3-F78 VanDerWaalsContact C-CE1 3.47Å; W3-F78 WeakPolarHBondContact O-CE1 2.78Å; L32-F78 HydrophobicContact CD1-CD1 4.26Å; L32-F78 HydrophobicContact CD1-CE1 4.04Å; L32-F78 HydrophobicContact CD1-CZ 4.41Å; C76-F78 PolarHBondContact O-N 2.83Å
79	K	71	Confident	73	Confident	157 Å²	157	83.4 Å²	83.4	68%	0.683	42%	0.418	S	S	*	.	S	Bend	trans	71	110	-164.3	-69	-180	167.5	178.6	0	114.9	V2	V2-K79 HydrophobicContact CG2-CD 4.17Å
80	C	64.1	Low	71.1	Confident	54 Å²	54	85.9 Å²	85.9	37%	0.365	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-71.7	137.9	169.8	-58.2	0	0	0	0	110.6	N93	C80-N93 WeakPolarHBondContact SG-CA 3.45Å; C80-N93 VanDerWaalsContact SG-CB 3.51Å; C80-N93 PolarHBondContact SG-OD1 2.96Å
81	T	60.2	Low	69.4	Low	93 Å²	93	90.9 Å²	90.9	57%	0.571	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-93.4	131.2	163.1	38.4	0	0	0	0	109.1	R83	T81-R83 PolarHBondContact O-N 2.76Å
82	R	56.3	Low	67.6	Low	128 Å²	128	93.6 Å²	93.6	48%	0.483	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-62.2	122	173.9	-158.1	-179.9	91.5	161.2	8	108.5	K84 N89 Y91	R82-K84 PolarHBondContact O-N 3.36Å; R82-N89 PolarHBondContact NH1-OD1 3.02Å; R82-Y91 HydrophobicContact CB-CE1 4.42Å; R82-Y91 HydrophobicContact CG-CD1 4.49Å; R82-Y91 HydrophobicContact CG-CE1 4.28Å
83	R	55.7	Low	65.7	Low	137 Å²	137	94.7 Å²	94.7	52%	0.517	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-67.2	129.3	167.2	-86.2	-175.1	160.9	-161.1	-15.8	107.5	T81 H85	T81-R83 PolarHBondContact O-N 2.76Å; R83-H85 VanDerWaalsContact C-N 3.3Å; R83-H85 PolarHBondContact O-N 3.03Å
84	K	52.6	Low	63.9	Low	192 Å²	192	98.8 Å²	98.8	84%	0.835	48%	0.479	S	S	*	.			trans	-86.4	14.5	179.8	-97.6	-171.2	177.2	-175.8	0	113.9	R82	R82-K84 PolarHBondContact O-N 3.36Å
85	H	51.7	Low	62.6	Low	153 Å²	153	103 Å²	103	71%	0.708	50%	0.5	S	S	*	.			trans	-93.8	117.8	-174.9	-106	-80.9	0	0	0	113.4	R83	R83-H85 VanDerWaalsContact C-N 3.3Å; R83-H85 PolarHBondContact O-N 3.03Å
86	T	46.8	Very low	62	Low	113 Å²	113	106.5 Å²	106.5	69%	0.693	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.1	109.9	150.3	51.5	0	0	0	0	117.9	S88	T86-S88 PolarHBondContact O-N 3.04Å
87	D	55.6	Low	62	Low	173 Å²	173	108.4 Å²	108.4	93%	0.925	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	5.5	163.4	-64.9	-11.5	0	0	0	120.9
88	S	54.2	Low	62.3	Low	58 Å²	58	108.9 Å²	108.9	41%	0.406	53%	0.529	S	S	.	.			trans	-143.8	125.8	160.6	65	0	0	0	0	112.6	T86 K90	T86-S88 PolarHBondContact O-N 3.04Å; S88-K90 PolarHBondContact O-N 2.73Å
89	N	55.6	Low	63.1	Low	119 Å²	119	110.9 Å²	110.9	64%	0.636	54%	0.539	S	S	*	.			trans	-66.8	43	166.3	-84.1	-33.5	0	0	0	111.4	R82 Y91	R82-N89 PolarHBondContact NH1-OD1 3.02Å; N89-Y91 PolarHBondContact O-N 2.92Å
90	K	55.1	Low	64.3	Low	148 Å²	148	105 Å²	105	64%	0.643	52%	0.518	S	S	*	.			trans	-81	112	180	-84	-179.1	178.2	177.4	0	109.7	S88 V92	S88-K90 PolarHBondContact O-N 2.73Å; K90-V92 PolarHBondContact O-N 3.05Å
91	Y	57.8	Low	65.8	Low	168 Å²	168	106.9 Å²	106.9	66%	0.659	52%	0.524	S	S	*	.			trans	-65.2	113.1	162.7	-67.7	-88	0	0	0	108.2	R82 N89	R82-Y91 HydrophobicContact CB-CE1 4.42Å; R82-Y91 HydrophobicContact CG-CD1 4.49Å; R82-Y91 HydrophobicContact CG-CE1 4.28Å; N89-Y91 PolarHBondContact O-N 2.92Å
92	V	56.4	Low	67.6	Low	57 Å²	57	102.7 Å²	102.7	35%	0.345	50%	0.498	S	S	.	.			trans	-93.9	105	171.2	-171.3	0	0	0	0	107.3	K90 R94	K90-V92 PolarHBondContact O-N 3.05Å; V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 HydrophobicContact CB-CG 4.49Å; V92-R94 HydrophobicContact CG1-CG 3.7Å; V92-R94 PolarHBondContact O-N 3.04Å
93	N	56	Low	69.4	Low	84 Å²	84	101.3 Å²	101.3	45%	0.449	50%	0.497	S	S	.	.			trans	-74.1	91.3	168	-165	1.3	0	0	0	108.2	C80 L95	C80-N93 WeakPolarHBondContact SG-CA 3.45Å; C80-N93 VanDerWaalsContact SG-CB 3.51Å; C80-N93 PolarHBondContact SG-OD1 2.96Å; N93-L95 PolarHBondContact O-N 3.39Å
94	R	57.6	Low	71.3	Confident	124 Å²	124	96.9 Å²	96.9	47%	0.468	49%	0.49	S	S	.	.			trans	-80.3	111.3	171.7	-70.7	-170.7	168.7	-141.8	-18.9	106.6	V92 F96	V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 HydrophobicContact CB-CG 4.49Å; V92-R94 HydrophobicContact CG1-CG 3.7Å; V92-R94 PolarHBondContact O-N 3.04Å; R94-F96 HydrophobicContact CB-CD2 4.03Å; R94-F96 HydrophobicContact CB-CE2 3.24Å; R94-F96 HydrophobicContact CB-CZ 3.8Å; R94-F96 HydrophobicContact CG-CE2 4.45Å; R94-F96 WeakPolarHBondContact O-CD2 3.24Å; R94-F96 WeakPolarHBondContact O-CE2 3.39Å
95	L	67	Low	73.4	Confident	91 Å²	91	94.6 Å²	94.6	48%	0.476	48%	0.48	S	S	.	.			trans	-69.1	124	175.6	-82.5	148.2	0	0	0	109.2	F38 N93	F38-L95 HydrophobicContact CB-CD1 3.57Å; F38-L95 HydrophobicContact CB-CD2 3.08Å; F38-L95 HydrophobicContact CB-CG 3.87Å; F38-L95 HydrophobicContact CD1-CD2 4.38Å; F38-L95 HydrophobicContact CD2-CD1 3.8Å; F38-L95 HydrophobicContact CG-CD1 3.96Å; F38-L95 HydrophobicContact CG-CD2 3.83Å; F38-L95 HydrophobicContact CG-CG 4.39Å; N93-L95 PolarHBondContact O-N 3.39Å
