A0A077ZH37_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZH37, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 226 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	45.5	Very low	46.2	Very low	214 Å²	214	118.1 Å²	118.1	100%	1.054	61%	0.613	S	S	*	*				0	-51.4	0	-75	-162.6	-112.7	0	0	113.7	A3 V5	M1-A3 PolarHBondContact O-N 3.39Å; M1-V5 PolarHBondContact O-N 2.72Å
2	R	41.9	Very low	45.8	Very low	227 Å²	227	113.8 Å²	113.8	86%	0.857	62%	0.619	S	S	*	*	H	α-helix	trans	-63.9	-34.5	-177.9	-118.1	180	178.1	-172.2	-1.1	115.6	L6	R2-L6 PolarHBondContact O-N 3.14Å
3	A	43.5	Very low	45.3	Very low	77 Å²	77	117 Å²	117	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-73.6	-35.3	-179.2	0	0	0	0	0	113.2	M1 L6 R7	M1-A3 PolarHBondContact O-N 3.39Å; A3-L6 PolarHBondContact O-N 3.27Å; A3-R7 PolarHBondContact O-N 3.38Å
4	E	44.4	Very low	45.5	Very low	103 Å²	103	116 Å²	116	48%	0.481	62%	0.623	S	S	.	*	H	α-helix	trans	-70.9	-39.5	-179.3	-153.5	64.3	-146.5	0	0	111.7	L6 R7 V8	E4-L6 VanDerWaalsContact C-N 3.33Å; E4-L6 PolarHBondContact O-N 3.17Å; E4-R7 WeakPolarHBondContact O-CB 3.47Å; E4-R7 PolarHBondContact O-N 2.78Å; E4-R7 IonicContact OE1-CZ 2.94Å; E4-R7 IonicContact OE1-NE 3.99Å; E4-R7 PolarHBondContact OE1-NE 3.41Å; E4-R7 IonicContact OE1-NH2 3.8Å; E4-R7 PolarHBondContact OE1-NH2 2.71Å; E4-V8 WeakPolarHBondContact O-CG2 3.48Å; E4-V8 PolarHBondContact O-N 2.79Å
5	V	50.7	Low	45.6	Very low	98 Å²	98	114 Å²	114	59%	0.594	62%	0.619	S	S	*	*	H	α-helix	trans	-64.8	-38.7	175.8	177.3	0	0	0	0	111	M1 V9	M1-V5 PolarHBondContact O-N 2.72Å; V5-V9 VanDerWaalsContact O-CG2 3.25Å; V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.45Å
6	L	43	Very low	45.5	Very low	119 Å²	119	117.6 Å²	117.6	62%	0.623	63%	0.63	S	S	*	*	H	α-helix	trans	-65.8	-37.1	173.5	-97.6	152.3	0	0	0	112.1	R2 A3 E4 V9 S10	R2-L6 PolarHBondContact O-N 3.14Å; A3-L6 PolarHBondContact O-N 3.27Å; E4-L6 VanDerWaalsContact C-N 3.33Å; E4-L6 PolarHBondContact O-N 3.17Å; L6-V9 PolarHBondContact O-N 3.44Å; L6-S10 VanDerWaalsContact O-CB 3.27Å; L6-S10 WeakPolarHBondContact O-CB 3.16Å; L6-S10 PolarHBondContact O-N 3.41Å; L6-S10 PolarHBondContact O-OG 2.91Å
7	R	50.6	Low	45.4	Very low	106 Å²	106	116.1 Å²	116.1	40%	0.4	63%	0.63	S	S	.	*	H	α-helix	trans	-65.7	-45.9	177.8	-166.4	-178.9	73	79.3	-0.3	112.7	A3 E4 V9 S10 E11	A3-R7 PolarHBondContact O-N 3.38Å; E4-R7 WeakPolarHBondContact O-CB 3.47Å; E4-R7 PolarHBondContact O-N 2.78Å; E4-R7 IonicContact OE1-CZ 2.94Å; E4-R7 IonicContact OE1-NE 3.99Å; E4-R7 PolarHBondContact OE1-NE 3.41Å; E4-R7 IonicContact OE1-NH2 3.8Å; E4-R7 PolarHBondContact OE1-NH2 2.71Å; R7-V9 VanDerWaalsContact C-N 3.26Å; R7-V9 PolarHBondContact O-N 3.36Å; R7-S10 WeakPolarHBondContact CA-OG 3.45Å; R7-S10 PolarHBondContact O-N 2.86Å; R7-S10 PolarHBondContact O-OG 2.75Å; R7-E11 WeakPolarHBondContact CD-OE1 3.25Å; R7-E11 HydrophobicContact CG-CG 4.39Å; R7-E11 WeakPolarHBondContact CG-OE1 3.48Å; R7-E11 IonicContact CZ-OE1 3.67Å; R7-E11 VanDerWaalsContact NH1-CD 3.33Å; R7-E11 IonicContact NH1-OE1 3.3Å; R7-E11 PolarHBondContact NH1-OE1 3.24Å; R7-E11 IonicContact NH1-OE2 2.68Å; R7-E11 PolarHBondContact NH1-OE2 3Å; R7-E11 VanDerWaalsContact NH1-OE2 3.08Å; R7-E11 WeakPolarHBondContact O-CB 3.27Å; R7-E11 PolarHBondContact O-N 2.74Å
8	V	45.7	Very low	45.4	Very low	53 Å²	53	118.2 Å²	118.2	32%	0.321	64%	0.641	S	S	.	*	H	α-helix	trans	-61.2	-36.1	176.3	172.9	0	0	0	0	111.4	E4	E4-V8 WeakPolarHBondContact O-CG2 3.48Å; E4-V8 PolarHBondContact O-N 2.79Å
9	V	49.2	Very low	45.6	Very low	111 Å²	111	116.1 Å²	116.1	67%	0.673	63%	0.632	S	S	*	*	H	α-helix	trans	-78.2	-33.1	177.1	176.6	0	0	0	0	112.3	V5 L6 R7	V5-V9 VanDerWaalsContact O-CG2 3.25Å; V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.45Å; L6-V9 PolarHBondContact O-N 3.44Å; R7-V9 VanDerWaalsContact C-N 3.26Å; R7-V9 PolarHBondContact O-N 3.36Å
10	S	45.1	Very low	46.1	Very low	92 Å²	92	115.9 Å²	115.9	64%	0.643	64%	0.637	S	S	*	*	H	α-helix	trans	-84.2	-23	-176.9	64.5	0	0	0	0	114.7	L6 R7 G12	L6-S10 VanDerWaalsContact O-CB 3.27Å; L6-S10 WeakPolarHBondContact O-CB 3.16Å; L6-S10 PolarHBondContact O-N 3.41Å; L6-S10 PolarHBondContact O-OG 2.91Å; R7-S10 WeakPolarHBondContact CA-OG 3.45Å; R7-S10 PolarHBondContact O-N 2.86Å; R7-S10 PolarHBondContact O-OG 2.75Å; S10-G12 VanDerWaalsContact C-N 3.33Å
11	E	48.2	Very low	46.5	Very low	99 Å²	99	117.1 Å²	117.1	46%	0.463	64%	0.638	S	S	.	*	S	Bend	trans	-86.1	-1.6	177	-71.7	178.6	-160.6	0	0	113.5	R7 K13	R7-E11 WeakPolarHBondContact CD-OE1 3.25Å; R7-E11 HydrophobicContact CG-CG 4.39Å; R7-E11 WeakPolarHBondContact CG-OE1 3.48Å; R7-E11 IonicContact CZ-OE1 3.67Å; R7-E11 VanDerWaalsContact NH1-CD 3.33Å; R7-E11 IonicContact NH1-OE1 3.3Å; R7-E11 PolarHBondContact NH1-OE1 3.24Å; R7-E11 IonicContact NH1-OE2 2.68Å; R7-E11 PolarHBondContact NH1-OE2 3Å; R7-E11 VanDerWaalsContact NH1-OE2 3.08Å; R7-E11 WeakPolarHBondContact O-CB 3.27Å; R7-E11 PolarHBondContact O-N 2.74Å; E11-K13 PolarHBondContact O-N 2.92Å
12	G	41.7	Very low	47.4	Very low	66 Å²	66	111.2 Å²	111.2	68%	0.68	61%	0.611	S	S	*	*	S	Bend	trans	64.3	5.3	-178.8	0	0	0	0	0	114.4	S10 V14	S10-G12 VanDerWaalsContact C-N 3.33Å; G12-V14 PolarHBondContact O-N 3Å
13	K	39.1	Very low	48.6	Very low	156 Å²	156	106.5 Å²	106.5	68%	0.678	60%	0.598	S	S	*	*			trans	-95.5	81.9	176.4	-70.8	-178.1	179.1	-179.6	0	108.4	E11 P15	E11-K13 PolarHBondContact O-N 2.92Å; K13-P15 WeakPolarHBondContact O-CD 3.35Å
14	V	47.8	Very low	50.1	Low	103 Å²	103	107.4 Å²	107.4	62%	0.624	60%	0.596	S	S	*	*			trans	-56.8	120.1	157.8	-177	0	0	0	0	105.4	G12 Q16	G12-V14 PolarHBondContact O-N 3Å; V14-Q16 PolarHBondContact O-N 2.85Å
15	P	47	Very low	51.6	Low	86 Å²	86	104.1 Å²	104.1	56%	0.558	58%	0.583	S	S	*	*			trans	-56.7	118.4	175.7	21.4	-29.5	0	0	0	106.7	K13 C17	K13-P15 WeakPolarHBondContact O-CD 3.35Å; P15-C17 PolarHBondContact O-N 2.93Å
16	Q	45.1	Very low	53	Low	171 Å²	171	100.3 Å²	100.3	80%	0.799	56%	0.56	S	S	*	*			trans	-61.5	97.4	165.6	-80.5	179.3	-34	0	0	105	V14 D18	V14-Q16 PolarHBondContact O-N 2.85Å; Q16-D18 PolarHBondContact O-N 3.24Å; Q16-D18 VanDerWaalsContact O-N 3.1Å
17	C	43.3	Very low	54.8	Low	92 Å²	92	100.5 Å²	100.5	62%	0.622	56%	0.556	S	S	*	*			trans	-61.9	112.3	158.7	-86.3	0	0	0	0	104.5	P15 V19	P15-C17 PolarHBondContact O-N 2.93Å; C17-V19 HydrophobicContact CB-CG2 3.77Å; C17-V19 PolarHBondContact O-N 2.72Å
18	D	44.9	Very low	56.2	Low	155 Å²	155	98.7 Å²	98.7	83%	0.829	55%	0.554	S	S	*	*			trans	-66.1	71.7	164.3	-72.8	-37.1	0	0	0	107.5	Q16 P20	Q16-D18 PolarHBondContact O-N 3.24Å; Q16-D18 VanDerWaalsContact O-N 3.1Å; D18-P20 WeakPolarHBondContact O-CD 3.06Å
19	V	49.9	Very low	58.1	Low	77 Å²	77	98.2 Å²	98.2	47%	0.467	55%	0.547	S	S	.	.			trans	-70.7	119	169.2	-174.7	0	0	0	0	104.5	C17 E21	C17-V19 HydrophobicContact CB-CG2 3.77Å; C17-V19 PolarHBondContact O-N 2.72Å; V19-E21 PolarHBondContact O-N 2.94Å; V19-E21 VanDerWaalsContact O-N 3.09Å
20	P	54.9	Low	59.8	Low	113 Å²	113	99.9 Å²	99.9	73%	0.734	55%	0.547	S	S	*	.			trans	-51.7	126.3	177.6	19.4	-30.2	0	0	0	108	D18 N22	D18-P20 WeakPolarHBondContact O-CD 3.06Å; P20-N22 PolarHBondContact O-N 3.36Å
21	E	56	Low	61.8	Low	142 Å²	142	98.8 Å²	98.8	66%	0.664	54%	0.536	S	S	*	.			trans	-51	115.1	-169	-165.6	179.4	-169.4	0	0	109	V19 H23 S26 R29	V19-E21 PolarHBondContact O-N 2.94Å; V19-E21 VanDerWaalsContact O-N 3.09Å; E21-H23 PolarHBondContact O-N 3.19Å; E21-S26 PolarHBondContact OE1-OG 3.02Å; E21-R29 IonicContact OE1-CZ 2.82Å; E21-R29 IonicContact OE1-NH2 2.75Å; E21-R29 PolarHBondContact OE1-NH2 3.4Å
22	N	63.6	Low	63.7	Low	89 Å²	89	99.9 Å²	99.9	48%	0.476	54%	0.542	S	S	.	.			trans	-69.8	102.8	-177.2	-173.4	-21.2	0	0	0	106.9	P20 T24 V25 S26	P20-N22 PolarHBondContact O-N 3.36Å; N22-T24 PolarHBondContact O-N 3.23Å; N22-T24 VanDerWaalsContact OD1-CB 3.26Å; N22-T24 WeakPolarHBondContact OD1-CB 3.28Å; N22-T24 PolarHBondContact OD1-N 3.48Å; N22-T24 PolarHBondContact OD1-OG1 3.39Å; N22-V25 HydrophobicContact CB-CB 4.12Å; N22-V25 HydrophobicContact CB-CG2 3.83Å; N22-V25 WeakPolarHBondContact O-CA 3.5Å; N22-V25 VanDerWaalsContact O-CB 3.31Å; N22-V25 WeakPolarHBondContact O-CB 3.16Å; N22-V25 PolarHBondContact O-N 3.02Å; N22-S26 PolarHBondContact O-N 3.42Å; N22-S26 VanDerWaalsContact O-N 3.15Å
23	H	67.7	Low	65.9	Low	129 Å²	129	100 Å²	100	60%	0.597	54%	0.536	S	S	*	.	H	α-helix	trans	-51.4	-27.9	-177.6	-170.8	-79.3	0	0	0	112.7	E21 K27	E21-H23 PolarHBondContact O-N 3.19Å; H23-K27 WeakPolarHBondContact CE1-CE 3.46Å; H23-K27 WeakPolarHBondContact O-CG 3.32Å; H23-K27 PolarHBondContact O-N 3.5Å; H23-K27 VanDerWaalsContact O-N 3.15Å
24	T	73.2	Confident	68.2	Low	95 Å²	95	92.7 Å²	92.7	58%	0.583	51%	0.505	S	S	*	.	H	α-helix	trans	-67.5	-41	174.1	-44	0	0	0	0	111.9	N22 K27 L28	N22-T24 PolarHBondContact O-N 3.23Å; N22-T24 VanDerWaalsContact OD1-CB 3.26Å; N22-T24 WeakPolarHBondContact OD1-CB 3.28Å; N22-T24 PolarHBondContact OD1-N 3.48Å; N22-T24 PolarHBondContact OD1-OG1 3.39Å; T24-K27 PolarHBondContact O-N 3.47Å; T24-L28 WeakPolarHBondContact O-CB 3.5Å; T24-L28 PolarHBondContact O-N 2.73Å
25	V	78	Confident	70.2	Confident	34 Å²	34	91.5 Å²	91.5	21%	0.206	49%	0.492	C	S	.	.	H	α-helix	trans	-68.5	-39.9	177.7	172.4	0	0	0	0	110.8	N22 L28 R29 L61	N22-V25 HydrophobicContact CB-CB 4.12Å; N22-V25 HydrophobicContact CB-CG2 3.83Å; N22-V25 WeakPolarHBondContact O-CA 3.5Å; N22-V25 VanDerWaalsContact O-CB 3.31Å; N22-V25 WeakPolarHBondContact O-CB 3.16Å; N22-V25 PolarHBondContact O-N 3.02Å; V25-L28 PolarHBondContact O-N 2.77Å; V25-R29 HydrophobicContact CG1-CG 4.45Å; V25-R29 VanDerWaalsContact O-CG 3.24Å; V25-R29 WeakPolarHBondContact O-CG 3.38Å; V25-R29 PolarHBondContact O-N 2.76Å; V25-R29 PolarHBondContact O-NE 2.84Å; V25-L61 HydrophobicContact CG1-CB 4.48Å; V25-L61 HydrophobicContact CG1-CD2 3.41Å; V25-L61 VanDerWaalsContact CG1-CD2 3.41Å; V25-L61 HydrophobicContact CG2-CD2 4.42Å
26	S	78.7	Confident	72.3	Confident	18 Å²	18	89.7 Å²	89.7	13%	0.126	48%	0.477	C	S	.	.	H	α-helix	trans	-58.6	-50.2	172.7	-51.1	0	0	0	0	111.4	E21 N22 L28 R29 E30	E21-S26 PolarHBondContact OE1-OG 3.02Å; N22-S26 PolarHBondContact O-N 3.42Å; N22-S26 VanDerWaalsContact O-N 3.15Å; S26-L28 VanDerWaalsContact C-N 3.3Å; S26-L28 PolarHBondContact O-N 3.47Å; S26-R29 WeakPolarHBondContact O-CB 3.35Å; S26-R29 PolarHBondContact O-N 2.85Å; S26-R29 VanDerWaalsContact O-N 3.14Å; S26-R29 PolarHBondContact OG-NH2 2.98Å; S26-E30 WeakPolarHBondContact O-CG 3.39Å; S26-E30 PolarHBondContact O-N 3.08Å; S26-E30 VanDerWaalsContact O-N 3.08Å
27	K	80.7	Confident	74.5	Confident	123 Å²	123	84.9 Å²	84.9	54%	0.535	46%	0.461	S	S	.	.	H	α-helix	trans	-57.7	-41.7	174.2	-77.9	-179.9	164.4	173.2	0	112.9	H23 T24 R29 E30 T31	H23-K27 WeakPolarHBondContact CE1-CE 3.46Å; H23-K27 WeakPolarHBondContact O-CG 3.32Å; H23-K27 PolarHBondContact O-N 3.5Å; H23-K27 VanDerWaalsContact O-N 3.15Å; T24-K27 PolarHBondContact O-N 3.47Å; K27-R29 VanDerWaalsContact C-N 3.33Å; K27-R29 PolarHBondContact O-N 3.01Å; K27-E30 PolarHBondContact O-N 3Å; K27-T31 WeakPolarHBondContact O-CG2 3.42Å; K27-T31 PolarHBondContact O-N 3.32Å
