A0A077Z233_TRITR Loading...

Cisplatin resistance associated overexpressed

AlphaFold DB , UniProt , Accession A0A077Z233, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 266 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	54.4	Low	76.8	Confident	207 Å²	207	101.4 Å²	101.4	100%	1.02	57%	0.57	S	S	*	*				0	-17.9	0	-65.9	-158.1	-171.9	0	0	114.5	T4	M1-T4 PolarHBondContact O-OG1 3.22Å; M1-T4 VanDerWaalsContact O-OG1 3.1Å
2	A	68.1	Low	77	Confident	66 Å²	66	97.1 Å²	97.1	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-72.1	-43.1	176.5	0	0	0	0	0	113.1	T4 K5 E6	A2-T4 VanDerWaalsContact C-N 3.29Å; A2-T4 PolarHBondContact O-N 3.21Å; A2-K5 WeakPolarHBondContact O-CB 3.44Å; A2-K5 PolarHBondContact O-N 3.42Å; A2-E6 PolarHBondContact O-N 3.17Å; A2-E6 VanDerWaalsContact O-N 3.12Å
3	A	70.9	Confident	76.9	Confident	73 Å²	73	99.2 Å²	99.2	60%	0.603	55%	0.548	S	S	*	.	H	α-helix	trans	-58.6	-35.5	-178.6	0	0	0	0	0	113.9	K5 L7	A3-K5 VanDerWaalsContact C-N 3.32Å; A3-K5 PolarHBondContact O-N 3.29Å; A3-L7 WeakPolarHBondContact O-CB 3.45Å; A3-L7 PolarHBondContact O-N 2.97Å
4	T	79.4	Confident	76.5	Confident	100 Å²	100	101.6 Å²	101.6	61%	0.613	56%	0.558	S	S	*	*	H	α-helix	trans	-71	-28.2	176.5	52.3	0	0	0	0	112.5	M1 A2 A8	M1-T4 PolarHBondContact O-OG1 3.22Å; M1-T4 VanDerWaalsContact O-OG1 3.1Å; A2-T4 VanDerWaalsContact C-N 3.29Å; A2-T4 PolarHBondContact O-N 3.21Å; T4-A8 WeakPolarHBondContact O-CB 3.44Å; T4-A8 PolarHBondContact O-N 3.2Å
5	K	82.4	Confident	75.8	Confident	160 Å²	160	103.5 Å²	103.5	70%	0.696	56%	0.564	S	S	*	*	H	α-helix	trans	-74.5	-41.6	175.2	-70.1	-175.9	178	-177.7	0	111.9	A2 A3 A8 S9	A2-K5 WeakPolarHBondContact O-CB 3.44Å; A2-K5 PolarHBondContact O-N 3.42Å; A3-K5 VanDerWaalsContact C-N 3.32Å; A3-K5 PolarHBondContact O-N 3.29Å; K5-A8 PolarHBondContact O-N 3.03Å; K5-S9 WeakPolarHBondContact O-CB 3.44Å; K5-S9 PolarHBondContact O-N 2.91Å
6	E	84.7	Confident	75.2	Confident	142 Å²	142	98.2 Å²	98.2	66%	0.664	54%	0.54	S	S	*	.	H	α-helix	trans	-64	-44.7	175.3	-70.3	175.5	-176.3	0	0	111.1	A2 A8 S9 L10	A2-E6 PolarHBondContact O-N 3.17Å; A2-E6 VanDerWaalsContact O-N 3.12Å; E6-A8 VanDerWaalsContact C-N 3.32Å; E6-A8 PolarHBondContact O-N 3.02Å; E6-S9 WeakPolarHBondContact O-CB 3.5Å; E6-S9 PolarHBondContact O-N 3.06Å; E6-L10 PolarHBondContact O-N 3.17Å
7	L	83.3	Confident	74.7	Confident	109 Å²	109	101.4 Å²	101.4	57%	0.571	54%	0.543	S	S	*	.	H	α-helix	trans	-64.2	-38.2	175.9	-148.3	99.8	0	0	0	111.8	A3 L10 L11	A3-L7 WeakPolarHBondContact O-CB 3.45Å; A3-L7 PolarHBondContact O-N 2.97Å; L7-L10 PolarHBondContact O-N 3.38Å; L7-L11 HydrophobicContact CD2-CD1 3.98Å; L7-L11 HydrophobicContact CG-CD1 4.33Å; L7-L11 WeakPolarHBondContact O-CB 3.43Å; L7-L11 WeakPolarHBondContact O-CD1 3.43Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 2.89Å