96	F	78.8	Confident	75.4	Confident	80 Å²	80	89.5 Å²	89.5	35%	0.351	46%	0.458	S	S	.	.			trans	-129	119.2	171.2	-61.9	-95.1	0	0	0	108.9	M1 W3 G77 R94	M1-F96 HydrophobicContact CE-CD2 3.11Å; M1-F96 HydrophobicContact CE-CE2 3.1Å; M1-F96 HydrophobicContact CE-CG 4.19Å; M1-F96 HydrophobicContact CE-CZ 4.23Å; M1-F96 HydrophobicContact SD-CB 3.91Å; M1-F96 HydrophobicContact SD-CD1 4.37Å; M1-F96 HydrophobicContact SD-CD2 3.06Å; M1-F96 WeakPolarHBondContact SD-CD2 3.43Å; M1-F96 HydrophobicContact SD-CE2 3.45Å; M1-F96 WeakPolarHBondContact SD-CE2 3.08Å; M1-F96 HydrophobicContact SD-CG 3.56Å; M1-F96 VanDerWaalsContact SD-CG 3.56Å; M1-F96 HydrophobicContact SD-CZ 4.28Å; W3-F96 HydrophobicContact CH2-CB 3.33Å; W3-F96 HydrophobicContact CH2-CG 4.27Å; W3-F96 HydrophobicContact CZ2-CB 3.95Å; W3-F96 HydrophobicContact CZ3-CB 3.78Å; G77-F96 PolarHBondContact N-O 3Å; R94-F96 HydrophobicContact CB-CD2 4.03Å; R94-F96 HydrophobicContact CB-CE2 3.24Å; R94-F96 HydrophobicContact CB-CZ 3.8Å; R94-F96 HydrophobicContact CG-CE2 4.45Å; R94-F96 WeakPolarHBondContact O-CD2 3.24Å; R94-F96 WeakPolarHBondContact O-CE2 3.39Å
97	V	87.4	Confident	77.7	Confident	51 Å²	51	84.3 Å²	84.3	31%	0.309	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.7	167	-179.6	0	0	0	0	105.1	Y39 Q74 S75 E99	Y39-V97 HydrophobicContact CE2-CG1 4.49Å; Y39-V97 HydrophobicContact CE2-CG2 3.6Å; Y39-V97 VanDerWaalsContact OH-CG1 3.24Å; Y39-V97 WeakPolarHBondContact OH-CG1 3.39Å; Y39-V97 WeakPolarHBondContact OH-CG2 3.31Å; Q74-V97 HydrophobicContact CB-CG1 4.12Å; Q74-V97 HydrophobicContact CG-CG1 3.74Å; S75-V97 WeakPolarHBondContact O-CA 3.46Å; V97-E99 HydrophobicContact CG1-CG 4.41Å
98	A	91.3	Very high	79.4	Confident	29 Å²	29	83.9 Å²	83.9	24%	0.24	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.2	167	0	0	0	0	0	107.7	W3 W6 Q74 S75	W3-A98 HydrophobicContact CE3-CB 4.41Å; W3-A98 HydrophobicContact CH2-CB 4Å; W3-A98 HydrophobicContact CZ3-CB 3.75Å; W6-A98 HydrophobicContact CH2-CB 3.91Å; W6-A98 HydrophobicContact CZ3-CB 4.32Å; W6-A98 WeakPolarHBondContact CZ3-O 3.26Å; Q74-A98 CarbonylContact C-O 3.51Å; Q74-A98 VanDerWaalsContact CA-O 3.24Å; Q74-A98 WeakPolarHBondContact CA-O 3.15Å; S75-A98 PolarHBondContact N-O 2.81Å; S75-A98 PolarHBondContact O-N 2.98Å
99	E	94	Very high	81.2	Confident	119 Å²	119	84 Å²	84	56%	0.556	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.3	174.2	-74.2	178.3	160.8	0	0	109.4	Y72 R73 Q74 V97	Y72-E99 HydrophobicContact CD2-CG 4.21Å; Y72-E99 HydrophobicContact CE2-CG 4.45Å; R73-E99 WeakPolarHBondContact O-CA 3.48Å; Q74-E99 HydrophobicContact CG-CG 3.6Å; Q74-E99 PolarHBondContact NE2-OE1 2.81Å; V97-E99 HydrophobicContact CG1-CG 4.41Å
100	S	95.9	Very high	83	Confident	35 Å²	35	81 Å²	81	25%	0.245	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.6	172.5	174.9	0	0	0	0	108.2	W6 Y72 R73	W6-S100 VanDerWaalsContact CH2-CB 3.48Å; Y72-S100 CarbonylContact C-O 3.38Å; Y72-S100 VanDerWaalsContact CA-O 3.23Å; Y72-S100 WeakPolarHBondContact CA-O 3.47Å; Y72-S100 WeakPolarHBondContact CB-O 3.28Å; R73-S100 PolarHBondContact N-O 3.04Å; R73-S100 PolarHBondContact O-N 3.18Å
101	L	96.3	Very high	84.8	Confident	93 Å²	93	75.4 Å²	75.4	49%	0.487	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	145.3	165.8	-66.5	178.7	0	0	0	109.7	M69	M69-L101 HydrophobicContact CB-CD1 4.36Å; M69-L101 HydrophobicContact CB-CD2 4.28Å; M69-L101 WeakPolarHBondContact O-CD2 3.45Å
102	C	96.8	Very high	86.5	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.027	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-83.6	128.7	171.3	-75.3	0	0	0	0	110.5	C9 A71 Y72 D106 L107 Q112	C9-C102 WeakPolarHBondContact CA-SG 3.34Å; C9-C102 HydrophobicContact CB-CB 3.92Å; C9-C102 WeakPolarHBondContact CB-SG 3.06Å; C9-C102 WeakPolarHBondContact SG-CB 3.45Å; C9-C102 CovalentContact SG-SG 2.01Å; C9-C102 PolarHBondContact SG-SG 2.89Å; A71-C102 HydrophobicContact CB-CB 4.45Å; A71-C102 PolarHBondContact O-N 3.23Å; Y72-C102 VanDerWaalsContact C-SG 3.52Å; C102-D106 HydrophobicContact CB-CB 4.23Å; C102-L107 HydrophobicContact CB-CD1 3.92Å; C102-L107 HydrophobicContact CB-CD2 4.26Å; C102-L107 HydrophobicContact CB-CG 3.96Å; C102-Q112 PolarHBondContact O-NE2 3Å
103	E	95.6	Very high	88.3	Confident	100 Å²	100	70.9 Å²	70.9	47%	0.467	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-89.3	169.9	174.6	-69	172.7	-155.3	0	0	110.5	K105 D106 L107	E103-K105 HydrophobicContact CB-CG 4.11Å; E103-K105 PolarHBondContact O-N 3.39Å; E103-K105 VanDerWaalsContact O-N 3.14Å; E103-K105 IonicContact OE1-NZ 3.69Å; E103-K105 WeakPolarHBondContact OE2-CE 3.46Å; E103-K105 IonicContact OE2-NZ 2.67Å; E103-K105 PolarHBondContact OE2-NZ 2.7Å; E103-D106 PolarHBondContact N-OD2 3.47Å; E103-D106 WeakPolarHBondContact O-CA 3.01Å; E103-D106 WeakPolarHBondContact O-CB 3.39Å; E103-D106 PolarHBondContact O-N 2.86Å; E103-L107 PolarHBondContact O-N 3.43Å