28	L	80.6	Confident	76.9	Confident	68 Å²	68	81 Å²	81	36%	0.356	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-42.3	179.4	-150.5	107.2	0	0	0	110.8	T24 V25 S26 E30 T31 G34 L38	T24-L28 WeakPolarHBondContact O-CB 3.5Å; T24-L28 PolarHBondContact O-N 2.73Å; V25-L28 PolarHBondContact O-N 2.77Å; S26-L28 VanDerWaalsContact C-N 3.3Å; S26-L28 PolarHBondContact O-N 3.47Å; L28-E30 VanDerWaalsContact C-N 3.29Å; L28-E30 PolarHBondContact O-N 3.38Å; L28-T31 PolarHBondContact O-N 3.38Å; L28-T31 PolarHBondContact O-OG1 2.77Å; L28-T31 VanDerWaalsContact O-OG1 3.06Å; L28-G34 CarbonylContact O-C 3.53Å; L28-G34 VanDerWaalsContact O-CA 3.24Å; L28-G34 WeakPolarHBondContact O-CA 3.5Å; L28-L38 HydrophobicContact CD2-CD1 4Å; L28-L38 HydrophobicContact CD2-CD2 3.62Å; L28-L38 HydrophobicContact CD2-CG 3.67Å
29	R	84.8	Confident	79.2	Confident	44 Å²	44	73.7 Å²	73.7	17%	0.166	40%	0.396	C	S	.	.	H	α-helix	trans	-65	-30.4	177.7	-71.1	176.8	-69.6	165.9	0.5	113.3	E21 V25 S26 K27 K35 L38 L61 L63	E21-R29 IonicContact OE1-CZ 2.82Å; E21-R29 IonicContact OE1-NH2 2.75Å; E21-R29 PolarHBondContact OE1-NH2 3.4Å; V25-R29 HydrophobicContact CG1-CG 4.45Å; V25-R29 VanDerWaalsContact O-CG 3.24Å; V25-R29 WeakPolarHBondContact O-CG 3.38Å; V25-R29 PolarHBondContact O-N 2.76Å; V25-R29 PolarHBondContact O-NE 2.84Å; S26-R29 WeakPolarHBondContact O-CB 3.35Å; S26-R29 PolarHBondContact O-N 2.85Å; S26-R29 VanDerWaalsContact O-N 3.14Å; S26-R29 PolarHBondContact OG-NH2 2.98Å; K27-R29 VanDerWaalsContact C-N 3.33Å; K27-R29 PolarHBondContact O-N 3.01Å; R29-K35 WeakPolarHBondContact O-CE 3.27Å; R29-K35 VanDerWaalsContact O-CG 3.32Å; R29-K35 WeakPolarHBondContact O-CG 3.48Å; R29-L38 HydrophobicContact CG-CD1 3.97Å; R29-L61 WeakPolarHBondContact CD-O 3.25Å; R29-L61 PolarHBondContact NE-O 3.36Å; R29-L61 PolarHBondContact NH1-O 3.06Å; R29-L63 HydrophobicContact CG-CD1 4.25Å; R29-L63 HydrophobicContact CG-CD2 4.16Å; R29-L63 HydrophobicContact CG-CG 4.34Å
30	E	85.5	Confident	81.2	Confident	145 Å²	145	70.8 Å²	70.8	68%	0.678	38%	0.377	S	S	*	.	H	α-helix	trans	-76.7	-25.8	-179.4	-72.5	169.3	-173.3	0	0	112.8	S26 K27 L28	S26-E30 WeakPolarHBondContact O-CG 3.39Å; S26-E30 PolarHBondContact O-N 3.08Å; S26-E30 VanDerWaalsContact O-N 3.08Å; K27-E30 PolarHBondContact O-N 3Å; L28-E30 VanDerWaalsContact C-N 3.29Å; L28-E30 PolarHBondContact O-N 3.38Å
31	T	87.2	Confident	83	Confident	69 Å²	69	67.5 Å²	67.5	42%	0.423	36%	0.355	S	S	.	.	S	Bend	trans	-87.7	140.8	180	65	0	0	0	0	112.5	K27 L28 A33 G34 K35	K27-T31 WeakPolarHBondContact O-CG2 3.42Å; K27-T31 PolarHBondContact O-N 3.32Å; L28-T31 PolarHBondContact O-N 3.38Å; L28-T31 PolarHBondContact O-OG1 2.77Å; L28-T31 VanDerWaalsContact O-OG1 3.06Å; T31-A33 VanDerWaalsContact C-N 3.3Å; T31-A33 PolarHBondContact O-N 3.03Å; T31-G34 PolarHBondContact O-N 2.92Å; T31-G34 VanDerWaalsContact O-N 3.16Å; T31-G34 WeakPolarHBondContact OG1-CA 3.46Å; T31-G34 PolarHBondContact OG1-N 2.85Å; T31-K35 WeakPolarHBondContact O-CG 3.37Å; T31-K35 PolarHBondContact O-N 3.1Å
32	E	87.8	Confident	84.8	Confident	123 Å²	123	61.5 Å²	61.5	58%	0.575	33%	0.326	S	S	*	.	H	α-helix	trans	-61.5	-39	174.6	-72.1	-59.9	118.2	0	0	112.2	G34 K35 L36	E32-G34 VanDerWaalsContact C-N 3.34Å; E32-G34 PolarHBondContact O-N 3.2Å; E32-K35 PolarHBondContact O-N 3.07Å; E32-K35 IonicContact OE1-NZ 2.98Å; E32-K35 PolarHBondContact OE1-NZ 3.31Å; E32-L36 WeakPolarHBondContact O-CB 3.35Å; E32-L36 PolarHBondContact O-N 3.42Å
33	A	87.3	Confident	86.2	Confident	67 Å²	67	57.5 Å²	57.5	55%	0.554	31%	0.305	S	S	*	.	H	α-helix	trans	-63.8	-40.1	174.7	0	0	0	0	0	111.9	T31 L36 C37	T31-A33 VanDerWaalsContact C-N 3.3Å; T31-A33 PolarHBondContact O-N 3.03Å; A33-L36 WeakPolarHBondContact O-CB 3.48Å; A33-L36 PolarHBondContact O-N 3.5Å; A33-C37 PolarHBondContact O-N 3.4Å; A33-C37 PolarHBondContact O-SG 2.88Å; A33-C37 VanDerWaalsContact O-SG 3.37Å
34	G	89	Confident	87.3	Confident	4 Å²	4	53.9 Å²	53.9	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-44.9	176.9	0	0	0	0	0	112.4	L28 T31 E32 L36 C37 L38	L28-G34 CarbonylContact O-C 3.53Å; L28-G34 VanDerWaalsContact O-CA 3.24Å; L28-G34 WeakPolarHBondContact O-CA 3.5Å; T31-G34 PolarHBondContact O-N 2.92Å; T31-G34 VanDerWaalsContact O-N 3.16Å; T31-G34 WeakPolarHBondContact OG1-CA 3.46Å; T31-G34 PolarHBondContact OG1-N 2.85Å; E32-G34 VanDerWaalsContact C-N 3.34Å; E32-G34 PolarHBondContact O-N 3.2Å; G34-L36 VanDerWaalsContact C-N 3.26Å; G34-L36 PolarHBondContact O-N 3.15Å; G34-C37 WeakPolarHBondContact O-CB 3.28Å; G34-C37 PolarHBondContact O-N 3.32Å; G34-C37 VanDerWaalsContact O-N 3.13Å; G34-L38 VanDerWaalsContact O-CG 3.3Å; G34-L38 WeakPolarHBondContact O-CG 3.4Å; G34-L38 PolarHBondContact O-N 2.95Å
35	K	89.9	Confident	88.2	Confident	78 Å²	78	50.8 Å²	50.8	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-40.5	172	-69	179.1	-164.5	161.4	0	112.2	R29 T31 E32 L38 S39	R29-K35 WeakPolarHBondContact O-CE 3.27Å; R29-K35 VanDerWaalsContact O-CG 3.32Å; R29-K35 WeakPolarHBondContact O-CG 3.48Å; T31-K35 WeakPolarHBondContact O-CG 3.37Å; T31-K35 PolarHBondContact O-N 3.1Å; E32-K35 PolarHBondContact O-N 3.07Å; E32-K35 IonicContact OE1-NZ 2.98Å; E32-K35 PolarHBondContact OE1-NZ 3.31Å; K35-L38 PolarHBondContact O-N 3.4Å; K35-S39 VanDerWaalsContact O-CB 3.29Å; K35-S39 WeakPolarHBondContact O-CB 3.48Å; K35-S39 PolarHBondContact O-N 2.92Å; K35-S39 PolarHBondContact O-OG 3.32Å
36	L	90.8	Very high	88.8	Confident	47 Å²	47	52.2 Å²	52.2	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-47.9	175.2	-179.2	69.8	0	0	0	111.3	E32 A33 G34 L38 S39 L40 L74 L78	E32-L36 WeakPolarHBondContact O-CB 3.35Å; E32-L36 PolarHBondContact O-N 3.42Å; A33-L36 WeakPolarHBondContact O-CB 3.48Å; A33-L36 PolarHBondContact O-N 3.5Å; G34-L36 VanDerWaalsContact C-N 3.26Å; G34-L36 PolarHBondContact O-N 3.15Å; L36-L38 PolarHBondContact O-N 2.83Å; L36-S39 WeakPolarHBondContact O-CB 3.44Å; L36-S39 PolarHBondContact O-N 3.13Å; L36-L40 HydrophobicContact CG-CD1 4.46Å; L36-L40 WeakPolarHBondContact O-CG 3.49Å; L36-L40 PolarHBondContact O-N 3.4Å; L36-L74 HydrophobicContact CD1-CD2 3.61Å; L36-L78 HydrophobicContact CD1-CD1 4.33Å; L36-L78 HydrophobicContact CD1-CD2 4.32Å; L36-L78 HydrophobicContact CD1-CG 4.38Å; L36-L78 HydrophobicContact CD2-CD2 4.12Å
37	C	91.3	Very high	89.3	Confident	70 Å²	70	55.9 Å²	55.9	47%	0.473	29%	0.286	S	S	.	.	H	α-helix	trans	-59.2	-45.8	175.9	-73.3	0	0	0	0	112.3	A33 G34 S39 L40 V41	A33-C37 PolarHBondContact O-N 3.4Å; A33-C37 PolarHBondContact O-SG 2.88Å; A33-C37 VanDerWaalsContact O-SG 3.37Å; G34-C37 WeakPolarHBondContact O-CB 3.28Å; G34-C37 PolarHBondContact O-N 3.32Å; G34-C37 VanDerWaalsContact O-N 3.13Å; C37-S39 VanDerWaalsContact C-N 3.3Å; C37-S39 PolarHBondContact O-N 2.85Å; C37-L40 PolarHBondContact O-N 3.14Å; C37-V41 WeakPolarHBondContact O-CG2 3.45Å; C37-V41 PolarHBondContact O-N 2.92Å
38	L	92.6	Very high	89.6	Confident	12 Å²	12	57 Å²	57	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-40.4	177.2	-65.4	176.1	0	0	0	111.5	L28 R29 G34 K35 L36 V41 R42 F57 L61 L63 L68	L28-L38 HydrophobicContact CD2-CD1 4Å; L28-L38 HydrophobicContact CD2-CD2 3.62Å; L28-L38 HydrophobicContact CD2-CG 3.67Å; R29-L38 HydrophobicContact CG-CD1 3.97Å; G34-L38 VanDerWaalsContact O-CG 3.3Å; G34-L38 WeakPolarHBondContact O-CG 3.4Å; G34-L38 PolarHBondContact O-N 2.95Å; K35-L38 PolarHBondContact O-N 3.4Å; L36-L38 PolarHBondContact O-N 2.83Å; L38-V41 PolarHBondContact O-N 2.66Å; L38-R42 PolarHBondContact O-N 2.88Å; L38-F57 HydrophobicContact CB-CZ 4.44Å; L38-F57 HydrophobicContact CD2-CE2 4.36Å; L38-F57 HydrophobicContact CD2-CZ 3.76Å; L38-L61 HydrophobicContact CD1-CD1 4.23Å; L38-L61 HydrophobicContact CD2-CD1 3.72Å; L38-L61 HydrophobicContact CD2-CD2 3.99Å; L38-L61 HydrophobicContact CG-CD1 4.42Å; L38-L63 HydrophobicContact CD1-CD1 4.07Å; L38-L68 HydrophobicContact CB-CD1 4.06Å; L38-L68 HydrophobicContact CB-CD2 3.67Å
39	S	93.1	Very high	90	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.007	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-39.8	176.9	-58.9	0	0	0	0	111.8	K35 L36 C37 V41 R42 D43 L68 D69	K35-S39 VanDerWaalsContact O-CB 3.29Å; K35-S39 WeakPolarHBondContact O-CB 3.48Å; K35-S39 PolarHBondContact O-N 2.92Å; K35-S39 PolarHBondContact O-OG 3.32Å; L36-S39 WeakPolarHBondContact O-CB 3.44Å; L36-S39 PolarHBondContact O-N 3.13Å; C37-S39 VanDerWaalsContact C-N 3.3Å; C37-S39 PolarHBondContact O-N 2.85Å; S39-V41 VanDerWaalsContact C-N 3.34Å; S39-V41 PolarHBondContact O-N 3.15Å; S39-R42 PolarHBondContact O-N 3.09Å; S39-D43 WeakPolarHBondContact O-CB 3.49Å; S39-D43 PolarHBondContact O-N 3.04Å; S39-L68 WeakPolarHBondContact OG-CB 3.3Å; S39-D69 PolarHBondContact OG-N 3.47Å
40	L	93.3	Very high	90.3	Very high	16 Å²	16	57.8 Å²	57.8	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-38.4	174.4	-71.6	169.5	0	0	0	112.5	L36 C37 L44 L74 L78 V88 M89 L92	L36-L40 HydrophobicContact CG-CD1 4.46Å; L36-L40 WeakPolarHBondContact O-CG 3.49Å; L36-L40 PolarHBondContact O-N 3.4Å; C37-L40 PolarHBondContact O-N 3.14Å; L40-L44 PolarHBondContact O-N 2.83Å; L40-L74 HydrophobicContact CD2-CD1 4.33Å; L40-L74 HydrophobicContact CD2-CD2 4.32Å; L40-L74 HydrophobicContact CG-CD2 4.43Å; L40-L78 HydrophobicContact CD2-CD1 4.09Å; L40-V88 HydrophobicContact CD2-CB 3.89Å; L40-V88 HydrophobicContact CD2-CG1 3.53Å; L40-M89 HydrophobicContact CB-CE 3.76Å; L40-L92 HydrophobicContact CD1-CD1 3.73Å; L40-L92 HydrophobicContact CD2-CD1 3.76Å; L40-L92 HydrophobicContact CG-CD1 4.43Å
41	V	93.1	Very high	90.5	Very high	44 Å²	44	58.3 Å²	58.3	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-68.3	-40.9	175.2	174.8	0	0	0	0	110.6	C37 L38 S39 L44 F45 F57 M89	C37-V41 WeakPolarHBondContact O-CG2 3.45Å; C37-V41 PolarHBondContact O-N 2.92Å; L38-V41 PolarHBondContact O-N 2.66Å; S39-V41 VanDerWaalsContact C-N 3.34Å; S39-V41 PolarHBondContact O-N 3.15Å; V41-L44 VanDerWaalsContact O-CB 3.28Å; V41-L44 WeakPolarHBondContact O-CB 3.16Å; V41-L44 PolarHBondContact O-N 2.93Å; V41-F45 HydrophobicContact CG1-CD2 4.29Å; V41-F45 HydrophobicContact CG1-CE1 4.3Å; V41-F45 HydrophobicContact CG1-CE2 3.51Å; V41-F45 HydrophobicContact CG1-CZ 3.51Å; V41-F45 WeakPolarHBondContact O-CD2 3.45Å; V41-F45 PolarHBondContact O-N 2.81Å; V41-F57 HydrophobicContact CB-CE2 4.44Å; V41-F57 HydrophobicContact CB-CZ 3.89Å; V41-F57 HydrophobicContact CG1-CD2 4.47Å; V41-F57 HydrophobicContact CG1-CE1 4.3Å; V41-F57 HydrophobicContact CG1-CE2 3.78Å; V41-F57 HydrophobicContact CG1-CZ 3.66Å; V41-M89 HydrophobicContact CG2-CE 4Å