104	A	95.7	Very high	90.1	Very high	43 Å²	43	74.4 Å²	74.4	36%	0.355	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-54	-36.2	176.9	0	0	0	0	0	112.4	D106 L107 N108 G109 I110	A104-D106 PolarHBondContact O-N 3.46Å; A104-L107 CarbonylContact O-C 3.54Å; A104-L107 PolarHBondContact O-N 3.16Å; A104-L107 VanDerWaalsContact O-N 3.08Å; A104-N108 PolarHBondContact O-N 2.89Å; A104-G109 WeakPolarHBondContact O-CA 3.35Å; A104-G109 PolarHBondContact O-N 2.95Å; A104-I110 WeakPolarHBondContact CA-O 3.06Å
105	K	95.2	Very high	91.9	Very high	145 Å²	145	72 Å²	72	63%	0.63	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-62	-29.7	175.4	73.2	-169.3	-176	-147.3	0	113.5	E103 L107	E103-K105 HydrophobicContact CB-CG 4.11Å; E103-K105 PolarHBondContact O-N 3.39Å; E103-K105 VanDerWaalsContact O-N 3.14Å; E103-K105 IonicContact OE1-NZ 3.69Å; E103-K105 WeakPolarHBondContact OE2-CE 3.46Å; E103-K105 IonicContact OE2-NZ 2.67Å; E103-K105 PolarHBondContact OE2-NZ 2.7Å; K105-L107 VanDerWaalsContact C-N 3.31Å
106	D	94.9	Very high	93.1	Very high	45 Å²	45	69.6 Å²	69.6	24%	0.241	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-84.8	-11.4	179	-52.2	-53	0	0	0	112	C9 R73 C102 E103 A104	C9-D106 VanDerWaalsContact SG-CB 3.51Å; R73-D106 IonicContact CZ-OD1 4Å; R73-D106 IonicContact CZ-OD2 3.46Å; R73-D106 VanDerWaalsContact NH1-CG 3.25Å; R73-D106 IonicContact NH1-OD1 3.36Å; R73-D106 PolarHBondContact NH1-OD1 2.67Å; R73-D106 IonicContact NH1-OD2 2.7Å; R73-D106 PolarHBondContact NH1-OD2 3.38Å; R73-D106 IonicContact NH2-OD1 3.73Å; R73-D106 IonicContact NH2-OD2 3.46Å; R73-D106 PolarHBondContact NH2-OD2 2.95Å; C102-D106 HydrophobicContact CB-CB 4.23Å; E103-D106 PolarHBondContact N-OD2 3.47Å; E103-D106 WeakPolarHBondContact O-CA 3.01Å; E103-D106 WeakPolarHBondContact O-CB 3.39Å; E103-D106 PolarHBondContact O-N 2.86Å; A104-D106 PolarHBondContact O-N 3.46Å
107	L	94.5	Very high	93.8	Very high	5 Å²	5	70.8 Å²	70.8	3%	0.026	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-122.8	30.5	-174.3	-63.5	175.1	0	0	0	112.3	C9 W21 P66 C102 E103 A104 K105 G109 I110 Q112	C9-L107 HydrophobicContact CB-CD2 3.58Å; W21-L107 HydrophobicContact CH2-CD2 4.16Å; W21-L107 HydrophobicContact CZ2-CD2 3.81Å; P66-L107 HydrophobicContact CB-CD1 3.76Å; P66-L107 HydrophobicContact CG-CD1 3.97Å; P66-L107 HydrophobicContact CG-CD2 4.01Å; C102-L107 HydrophobicContact CB-CD1 3.92Å; C102-L107 HydrophobicContact CB-CD2 4.26Å; C102-L107 HydrophobicContact CB-CG 3.96Å; E103-L107 PolarHBondContact O-N 3.43Å; A104-L107 CarbonylContact O-C 3.54Å; A104-L107 PolarHBondContact O-N 3.16Å; A104-L107 VanDerWaalsContact O-N 3.08Å; K105-L107 VanDerWaalsContact C-N 3.31Å; L107-G109 VanDerWaalsContact C-N 3.29Å; L107-G109 PolarHBondContact O-N 2.8Å; L107-I110 HydrophobicContact CB-CB 4.21Å; L107-I110 WeakPolarHBondContact CB-O 2.99Å; L107-I110 VanDerWaalsContact O-CB 3.29Å; L107-I110 WeakPolarHBondContact O-CB 3.42Å; L107-I110 WeakPolarHBondContact O-CG1 3.25Å; L107-I110 PolarHBondContact O-N 2.85Å; L107-Q112 HydrophobicContact CD1-CG 3.45Å; L107-Q112 VanDerWaalsContact CD1-CG 3.45Å
108	N	91.1	Very high	94	Very high	163 Å²	163	70.4 Å²	70.4	87%	0.872	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	41.1	178	-58.1	-36.4	0	0	0	113.9	A104 I110	A104-N108 PolarHBondContact O-N 2.89Å; N108-I110 VanDerWaalsContact C-N 3.33Å
109	G	93.4	Very high	93.9	Very high	61 Å²	61	69.7 Å²	69.7	63%	0.629	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-1.2	-179.1	0	0	0	0	0	114.7	A104 L107 G111	A104-G109 WeakPolarHBondContact O-CA 3.35Å; A104-G109 PolarHBondContact O-N 2.95Å; L107-G109 VanDerWaalsContact C-N 3.29Å; L107-G109 PolarHBondContact O-N 2.8Å; G109-G111 PolarHBondContact O-N 2.98Å
110	I	91.9	Very high	93.6	Very high	55 Å²	55	69.5 Å²	69.5	28%	0.282	39%	0.388	S	S	.	.			trans	-81.5	114.9	178.2	-58.4	170.9	0	0	0	109.6	K65 A104 L107 N108	K65-I110 HydrophobicContact CB-CG2 4.32Å; K65-I110 HydrophobicContact CD-CD1 4.5Å; K65-I110 HydrophobicContact CD-CG2 4.45Å; A104-I110 WeakPolarHBondContact CA-O 3.06Å; L107-I110 HydrophobicContact CB-CB 4.21Å; L107-I110 WeakPolarHBondContact CB-O 2.99Å; L107-I110 VanDerWaalsContact O-CB 3.29Å; L107-I110 WeakPolarHBondContact O-CB 3.42Å; L107-I110 WeakPolarHBondContact O-CG1 3.25Å; L107-I110 PolarHBondContact O-N 2.85Å; N108-I110 VanDerWaalsContact C-N 3.33Å
111	G	93	Very high	93.2	Very high	32 Å²	32	76.3 Å²	76.3	33%	0.33	42%	0.416	S	S	.	.			trans	-71	157	170.5	0	0	0	0	0	112.9	G109	G109-G111 PolarHBondContact O-N 2.98Å