42	R	92.3	Very high	90.4	Very high	15 Å²	15	60.1 Å²	60.1	6%	0.057	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-45.8	174.7	-167.3	-167.5	72.1	-174.3	-7.2	111.8	L38 S39 L44 F45 D46 R54 E65 L68 D69	L38-R42 PolarHBondContact O-N 2.88Å; S39-R42 PolarHBondContact O-N 3.09Å; R42-L44 PolarHBondContact O-N 3.29Å; R42-F45 WeakPolarHBondContact O-CB 3.43Å; R42-F45 PolarHBondContact O-N 2.85Å; R42-D46 IonicContact NE-OD2 3.83Å; R42-D46 PolarHBondContact O-N 3.5Å; R42-R54 HydrophobicContact CG-CG 3.92Å; R42-E65 PolarHBondContact NH1-O 2.91Å; R42-L68 HydrophobicContact CB-CD1 4.02Å; R42-L68 HydrophobicContact CG-CD1 4.49Å; R42-L68 PolarHBondContact NH1-O 2.95Å; R42-L68 PolarHBondContact NH2-O 2.69Å; R42-D69 PolarHBondContact NH2-O 3.27Å
43	D	92.7	Very high	90.5	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-54.8	-42.3	175.9	176	68.2	0	0	0	111.7	S39 F45 D46 R47 D71 L74 V88	S39-D43 WeakPolarHBondContact O-CB 3.49Å; S39-D43 PolarHBondContact O-N 3.04Å; D43-F45 VanDerWaalsContact C-N 3.34Å; D43-F45 PolarHBondContact O-N 2.82Å; D43-D46 PolarHBondContact O-N 2.96Å; D43-R47 VanDerWaalsContact O-CB 3.28Å; D43-R47 WeakPolarHBondContact O-CB 3.29Å; D43-R47 PolarHBondContact O-N 3.49Å; D43-D71 WeakPolarHBondContact OD1-CB 3.35Å; D43-L74 HydrophobicContact CB-CD1 3.8Å; D43-V88 PolarHBondContact OD2-N 3.46Å
44	L	92	Very high	90.5	Very high	52 Å²	52	57.2 Å²	57.2	27%	0.272	30%	0.298	S	S	.	.	H	α-helix	trans	-58.1	-46.7	174.4	-161.7	85.3	0	0	0	111.4	L40 V41 R42 R47 Y48 A87	L40-L44 PolarHBondContact O-N 2.83Å; V41-L44 VanDerWaalsContact O-CB 3.28Å; V41-L44 WeakPolarHBondContact O-CB 3.16Å; V41-L44 PolarHBondContact O-N 2.93Å; R42-L44 PolarHBondContact O-N 3.29Å; L44-R47 PolarHBondContact O-N 3.2Å; L44-Y48 HydrophobicContact CD1-CD2 4.42Å; L44-Y48 HydrophobicContact CD1-CE2 3.81Å; L44-Y48 HydrophobicContact CG-CD2 4.01Å; L44-Y48 HydrophobicContact CG-CE2 3.89Å; L44-Y48 WeakPolarHBondContact O-CD2 3.48Å; L44-Y48 PolarHBondContact O-N 3.33Å; L44-Y48 VanDerWaalsContact O-N 3.15Å; L44-A87 HydrophobicContact CD1-CB 4.1Å
45	F	92.1	Very high	90.3	Very high	30 Å²	30	59.5 Å²	59.5	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-42.6	178.6	-59.7	-33.4	0	0	0	112.5	V41 R42 D43 R47 Y48 G49 L50 T53 R54 F57	V41-F45 HydrophobicContact CG1-CD2 4.29Å; V41-F45 HydrophobicContact CG1-CE1 4.3Å; V41-F45 HydrophobicContact CG1-CE2 3.51Å; V41-F45 HydrophobicContact CG1-CZ 3.51Å; V41-F45 WeakPolarHBondContact O-CD2 3.45Å; V41-F45 PolarHBondContact O-N 2.81Å; R42-F45 WeakPolarHBondContact O-CB 3.43Å; R42-F45 PolarHBondContact O-N 2.85Å; D43-F45 VanDerWaalsContact C-N 3.34Å; D43-F45 PolarHBondContact O-N 2.82Å; F45-R47 VanDerWaalsContact C-N 3.33Å; F45-R47 PolarHBondContact O-N 3Å; F45-Y48 PolarHBondContact O-N 3Å; F45-G49 PolarHBondContact O-N 3.41Å; F45-L50 HydrophobicContact CB-CB 4.21Å; F45-L50 HydrophobicContact CD1-CB 4.46Å; F45-L50 HydrophobicContact CD1-CD1 4.08Å; F45-L50 PolarHBondContact O-N 3.42Å; F45-T53 HydrophobicContact CD1-CG2 4.21Å; F45-T53 HydrophobicContact CE1-CG2 3.89Å; F45-T53 HydrophobicContact CE2-CG2 4.31Å; F45-T53 HydrophobicContact CZ-CG2 3.94Å; F45-R54 HydrophobicContact CB-CB 4.16Å; F45-R54 HydrophobicContact CD2-CB 4.43Å; F45-F57 HydrophobicContact CD2-CB 4.4Å; F45-F57 HydrophobicContact CD2-CD1 4.4Å; F45-F57 HydrophobicContact CD2-CG 4.4Å; F45-F57 HydrophobicContact CE2-CB 3.81Å; F45-F57 AromaticContact CE2-CD1 4Å; F45-F57 HydrophobicContact CE2-CD1 4Å; F45-F57 AromaticContact CE2-CD2 3.91Å; F45-F57 HydrophobicContact CE2-CD2 3.91Å; F45-F57 HydrophobicContact CE2-CE1 4.47Å; F45-F57 HydrophobicContact CE2-CE2 4.39Å; F45-F57 AromaticContact CE2-CG 3.66Å; F45-F57 HydrophobicContact CE2-CG 3.66Å
46	D	89.9	Confident	90.2	Very high	64 Å²	64	59.5 Å²	59.5	34%	0.342	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-43.8	177.1	-74.4	-34.1	0	0	0	110.8	R42 D43 Y48 G49 R54	R42-D46 IonicContact NE-OD2 3.83Å; R42-D46 PolarHBondContact O-N 3.5Å; D43-D46 PolarHBondContact O-N 2.96Å; D46-Y48 VanDerWaalsContact C-N 3.35Å; D46-Y48 PolarHBondContact O-N 3.38Å; D46-G49 PolarHBondContact O-N 3.02Å; D46-G49 VanDerWaalsContact O-N 3.1Å; D46-R54 WeakPolarHBondContact OD1-CD 3.48Å; D46-R54 IonicContact OD1-CZ 3.13Å; D46-R54 IonicContact OD1-NE 2.83Å; D46-R54 IonicContact OD1-NH1 2.74Å; D46-R54 PolarHBondContact OD1-NH1 2.81Å
47	R	88.9	Confident	90.1	Very high	95 Å²	95	59.2 Å²	59.2	36%	0.358	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-40.8	179.5	-165.8	77.5	-166.6	150.1	29.4	113.2	D43 L44 F45 G49 D85 A87	D43-R47 VanDerWaalsContact O-CB 3.28Å; D43-R47 WeakPolarHBondContact O-CB 3.29Å; D43-R47 PolarHBondContact O-N 3.49Å; L44-R47 PolarHBondContact O-N 3.2Å; F45-R47 VanDerWaalsContact C-N 3.33Å; F45-R47 PolarHBondContact O-N 3Å; R47-G49 VanDerWaalsContact C-N 3.32Å; R47-D85 VanDerWaalsContact CZ-C 3.43Å; R47-D85 IonicContact CZ-OD1 3.73Å; R47-D85 IonicContact CZ-OD2 2.83Å; R47-D85 PolarHBondContact NE-O 2.92Å; R47-D85 IonicContact NH1-OD1 3.7Å; R47-D85 PolarHBondContact NH1-OD1 3.25Å; R47-D85 PolarHBondContact NH2-O 2.9Å; R47-D85 IonicContact NH2-OD1 2.93Å; R47-D85 PolarHBondContact NH2-OD1 2.97Å; R47-D85 IonicContact NH2-OD2 3.63Å; R47-D85 PolarHBondContact NH2-OD2 3.5Å; R47-A87 HydrophobicContact CB-CB 4.25Å; R47-A87 HydrophobicContact CG-CB 4.06Å
48	Y	88.5	Confident	89.9	Confident	147 Å²	147	56.3 Å²	56.3	58%	0.576	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	5.9	178	-67	-67.9	0	0	0	113.5	L44 F45 D46 L50	L44-Y48 HydrophobicContact CD1-CD2 4.42Å; L44-Y48 HydrophobicContact CD1-CE2 3.81Å; L44-Y48 HydrophobicContact CG-CD2 4.01Å; L44-Y48 HydrophobicContact CG-CE2 3.89Å; L44-Y48 WeakPolarHBondContact O-CD2 3.48Å; L44-Y48 PolarHBondContact O-N 3.33Å; L44-Y48 VanDerWaalsContact O-N 3.15Å; F45-Y48 PolarHBondContact O-N 3Å; D46-Y48 VanDerWaalsContact C-N 3.35Å; D46-Y48 PolarHBondContact O-N 3.38Å; Y48-L50 VanDerWaalsContact C-N 3.25Å; Y48-L50 PolarHBondContact O-N 3.32Å
49	G	88.9	Confident	89.5	Confident	50 Å²	50	59.2 Å²	59.2	52%	0.515	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	23.2	178.8	0	0	0	0	0	114.3	F45 D46 R47 K51	F45-G49 PolarHBondContact O-N 3.41Å; D46-G49 PolarHBondContact O-N 3.02Å; D46-G49 VanDerWaalsContact O-N 3.1Å; R47-G49 VanDerWaalsContact C-N 3.32Å; G49-K51 PolarHBondContact O-N 3.18Å
50	L	89.8	Confident	89.1	Confident	78 Å²	78	64.4 Å²	64.4	41%	0.408	34%	0.343	S	S	.	.			trans	-81.2	58.3	-177.2	-60	178	0	0	0	111.9	F45 Y48 C52 T53 R54	F45-L50 HydrophobicContact CB-CB 4.21Å; F45-L50 HydrophobicContact CD1-CB 4.46Å; F45-L50 HydrophobicContact CD1-CD1 4.08Å; F45-L50 PolarHBondContact O-N 3.42Å; Y48-L50 VanDerWaalsContact C-N 3.25Å; Y48-L50 PolarHBondContact O-N 3.32Å; L50-C52 PolarHBondContact O-N 3.32Å; L50-T53 PolarHBondContact O-N 3.24Å; L50-R54 PolarHBondContact O-N 3.18Å
51	K	89.2	Confident	88.7	Confident	156 Å²	156	64.3 Å²	64.3	68%	0.678	34%	0.343	S	S	*	.	H	α-helix	trans	-58.3	-41.3	-173.1	-63.2	-177.2	-178.3	-179.4	0	113.7	G49 R54 S55	G49-K51 PolarHBondContact O-N 3.18Å; K51-R54 WeakPolarHBondContact O-CB 3.5Å; K51-R54 PolarHBondContact O-N 2.78Å; K51-S55 PolarHBondContact O-N 3Å
52	C	86.6	Confident	88.3	Confident	108 Å²	108	64.9 Å²	64.9	73%	0.73	36%	0.358	S	S	*	.	H	α-helix	trans	-66	-45.4	178.9	-58.8	0	0	0	0	110.9	L50 R54 S55 V56	L50-C52 PolarHBondContact O-N 3.32Å; C52-R54 VanDerWaalsContact C-N 3.29Å; C52-R54 PolarHBondContact O-N 3.26Å; C52-S55 PolarHBondContact O-N 2.84Å; C52-V56 WeakPolarHBondContact O-CG2 3.27Å; C52-V56 PolarHBondContact O-N 3.42Å
53	T	89.8	Confident	87.9	Confident	66 Å²	66	66.2 Å²	66.2	41%	0.405	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-39.9	176.4	-48.6	0	0	0	0	111.3	F45 L50 V56 F57	F45-T53 HydrophobicContact CD1-CG2 4.21Å; F45-T53 HydrophobicContact CE1-CG2 3.89Å; F45-T53 HydrophobicContact CE2-CG2 4.31Å; F45-T53 HydrophobicContact CZ-CG2 3.94Å; L50-T53 PolarHBondContact O-N 3.24Å; T53-V56 PolarHBondContact O-N 2.74Å; T53-F57 WeakPolarHBondContact O-CB 3.38Å; T53-F57 PolarHBondContact O-N 2.91Å
54	R	87.1	Confident	87.4	Confident	63 Å²	63	68.7 Å²	68.7	24%	0.238	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-45.6	174.7	-169.9	-170.4	82.9	-176.1	8	112.2	R42 F45 D46 L50 K51 C52 F57 A58 E65	R42-R54 HydrophobicContact CG-CG 3.92Å; F45-R54 HydrophobicContact CB-CB 4.16Å; F45-R54 HydrophobicContact CD2-CB 4.43Å; D46-R54 WeakPolarHBondContact OD1-CD 3.48Å; D46-R54 IonicContact OD1-CZ 3.13Å; D46-R54 IonicContact OD1-NE 2.83Å; D46-R54 IonicContact OD1-NH1 2.74Å; D46-R54 PolarHBondContact OD1-NH1 2.81Å; L50-R54 PolarHBondContact O-N 3.18Å; K51-R54 WeakPolarHBondContact O-CB 3.5Å; K51-R54 PolarHBondContact O-N 2.78Å; C52-R54 VanDerWaalsContact C-N 3.29Å; C52-R54 PolarHBondContact O-N 3.26Å; R54-F57 PolarHBondContact O-N 3.17Å; R54-A58 PolarHBondContact O-N 3.03Å; R54-E65 IonicContact CZ-OE2 2.91Å; R54-E65 IonicContact NH2-OE2 2.75Å; R54-E65 PolarHBondContact NH2-OE2 3.13Å
55	S	84.2	Confident	86.6	Confident	52 Å²	52	70.8 Å²	70.8	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-64.6	-45.4	-179.5	-172.6	0	0	0	0	111.4	K51 C52 F57 A58 S59	K51-S55 PolarHBondContact O-N 3Å; C52-S55 PolarHBondContact O-N 2.84Å; S55-F57 PolarHBondContact O-N 2.96Å; S55-A58 PolarHBondContact O-N 3.38Å; S55-S59 WeakPolarHBondContact O-CB 3.34Å; S55-S59 PolarHBondContact O-N 3.23Å
56	V	88.4	Confident	86.1	Confident	78 Å²	78	75.9 Å²	75.9	47%	0.473	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-45.8	173.8	175.4	0	0	0	0	110.6	C52 T53 A58 S59 E60	C52-V56 WeakPolarHBondContact O-CG2 3.27Å; C52-V56 PolarHBondContact O-N 3.42Å; T53-V56 PolarHBondContact O-N 2.74Å; V56-A58 PolarHBondContact O-N 3.24Å; V56-S59 PolarHBondContact O-N 2.95Å; V56-E60 HydrophobicContact CG1-CG 3.93Å; V56-E60 WeakPolarHBondContact O-CB 3.34Å; V56-E60 VanDerWaalsContact O-CG 3.25Å; V56-E60 WeakPolarHBondContact O-CG 3.21Å; V56-E60 PolarHBondContact O-N 2.96Å
57	F	88.7	Confident	85.9	Confident	41 Å²	41	75.5 Å²	75.5	18%	0.18	43%	0.43	C	S	.	.	H	α-helix	trans	-57.9	-46.9	177.5	176.6	-103.9	0	0	0	112.4	L38 V41 F45 T53 R54 S55 S59 L61 L68	L38-F57 HydrophobicContact CB-CZ 4.44Å; L38-F57 HydrophobicContact CD2-CE2 4.36Å; L38-F57 HydrophobicContact CD2-CZ 3.76Å; V41-F57 HydrophobicContact CB-CE2 4.44Å; V41-F57 HydrophobicContact CB-CZ 3.89Å; V41-F57 HydrophobicContact CG1-CD2 4.47Å; V41-F57 HydrophobicContact CG1-CE1 4.3Å; V41-F57 HydrophobicContact CG1-CE2 3.78Å; V41-F57 HydrophobicContact CG1-CZ 3.66Å; F45-F57 HydrophobicContact CD2-CB 4.4Å; F45-F57 HydrophobicContact CD2-CD1 4.4Å; F45-F57 HydrophobicContact CD2-CG 4.4Å; F45-F57 HydrophobicContact CE2-CB 3.81Å; F45-F57 AromaticContact CE2-CD1 4Å; F45-F57 HydrophobicContact CE2-CD1 4Å; F45-F57 AromaticContact CE2-CD2 3.91Å; F45-F57 HydrophobicContact CE2-CD2 3.91Å; F45-F57 HydrophobicContact CE2-CE1 4.47Å; F45-F57 HydrophobicContact CE2-CE2 4.39Å; F45-F57 AromaticContact CE2-CG 3.66Å; F45-F57 HydrophobicContact CE2-CG 3.66Å; T53-F57 WeakPolarHBondContact O-CB 3.38Å; T53-F57 PolarHBondContact O-N 2.91Å; R54-F57 PolarHBondContact O-N 3.17Å; S55-F57 PolarHBondContact O-N 2.96Å; F57-S59 PolarHBondContact O-N 2.84Å; F57-L61 HydrophobicContact CD1-CD1 3.68Å; F57-L61 HydrophobicContact CD2-CD1 3.96Å; F57-L61 HydrophobicContact CE1-CD1 3.37Å; F57-L61 HydrophobicContact CE2-CD1 3.67Å; F57-L61 HydrophobicContact CE2-CG 4.44Å; F57-L61 HydrophobicContact CG-CD1 3.99Å; F57-L61 HydrophobicContact CZ-CD1 3.39Å; F57-L61 WeakPolarHBondContact O-CB 3.4Å; F57-L61 WeakPolarHBondContact O-CD1 3.19Å; F57-L61 WeakPolarHBondContact O-CG 3.11Å; F57-L61 PolarHBondContact O-N 2.81Å; F57-L61 VanDerWaalsContact O-N 3.07Å; F57-L68 HydrophobicContact CE1-CD1 4.11Å