112	Q	94.9	Very high	92.8	Very high	7 Å²	7	76.3 Å²	76.3	3%	0.033	42%	0.415	C	S	.	.			trans	-113.8	9.5	175.6	-55	-162.6	70.7	0	0	113.1	P66 G68 M69 A71 C102 L107 K114	P66-Q112 HydrophobicContact CB-CG 3.83Å; G68-Q112 PolarHBondContact N-O 3.48Å; G68-Q112 VanDerWaalsContact N-O 3.08Å; M69-Q112 PolarHBondContact N-O 2.77Å; M69-Q112 HydrophobicContact SD-CB 3.86Å; A71-Q112 VanDerWaalsContact CA-OE1 3.31Å; A71-Q112 PolarHBondContact O-NE2 3.21Å; C102-Q112 PolarHBondContact O-NE2 3Å; L107-Q112 HydrophobicContact CD1-CG 3.45Å; L107-Q112 VanDerWaalsContact CD1-CG 3.45Å; Q112-K114 VanDerWaalsContact C-N 3.27Å; Q112-K114 PolarHBondContact O-N 2.68Å
113	D	94	Very high	92.4	Very high	122 Å²	122	77.3 Å²	77.3	65%	0.652	42%	0.419	S	S	*	.			trans	-68	-24.4	-174	55	-61.6	0	0	0	113.4	M69	M69-D113 HydrophobicContact CE-CB 4.34Å
114	K	93.9	Very high	91.8	Very high	158 Å²	158	73.3 Å²	73.3	69%	0.687	40%	0.402	S	S	*	.	S	Bend	trans	-78.2	140.7	175.8	-61.4	-170.3	178.7	-172.2	0	111.3	C67 G68 Q112	C67-K114 WeakPolarHBondContact CB-O 3.42Å; G68-K114 PolarHBondContact N-O 3.22Å; Q112-K114 VanDerWaalsContact C-N 3.27Å; Q112-K114 PolarHBondContact O-N 2.68Å
115	A	93.4	Very high	91.1	Very high	74 Å²	74	81 Å²	81	61%	0.612	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-60.8	149.7	172.7	0	0	0	0	0	111.8
116	C	93.4	Very high	90.2	Very high	41 Å²	41	79.8 Å²	79.8	28%	0.277	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-81	141	171.5	-62.3	0	0	0	0	111.1	C67	C67-C116 HydrophobicContact CB-CB 4.07Å; C67-C116 WeakPolarHBondContact CB-SG 3.3Å; C67-C116 PolarHBondContact O-SG 3.3Å; C67-C116 VanDerWaalsContact O-SG 3.32Å; C67-C116 WeakPolarHBondContact SG-CA 3.46Å; C67-C116 WeakPolarHBondContact SG-CB 3.36Å; C67-C116 CovalentContact SG-SG 2.03Å; C67-C116 PolarHBondContact SG-SG 3.34Å
117	H	93.2	Very high	89.1	Confident	104 Å²	104	79 Å²	79	48%	0.481	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-92.4	130.8	172.1	-53.6	89.1	0	0	0	109.9	Q62 D63	Q62-H117 HydrophobicContact CB-CB 4.18Å; Q62-H117 PolarHBondContact N-O 3.27Å; D63-H117 IonicContact OD1-ND1 3.17Å; D63-H117 PolarHBondContact OD1-ND1 3.13Å; D63-H117 VanDerWaalsContact OD1-ND1 3.17Å; D63-H117 WeakPolarHBondContact OD2-CA 3.5Å; D63-H117 WeakPolarHBondContact OD2-CB 3.48Å; D63-H117 IonicContact OD2-CG 3.79Å; D63-H117 PolarHBondContact OD2-N 2.03Å; D63-H117 IonicContact OD2-ND1 3.35Å; D63-H117 PolarHBondContact OD2-ND1 2.94Å
118	T	91.1	Very high	88.1	Confident	43 Å²	43	85.1 Å²	85.1	26%	0.264	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-121.6	135.9	-178.2	-60.1	0	0	0	0	108.8	I60 Y120 L123 I132	I60-T118 HydrophobicContact CB-CG2 3.83Å; I60-T118 HydrophobicContact CD1-CG2 3.97Å; I60-T118 HydrophobicContact CG1-CG2 3.93Å; I60-T118 CarbonylContact O-C 3.44Å; I60-T118 VanDerWaalsContact O-CA 3.31Å; I60-T118 WeakPolarHBondContact O-CA 3.28Å; T118-Y120 PolarHBondContact O-N 3.07Å; T118-Y120 VanDerWaalsContact O-N 3.11Å; T118-L123 HydrophobicContact CG2-CD2 3.83Å; T118-L123 HydrophobicContact CG2-CG 4.46Å; T118-I132 HydrophobicContact CG2-CG2 4.46Å
119	S	89.9	Confident	87.3	Confident	14 Å²	14	83.2 Å²	83.2	10%	0.098	45%	0.447	C	S	.	.			trans	-69	108.4	173.2	177.2	0	0	0	0	109.8	I60 E121 M122	I60-S119 PolarHBondContact O-N 3.33Å; S119-E121 VanDerWaalsContact C-N 3.28Å; S119-E121 PolarHBondContact O-N 3.04Å; S119-M122 PolarHBondContact O-N 3.26Å; S119-M122 WeakPolarHBondContact OG-CE 3.22Å
120	Y	86.9	Confident	86.6	Confident	116 Å²	116	81.7 Å²	81.7	46%	0.455	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-59.7	-38.3	179.7	-174.3	-99.2	0	0	0	112.5	T118 M122 L123 K161	T118-Y120 PolarHBondContact O-N 3.07Å; T118-Y120 VanDerWaalsContact O-N 3.11Å; Y120-M122 PolarHBondContact O-N 3Å; Y120-L123 HydrophobicContact CD2-CD1 4.16Å; Y120-L123 WeakPolarHBondContact O-CB 3.35Å; Y120-L123 PolarHBondContact O-N 3.47Å; Y120-L123 VanDerWaalsContact O-N 3.11Å; Y120-K161 HydrophobicContact CE2-CD 4.05Å; Y120-K161 PolarHBondContact OH-NZ 2.72Å
121	E	87.3	Confident	86.3	Confident	177 Å²	177	82.4 Å²	82.4	83%	0.827	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-64.8	-25.7	-178.5	-60.7	177.6	-173.3	0	0	113.6	S119 L123	S119-E121 VanDerWaalsContact C-N 3.28Å; S119-E121 PolarHBondContact O-N 3.04Å; E121-L123 VanDerWaalsContact C-N 3.35Å
122	M	88.4	Confident	86.1	Confident	94 Å²	94	81.8 Å²	81.8	46%	0.463	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-88.7	-0.9	178.5	-66	-164.3	-94	0	0	113.3	S59 I60 S119 Y120	S59-M122 WeakPolarHBondContact O-CE 3.49Å; I60-M122 HydrophobicContact CG2-CB 3.89Å; S119-M122 PolarHBondContact O-N 3.26Å; S119-M122 WeakPolarHBondContact OG-CE 3.22Å; Y120-M122 PolarHBondContact O-N 3Å