58	A	86.8	Confident	85.8	Confident	8 Å²	8	71.5 Å²	71.5	7%	0.066	42%	0.415	C	S	.	.	H	α-helix	trans	-62.5	-43.1	176.7	0	0	0	0	0	111.7	R54 S55 V56 L61 G62 L63	R54-A58 PolarHBondContact O-N 3.03Å; S55-A58 PolarHBondContact O-N 3.38Å; V56-A58 PolarHBondContact O-N 3.24Å; A58-L61 CarbonylContact O-C 3.52Å; A58-L61 PolarHBondContact O-N 3.04Å; A58-G62 PolarHBondContact O-N 3.14Å; A58-G62 VanDerWaalsContact O-N 3.1Å; A58-L63 PolarHBondContact O-N 3.4Å
59	S	83.7	Confident	85.8	Confident	74 Å²	74	65.8 Å²	65.8	52%	0.517	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-46.8	178.3	-172.9	0	0	0	0	112.7	S55 V56 F57 L61 G62	S55-S59 WeakPolarHBondContact O-CB 3.34Å; S55-S59 PolarHBondContact O-N 3.23Å; V56-S59 PolarHBondContact O-N 2.95Å; F57-S59 PolarHBondContact O-N 2.84Å; S59-L61 PolarHBondContact O-N 2.75Å; S59-G62 PolarHBondContact O-N 2.84Å
60	E	85.1	Confident	85.9	Confident	109 Å²	109	66.5 Å²	66.5	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-65.4	-29.1	178.5	-70.9	-67.7	158	0	0	112	V56 G62	V56-E60 HydrophobicContact CG1-CG 3.93Å; V56-E60 WeakPolarHBondContact O-CB 3.34Å; V56-E60 VanDerWaalsContact O-CG 3.25Å; V56-E60 WeakPolarHBondContact O-CG 3.21Å; V56-E60 PolarHBondContact O-N 2.96Å; E60-G62 VanDerWaalsContact C-N 3.29Å
61	L	85	Confident	85.9	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.079	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.5	172.1	-63.5	171.3	0	0	0	112.6	V25 R29 L38 F57 A58 S59 L63	V25-L61 HydrophobicContact CG1-CB 4.48Å; V25-L61 HydrophobicContact CG1-CD2 3.41Å; V25-L61 VanDerWaalsContact CG1-CD2 3.41Å; V25-L61 HydrophobicContact CG2-CD2 4.42Å; R29-L61 WeakPolarHBondContact CD-O 3.25Å; R29-L61 PolarHBondContact NE-O 3.36Å; R29-L61 PolarHBondContact NH1-O 3.06Å; L38-L61 HydrophobicContact CD1-CD1 4.23Å; L38-L61 HydrophobicContact CD2-CD1 3.72Å; L38-L61 HydrophobicContact CD2-CD2 3.99Å; L38-L61 HydrophobicContact CG-CD1 4.42Å; F57-L61 HydrophobicContact CD1-CD1 3.68Å; F57-L61 HydrophobicContact CD2-CD1 3.96Å; F57-L61 HydrophobicContact CE1-CD1 3.37Å; F57-L61 HydrophobicContact CE2-CD1 3.67Å; F57-L61 HydrophobicContact CE2-CG 4.44Å; F57-L61 HydrophobicContact CG-CD1 3.99Å; F57-L61 HydrophobicContact CZ-CD1 3.39Å; F57-L61 WeakPolarHBondContact O-CB 3.4Å; F57-L61 WeakPolarHBondContact O-CD1 3.19Å; F57-L61 WeakPolarHBondContact O-CG 3.11Å; F57-L61 PolarHBondContact O-N 2.81Å; F57-L61 VanDerWaalsContact O-N 3.07Å; A58-L61 CarbonylContact O-C 3.52Å; A58-L61 PolarHBondContact O-N 3.04Å; S59-L61 PolarHBondContact O-N 2.75Å; L61-L63 HydrophobicContact CB-CB 4.36Å; L61-L63 HydrophobicContact CB-CD1 3.98Å; L61-L63 HydrophobicContact CB-CG 3.95Å; L61-L63 HydrophobicContact CD1-CD1 4.14Å; L61-L63 PolarHBondContact O-N 2.87Å
62	G	85	Confident	85.8	Confident	56 Å²	56	66.3 Å²	66.3	58%	0.577	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	34.4	-173.2	0	0	0	0	0	113.1	A58 S59 E60	A58-G62 PolarHBondContact O-N 3.14Å; A58-G62 VanDerWaalsContact O-N 3.1Å; S59-G62 PolarHBondContact O-N 2.84Å; E60-G62 VanDerWaalsContact C-N 3.29Å
63	L	83.1	Confident	86.1	Confident	43 Å²	43	65.5 Å²	65.5	23%	0.225	37%	0.368	C	S	.	.			trans	-107.9	144.7	178.9	-69.5	177.6	0	0	0	110.1	R29 L38 A58 L61 A67 L68	R29-L63 HydrophobicContact CG-CD1 4.25Å; R29-L63 HydrophobicContact CG-CD2 4.16Å; R29-L63 HydrophobicContact CG-CG 4.34Å; L38-L63 HydrophobicContact CD1-CD1 4.07Å; A58-L63 PolarHBondContact O-N 3.4Å; L61-L63 HydrophobicContact CB-CB 4.36Å; L61-L63 HydrophobicContact CB-CD1 3.98Å; L61-L63 HydrophobicContact CB-CG 3.95Å; L61-L63 HydrophobicContact CD1-CD1 4.14Å; L61-L63 PolarHBondContact O-N 2.87Å; L63-A67 HydrophobicContact CB-CB 4.25Å; L63-A67 HydrophobicContact CD2-CB 4.25Å; L63-L68 HydrophobicContact CD1-CD1 4.28Å; L63-L68 HydrophobicContact CD1-CD2 3.91Å; L63-L68 HydrophobicContact CD1-CG 4.13Å
64	A	83.5	Confident	86.2	Confident	58 Å²	58	62.3 Å²	62.3	48%	0.479	35%	0.349	S	S	.	.			trans	-66.9	151	164.7	0	0	0	0	0	110.1	D66 A67	A64-D66 WeakPolarHBondContact CB-OD1 3.39Å; A64-D66 PolarHBondContact O-N 3.39Å; A64-D66 VanDerWaalsContact O-N 3.14Å; A64-A67 HydrophobicContact CB-CB 4.43Å; A64-A67 VanDerWaalsContact O-CB 3.26Å; A64-A67 WeakPolarHBondContact O-CB 3.37Å; A64-A67 PolarHBondContact O-N 3.01Å
65	E	73.6	Confident	86.4	Confident	95 Å²	95	59.6 Å²	59.6	44%	0.444	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.8	-176.1	-64.9	-159.7	167.9	0	0	113.2	R42 R54	R42-E65 PolarHBondContact NH1-O 2.91Å; R54-E65 IonicContact CZ-OE2 2.91Å; R54-E65 IonicContact NH2-OE2 2.75Å; R54-E65 PolarHBondContact NH2-OE2 3.13Å
66	D	81.6	Confident	86.7	Confident	138 Å²	138	61.7 Å²	61.7	74%	0.738	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.8	179.6	61.8	-25	0	0	0	114.1	A64 L68	A64-D66 WeakPolarHBondContact CB-OD1 3.39Å; A64-D66 PolarHBondContact O-N 3.39Å; A64-D66 VanDerWaalsContact O-N 3.14Å; D66-L68 PolarHBondContact O-N 3.5Å
67	A	85.3	Confident	86.8	Confident	56 Å²	56	63.7 Å²	63.7	46%	0.463	35%	0.352	S	S	.	.	S	Bend	trans	-69.8	-16.2	-178.4	0	0	0	0	0	114.2	L63 A64	L63-A67 HydrophobicContact CB-CB 4.25Å; L63-A67 HydrophobicContact CD2-CB 4.25Å; A64-A67 HydrophobicContact CB-CB 4.43Å; A64-A67 VanDerWaalsContact O-CB 3.26Å; A64-A67 WeakPolarHBondContact O-CB 3.37Å; A64-A67 PolarHBondContact O-N 3.01Å
68	L	87	Confident	86.8	Confident	11 Å²	11	63.7 Å²	63.7	6%	0.058	35%	0.353	C	S	.	.	S	Bend	trans	-105.4	153.9	-176.5	-64.1	176.1	0	0	0	112.3	L38 S39 R42 F57 L63 D66	L38-L68 HydrophobicContact CB-CD1 4.06Å; L38-L68 HydrophobicContact CB-CD2 3.67Å; S39-L68 WeakPolarHBondContact OG-CB 3.3Å; R42-L68 HydrophobicContact CB-CD1 4.02Å; R42-L68 HydrophobicContact CG-CD1 4.49Å; R42-L68 PolarHBondContact NH1-O 2.95Å; R42-L68 PolarHBondContact NH2-O 2.69Å; F57-L68 HydrophobicContact CE1-CD1 4.11Å; L63-L68 HydrophobicContact CD1-CD1 4.28Å; L63-L68 HydrophobicContact CD1-CD2 3.91Å; L63-L68 HydrophobicContact CD1-CG 4.13Å; D66-L68 PolarHBondContact O-N 3.5Å
69	D	90.4	Very high	86.9	Confident	26 Å²	26	68 Å²	68	14%	0.139	38%	0.383	C	S	.	.			trans	-70.5	132.8	-177.8	-70.3	-45.2	0	0	0	111.9	S39 R42 Q73 L74 K77	S39-D69 PolarHBondContact OG-N 3.47Å; R42-D69 PolarHBondContact NH2-O 3.27Å; D69-Q73 HydrophobicContact CB-CB 3.93Å; D69-L74 HydrophobicContact CB-CD2 3.94Å; D69-L74 HydrophobicContact CB-CG 3.85Å; D69-K77 VanDerWaalsContact CG-NZ 3.25Å; D69-K77 IonicContact OD1-NZ 3.89Å; D69-K77 PolarHBondContact OD1-NZ 3.48Å; D69-K77 VanDerWaalsContact OD1-NZ 3.07Å; D69-K77 WeakPolarHBondContact OD2-CD 3.47Å; D69-K77 WeakPolarHBondContact OD2-CE 3.43Å; D69-K77 IonicContact OD2-NZ 3.8Å; D69-K77 PolarHBondContact OD2-NZ 3.49Å
70	T	89.5	Confident	87	Confident	66 Å²	66	65.1 Å²	65.1	41%	0.405	36%	0.362	S	S	.	.			trans	-69.8	161.3	175.2	56.7	0	0	0	0	111.6	R72 Q73 L74	T70-R72 PolarHBondContact O-N 3.2Å; T70-R72 VanDerWaalsContact O-N 3.14Å; T70-Q73 WeakPolarHBondContact O-CB 3.26Å; T70-Q73 PolarHBondContact O-N 3.1Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.39Å; T70-Q73 PolarHBondContact OG1-OE1 2.88Å; T70-L74 WeakPolarHBondContact O-CG 3.36Å; T70-L74 PolarHBondContact O-N 3.42Å
71	D	89.5	Confident	86.9	Confident	55 Å²	55	63.2 Å²	63.2	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-44.5	-48	175	171.1	77.9	0	0	0	111.8	D43 Q73 L74 R75 V88	D43-D71 WeakPolarHBondContact OD1-CB 3.35Å; D71-Q73 PolarHBondContact O-N 2.93Å; D71-L74 WeakPolarHBondContact O-CB 3.37Å; D71-L74 PolarHBondContact O-N 3.36Å; D71-R75 VanDerWaalsContact O-CG 3.32Å; D71-R75 WeakPolarHBondContact O-CG 3.48Å; D71-R75 PolarHBondContact O-N 2.82Å; D71-R75 IonicContact OD1-CZ 3.69Å; D71-R75 VanDerWaalsContact OD1-CZ 3.3Å; D71-R75 IonicContact OD1-NE 2.76Å; D71-R75 PolarHBondContact OD1-NE 3.43Å; D71-R75 IonicContact OD1-NH2 2.77Å; D71-R75 PolarHBondContact OD1-NH2 3.24Å; D71-R75 IonicContact OD2-CZ 2.88Å; D71-R75 IonicContact OD2-NE 2.75Å; D71-R75 PolarHBondContact OD2-NE 3.49Å; D71-R75 IonicContact OD2-NH2 3.83Å; D71-V88 VanDerWaalsContact OD1-CG2 3.27Å; D71-V88 WeakPolarHBondContact OD1-CG2 3.34Å
72	R	88.9	Confident	86.7	Confident	174 Å²	174	68.5 Å²	68.5	66%	0.657	38%	0.383	S	S	*	.	H	α-helix	trans	-62.7	-43.9	179.1	-168.7	178.5	-174.6	-167.3	-1.3	112.9	T70 T76 E82	T70-R72 PolarHBondContact O-N 3.2Å; T70-R72 VanDerWaalsContact O-N 3.14Å; R72-T76 WeakPolarHBondContact O-CB 3.3Å; R72-T76 PolarHBondContact O-N 3.07Å; R72-T76 PolarHBondContact O-OG1 2.9Å; R72-E82 IonicContact NE-OE1 3.07Å
73	Q	91.8	Very high	85.9	Confident	91 Å²	91	70.8 Å²	70.8	43%	0.425	39%	0.39	S	S	.	.	H	α-helix	trans	-65.2	-41.9	177.5	-74.1	165.7	-39.9	0	0	111	D69 T70 D71 T76 K77	D69-Q73 HydrophobicContact CB-CB 3.93Å; T70-Q73 WeakPolarHBondContact O-CB 3.26Å; T70-Q73 PolarHBondContact O-N 3.1Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.39Å; T70-Q73 PolarHBondContact OG1-OE1 2.88Å; D71-Q73 PolarHBondContact O-N 2.93Å; Q73-T76 PolarHBondContact O-N 3.26Å; Q73-K77 WeakPolarHBondContact O-CB 3.42Å; Q73-K77 WeakPolarHBondContact O-CG 3.48Å; Q73-K77 PolarHBondContact O-N 3.33Å
74	L	91.4	Very high	85.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-61.7	-47.6	176.5	-75.3	171.3	0	0	0	111.9	L36 L40 D43 D69 T70 D71 T76 K77 L78 V88	L36-L74 HydrophobicContact CD1-CD2 3.61Å; L40-L74 HydrophobicContact CD2-CD1 4.33Å; L40-L74 HydrophobicContact CD2-CD2 4.32Å; L40-L74 HydrophobicContact CG-CD2 4.43Å; D43-L74 HydrophobicContact CB-CD1 3.8Å; D69-L74 HydrophobicContact CB-CD2 3.94Å; D69-L74 HydrophobicContact CB-CG 3.85Å; T70-L74 WeakPolarHBondContact O-CG 3.36Å; T70-L74 PolarHBondContact O-N 3.42Å; D71-L74 WeakPolarHBondContact O-CB 3.37Å; D71-L74 PolarHBondContact O-N 3.36Å; L74-T76 VanDerWaalsContact C-N 3.3Å; L74-T76 PolarHBondContact O-N 2.92Å; L74-K77 PolarHBondContact O-N 3.04Å; L74-L78 VanDerWaalsContact O-CB 3.27Å; L74-L78 WeakPolarHBondContact O-CB 3.45Å; L74-L78 WeakPolarHBondContact O-CG 3.02Å; L74-L78 PolarHBondContact O-N 3.4Å; L74-V88 HydrophobicContact CB-CG1 4.14Å; L74-V88 HydrophobicContact CB-CG2 4.03Å; L74-V88 HydrophobicContact CD1-CG2 4.37Å
75	R	91	Very high	85.1	Confident	6 Å²	6	73.9 Å²	73.9	2%	0.023	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-41.8	177.2	-71.3	177.7	-167.1	-104.9	-5.5	112.2	D71 L78 S79 L80 P81 D84 A86 V88 L91	D71-R75 VanDerWaalsContact O-CG 3.32Å; D71-R75 WeakPolarHBondContact O-CG 3.48Å; D71-R75 PolarHBondContact O-N 2.82Å; D71-R75 IonicContact OD1-CZ 3.69Å; D71-R75 VanDerWaalsContact OD1-CZ 3.3Å; D71-R75 IonicContact OD1-NE 2.76Å; D71-R75 PolarHBondContact OD1-NE 3.43Å; D71-R75 IonicContact OD1-NH2 2.77Å; D71-R75 PolarHBondContact OD1-NH2 3.24Å; D71-R75 IonicContact OD2-CZ 2.88Å; D71-R75 IonicContact OD2-NE 2.75Å; D71-R75 PolarHBondContact OD2-NE 3.49Å; D71-R75 IonicContact OD2-NH2 3.83Å; R75-L78 PolarHBondContact O-N 3.07Å; R75-S79 PolarHBondContact O-N 2.92Å; R75-L80 HydrophobicContact CB-CB 4.36Å; R75-L80 HydrophobicContact CG-CB 4.33Å; R75-L80 PolarHBondContact O-N 3.2Å; R75-P81 PolarHBondContact NH1-O 2.92Å; R75-D84 VanDerWaalsContact CZ-O 3.3Å; R75-D84 PolarHBondContact NH1-O 2.83Å; R75-D84 PolarHBondContact NH2-O 3.1Å; R75-A86 PolarHBondContact NH2-O 3.29Å; R75-V88 HydrophobicContact CG-CG2 3.99Å; R75-L91 VanDerWaalsContact NH1-CD1 3.32Å
76	T	91	Very high	85.6	Confident	96 Å²	96	70.2 Å²	70.2	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-63.1	-51.5	176.2	-53.8	0	0	0	0	110.8	R72 Q73 L74 L78 S79	R72-T76 WeakPolarHBondContact O-CB 3.3Å; R72-T76 PolarHBondContact O-N 3.07Å; R72-T76 PolarHBondContact O-OG1 2.9Å; Q73-T76 PolarHBondContact O-N 3.26Å; L74-T76 VanDerWaalsContact C-N 3.3Å; L74-T76 PolarHBondContact O-N 2.92Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 2.91Å; T76-S79 PolarHBondContact O-N 2.92Å
77	K	90.2	Very high	85.9	Confident	120 Å²	120	63.8 Å²	63.8	52%	0.522	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-37.7	179.5	-77.7	-174.6	-179.8	-179.8	0	112.5	D69 Q73 L74	D69-K77 VanDerWaalsContact CG-NZ 3.25Å; D69-K77 IonicContact OD1-NZ 3.89Å; D69-K77 PolarHBondContact OD1-NZ 3.48Å; D69-K77 VanDerWaalsContact OD1-NZ 3.07Å; D69-K77 WeakPolarHBondContact OD2-CD 3.47Å; D69-K77 WeakPolarHBondContact OD2-CE 3.43Å; D69-K77 IonicContact OD2-NZ 3.8Å; D69-K77 PolarHBondContact OD2-NZ 3.49Å; Q73-K77 WeakPolarHBondContact O-CB 3.42Å; Q73-K77 WeakPolarHBondContact O-CG 3.48Å; Q73-K77 PolarHBondContact O-N 3.33Å; L74-K77 PolarHBondContact O-N 3.04Å
78	L	89.1	Confident	86.1	Confident	40 Å²	40	61.1 Å²	61.1	21%	0.209	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	3.2	-175.2	-64.9	167.9	0	0	0	114.1	L36 L40 L74 R75 T76 L80 V88 L92	L36-L78 HydrophobicContact CD1-CD1 4.33Å; L36-L78 HydrophobicContact CD1-CD2 4.32Å; L36-L78 HydrophobicContact CD1-CG 4.38Å; L36-L78 HydrophobicContact CD2-CD2 4.12Å; L40-L78 HydrophobicContact CD2-CD1 4.09Å; L74-L78 VanDerWaalsContact O-CB 3.27Å; L74-L78 WeakPolarHBondContact O-CB 3.45Å; L74-L78 WeakPolarHBondContact O-CG 3.02Å; L74-L78 PolarHBondContact O-N 3.4Å; R75-L78 PolarHBondContact O-N 3.07Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 2.91Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 HydrophobicContact CB-CD1 3.7Å; L78-L80 HydrophobicContact CB-CG 3.84Å; L78-L80 HydrophobicContact CD1-CD1 4.06Å; L78-L80 PolarHBondContact O-N 3.41Å; L78-V88 HydrophobicContact CD1-CG1 3.7Å; L78-L92 HydrophobicContact CB-CD2 4.5Å; L78-L92 HydrophobicContact CD1-CD1 3.78Å; L78-L92 HydrophobicContact CD1-CD2 4.14Å; L78-L92 HydrophobicContact CD1-CG 4.21Å; L78-L92 HydrophobicContact CD2-CD2 4.37Å
79	S	88.6	Confident	86.1	Confident	98 Å²	98	63.5 Å²	63.5	69%	0.685	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	51.7	-176.1	-57.2	0	0	0	0	111.9	R75 T76	R75-S79 PolarHBondContact O-N 2.92Å; T76-S79 PolarHBondContact O-N 2.92Å
80	L	86	Confident	85.8	Confident	14 Å²	14	67.5 Å²	67.5	7%	0.073	35%	0.354	C	S	.	.			trans	-107.5	149.9	178.1	-65.2	170.5	0	0	0	110.4	R75 L78 V88 L91 L92 K95	R75-L80 HydrophobicContact CB-CB 4.36Å; R75-L80 HydrophobicContact CG-CB 4.33Å; R75-L80 PolarHBondContact O-N 3.2Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 HydrophobicContact CB-CD1 3.7Å; L78-L80 HydrophobicContact CB-CG 3.84Å; L78-L80 HydrophobicContact CD1-CD1 4.06Å; L78-L80 PolarHBondContact O-N 3.41Å; L80-V88 HydrophobicContact CD1-CG1 3.5Å; L80-L91 HydrophobicContact CD1-CB 4.36Å; L80-L91 HydrophobicContact CD2-CB 4.45Å; L80-L92 HydrophobicContact CD1-CD2 4.03Å; L80-L92 HydrophobicContact CD1-CG 4.04Å; L80-L92 HydrophobicContact CD2-CD2 4.48Å; L80-K95 HydrophobicContact CD2-CD 3.92Å
81	P	83.6	Confident	85.6	Confident	69 Å²	69	65 Å²	65	45%	0.448	34%	0.339	S	S	.	.			trans	-66.6	140.1	-179.1	26.8	-33.6	0	0	0	112	R75 S83	R75-P81 PolarHBondContact NH1-O 2.92Å; P81-S83 VanDerWaalsContact C-N 3.29Å; P81-S83 PolarHBondContact O-N 3.49Å
82	E	79.9	Confident	85.4	Confident	126 Å²	126	64.2 Å²	64.2	59%	0.589	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-18	176.4	-70.1	-169.2	152	0	0	113.3	R72	R72-E82 IonicContact NE-OE1 3.07Å
83	S	68.1	Low	85.2	Confident	105 Å²	105	59.6 Å²	59.6	73%	0.734	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.5	-165.6	58.5	0	0	0	0	116.1	P81	P81-S83 VanDerWaalsContact C-N 3.29Å; P81-S83 PolarHBondContact O-N 3.49Å
84	D	70.4	Confident	84.7	Confident	50 Å²	50	57 Å²	57	27%	0.267	32%	0.316	S	S	.	.			trans	-94.9	126.9	179.8	-92	-30	0	0	0	111.4	R75 A86 L91 R120	R75-D84 VanDerWaalsContact CZ-O 3.3Å; R75-D84 PolarHBondContact NH1-O 2.83Å; R75-D84 PolarHBondContact NH2-O 3.1Å; D84-A86 PolarHBondContact O-N 3.08Å; D84-L91 HydrophobicContact CB-CD1 4.28Å; D84-L91 HydrophobicContact CB-CD2 3.94Å; D84-R120 IonicContact OD1-CZ 3.91Å; D84-R120 IonicContact OD1-NE 2.85Å; D84-R120 IonicContact OD1-NH2 2.92Å; D84-R120 PolarHBondContact OD1-NH2 2.82Å
85	D	79.3	Confident	84.1	Confident	116 Å²	116	62.4 Å²	62.4	62%	0.62	34%	0.339	S	S	*	.			trans	-70.6	23.2	171.1	-136.8	21.2	0	0	0	111.8	R47	R47-D85 VanDerWaalsContact CZ-C 3.43Å; R47-D85 IonicContact CZ-OD1 3.73Å; R47-D85 IonicContact CZ-OD2 2.83Å; R47-D85 PolarHBondContact NE-O 2.92Å; R47-D85 IonicContact NH1-OD1 3.7Å; R47-D85 PolarHBondContact NH1-OD1 3.25Å; R47-D85 PolarHBondContact NH2-O 2.9Å; R47-D85 IonicContact NH2-OD1 2.93Å; R47-D85 PolarHBondContact NH2-OD1 2.97Å; R47-D85 IonicContact NH2-OD2 3.63Å; R47-D85 PolarHBondContact NH2-OD2 3.5Å
86	A	85	Confident	83.5	Confident	18 Å²	18	66.6 Å²	66.6	15%	0.149	36%	0.362	C	S	.	.	S	Bend	trans	-64.1	145.7	165.7	0	0	0	0	0	113	R75 D84 Y90	R75-A86 PolarHBondContact NH2-O 3.29Å; D84-A86 PolarHBondContact O-N 3.08Å; A86-Y90 HydrophobicContact CB-CD1 3.97Å
87	A	87.1	Confident	82.5	Confident	3 Å²	3	67.1 Å²	67.1	3%	0.025	36%	0.361	C	S	.	.			trans	-66.4	145.2	149.9	0	0	0	0	0	109	L44 R47 M89 Y90 L91	L44-A87 HydrophobicContact CD1-CB 4.1Å; R47-A87 HydrophobicContact CB-CB 4.25Å; R47-A87 HydrophobicContact CG-CB 4.06Å; A87-M89 PolarHBondContact O-N 3.34Å; A87-Y90 WeakPolarHBondContact O-CB 3.45Å; A87-Y90 PolarHBondContact O-N 3.5Å; A87-L91 PolarHBondContact O-N 3.44Å
88	V	89.4	Confident	81.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-58.7	-40.1	-178	-179.4	0	0	0	0	111.2	L40 D43 D71 L74 R75 L78 L80 Y90 L91 L92	L40-V88 HydrophobicContact CD2-CB 3.89Å; L40-V88 HydrophobicContact CD2-CG1 3.53Å; D43-V88 PolarHBondContact OD2-N 3.46Å; D71-V88 VanDerWaalsContact OD1-CG2 3.27Å; D71-V88 WeakPolarHBondContact OD1-CG2 3.34Å; L74-V88 HydrophobicContact CB-CG1 4.14Å; L74-V88 HydrophobicContact CB-CG2 4.03Å; L74-V88 HydrophobicContact CD1-CG2 4.37Å; R75-V88 HydrophobicContact CG-CG2 3.99Å; L78-V88 HydrophobicContact CD1-CG1 3.7Å; L80-V88 HydrophobicContact CD1-CG1 3.5Å; V88-Y90 VanDerWaalsContact C-N 3.27Å; V88-Y90 PolarHBondContact O-N 3.35Å; V88-L91 WeakPolarHBondContact O-CB 3.46Å; V88-L91 PolarHBondContact O-N 2.94Å; V88-L91 VanDerWaalsContact O-N 3.13Å; V88-L92 PolarHBondContact O-N 2.99Å
89	M	87.6	Confident	80.3	Confident	61 Å²	61	67.5 Å²	67.5	30%	0.3	37%	0.374	S	S	.	.	H	α-helix	trans	-58.9	-39	177	-170.4	179.8	-69.3	0	0	112	L40 V41 A87 L92 V93	L40-M89 HydrophobicContact CB-CE 3.76Å; V41-M89 HydrophobicContact CG2-CE 4Å; A87-M89 PolarHBondContact O-N 3.34Å; M89-L92 PolarHBondContact O-N 2.98Å; M89-V93 WeakPolarHBondContact O-CG2 2.98Å; M89-V93 PolarHBondContact O-N 3.07Å; M89-V93 VanDerWaalsContact O-N 3.08Å
90	Y	85.3	Confident	78.6	Confident	109 Å²	109	69.1 Å²	69.1	43%	0.427	37%	0.374	S	S	.	.	H	α-helix	trans	-67.1	-40.8	176.5	-176.8	-96.4	0	0	0	111.8	A86 A87 V88 L92 V93 T94	A86-Y90 HydrophobicContact CB-CD1 3.97Å; A87-Y90 WeakPolarHBondContact O-CB 3.45Å; A87-Y90 PolarHBondContact O-N 3.5Å; V88-Y90 VanDerWaalsContact C-N 3.27Å; V88-Y90 PolarHBondContact O-N 3.35Å; Y90-L92 VanDerWaalsContact C-N 3.34Å; Y90-L92 PolarHBondContact O-N 3.23Å; Y90-V93 PolarHBondContact O-N 3.38Å; Y90-T94 HydrophobicContact CD1-CG2 4.08Å; Y90-T94 HydrophobicContact CE1-CG2 3.62Å; Y90-T94 HydrophobicContact CE2-CG2 4.2Å; Y90-T94 WeakPolarHBondContact O-CB 3.25Å; Y90-T94 WeakPolarHBondContact O-CG2 3.48Å; Y90-T94 PolarHBondContact O-N 3.44Å; Y90-T94 PolarHBondContact O-OG1 3.3Å
91	L	85.4	Confident	77	Confident	15 Å²	15	73.1 Å²	73.1	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-63.1	-39.4	175.4	-66.1	174	0	0	0	112.1	R75 L80 D84 A87 V88 T94 K95	R75-L91 VanDerWaalsContact NH1-CD1 3.32Å; L80-L91 HydrophobicContact CD1-CB 4.36Å; L80-L91 HydrophobicContact CD2-CB 4.45Å; D84-L91 HydrophobicContact CB-CD1 4.28Å; D84-L91 HydrophobicContact CB-CD2 3.94Å; A87-L91 PolarHBondContact O-N 3.44Å; V88-L91 WeakPolarHBondContact O-CB 3.46Å; V88-L91 PolarHBondContact O-N 2.94Å; V88-L91 VanDerWaalsContact O-N 3.13Å; L91-T94 WeakPolarHBondContact CA-OG1 3.47Å; L91-T94 PolarHBondContact O-OG1 3.17Å; L91-K95 WeakPolarHBondContact O-CB 3.24Å; L91-K95 PolarHBondContact O-N 3.46Å
92	L	84.9	Confident	75.2	Confident	38 Å²	38	74.6 Å²	74.6	20%	0.199	41%	0.412	C	S	.	.	H	α-helix	trans	-63.3	-46.8	174.9	-77.1	173.5	0	0	0	112.4	L40 L78 L80 V88 M89 Y90 K95 N96	L40-L92 HydrophobicContact CD1-CD1 3.73Å; L40-L92 HydrophobicContact CD2-CD1 3.76Å; L40-L92 HydrophobicContact CG-CD1 4.43Å; L78-L92 HydrophobicContact CB-CD2 4.5Å; L78-L92 HydrophobicContact CD1-CD1 3.78Å; L78-L92 HydrophobicContact CD1-CD2 4.14Å; L78-L92 HydrophobicContact CD1-CG 4.21Å; L78-L92 HydrophobicContact CD2-CD2 4.37Å; L80-L92 HydrophobicContact CD1-CD2 4.03Å; L80-L92 HydrophobicContact CD1-CG 4.04Å; L80-L92 HydrophobicContact CD2-CD2 4.48Å; V88-L92 PolarHBondContact O-N 2.99Å; M89-L92 PolarHBondContact O-N 2.98Å; Y90-L92 VanDerWaalsContact C-N 3.34Å; Y90-L92 PolarHBondContact O-N 3.23Å; L92-K95 PolarHBondContact O-N 2.68Å; L92-N96 PolarHBondContact O-N 3.07Å; L92-N96 PolarHBondContact O-ND2 3.33Å
93	V	83.9	Confident	73.6	Confident	77 Å²	77	77.2 Å²	77.2	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-64.2	-46.8	-180	172.7	0	0	0	0	110.2	M89 Y90 K95 N96 L97	M89-V93 WeakPolarHBondContact O-CG2 2.98Å; M89-V93 PolarHBondContact O-N 3.07Å; M89-V93 VanDerWaalsContact O-N 3.08Å; Y90-V93 PolarHBondContact O-N 3.38Å; V93-K95 PolarHBondContact O-N 2.91Å; V93-N96 PolarHBondContact O-N 2.88Å; V93-L97 HydrophobicContact CG1-CD1 3.86Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 VanDerWaalsContact O-CG 3.3Å; V93-L97 WeakPolarHBondContact O-CG 3.44Å; V93-L97 PolarHBondContact O-N 3.31Å