123	L	88.3	Confident	85.9	Confident	24 Å²	24	82.4 Å²	82.4	13%	0.126	42%	0.419	C	S	.	.	S	Bend	trans	-76.6	153.3	176.9	-61.6	-175.7	0	0	0	111.7	I60 T118 Y120 E121 K125 I132	I60-L123 HydrophobicContact CB-CD2 4.46Å; I60-L123 HydrophobicContact CD1-CD2 3.97Å; I60-L123 HydrophobicContact CG2-CD2 4.4Å; T118-L123 HydrophobicContact CG2-CD2 3.83Å; T118-L123 HydrophobicContact CG2-CG 4.46Å; Y120-L123 HydrophobicContact CD2-CD1 4.16Å; Y120-L123 WeakPolarHBondContact O-CB 3.35Å; Y120-L123 PolarHBondContact O-N 3.47Å; Y120-L123 VanDerWaalsContact O-N 3.11Å; E121-L123 VanDerWaalsContact C-N 3.35Å; L123-K125 PolarHBondContact O-N 2.93Å; L123-K125 VanDerWaalsContact O-N 3.16Å; L123-I132 HydrophobicContact CD2-CB 4.3Å; L123-I132 HydrophobicContact CD2-CG2 3.81Å
124	P	84.4	Confident	85.8	Confident	17 Å²	17	78 Å²	78	11%	0.11	40%	0.397	C	S	.	.			trans	-63.8	118.7	175	-14.9	30.6	0	0	0	109.1	Y56 T126 N127 N135	Y56-P124 WeakPolarHBondContact OH-CD 3.37Å; P124-T126 PolarHBondContact O-N 3.03Å; P124-T126 VanDerWaalsContact O-N 3.09Å; P124-N127 HydrophobicContact CB-CB 4.38Å; P124-N127 WeakPolarHBondContact O-CB 3.12Å; P124-N127 PolarHBondContact O-N 2.75Å; P124-N127 VanDerWaalsContact O-N 3.12Å; P124-N135 HydrophobicContact CG-CB 3.73Å
125	K	79.6	Confident	85.7	Confident	205 Å²	205	71.2 Å²	71.2	89%	0.891	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17	-178.9	-63	-173.1	179.1	-175.7	0	114	L123 N127	L123-K125 PolarHBondContact O-N 2.93Å; L123-K125 VanDerWaalsContact O-N 3.16Å; K125-N127 VanDerWaalsContact C-N 3.31Å
126	T	76.9	Confident	85.5	Confident	119 Å²	119	72.1 Å²	72.1	73%	0.73	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.8	179.7	52.3	0	0	0	0	113.3	P124	P124-T126 PolarHBondContact O-N 3.03Å; P124-T126 VanDerWaalsContact O-N 3.09Å
127	N	71	Confident	85.4	Confident	29 Å²	29	75.4 Å²	75.4	16%	0.155	39%	0.392	C	S	.	.	S	Bend	trans	-93.1	155.2	-175.2	-72.2	10.2	0	0	0	110.1	P124 K125 Q131 P134	P124-N127 HydrophobicContact CB-CB 4.38Å; P124-N127 WeakPolarHBondContact O-CB 3.12Å; P124-N127 PolarHBondContact O-N 2.75Å; P124-N127 VanDerWaalsContact O-N 3.12Å; K125-N127 VanDerWaalsContact C-N 3.31Å; N127-Q131 HydrophobicContact CB-CB 3.83Å; N127-Q131 HydrophobicContact CB-CG 3.91Å; N127-Q131 WeakPolarHBondContact CB-O 3.38Å; N127-Q131 PolarHBondContact ND2-O 3.24Å; N127-P134 PolarHBondContact ND2-O 3.34Å
128	D	73.3	Confident	85.5	Confident	132 Å²	132	71.8 Å²	71.8	71%	0.706	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-56.6	156.8	173.1	-73.6	-27.9	0	0	0	110.6	C130 Q131	D128-C130 PolarHBondContact O-N 2.88Å; D128-C130 VanDerWaalsContact O-N 3.08Å; D128-Q131 PolarHBondContact O-N 3.37Å
129	E	74.3	Confident	85.7	Confident	124 Å²	124	78.8 Å²	78.8	58%	0.579	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	125.2	174.7	-64.4	-164	147.3	0	0	108.6	K161	E129-K161 IonicContact OE1-NZ 2.68Å; E129-K161 PolarHBondContact OE1-NZ 3.46Å
130	C	80	Confident	86	Confident	28 Å²	28	78.7 Å²	78.7	19%	0.189	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	3.3	-178.6	-107.4	0	0	0	0	118.3	D128 I132 C159 H160	D128-C130 PolarHBondContact O-N 2.88Å; D128-C130 VanDerWaalsContact O-N 3.08Å; C130-I132 PolarHBondContact O-N 3.17Å; C130-I132 VanDerWaalsContact O-N 3.13Å; C130-C159 WeakPolarHBondContact CA-SG 3.37Å; C130-C159 HydrophobicContact CB-CB 4.16Å; C130-C159 WeakPolarHBondContact CB-SG 3.44Å; C130-C159 PolarHBondContact O-SG 3.38Å; C130-C159 WeakPolarHBondContact SG-CB 3.42Å; C130-C159 PolarHBondContact SG-O 3.34Å; C130-C159 CovalentContact SG-SG 2.02Å; C130-C159 PolarHBondContact SG-SG 3.49Å; C130-H160 PolarHBondContact SG-N 3.36Å; C130-H160 VanDerWaalsContact SG-N 3.38Å
131	Q	84.7	Confident	86.4	Confident	71 Å²	71	74.6 Å²	74.6	33%	0.332	38%	0.383	S	S	.	.			trans	-85.1	93.3	174.2	175.6	-170.7	16	0	0	111.6	N127 D128 W133	N127-Q131 HydrophobicContact CB-CB 3.83Å; N127-Q131 HydrophobicContact CB-CG 3.91Å; N127-Q131 WeakPolarHBondContact CB-O 3.38Å; N127-Q131 PolarHBondContact ND2-O 3.24Å; D128-Q131 PolarHBondContact O-N 3.37Å; Q131-W133 VanDerWaalsContact C-N 3.26Å; Q131-W133 WeakPolarHBondContact CG-O 3.45Å; Q131-W133 PolarHBondContact NE2-O 2.92Å; Q131-W133 PolarHBondContact O-N 2.98Å
132	I	89.2	Confident	86.7	Confident	18 Å²	18	71.1 Å²	71.1	9%	0.092	37%	0.37	C	S	.	.			trans	-73.2	-15.8	178.2	69	170.6	0	0	0	113.6	Y56 L57 I60 T118 L123 C130 L156 A157	Y56-I132 WeakPolarHBondContact CE1-O 3.39Å; Y56-I132 PolarHBondContact OH-O 3.22Å; Y56-I132 VanDerWaalsContact OH-O 3.09Å; L57-I132 HydrophobicContact CD2-CD1 4.1Å; I60-I132 HydrophobicContact CD1-CB 3.96Å; I60-I132 HydrophobicContact CD1-CG2 4.15Å; T118-I132 HydrophobicContact CG2-CG2 4.46Å; L123-I132 HydrophobicContact CD2-CB 4.3Å; L123-I132 HydrophobicContact CD2-CG2 3.81Å; C130-I132 PolarHBondContact O-N 3.17Å; C130-I132 VanDerWaalsContact O-N 3.13Å; I132-L156 HydrophobicContact CD1-CB 3.96Å; I132-L156 HydrophobicContact CG1-CB 4.33Å; I132-A157 HydrophobicContact CD1-CB 3.56Å; I132-A157 HydrophobicContact CG1-CB 4.32Å