94	T	81.1	Confident	72.3	Confident	37 Å²	37	75.4 Å²	75.4	23%	0.227	42%	0.416	C	S	.	.	H	α-helix	trans	-64	-40.9	178.4	49.3	0	0	0	0	112.6	Y90 L91 N96 L97 N98	Y90-T94 HydrophobicContact CD1-CG2 4.08Å; Y90-T94 HydrophobicContact CE1-CG2 3.62Å; Y90-T94 HydrophobicContact CE2-CG2 4.2Å; Y90-T94 WeakPolarHBondContact O-CB 3.25Å; Y90-T94 WeakPolarHBondContact O-CG2 3.48Å; Y90-T94 PolarHBondContact O-N 3.44Å; Y90-T94 PolarHBondContact O-OG1 3.3Å; L91-T94 WeakPolarHBondContact CA-OG1 3.47Å; L91-T94 PolarHBondContact O-OG1 3.17Å; T94-N96 VanDerWaalsContact C-N 3.33Å; T94-N96 PolarHBondContact O-N 2.97Å; T94-L97 PolarHBondContact O-N 2.66Å; T94-N98 WeakPolarHBondContact O-CB 3.32Å; T94-N98 PolarHBondContact O-N 3.3Å; T94-N98 PolarHBondContact O-ND2 3.37Å
95	K	79.5	Confident	70.8	Confident	113 Å²	113	82.7 Å²	82.7	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-59.3	-43.7	174	-172.3	176.6	179.3	-179.8	0	111.5	L80 L91 L92 V93 N98 S99	L80-K95 HydrophobicContact CD2-CD 3.92Å; L91-K95 WeakPolarHBondContact O-CB 3.24Å; L91-K95 PolarHBondContact O-N 3.46Å; L92-K95 PolarHBondContact O-N 2.68Å; V93-K95 PolarHBondContact O-N 2.91Å; K95-N98 PolarHBondContact O-N 2.71Å; K95-S99 PolarHBondContact O-N 3.44Å; K95-S99 PolarHBondContact O-OG 2.88Å
96	N	77.1	Confident	68.8	Low	93 Å²	93	86.4 Å²	86.4	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-67.8	-39	177.7	-82.1	-63.9	0	0	0	113.3	L92 V93 T94 N98 S99 N100	L92-N96 PolarHBondContact O-N 3.07Å; L92-N96 PolarHBondContact O-ND2 3.33Å; V93-N96 PolarHBondContact O-N 2.88Å; T94-N96 VanDerWaalsContact C-N 3.33Å; T94-N96 PolarHBondContact O-N 2.97Å; N96-N98 VanDerWaalsContact C-N 3.32Å; N96-N98 PolarHBondContact O-N 2.89Å; N96-S99 WeakPolarHBondContact CA-OG 3.24Å; N96-S99 PolarHBondContact O-OG 2.97Å; N96-N100 VanDerWaalsContact O-CG 3.29Å; N96-N100 PolarHBondContact O-N 3.38Å; N96-N100 PolarHBondContact O-ND2 3.33Å
97	L	71.2	Confident	66.6	Low	108 Å²	108	90.6 Å²	90.6	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-65.2	-38.1	175.6	-69.9	171.6	0	0	0	111.6	V93 T94 T101	V93-L97 HydrophobicContact CG1-CD1 3.86Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 VanDerWaalsContact O-CG 3.3Å; V93-L97 WeakPolarHBondContact O-CG 3.44Å; V93-L97 PolarHBondContact O-N 3.31Å; T94-L97 PolarHBondContact O-N 2.66Å; L97-T101 PolarHBondContact O-OG1 3.09Å; L97-T101 VanDerWaalsContact O-OG1 3.07Å
98	N	70.4	Confident	64.1	Low	105 Å²	105	98.5 Å²	98.5	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-77.2	-30.6	179.4	-67.1	-20.7	0	0	0	113	T94 K95 N96 N100 T101 S102	T94-N98 WeakPolarHBondContact O-CB 3.32Å; T94-N98 PolarHBondContact O-N 3.3Å; T94-N98 PolarHBondContact O-ND2 3.37Å; K95-N98 PolarHBondContact O-N 2.71Å; N96-N98 VanDerWaalsContact C-N 3.32Å; N96-N98 PolarHBondContact O-N 2.89Å; N98-N100 VanDerWaalsContact C-N 3.32Å; N98-T101 WeakPolarHBondContact CA-OG1 3.42Å; N98-T101 PolarHBondContact O-N 3.47Å; N98-T101 PolarHBondContact O-OG1 2.91Å; N98-S102 PolarHBondContact O-OG 3.13Å
99	S	62.3	Low	61.3	Low	63 Å²	63	101.9 Å²	101.9	44%	0.441	56%	0.56	S	S	.	*	H	α-helix	trans	-68.9	-33.3	173.4	56	0	0	0	0	112	K95 N96 T101	K95-S99 PolarHBondContact O-N 3.44Å; K95-S99 PolarHBondContact O-OG 2.88Å; N96-S99 WeakPolarHBondContact CA-OG 3.24Å; N96-S99 PolarHBondContact O-OG 2.97Å; S99-T101 VanDerWaalsContact C-N 3.3Å; S99-T101 PolarHBondContact O-N 2.72Å
100	N	54.1	Low	58.8	Low	131 Å²	131	108.2 Å²	108.2	70%	0.701	59%	0.589	S	S	*	*	H	α-helix	trans	-77	-14.6	180	-70.3	-7.2	0	0	0	113.8	N96 N98	N96-N100 VanDerWaalsContact O-CG 3.29Å; N96-N100 PolarHBondContact O-N 3.38Å; N96-N100 PolarHBondContact O-ND2 3.33Å; N98-N100 VanDerWaalsContact C-N 3.32Å
101	T	52.2	Low	56.4	Low	99 Å²	99	115.4 Å²	115.4	61%	0.607	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-9.3	177.3	26.7	0	0	0	0	113.6	L97 N98 S99	L97-T101 PolarHBondContact O-OG1 3.09Å; L97-T101 VanDerWaalsContact O-OG1 3.07Å; N98-T101 WeakPolarHBondContact CA-OG1 3.42Å; N98-T101 PolarHBondContact O-N 3.47Å; N98-T101 PolarHBondContact O-OG1 2.91Å; S99-T101 VanDerWaalsContact C-N 3.3Å; S99-T101 PolarHBondContact O-N 2.72Å
102	S	45.6	Very low	53.9	Low	100 Å²	100	118 Å²	118	70%	0.699	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	10.3	-172.1	-59.3	0	0	0	0	115.4	N98	N98-S102 PolarHBondContact O-OG 3.13Å
103	Q	45.4	Very low	51.6	Low	180 Å²	180	121.7 Å²	121.7	84%	0.841	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	4.1	172.6	-79.1	-160.1	-4.9	0	0	115.1	K105	Q103-K105 VanDerWaalsContact C-N 3.32Å; Q103-K105 PolarHBondContact O-N 3.49Å
104	A	41.5	Very low	49.6	Very low	68 Å²	68	128.9 Å²	128.9	56%	0.562	69%	0.694	S	S	*	*	S	Bend	trans	-72	94.9	161.9	0	0	0	0	0	107.8	F106	A104-F106 VanDerWaalsContact C-N 3.29Å; A104-F106 PolarHBondContact O-N 3.44Å
105	K	37.8	Very low	47.5	Very low	202 Å²	202	134.1 Å²	134.1	88%	0.878	72%	0.719	S	S	*	*			trans	-50.6	98.8	163.9	-74.6	178.2	178.7	175.6	0	107.5	Q103 S107	Q103-K105 VanDerWaalsContact C-N 3.32Å; Q103-K105 PolarHBondContact O-N 3.49Å; K105-S107 PolarHBondContact O-N 3.22Å
106	F	37.9	Very low	45.7	Very low	195 Å²	195	136 Å²	136	86%	0.855	73%	0.732	S	S	*	*			trans	-66.6	91.6	158.7	-80.4	-84.1	0	0	0	105.9	A104 N108	A104-F106 VanDerWaalsContact C-N 3.29Å; A104-F106 PolarHBondContact O-N 3.44Å; F106-N108 PolarHBondContact O-N 3.29Å
107	S	38.4	Very low	43.6	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	75%	0.746	S	S	*	*			trans	-54.1	123.8	159.6	50.9	0	0	0	0	107.7	K105 G109	K105-S107 PolarHBondContact O-N 3.22Å; S107-G109 PolarHBondContact O-N 2.79Å
108	N	34.4	Very low	42.3	Very low	169 Å²	169	138 Å²	138	90%	0.904	75%	0.748	S	S	*	*	S	Bend	trans	-33.4	124.3	176.5	-69.8	-30.5	0	0	0	113.8	F106	F106-N108 PolarHBondContact O-N 3.29Å
109	G	31.5	Very low	40.7	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	75%	0.754	S	S	*	*			trans	150	107.8	162.7	0	0	0	0	0	113.8	S107	S107-G109 PolarHBondContact O-N 2.79Å
110	E	34.1	Very low	39.7	Very low	194 Å²	194	142.4 Å²	142.4	91%	0.907	77%	0.768	S	S	*	*			trans	81.8	102.4	156.8	-63.4	-173.1	126.9	0	0	120.2	G112	E110-G112 PolarHBondContact O-N 2.88Å
111	R	35.1	Very low	39.1	Very low	261 Å²	261	141 Å²	141	99%	0.985	77%	0.768	S	S	*	*			trans	12.3	102.5	136.4	-82.3	179.3	174	-175.9	-1.6	116.2
112	G	33.2	Very low	38.7	Very low	68 Å²	68	146.2 Å²	146.2	70%	0.701	78%	0.777	S	S	*	*			trans	-154.6	91.8	162.8	0	0	0	0	0	111.1	E110 R114	E110-G112 PolarHBondContact O-N 2.88Å; G112-R114 PolarHBondContact O-N 2.95Å
113	S	36.5	Very low	38.7	Very low	116 Å²	116	146.1 Å²	146.1	81%	0.811	77%	0.767	S	S	*	*			trans	-45.1	107.6	166.4	159.4	0	0	0	0	111.1
114	R	41.7	Very low	38.5	Very low	229 Å²	229	140.3 Å²	140.3	86%	0.864	76%	0.756	S	S	*	*			trans	-128.7	108.3	158.8	-81.2	-172.5	-179.1	179.4	1.2	109	G112 I116	G112-R114 PolarHBondContact O-N 2.95Å; R114-I116 PolarHBondContact O-N 3.01Å; R114-I116 VanDerWaalsContact O-N 3.15Å
115	I	37.1	Very low	38.4	Very low	147 Å²	147	144 Å²	144	75%	0.754	76%	0.762	S	S	*	*			trans	-48.1	112.8	165.1	-65.2	161.2	0	0	0	107.2	D117	I115-D117 VanDerWaalsContact C-N 3.29Å; I115-D117 PolarHBondContact O-N 3.26Å; I115-D117 VanDerWaalsContact O-N 3.09Å
116	I	41.6	Very low	38.4	Very low	151 Å²	151	142.6 Å²	142.6	77%	0.774	76%	0.756	S	S	*	*			trans	-73.7	96.9	163.3	-61.6	174.1	0	0	0	104.4	R114 T118	R114-I116 PolarHBondContact O-N 3.01Å; R114-I116 VanDerWaalsContact O-N 3.15Å; I116-T118 HydrophobicContact CG2-CG2 4.36Å; I116-T118 PolarHBondContact O-N 3.46Å
117	D	34.4	Very low	38.6	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	75%	0.747	S	S	*	*			trans	-67.7	84.9	172.1	-139.8	-4.5	0	0	0	106.9	I115 G119	I115-D117 VanDerWaalsContact C-N 3.29Å; I115-D117 PolarHBondContact O-N 3.26Å; I115-D117 VanDerWaalsContact O-N 3.09Å; D117-G119 PolarHBondContact O-N 3.44Å; D117-G119 VanDerWaalsContact O-N 3.13Å
118	T	43.2	Very low	38.5	Very low	97 Å²	97	141.2 Å²	141.2	60%	0.595	75%	0.752	S	S	*	*			trans	-58.1	117.5	170.5	50.6	0	0	0	0	106.5	I116 R120	I116-T118 HydrophobicContact CG2-CG2 4.36Å; I116-T118 PolarHBondContact O-N 3.46Å; T118-R120 PolarHBondContact O-N 3.09Å
119	G	37	Very low	38.4	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	74%	0.74	S	S	*	*	S	Bend	trans	-63.9	44.7	-179.9	0	0	0	0	0	114.9	D117 S121	D117-G119 PolarHBondContact O-N 3.44Å; D117-G119 VanDerWaalsContact O-N 3.13Å; G119-S121 VanDerWaalsContact C-N 3.35Å; G119-S121 PolarHBondContact O-N 3.21Å
120	R	42	Very low	38.6	Very low	191 Å²	191	142.7 Å²	142.7	72%	0.721	74%	0.737	S	S	*	*			trans	-91.1	11.5	-172.3	-148.3	177.8	-170.1	-175.3	3.8	113.1	D84 T118	D84-R120 IonicContact OD1-CZ 3.91Å; D84-R120 IonicContact OD1-NE 2.85Å; D84-R120 IonicContact OD1-NH2 2.92Å; D84-R120 PolarHBondContact OD1-NH2 2.82Å; T118-R120 PolarHBondContact O-N 3.09Å
121	S	41.1	Very low	38.7	Very low	103 Å²	103	141.3 Å²	141.3	72%	0.72	73%	0.728	S	S	*	*	S	Bend	trans	-128.6	32.3	-163.7	-165.3	0	0	0	0	116.3	G119	G119-S121 VanDerWaalsContact C-N 3.35Å; G119-S121 PolarHBondContact O-N 3.21Å
122	R	42.7	Very low	38.5	Very low	208 Å²	208	133.5 Å²	133.5	79%	0.785	71%	0.713	S	S	*	*	S	Bend	trans	-139.7	-10	168.9	-69	-168.5	-177.2	174.3	2.1	117.1
123	I	46.5	Very low	38.3	Very low	97 Å²	97	139.7 Å²	139.7	50%	0.497	72%	0.723	S	S	.	*	S	Bend	trans	-89.3	-21.4	-179.1	-60.1	171.1	0	0	0	111.8	E125	I123-E125 VanDerWaalsContact C-N 3.34Å; I123-E125 PolarHBondContact O-N 2.96Å
124	G	40	Very low	38	Very low	59 Å²	59	138.3 Å²	138.3	61%	0.608	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-8.9	175.7	0	0	0	0	0	115.8
125	E	40	Very low	37.7	Very low	144 Å²	144	132.8 Å²	132.8	67%	0.673	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-24.2	179.5	-104.6	-179.1	155.6	0	0	113.2	I123	I123-E125 VanDerWaalsContact C-N 3.34Å; I123-E125 PolarHBondContact O-N 2.96Å
126	F	37.5	Very low	37.4	Very low	173 Å²	173	134.2 Å²	134.2	76%	0.759	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-85.6	-17.7	179.2	-71.8	-81.8	0	0	0	113.6	K128	F126-K128 VanDerWaalsContact C-N 3.32Å; F126-K128 PolarHBondContact O-N 2.88Å
127	A	42.8	Very low	36.6	Very low	82 Å²	82	135.9 Å²	135.9	68%	0.678	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-82.1	-3	179	0	0	0	0	0	114.4
128	K	36.2	Very low	36.3	Very low	189 Å²	189	134.8 Å²	134.8	82%	0.822	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-103.2	2.1	179.3	-76.8	-174.1	178.3	179.9	0	114.7	F126	F126-K128 VanDerWaalsContact C-N 3.32Å; F126-K128 PolarHBondContact O-N 2.88Å
129	I	33.1	Very low	35.6	Very low	129 Å²	129	141.2 Å²	141.2	66%	0.662	74%	0.742	S	S	*	*	S	Bend	trans	-117.8	103.5	178.3	-46.1	-179.6	0	0	0	108.4
130	Q	34.3	Very low	35.2	Very low	143 Å²	143	149 Å²	149	67%	0.668	75%	0.751	S	S	*	*	S	Bend	trans	108.7	97.5	165.1	-52.4	-159	35.1	0	0	117.6
131	K	36	Very low	34.7	Very low	164 Å²	164	145.1 Å²	145.1	71%	0.713	75%	0.754	S	S	*	*				80	96.4	123.7	-67.3	170.8	-174.3	162.8	0	116.1
132	S	32.2	Very low	34.3	Very low	97 Å²	97	144.9 Å²	144.9	68%	0.678	76%	0.758	S	S	*	*				63.3	75.3	83	76.8	0	0	0	0	113.1
133	H	28.7	Very low	33.9	Very low	198 Å²	198	143.4 Å²	143.4	92%	0.917	76%	0.76	S	S	*	*			trans	-140.8	97.5	136	-94.9	-79.6	0	0	0	106.6
134	A	30	Very low	33.4	Very low	88 Å²	88	147.4 Å²	147.4	73%	0.727	78%	0.777	S	S	*	*			trans	-73.1	159.8	169.1	0	0	0	0	0	108.5