133	W	91.3	Very high	87	Confident	20 Å²	20	67.1 Å²	67.1	8%	0.076	35%	0.351	C	S	.	.			trans	-149.4	144	-176.6	-172.8	-97	0	0	0	110.9	A53 Y56 Q131 L140 V151 I154 L156	A53-W133 HydrophobicContact CB-CH2 4.2Å; A53-W133 HydrophobicContact CB-CZ3 4.29Å; Y56-W133 HydrophobicContact CD1-CE3 4.43Å; Y56-W133 HydrophobicContact CD1-CZ3 4.48Å; Y56-W133 HydrophobicContact CE1-CE3 4.43Å; Q131-W133 VanDerWaalsContact C-N 3.26Å; Q131-W133 WeakPolarHBondContact CG-O 3.45Å; Q131-W133 PolarHBondContact NE2-O 2.92Å; Q131-W133 PolarHBondContact O-N 2.98Å; W133-L140 HydrophobicContact CH2-CD1 3.84Å; W133-L140 HydrophobicContact CH2-CD2 4.17Å; W133-L140 HydrophobicContact CH2-CG 4.48Å; W133-L140 HydrophobicContact CZ2-CD1 3.92Å; W133-V151 HydrophobicContact CZ2-CG1 3.75Å; W133-V151 PolarHBondContact NE1-O 2.68Å; W133-I154 VanDerWaalsContact CD1-O 3.3Å; W133-L156 HydrophobicContact CB-CB 4.48Å; W133-L156 HydrophobicContact CB-CD1 3.7Å; W133-L156 HydrophobicContact CB-CG 4.15Å; W133-L156 HydrophobicContact CD2-CD1 3.89Å; W133-L156 HydrophobicContact CE3-CD1 4.23Å; W133-L156 HydrophobicContact CG-CD1 3.65Å; W133-L156 HydrophobicContact CG-CG 4.18Å
134	P	91.7	Very high	87.2	Confident	30 Å²	30	70.6 Å²	70.6	20%	0.195	37%	0.374	C	S	.	.			cis	-72.5	156.6	-2.7	31.7	-35.5	0	0	0	113.3	N127 N152	N127-P134 PolarHBondContact ND2-O 3.34Å; P134-N152 HydrophobicContact CB-CB 4.14Å; P134-N152 HydrophobicContact CG-CB 4.2Å
135	N	91.5	Very high	87.6	Confident	16 Å²	16	72.7 Å²	72.7	9%	0.086	40%	0.398	C	S	.	.			trans	-113.6	107.7	167	-179.2	-13.6	0	0	0	109.2	Y56 P124 S137 I138	Y56-N135 HydrophobicContact CD1-CB 4.44Å; Y56-N135 HydrophobicContact CE1-CB 3.98Å; Y56-N135 HydrophobicContact CE2-CB 4.41Å; Y56-N135 WeakPolarHBondContact CE2-ND2 3.4Å; P124-N135 HydrophobicContact CG-CB 3.73Å; N135-S137 PolarHBondContact O-N 3.39Å; N135-S137 VanDerWaalsContact O-N 3.15Å; N135-S137 WeakPolarHBondContact OD1-CB 3.11Å; N135-S137 PolarHBondContact OD1-N 3.01Å; N135-I138 HydrophobicContact CB-CG1 3.75Å; N135-I138 WeakPolarHBondContact O-CB 3.46Å; N135-I138 PolarHBondContact O-N 2.9Å
136	P	89.8	Confident	88.1	Confident	93 Å²	93	70.7 Å²	70.7	60%	0.604	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.1	-177.4	-25.7	34.8	0	0	0	114.5	I138	P136-I138 PolarHBondContact O-N 3.13Å
137	S	91.2	Very high	88.7	Confident	109 Å²	109	72.2 Å²	72.2	76%	0.762	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.3	178.2	-55.3	0	0	0	0	112.9	N135	N135-S137 PolarHBondContact O-N 3.39Å; N135-S137 VanDerWaalsContact O-N 3.15Å; N135-S137 WeakPolarHBondContact OD1-CB 3.11Å; N135-S137 PolarHBondContact OD1-N 3.01Å
138	I	94.4	Very high	89.8	Confident	29 Å²	29	74 Å²	74	15%	0.149	39%	0.39	C	S	.	.	S	Bend	trans	-84.9	117.7	179.5	-53.7	-53.4	0	0	0	110.2	N52 Y56 N135 P136 L140	N52-I138 HydrophobicContact CB-CG2 3.95Å; Y56-I138 HydrophobicContact CD1-CG1 4.23Å; Y56-I138 HydrophobicContact CD2-CD1 3.92Å; Y56-I138 HydrophobicContact CD2-CG1 4.25Å; Y56-I138 HydrophobicContact CG-CD1 3.81Å; Y56-I138 HydrophobicContact CG-CG1 3.84Å; N135-I138 HydrophobicContact CB-CG1 3.75Å; N135-I138 WeakPolarHBondContact O-CB 3.46Å; N135-I138 PolarHBondContact O-N 2.9Å; P136-I138 PolarHBondContact O-N 3.13Å; I138-L140 HydrophobicContact CG2-CD2 4.1Å; I138-L140 PolarHBondContact O-N 2.98Å
139	R	95.4	Very high	90.7	Very high	190 Å²	190	71 Å²	71	72%	0.717	38%	0.379	S	S	*	.			trans	-72.5	121.6	177.1	-172	-176.5	166.9	168.1	-3	110.4	N52 P141	N52-R139 WeakPolarHBondContact CB-O 3.21Å; N52-R139 PolarHBondContact ND2-O 3Å; R139-P141 WeakPolarHBondContact O-CD 3.47Å
140	L	95.8	Very high	91.5	Very high	11 Å²	11	70.1 Å²	70.1	6%	0.058	38%	0.377	C	S	.	.			trans	-114.1	81.9	173	-51.9	176.7	0	0	0	109.7	A49 A53 W133 I138 V143 V151	A49-L140 HydrophobicContact CB-CB 3.92Å; A49-L140 HydrophobicContact CB-CD2 4.03Å; A49-L140 WeakPolarHBondContact O-CD2 3.44Å; A53-L140 HydrophobicContact CB-CD2 4.35Å; W133-L140 HydrophobicContact CH2-CD1 3.84Å; W133-L140 HydrophobicContact CH2-CD2 4.17Å; W133-L140 HydrophobicContact CH2-CG 4.48Å; W133-L140 HydrophobicContact CZ2-CD1 3.92Å; I138-L140 HydrophobicContact CG2-CD2 4.1Å; I138-L140 PolarHBondContact O-N 2.98Å; L140-V143 HydrophobicContact CB-CB 3.93Å; L140-V143 HydrophobicContact CB-CG2 4.04Å; L140-V143 PolarHBondContact O-N 3.34Å; L140-V151 HydrophobicContact CD1-CG1 3.79Å
141	P	95.7	Very high	92.1	Very high	30 Å²	30	70.7 Å²	70.7	20%	0.195	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	148	178.3	27.9	-35.6	0	0	0	111	A48 A49 R139 V143	A48-P141 HydrophobicContact CB-CG 3.69Å; A49-P141 HydrophobicContact CB-CG 4.39Å; R139-P141 WeakPolarHBondContact O-CD 3.47Å; P141-V143 PolarHBondContact O-N 2.97Å