135	P	35	Very low	33.4	Very low	113 Å²	113	150.6 Å²	150.6	73%	0.734	78%	0.784	S	S	*	*				-144.7	117.3	51.9	35.3	-13.5	0	0	0	114.9
136	L	30.5	Very low	33.2	Very low	177 Å²	177	151.3 Å²	151.3	93%	0.927	79%	0.793	S	S	*	*			trans	-129.9	116	144.4	-82.4	172.2	0	0	0	108.7	C138	L136-C138 PolarHBondContact O-N 3.29Å
137	Q	25.6	Very low	33.4	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	79%	0.787	S	S	*	*			trans	-56.4	119.4	178.1	-66.1	170.9	-10.8	0	0	110.4
138	C	27.9	Very low	33.5	Very low	124 Å²	124	154.4 Å²	154.4	84%	0.838	80%	0.799	S	S	*	*			trans	-139.2	103.9	150.4	-96.5	0	0	0	0	107.7	L136	L136-C138 PolarHBondContact O-N 3.29Å
139	R	28.5	Very low	34.2	Very low	232 Å²	232	154.6 Å²	154.6	88%	0.875	80%	0.8	S	S	*	*			trans	-55.4	127.4	170.1	-67.5	173.6	169.7	177.9	-4.1	109.6
140	Y	29.1	Very low	34.6	Very low	231 Å²	231	156.1 Å²	156.1	91%	0.906	81%	0.809	S	S	*	*			trans	-148.2	141.7	138.1	-79.5	-69.6	0	0	0	109.4
141	S	31.3	Very low	35.5	Very low	110 Å²	110	158.3 Å²	158.3	77%	0.769	82%	0.817	S	S	*	*			trans	-74.4	150.6	-157.8	37	0	0	0	0	115.1
142	A	31.6	Very low	36.4	Very low	99 Å²	99	156.3 Å²	156.3	82%	0.818	82%	0.82	S	S	*	*			trans	-78	116.7	168.8	0	0	0	0	0	110
143	E	36	Very low	37.3	Very low	176 Å²	176	160 Å²	160	82%	0.822	82%	0.824	S	S	*	*			trans	-154.2	114.8	157	-106.1	161.5	-154.5	0	0	107.8
144	E	34	Very low	38	Very low	182 Å²	182	157 Å²	157	85%	0.85	81%	0.814	S	S	*	*			trans	49.2	101.6	148.5	-61.7	179.6	155	0	0	119.6
145	V	41.3	Very low	39	Very low	126 Å²	126	157.7 Å²	157.7	76%	0.764	82%	0.82	S	S	*	*				-148.4	100.8	125.3	-172.6	0	0	0	0	108.9	N147	V145-N147 HydrophobicContact CG1-CB 4.37Å; V145-N147 WeakPolarHBondContact CG1-ND2 3.24Å; V145-N147 PolarHBondContact O-N 3.08Å
146	D	35.7	Very low	39.7	Very low	159 Å²	159	156.9 Å²	156.9	85%	0.85	82%	0.817	S	S	*	*			trans	-65.6	114.1	162.3	-152.1	1.8	0	0	0	108.1
147	N	41.7	Very low	40.4	Very low	120 Å²	120	153.6 Å²	153.6	64%	0.642	80%	0.8	S	S	*	*			trans	-141.9	110.7	172.5	-103.6	-35.6	0	0	0	109	V145 K149	V145-N147 HydrophobicContact CG1-CB 4.37Å; V145-N147 WeakPolarHBondContact CG1-ND2 3.24Å; V145-N147 PolarHBondContact O-N 3.08Å; N147-K149 PolarHBondContact O-N 3.4Å
148	E	45	Very low	41.4	Very low	200 Å²	200	152.1 Å²	152.1	94%	0.935	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	60.1	173.7	-72.9	-166.3	124.7	0	0	113.5
149	K	49.8	Very low	42.4	Very low	192 Å²	192	151.2 Å²	151.2	84%	0.835	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	0	171.2	-79.2	-173.2	177.8	176.8	0	114.3	N147 K151	N147-K149 PolarHBondContact O-N 3.4Å; K149-K151 VanDerWaalsContact C-N 3.34Å; K149-K151 PolarHBondContact O-N 2.91Å; K149-K151 VanDerWaalsContact O-N 3.14Å
150	D	43.2	Very low	43	Very low	161 Å²	161	147.8 Å²	147.8	86%	0.861	78%	0.783	S	S	*	*			trans	-88.9	63.6	176.4	-76.4	-27.5	0	0	0	112.9
151	K	52.2	Low	43.7	Very low	190 Å²	190	144 Å²	144	83%	0.826	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-100.8	119.3	151.3	-76.3	-175.3	-178.4	177.2	0	107.9	K149 K153	K149-K151 VanDerWaalsContact C-N 3.34Å; K149-K151 PolarHBondContact O-N 2.91Å; K149-K151 VanDerWaalsContact O-N 3.14Å; K151-K153 PolarHBondContact O-N 3.16Å
152	P	54	Low	44	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62	121.2	173.3	23.9	-30.2	0	0	0	108.8	L154	P152-L154 PolarHBondContact O-N 3.46Å
153	K	53.1	Low	44.6	Very low	174 Å²	174	153 Å²	153	76%	0.757	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.1	123.6	173.1	-67	-176.6	178.7	-177.8	0	108.7	K151	K151-K153 PolarHBondContact O-N 3.16Å
154	L	43.1	Very low	44.9	Very low	136 Å²	136	149.2 Å²	149.2	71%	0.712	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.7	151.1	172	-76.7	158.9	0	0	0	109	P152 S156 D157	P152-L154 PolarHBondContact O-N 3.46Å; L154-S156 PolarHBondContact O-N 3.4Å; L154-D157 PolarHBondContact O-N 3.49Å
155	A	51.1	Low	45.4	Very low	102 Å²	102	152.4 Å²	152.4	84%	0.843	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	8.5	-177.4	0	0	0	0	0	115.2
156	S	49	Very low	45.4	Very low	96 Å²	96	153.7 Å²	153.7	67%	0.671	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-1.9	179.6	58.2	0	0	0	0	114.7	L154	L154-S156 PolarHBondContact O-N 3.4Å
157	D	44.9	Very low	45.8	Very low	108 Å²	108	149.6 Å²	149.6	58%	0.578	76%	0.757	S	S	*	*	S	Bend	trans	-99.7	5.8	-175.9	-69.4	-12.9	0	0	0	114.2	L154	L154-D157 PolarHBondContact O-N 3.49Å
158	F	46.7	Very low	46.1	Very low	156 Å²	156	148.1 Å²	148.1	68%	0.684	76%	0.762	S	S	*	*	S	Bend	trans	-94.7	122.8	170.8	-71.8	-84.8	0	0	0	108.8	D160	F158-D160 PolarHBondContact O-N 2.75Å
159	P	48.9	Very low	46.2	Very low	104 Å²	104	145 Å²	145	68%	0.675	75%	0.751	S	S	*	*			trans	-59.3	138.4	166.3	27.4	-30.8	0	0	0	106.9	L161	P159-L161 VanDerWaalsContact C-N 3.32Å; P159-L161 PolarHBondContact O-N 2.8Å
160	D	41.5	Very low	46.5	Very low	161 Å²	161	138 Å²	138	86%	0.861	73%	0.726	S	S	*	*			trans	-43.6	99.7	174.1	-83.6	-42.5	0	0	0	108.7	F158 E162	F158-D160 PolarHBondContact O-N 2.75Å; D160-E162 PolarHBondContact O-N 3.01Å
161	L	43.9	Very low	46.9	Very low	151 Å²	151	135.5 Å²	135.5	79%	0.791	71%	0.713	S	S	*	*			trans	-67.8	91.8	165.7	-74.9	171.9	0	0	0	103	P159 R163	P159-L161 VanDerWaalsContact C-N 3.32Å; P159-L161 PolarHBondContact O-N 2.8Å; L161-R163 PolarHBondContact O-N 3.24Å
162	E	38.4	Very low	47	Very low	176 Å²	176	136.3 Å²	136.3	82%	0.822	71%	0.711	S	S	*	*			trans	-38.1	111.1	166.6	-70.5	-173.3	154.1	0	0	106.1	D160 P164	D160-E162 PolarHBondContact O-N 3.01Å; E162-P164 WeakPolarHBondContact O-CD 3.37Å
163	R	44.2	Very low	47.3	Very low	221 Å²	221	137.5 Å²	137.5	83%	0.834	70%	0.703	S	S	*	*			trans	-38.6	122.8	168.5	-99.5	179.1	173	176.9	-2.1	105.4	L161 R165	L161-R163 PolarHBondContact O-N 3.24Å; R163-R165 VanDerWaalsContact C-N 3.32Å; R163-R165 PolarHBondContact O-N 2.95Å
164	P	41.4	Very low	47.6	Very low	98 Å²	98	134.8 Å²	134.8	64%	0.636	69%	0.693	S	S	*	*			trans	-52.8	109.8	171.9	-21.2	30.5	0	0	0	105.6	E162 H166	E162-P164 WeakPolarHBondContact O-CD 3.37Å; P164-H166 WeakPolarHBondContact CB-CD2 3.31Å; P164-H166 PolarHBondContact O-N 3.15Å
165	R	43.7	Very low	48.5	Very low	248 Å²	248	133.9 Å²	133.9	94%	0.936	69%	0.689	S	S	*	*			trans	-72.6	54.1	172.5	-74.7	-176.2	168.4	175.7	-1.4	107.2	R163 S167	R163-R165 VanDerWaalsContact C-N 3.32Å; R163-R165 PolarHBondContact O-N 2.95Å; R165-S167 PolarHBondContact O-N 3.14Å
166	H	41.3	Very low	49.2	Very low	154 Å²	154	130.6 Å²	130.6	71%	0.713	67%	0.665	S	S	*	*			trans	-79.2	108.4	161.9	-65.7	-53.7	0	0	0	104.7	P164 A168	P164-H166 WeakPolarHBondContact CB-CD2 3.31Å; P164-H166 PolarHBondContact O-N 3.15Å; H166-A168 PolarHBondContact O-N 3.46Å
167	S	44.1	Very low	50	Low	72 Å²	72	130.3 Å²	130.3	50%	0.503	66%	0.656	S	S	.	*			trans	-44.1	133.3	178.1	47.1	0	0	0	0	110	R165 L169 S170	R165-S167 PolarHBondContact O-N 3.14Å; S167-L169 PolarHBondContact O-N 3.25Å; S167-S170 PolarHBondContact O-N 3.32Å
168	A	48.6	Very low	51	Low	90 Å²	90	129.3 Å²	129.3	74%	0.744	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	1.8	172.3	0	0	0	0	0	114.2	H166	H166-A168 PolarHBondContact O-N 3.46Å
169	L	47.1	Very low	51.9	Low	134 Å²	134	126.9 Å²	126.9	70%	0.702	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-13.8	174.9	-66.3	169.5	0	0	0	113.3	S167	S167-L169 PolarHBondContact O-N 3.25Å
170	S	57.2	Low	52.5	Low	46 Å²	46	127.4 Å²	127.4	32%	0.322	64%	0.641	S	S	.	*	H	α-helix	trans	-74.8	-40.3	178.8	-170.9	0	0	0	0	112.2	S167 R172 K173 Q174	S167-S170 PolarHBondContact O-N 3.32Å; S170-R172 PolarHBondContact O-N 2.99Å; S170-K173 PolarHBondContact O-N 2.91Å; S170-Q174 WeakPolarHBondContact O-CG 3.37Å; S170-Q174 PolarHBondContact O-N 3.06Å
171	D	50.9	Low	53.3	Low	108 Å²	108	123.1 Å²	123.1	58%	0.578	62%	0.624	S	S	*	*	H	α-helix	trans	-70.1	-34.6	-174.1	-61.4	-12	0	0	0	112.6	K173 L175	D171-K173 VanDerWaalsContact C-N 3.34Å; D171-L175 WeakPolarHBondContact O-CB 3.4Å; D171-L175 PolarHBondContact O-N 2.87Å
172	R	53.8	Low	53.6	Low	206 Å²	206	120.7 Å²	120.7	78%	0.777	61%	0.611	S	S	*	*	H	α-helix	trans	-67.7	-34.7	174.6	-78.9	-175.1	174.6	-178.3	-1.6	112.5	S170 G176	S170-R172 PolarHBondContact O-N 2.99Å; R172-G176 PolarHBondContact O-N 2.94Å
173	K	60.4	Low	54.4	Low	146 Å²	146	118.5 Å²	118.5	64%	0.635	60%	0.599	S	S	*	*	H	α-helix	trans	-73.4	-41.6	177.8	-158.2	-178.7	179.8	-174.4	0	110.8	S170 D171 L175 G176 D177	S170-K173 PolarHBondContact O-N 2.91Å; D171-K173 VanDerWaalsContact C-N 3.34Å; K173-L175 PolarHBondContact O-N 2.94Å; K173-G176 PolarHBondContact O-N 2.74Å; K173-D177 WeakPolarHBondContact O-CB 3.26Å; K173-D177 PolarHBondContact O-N 3.43Å
174	Q	59.8	Low	54.7	Low	117 Å²	117	114 Å²	114	55%	0.547	59%	0.59	S	S	.	*	H	α-helix	trans	-63.2	-39.8	174.1	-73	-178.2	-35	0	0	112.6	S170 V178	S170-Q174 WeakPolarHBondContact O-CG 3.37Å; S170-Q174 PolarHBondContact O-N 3.06Å; Q174-V178 VanDerWaalsContact O-CG2 3.24Å; Q174-V178 WeakPolarHBondContact O-CG2 3.38Å; Q174-V178 PolarHBondContact O-N 3.15Å; Q174-V178 VanDerWaalsContact O-N 3.09Å
175	L	61.1	Low	54.9	Low	117 Å²	117	116.1 Å²	116.1	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-66.9	-39.9	174	-159.2	81.2	0	0	0	111.5	D171 K173 V178 L179	D171-L175 WeakPolarHBondContact O-CB 3.4Å; D171-L175 PolarHBondContact O-N 2.87Å; K173-L175 PolarHBondContact O-N 2.94Å; L175-V178 PolarHBondContact O-N 2.86Å; L175-L179 HydrophobicContact CG-CD1 4.37Å; L175-L179 WeakPolarHBondContact O-CB 3.41Å; L175-L179 VanDerWaalsContact O-CG 3.25Å; L175-L179 WeakPolarHBondContact O-CG 3.49Å; L175-L179 PolarHBondContact O-N 3.42Å
176	G	65.7	Low	55.1	Low	34 Å²	34	109.3 Å²	109.3	35%	0.351	59%	0.585	S	S	.	*	H	α-helix	trans	-61.2	-45.6	174.2	0	0	0	0	0	112.8	R172 K173 V178 L179 E180	R172-G176 PolarHBondContact O-N 2.94Å; K173-G176 PolarHBondContact O-N 2.74Å; G176-V178 VanDerWaalsContact C-N 3.33Å; G176-V178 PolarHBondContact O-N 3.07Å; G176-L179 PolarHBondContact O-N 3.4Å; G176-E180 WeakPolarHBondContact O-CB 3.48Å; G176-E180 PolarHBondContact O-N 3.36Å
177	D	66.8	Low	55.1	Low	90 Å²	90	106.8 Å²	106.8	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-66.7	-34.7	-179.9	-66.6	-21.2	0	0	0	111.8	K173 S181	K173-D177 WeakPolarHBondContact O-CB 3.26Å; K173-D177 PolarHBondContact O-N 3.43Å; D177-S181 WeakPolarHBondContact O-CB 3.28Å; D177-S181 PolarHBondContact O-N 3.35Å; D177-S181 VanDerWaalsContact O-N 3.07Å; D177-S181 PolarHBondContact O-OG 3.47Å
178	V	65.5	Low	55	Low	86 Å²	86	106.2 Å²	106.2	52%	0.521	59%	0.59	S	S	.	*	H	α-helix	trans	-69.4	-41.9	173.8	171.1	0	0	0	0	111.4	Q174 L175 G176 S181 L182	Q174-V178 VanDerWaalsContact O-CG2 3.24Å; Q174-V178 WeakPolarHBondContact O-CG2 3.38Å; Q174-V178 PolarHBondContact O-N 3.15Å; Q174-V178 VanDerWaalsContact O-N 3.09Å; L175-V178 PolarHBondContact O-N 2.86Å; G176-V178 VanDerWaalsContact C-N 3.33Å; G176-V178 PolarHBondContact O-N 3.07Å; V178-S181 PolarHBondContact O-N 3.34Å; V178-L182 HydrophobicContact CG1-CD1 4.19Å; V178-L182 PolarHBondContact O-N 3.1Å; V178-L182 VanDerWaalsContact O-N 3.1Å
179	L	65	Low	54.7	Low	106 Å²	106	107.1 Å²	107.1	56%	0.555	59%	0.591	S	S	*	*	H	α-helix	trans	-69	-36.8	177.7	-71	171.5	0	0	0	112.3	L175 G176 L182 K183	L175-L179 HydrophobicContact CG-CD1 4.37Å; L175-L179 WeakPolarHBondContact O-CB 3.41Å; L175-L179 VanDerWaalsContact O-CG 3.25Å; L175-L179 WeakPolarHBondContact O-CG 3.49Å; L175-L179 PolarHBondContact O-N 3.42Å; G176-L179 PolarHBondContact O-N 3.4Å; L179-L182 PolarHBondContact O-N 2.73Å; L179-K183 PolarHBondContact O-N 3.07Å
180	E	61.8	Low	54.4	Low	115 Å²	115	108.5 Å²	108.5	54%	0.537	60%	0.599	S	S	.	*	H	α-helix	trans	-66.4	-40.1	174.9	-159.1	69.1	-163	0	0	111	G176 L182 K183 I184	G176-E180 WeakPolarHBondContact O-CB 3.48Å; G176-E180 PolarHBondContact O-N 3.36Å; E180-L182 VanDerWaalsContact C-N 3.31Å; E180-L182 PolarHBondContact O-N 3.15Å; E180-K183 VanDerWaalsContact O-CB 3.28Å; E180-K183 WeakPolarHBondContact O-CB 3.34Å; E180-K183 PolarHBondContact O-N 3.21Å; E180-K183 VanDerWaalsContact O-N 3.12Å; E180-I184 PolarHBondContact O-N 3.48Å
181	S	58.7	Low	53.5	Low	71 Å²	71	112 Å²	112	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-63.4	-35	175	-58.7	0	0	0	0	112.7	D177 V178	D177-S181 WeakPolarHBondContact O-CB 3.28Å; D177-S181 PolarHBondContact O-N 3.35Å; D177-S181 VanDerWaalsContact O-N 3.07Å; D177-S181 PolarHBondContact O-OG 3.47Å; V178-S181 PolarHBondContact O-N 3.34Å
182	L	50.5	Low	53.1	Low	100 Å²	100	110.8 Å²	110.8	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-71.7	-29.9	173.9	-83.3	157.2	0	0	0	112.6	V178 L179 E180 I184 L185 S186	V178-L182 HydrophobicContact CG1-CD1 4.19Å; V178-L182 PolarHBondContact O-N 3.1Å; V178-L182 VanDerWaalsContact O-N 3.1Å; L179-L182 PolarHBondContact O-N 2.73Å; E180-L182 VanDerWaalsContact C-N 3.31Å; E180-L182 PolarHBondContact O-N 3.15Å; L182-I184 VanDerWaalsContact C-N 3.32Å; L182-I184 PolarHBondContact O-N 3.21Å; L182-L185 PolarHBondContact O-N 3.42Å; L182-S186 PolarHBondContact O-N 3.48Å
183	K	54.5	Low	52.3	Low	130 Å²	130	108.9 Å²	108.9	57%	0.565	63%	0.629	S	S	*	*	H	α-helix	trans	-66.3	-33.7	176.1	-141.3	176	-175	-178.7	0	112.4	L179 E180 L185 S186 S187	L179-K183 PolarHBondContact O-N 3.07Å; E180-K183 VanDerWaalsContact O-CB 3.28Å; E180-K183 WeakPolarHBondContact O-CB 3.34Å; E180-K183 PolarHBondContact O-N 3.21Å; E180-K183 VanDerWaalsContact O-N 3.12Å; K183-L185 VanDerWaalsContact C-N 3.31Å; K183-L185 PolarHBondContact O-N 3.49Å; K183-S186 PolarHBondContact O-N 2.86Å; K183-S187 PolarHBondContact O-N 3.12Å; K183-S187 PolarHBondContact O-OG 3.25Å
184	I	51	Low	51.6	Low	127 Å²	127	106.8 Å²	106.8	65%	0.651	63%	0.633	S	S	*	*	H	α-helix	trans	-64.8	-36.5	174.1	-60.1	171	0	0	0	110.8	E180 L182 S186 S187	E180-I184 PolarHBondContact O-N 3.48Å; L182-I184 VanDerWaalsContact C-N 3.32Å; L182-I184 PolarHBondContact O-N 3.21Å; I184-S186 VanDerWaalsContact C-N 3.34Å; I184-S187 PolarHBondContact O-N 3.22Å
185	L	46.2	Very low	50.8	Low	142 Å²	142	109.2 Å²	109.2	74%	0.743	65%	0.65	S	S	*	*	H	α-helix	trans	-74.3	-22.9	176.8	-66.6	172.5	0	0	0	113.3	L182 K183	L182-L185 PolarHBondContact O-N 3.42Å; K183-L185 VanDerWaalsContact C-N 3.31Å; K183-L185 PolarHBondContact O-N 3.49Å
186	S	46.6	Very low	49.8	Very low	104 Å²	104	106.5 Å²	106.5	73%	0.727	65%	0.65	S	S	*	*	H	α-helix	trans	-84.7	-8.9	177	-171	0	0	0	0	114.1	L182 K183 I184	L182-S186 PolarHBondContact O-N 3.48Å; K183-S186 PolarHBondContact O-N 2.86Å; I184-S186 VanDerWaalsContact C-N 3.34Å
187	S	41.7	Very low	48.7	Very low	101 Å²	101	111.4 Å²	111.4	71%	0.706	67%	0.673	S	S	*	*	S	Bend	trans	-111.2	11.3	-173	-46.2	0	0	0	0	113.6	K183 I184	K183-S187 PolarHBondContact O-N 3.12Å; K183-S187 PolarHBondContact O-OG 3.25Å; I184-S187 PolarHBondContact O-N 3.22Å
188	G	42.4	Very low	47.5	Very low	60 Å²	60	115 Å²	115	62%	0.619	69%	0.693	S	S	*	*			trans	-131.8	29.6	-165.5	0	0	0	0	0	116.3
189	S	42.1	Very low	47	Very low	110 Å²	110	118.6 Å²	118.6	77%	0.769	70%	0.704	S	S	*	*			trans	-116.8	61.2	172.1	-158	0	0	0	0	111.8
190	N	40	Very low	46	Very low	162 Å²	162	120.2 Å²	120.2	87%	0.866	71%	0.708	S	S	*	*			trans	-120	63.5	156.1	-78.3	-9	0	0	0	107.8
191	T	39.2	Very low	45.7	Very low	121 Å²	121	122.2 Å²	122.2	74%	0.742	72%	0.721	S	S	*	*			trans	-107.3	70.1	155	57	0	0	0	0	106.7	N193	T191-N193 PolarHBondContact O-N 3.3Å
192	A	41.8	Very low	44.8	Very low	82 Å²	82	126 Å²	126	68%	0.678	73%	0.729	S	S	*	*			trans	-61.8	112.3	156.1	0	0	0	0	0	106.4	S194	A192-S194 PolarHBondContact O-N 3.39Å
193	N	38	Very low	45	Very low	166 Å²	166	129.3 Å²	129.3	89%	0.888	74%	0.742	S	S	*	*			trans	-62.9	88.3	152.3	-68.4	-19.2	0	0	0	106.3	T191	T191-N193 PolarHBondContact O-N 3.3Å
194	S	44.8	Very low	44.7	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	75%	0.754	S	S	*	*			trans	-110.2	94	163.4	65.4	0	0	0	0	107.8	A192	A192-S194 PolarHBondContact O-N 3.39Å
195	D	43.6	Very low	44.3	Very low	167 Å²	167	133 Å²	133	89%	0.893	76%	0.762	S	S	*	*			trans	-47.5	144.7	152.2	-158.8	-0.2	0	0	0	109.3
196	G	39.9	Very low	44.1	Very low	61 Å²	61	130.8 Å²	130.8	63%	0.629	76%	0.758	S	S	*	*			trans	-60.3	140.6	-158.7	0	0	0	0	0	115.3
197	T	43.4	Very low	44	Very low	136 Å²	136	131 Å²	131	83%	0.834	77%	0.766	S	S	*	*				-167.3	129.2	124.5	30.8	0	0	0	0	108	E199	T197-E199 PolarHBondContact O-N 3.2Å
198	D	41	Very low	43.7	Very low	167 Å²	167	129.6 Å²	129.6	89%	0.893	77%	0.767	S	S	*	*			trans	-73.1	96.8	176.8	-165.3	22.7	0	0	0	108.7
199	E	55.9	Low	43.7	Very low	160 Å²	160	131.6 Å²	131.6	75%	0.748	78%	0.778	S	S	*	*			trans	-134.1	128.3	168.3	-77.2	-68.8	166.3	0	0	108.9	T197 I201	T197-E199 PolarHBondContact O-N 3.2Å; E199-I201 PolarHBondContact O-N 2.94Å
200	E	43.6	Very low	43.4	Very low	140 Å²	140	134.7 Å²	134.7	65%	0.654	79%	0.786	S	S	*	*			trans	-48.3	119.6	-174	-67.6	177.5	129.5	0	0	113.7	K202	E200-K202 PolarHBondContact O-N 3.43Å; E200-K202 WeakPolarHBondContact OE1-CE 3.46Å; E200-K202 IonicContact OE1-NZ 3.08Å; E200-K202 PolarHBondContact OE1-NZ 3.16Å; E200-K202 IonicContact OE2-NZ 3.34Å; E200-K202 PolarHBondContact OE2-NZ 3.36Å
201	I	54.5	Low	43.3	Very low	158 Å²	158	130.4 Å²	130.4	81%	0.81	78%	0.78	S	S	*	*			trans	-88.8	88.7	152.7	-57.9	176.7	0	0	0	107.2	E199 E203	E199-I201 PolarHBondContact O-N 2.94Å; I201-E203 HydrophobicContact CG2-CG 4.24Å; I201-E203 PolarHBondContact O-N 3.37Å
202	K	40.6	Very low	43.2	Very low	150 Å²	150	129.4 Å²	129.4	65%	0.652	78%	0.784	S	S	*	*			trans	-75.6	101.4	159.1	-81.4	178.8	177.8	120	0	108	E200 E204	E200-K202 PolarHBondContact O-N 3.43Å; E200-K202 WeakPolarHBondContact OE1-CE 3.46Å; E200-K202 IonicContact OE1-NZ 3.08Å; E200-K202 PolarHBondContact OE1-NZ 3.16Å; E200-K202 IonicContact OE2-NZ 3.34Å; E200-K202 PolarHBondContact OE2-NZ 3.36Å; K202-E204 VanDerWaalsContact C-N 3.35Å; K202-E204 PolarHBondContact O-N 3.24Å; K202-E204 VanDerWaalsContact O-N 3.16Å
203	E	55.4	Low	43.1	Very low	170 Å²	170	133 Å²	133	79%	0.794	79%	0.792	S	S	*	*			trans	-77.4	92.9	158.9	-81.2	-169.2	163.8	0	0	108.7	I201 I205	I201-E203 HydrophobicContact CG2-CG 4.24Å; I201-E203 PolarHBondContact O-N 3.37Å; E203-I205 PolarHBondContact O-N 3.43Å
204	E	46.7	Very low	43.1	Very low	174 Å²	174	129.7 Å²	129.7	81%	0.813	79%	0.788	S	S	*	*			trans	-78.4	95.9	166.4	-168.9	176	-156.3	0	0	108.5	K202 S206	K202-E204 VanDerWaalsContact C-N 3.35Å; K202-E204 PolarHBondContact O-N 3.24Å; K202-E204 VanDerWaalsContact O-N 3.16Å; E204-S206 PolarHBondContact O-N 3.33Å
205	I	44	Very low	42.6	Very low	161 Å²	161	134.1 Å²	134.1	83%	0.826	80%	0.797	S	S	*	*			trans	-89.5	87.5	163	-23.2	174.6	0	0	0	106.5	E203	E203-I205 PolarHBondContact O-N 3.43Å
206	S	41.2	Very low	42.3	Very low	95 Å²	95	131.5 Å²	131.5	66%	0.664	79%	0.791	S	S	*	*			trans	-151.8	97.1	170.1	-161.6	0	0	0	0	112.9	E204	E204-S206 PolarHBondContact O-N 3.33Å
207	A	43.6	Very low	42.1	Very low	109 Å²	109	133 Å²	133	90%	0.901	79%	0.793	S	S	*	*			trans	-135.9	110.2	135.4	0	0	0	0	0	103.9
208	G	36.6	Very low	42.1	Very low	70 Å²	70	134.3 Å²	134.3	72%	0.722	79%	0.794	S	S	*	*			cis	114.1	100.2	28.5	0	0	0	0	0	107.3
209	A	42	Very low	41.9	Very low	103 Å²	103	135.1 Å²	135.1	85%	0.851	79%	0.793	S	S	*	*			trans	142.2	104.3	141.2	0	0	0	0	0	112.9
210	D	35.4	Very low	41.5	Very low	175 Å²	175	132.7 Å²	132.7	94%	0.936	79%	0.794	S	S	*	*			trans	-56.8	143.1	156.7	-71.3	-52.6	0	0	0	111.2
211	G	37.7	Very low	41.3	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	80%	0.798	S	S	*	*			trans	155.8	82.2	161	0	0	0	0	0	116.8
212	A	37.1	Very low	40.6	Very low	100 Å²	100	134.6 Å²	134.6	83%	0.826	80%	0.804	S	S	*	*			trans	64	142.9	139.6	0	0	0	0	0	121.4
213	N	39.7	Very low	40.3	Very low	158 Å²	158	134.2 Å²	134.2	85%	0.845	80%	0.804	S	S	*	*			trans	81	96.7	165	-80.7	8.7	0	0	0	119.4	Q215	N213-Q215 PolarHBondContact O-N 3.39Å
214	A	37.8	Very low	39.2	Very low	97 Å²	97	134 Å²	134	80%	0.802	81%	0.808	S	S	*	*			trans	-44.9	123.6	146.7	0	0	0	0	0	112.6
215	Q	34.8	Very low	39.4	Very low	195 Å²	195	130.8 Å²	130.8	91%	0.911	80%	0.804	S	S	*	*			trans	-133.5	109.1	140.3	-78.9	-166.9	-60.1	0	0	108.8	N213	N213-Q215 PolarHBondContact O-N 3.39Å
216	S	37.1	Very low	39.3	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	82%	0.824	S	S	*	*			trans	-58.2	142	159.4	145.8	0	0	0	0	110.3
217	S	35.6	Very low	39.2	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	83%	0.832	S	S	*	*			trans	139.9	106.4	145.7	-57.7	0	0	0	0	110.8
218	N	43.5	Very low	38.9	Very low	162 Å²	162	140.3 Å²	140.3	87%	0.866	83%	0.829	S	S	*	*				173.8	106.8	115.7	-83.4	-10.5	0	0	0	110.9
219	E	36.3	Very low	39.1	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	84%	0.835	S	S	*	*			trans	-67.2	147.4	156.3	-52.2	176.5	167	0	0	109
220	S	48.1	Very low	38.9	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	83%	0.834	S	S	*	*			trans	169.5	99.2	148.1	-73	0	0	0	0	108.5
221	E	39	Very low	39.1	Very low	161 Å²	161	144.8 Å²	144.8	75%	0.752	83%	0.827	S	S	*	*				80.2	97.7	101.2	-83.2	-172.8	161.9	0	0	114.5	H223	E221-H223 PolarHBondContact O-N 2.82Å; E221-H223 IonicContact OE2-NE2 3.96Å
222	L	40.1	Very low	39.2	Very low	176 Å²	176	149.7 Å²	149.7	92%	0.921	83%	0.834	S	S	*	*			trans	-84.1	97.1	160.1	-74.4	169.5	0	0	0	108.5	L224	L222-L224 PolarHBondContact O-N 2.75Å
223	H	33.7	Very low	39.3	Very low	142 Å²	142	153.3 Å²	153.3	66%	0.657	83%	0.834	S	S	*	*			trans	-75.5	111.9	166.3	-95.7	-109.1	0	0	0	109.9	E221	E221-H223 PolarHBondContact O-N 2.82Å; E221-H223 IonicContact OE2-NE2 3.96Å
224	L	33.2	Very low	39.3	Very low	166 Å²	166	152.9 Å²	152.9	87%	0.869	83%	0.833	S	S	*	*			trans	-110.3	112.6	156.9	-72	171.9	0	0	0	107.1	L222	L222-L224 PolarHBondContact O-N 2.75Å
225	S	49.8	Very low	39.4	Very low	107 Å²	107	157.6 Å²	157.6	75%	0.748	84%	0.836	S	S	*	*			trans	-90.3	140.3	175.6	-51.4	0	0	0	0	109.3
226	F	42	Very low	39.9	Very low	283 Å²	283	154.2 Å²	154.2	100%	1.241	83%	0.829	S	S	*	*			trans	-67.9	0	178	-68	-86.6	0	0	0	113.4

Retrieved 226 of 226 residues in 419.4 ms (Link to these results)

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