142	N	94.2	Very high	92.4	Very high	104 Å²	104	69.6 Å²	69.6	56%	0.556	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	-8	-179	-52.3	-29.3	0	0	0	116	Y45 F46 T144	Y45-N142 WeakPolarHBondContact O-CB 3.49Å; Y45-N142 PolarHBondContact O-ND2 2.82Å; F46-N142 HydrophobicContact CD1-CB 4.45Å; F46-N142 HydrophobicContact CE1-CB 4.47Å; F46-N142 WeakPolarHBondContact CE1-O 3.25Å; N142-T144 PolarHBondContact O-N 2.81Å
143	V	94	Very high	92.5	Very high	11 Å²	11	74.8 Å²	74.8	7%	0.067	40%	0.404	C	S	.	.			trans	-87.9	94.2	173.1	-174.6	0	0	0	0	108.6	F46 A49 L140 P141 R148 V151	F46-V143 HydrophobicContact CD1-CG2 3.63Å; F46-V143 HydrophobicContact CE1-CG2 4.04Å; A49-V143 HydrophobicContact CB-CG2 3.72Å; L140-V143 HydrophobicContact CB-CB 3.93Å; L140-V143 HydrophobicContact CB-CG2 4.04Å; L140-V143 PolarHBondContact O-N 3.34Å; P141-V143 PolarHBondContact O-N 2.97Å; V143-R148 HydrophobicContact CG1-CB 4.16Å; V143-V151 HydrophobicContact CG1-CB 4.17Å; V143-V151 HydrophobicContact CG1-CG2 3.95Å
144	T	93.3	Very high	92.4	Very high	97 Å²	97	77.7 Å²	77.7	60%	0.595	42%	0.42	S	S	*	.			trans	-125.3	167.1	-175.1	63.7	0	0	0	0	112.2	N142 Q146 Y147 R148	N142-T144 PolarHBondContact O-N 2.81Å; T144-Q146 PolarHBondContact O-N 3.44Å; T144-Y147 WeakPolarHBondContact O-CB 3.26Å; T144-Y147 PolarHBondContact O-N 3.32Å; T144-Y147 VanDerWaalsContact O-N 3.17Å; T144-R148 PolarHBondContact O-N 3.4Å
145	G	92.4	Very high	92.1	Very high	60 Å²	60	85.4 Å²	85.4	62%	0.619	45%	0.45	S	S	*	.	H	α-helix	trans	52.9	-132.5	174.6	0	0	0	0	0	112.9	Y147 R148 S149	G145-Y147 VanDerWaalsContact C-N 3.28Å; G145-Y147 PolarHBondContact O-N 3.27Å; G145-R148 WeakPolarHBondContact O-CB 3.29Å; G145-R148 PolarHBondContact O-N 2.88Å; G145-S149 PolarHBondContact O-N 3.39Å
146	Q	90.6	Very high	91.8	Very high	163 Å²	163	87.9 Å²	87.9	76%	0.762	46%	0.464	S	S	*	.	H	α-helix	trans	-60.1	-34.3	-179.1	-68.1	179.4	-5.8	0	0	113.3	T144 R148 S149 I150	T144-Q146 PolarHBondContact O-N 3.44Å; Q146-R148 PolarHBondContact O-N 3.15Å; Q146-S149 PolarHBondContact O-N 2.93Å; Q146-I150 WeakPolarHBondContact O-CG1 3.46Å; Q146-I150 PolarHBondContact O-N 2.76Å
147	Y	89.8	Confident	91.5	Very high	151 Å²	151	85.7 Å²	85.7	59%	0.592	45%	0.453	S	S	*	.	H	α-helix	trans	-63.6	-33.6	176.8	-66.8	-71.7	0	0	0	111.7	T144 G145 I150 V151	T144-Y147 WeakPolarHBondContact O-CB 3.26Å; T144-Y147 PolarHBondContact O-N 3.32Å; T144-Y147 VanDerWaalsContact O-N 3.17Å; G145-Y147 VanDerWaalsContact C-N 3.28Å; G145-Y147 PolarHBondContact O-N 3.27Å; Y147-I150 PolarHBondContact O-N 3.18Å; Y147-V151 WeakPolarHBondContact O-CB 3.46Å; Y147-V151 VanDerWaalsContact O-CG2 3.25Å; Y147-V151 WeakPolarHBondContact O-CG2 3.48Å; Y147-V151 PolarHBondContact O-N 2.96Å
148	R	93	Very high	91.1	Very high	68 Å²	68	88.3 Å²	88.3	26%	0.257	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-41.2	176.2	-171.3	60.5	179.4	-114.1	5.7	111.7	V143 T144 G145 Q146 V151 N152	V143-R148 HydrophobicContact CG1-CB 4.16Å; T144-R148 PolarHBondContact O-N 3.4Å; G145-R148 WeakPolarHBondContact O-CB 3.29Å; G145-R148 PolarHBondContact O-N 2.88Å; Q146-R148 PolarHBondContact O-N 3.15Å; R148-V151 PolarHBondContact O-N 3.24Å; R148-N152 PolarHBondContact NE-OD1 3.23Å; R148-N152 WeakPolarHBondContact O-CB 3.33Å; R148-N152 PolarHBondContact O-N 3.02Å; R148-N152 PolarHBondContact O-ND2 2.77Å
149	S	92	Very high	90.7	Very high	68 Å²	68	89.7 Å²	89.7	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-50.2	173.9	-57.5	0	0	0	0	111.1	G145 Q146 V151 N152 D153	G145-S149 PolarHBondContact O-N 3.39Å; Q146-S149 PolarHBondContact O-N 2.93Å; S149-V151 VanDerWaalsContact C-N 3.29Å; S149-V151 PolarHBondContact O-N 3.21Å; S149-N152 PolarHBondContact O-N 3.19Å; S149-N152 VanDerWaalsContact O-N 3.11Å; S149-D153 VanDerWaalsContact O-CG 3.27Å; S149-D153 PolarHBondContact O-N 3.49Å
150	I	91.5	Very high	90.2	Very high	105 Å²	105	88.2 Å²	88.2	54%	0.538	47%	0.471	S	S	.	.	H	α-helix	trans	-55.8	-46	177.6	-66.8	165.4	0	0	0	111.1	Q146 Y147 D153 I154	Q146-I150 WeakPolarHBondContact O-CG1 3.46Å; Q146-I150 PolarHBondContact O-N 2.76Å; Y147-I150 PolarHBondContact O-N 3.18Å; I150-D153 PolarHBondContact O-N 2.91Å; I150-I154 WeakPolarHBondContact O-CG1 3.31Å
151	V	92.1	Very high	89.6	Confident	40 Å²	40	91.8 Å²	91.8	24%	0.242	49%	0.486	C	S	.	.	H	α-helix	trans	-66.4	-40.4	179.9	165.4	0	0	0	0	111.5	W133 L140 V143 Y147 R148 S149 D153 I154	W133-V151 HydrophobicContact CZ2-CG1 3.75Å; W133-V151 PolarHBondContact NE1-O 2.68Å; L140-V151 HydrophobicContact CD1-CG1 3.79Å; V143-V151 HydrophobicContact CG1-CB 4.17Å; V143-V151 HydrophobicContact CG1-CG2 3.95Å; Y147-V151 WeakPolarHBondContact O-CB 3.46Å; Y147-V151 VanDerWaalsContact O-CG2 3.25Å; Y147-V151 WeakPolarHBondContact O-CG2 3.48Å; Y147-V151 PolarHBondContact O-N 2.96Å; R148-V151 PolarHBondContact O-N 3.24Å; S149-V151 VanDerWaalsContact C-N 3.29Å; S149-V151 PolarHBondContact O-N 3.21Å; V151-D153 VanDerWaalsContact C-N 3.29Å; V151-D153 PolarHBondContact O-N 3.19Å; V151-I154 WeakPolarHBondContact O-CG1 3.5Å; V151-I154 PolarHBondContact O-N 2.77Å
152	N	91.2	Very high	89	Confident	49 Å²	49	95.8 Å²	95.8	26%	0.262	51%	0.51	S	S	.	.	H	α-helix	trans	-67.5	-29.6	178	-73	-10.8	0	0	0	112.6	P134 R148 S149 I154	P134-N152 HydrophobicContact CB-CB 4.14Å; P134-N152 HydrophobicContact CG-CB 4.2Å; R148-N152 PolarHBondContact NE-OD1 3.23Å; R148-N152 WeakPolarHBondContact O-CB 3.33Å; R148-N152 PolarHBondContact O-N 3.02Å; R148-N152 PolarHBondContact O-ND2 2.77Å; S149-N152 PolarHBondContact O-N 3.19Å; S149-N152 VanDerWaalsContact O-N 3.11Å; N152-I154 VanDerWaalsContact C-N 3.25Å; N152-I154 PolarHBondContact O-N 3.48Å
153	D	91.3	Very high	87.9	Confident	127 Å²	127	100.9 Å²	100.9	68%	0.679	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.1	-179.5	-68.7	-15	0	0	0	113.5	S149 I150 V151 K155	S149-D153 VanDerWaalsContact O-CG 3.27Å; S149-D153 PolarHBondContact O-N 3.49Å; I150-D153 PolarHBondContact O-N 2.91Å; V151-D153 VanDerWaalsContact C-N 3.29Å; V151-D153 PolarHBondContact O-N 3.19Å; D153-K155 PolarHBondContact O-N 3.13Å
154	I	89.5	Confident	87.6	Confident	81 Å²	81	105.4 Å²	105.4	42%	0.415	57%	0.568	S	S	.	*			trans	-66.2	117.8	178.7	-60.4	174.5	0	0	0	110.1	W133 I150 V151 N152 L156	W133-I154 VanDerWaalsContact CD1-O 3.3Å; I150-I154 WeakPolarHBondContact O-CG1 3.31Å; V151-I154 WeakPolarHBondContact O-CG1 3.5Å; V151-I154 PolarHBondContact O-N 2.77Å; N152-I154 VanDerWaalsContact C-N 3.25Å; N152-I154 PolarHBondContact O-N 3.48Å; I154-L156 HydrophobicContact CG2-CD2 3.51Å; I154-L156 HydrophobicContact CG2-CG 3.99Å; I154-L156 PolarHBondContact O-N 3.38Å
155	K	86.3	Confident	87.3	Confident	191 Å²	191	105.8 Å²	105.8	83%	0.83	57%	0.567	S	S	*	*			trans	-79.6	96.2	169.2	-65.3	-171.4	178.7	-173.2	0	110.1	D153	D153-K155 PolarHBondContact O-N 3.13Å
156	L	83.6	Confident	87.1	Confident	69 Å²	69	108.3 Å²	108.3	36%	0.361	56%	0.564	S	S	.	*			trans	-78	-26.9	-176.7	-69.9	-179.4	0	0	0	114.3	L57 I132 W133 I154	L57-L156 HydrophobicContact CD1-CD1 4.05Å; L57-L156 HydrophobicContact CD2-CD1 3.91Å; L57-L156 HydrophobicContact CG-CD1 4.48Å; I132-L156 HydrophobicContact CD1-CB 3.96Å; I132-L156 HydrophobicContact CG1-CB 4.33Å; W133-L156 HydrophobicContact CB-CB 4.48Å; W133-L156 HydrophobicContact CB-CD1 3.7Å; W133-L156 HydrophobicContact CB-CG 4.15Å; W133-L156 HydrophobicContact CD2-CD1 3.89Å; W133-L156 HydrophobicContact CE3-CD1 4.23Å; W133-L156 HydrophobicContact CG-CD1 3.65Å; W133-L156 HydrophobicContact CG-CG 4.18Å; I154-L156 HydrophobicContact CG2-CD2 3.51Å; I154-L156 HydrophobicContact CG2-CG 3.99Å; I154-L156 PolarHBondContact O-N 3.38Å
157	A	83.1	Confident	86.8	Confident	47 Å²	47	105.1 Å²	105.1	39%	0.388	55%	0.553	S	S	.	*			trans	-154.2	153.1	179.3	0	0	0	0	0	111.1	I132	I132-A157 HydrophobicContact CD1-CB 3.56Å; I132-A157 HydrophobicContact CG1-CB 4.32Å
158	N	84.3	Confident	86.7	Confident	163 Å²	163	102.3 Å²	102.3	87%	0.872	55%	0.55	S	S	*	*			trans	-101.1	125.4	156.9	-60.4	-53.4	0	0	0	106.1
159	C	86	Confident	86.2	Confident	58 Å²	58	104.5 Å²	104.5	39%	0.392	57%	0.57	S	S	.	*			trans	-133.3	165.1	176.2	72	0	0	0	0	112.9	C130	C130-C159 WeakPolarHBondContact CA-SG 3.37Å; C130-C159 HydrophobicContact CB-CB 4.16Å; C130-C159 WeakPolarHBondContact CB-SG 3.44Å; C130-C159 PolarHBondContact O-SG 3.38Å; C130-C159 WeakPolarHBondContact SG-CB 3.42Å; C130-C159 PolarHBondContact SG-O 3.34Å; C130-C159 CovalentContact SG-SG 2.02Å; C130-C159 PolarHBondContact SG-SG 3.49Å
160	H	85.5	Confident	85.8	Confident	159 Å²	159	107.1 Å²	107.1	74%	0.736	58%	0.576	S	S	*	*			trans	-132.4	129.1	179.6	175.5	-84.3	0	0	0	108.3	C130 T162	C130-H160 PolarHBondContact SG-N 3.36Å; C130-H160 VanDerWaalsContact SG-N 3.38Å; H160-T162 PolarHBondContact O-N 3.2Å
161	K	82.7	Confident	85.4	Confident	86 Å²	86	107.3 Å²	107.3	37%	0.374	58%	0.579	S	S	.	*			trans	-73.5	117.4	175.8	-178.5	175.7	173.5	177.3	0	109.3	Y120 E129	Y120-K161 HydrophobicContact CE2-CD 4.05Å; Y120-K161 PolarHBondContact OH-NZ 2.72Å; E129-K161 IonicContact OE1-NZ 2.68Å; E129-K161 PolarHBondContact OE1-NZ 3.46Å
162	T	81.6	Confident	84.8	Confident	115 Å²	115	112.9 Å²	112.9	71%	0.706	61%	0.607	S	S	*	*			trans	-86.5	132.5	172.6	53.4	0	0	0	0	109.4	H160	H160-T162 PolarHBondContact O-N 3.2Å
163	V	72.8	Confident	84.2	Confident	210 Å²	210	118.7 Å²	118.7	100%	1.273	64%	0.639	S	S	*	*			trans	-81	0	176.6	-171.5	0	0	0	0	110.4

Retrieved 163 of 163 residues in 100 ms (Link to these results)

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