8	A	79	Confident	73.7	Confident	33 Å²	33	99.2 Å²	99.2	27%	0.273	54%	0.536	S	S	.	.	H	α-helix	trans	-64.1	-42.3	173.7	0	0	0	0	0	111.7	T4 K5 E6 L11 D12 R19	T4-A8 WeakPolarHBondContact O-CB 3.44Å; T4-A8 PolarHBondContact O-N 3.2Å; K5-A8 PolarHBondContact O-N 3.03Å; E6-A8 VanDerWaalsContact C-N 3.32Å; E6-A8 PolarHBondContact O-N 3.02Å; A8-L11 PolarHBondContact O-N 3.02Å; A8-D12 WeakPolarHBondContact O-CB 3.42Å; A8-D12 PolarHBondContact O-N 3.18Å; A8-R19 PolarHBondContact O-NH2 3.34Å
9	S	82.9	Confident	73.1	Confident	62 Å²	62	98.5 Å²	98.5	43%	0.434	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-46.3	175	-167.2	0	0	0	0	111.5	K5 E6 L11 D12 E13	K5-S9 WeakPolarHBondContact O-CB 3.44Å; K5-S9 PolarHBondContact O-N 2.91Å; E6-S9 WeakPolarHBondContact O-CB 3.5Å; E6-S9 PolarHBondContact O-N 3.06Å; S9-L11 PolarHBondContact O-N 3.4Å; S9-D12 PolarHBondContact O-N 2.91Å; S9-E13 WeakPolarHBondContact O-CG 3.23Å; S9-E13 PolarHBondContact O-N 3.4Å
10	L	83.7	Confident	72.9	Confident	104 Å²	104	100.3 Å²	100.3	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-41	177.3	-173.8	72.3	0	0	0	112	E6 L7 E13 L14	E6-L10 PolarHBondContact O-N 3.17Å; L7-L10 PolarHBondContact O-N 3.38Å; L10-E13 WeakPolarHBondContact O-CB 3.27Å; L10-E13 PolarHBondContact O-N 3.46Å; L10-L14 WeakPolarHBondContact O-CB 3.35Å; L10-L14 PolarHBondContact O-N 2.93Å
11	L	76	Confident	72.5	Confident	59 Å²	59	97.7 Å²	97.7	31%	0.309	53%	0.527	S	S	.	.	H	α-helix	trans	-70.3	-32.4	177.2	-73.8	159.6	0	0	0	112.2	L7 A8 S9 E13 L14 M15	L7-L11 HydrophobicContact CD2-CD1 3.98Å; L7-L11 HydrophobicContact CG-CD1 4.33Å; L7-L11 WeakPolarHBondContact O-CB 3.43Å; L7-L11 WeakPolarHBondContact O-CD1 3.43Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 2.89Å; A8-L11 PolarHBondContact O-N 3.02Å; S9-L11 PolarHBondContact O-N 3.4Å; L11-E13 VanDerWaalsContact C-N 3.33Å; L11-L14 PolarHBondContact O-N 3.11Å; L11-M15 WeakPolarHBondContact O-CA 3.27Å; L11-M15 VanDerWaalsContact O-CB 3.31Å; L11-M15 WeakPolarHBondContact O-CB 3.5Å; L11-M15 PolarHBondContact O-N 3.49Å
12	D	79	Confident	72.6	Confident	50 Å²	50	93 Å²	93	27%	0.267	51%	0.506	S	S	.	.	H	α-helix	trans	-70.7	-32.3	173.2	-67	-5.9	0	0	0	111.1	A8 S9 G16 R17 R19	A8-D12 WeakPolarHBondContact O-CB 3.42Å; A8-D12 PolarHBondContact O-N 3.18Å; S9-D12 PolarHBondContact O-N 2.91Å; D12-G16 CarbonylContact O-C 3.37Å; D12-G16 WeakPolarHBondContact O-CA 3.35Å; D12-G16 PolarHBondContact O-N 2.99Å; D12-R17 HydrophobicContact CB-CG 3.98Å; D12-R19 IonicContact OD1-CZ 3.36Å; D12-R19 IonicContact OD1-NE 2.83Å; D12-R19 PolarHBondContact OD1-NE 3.24Å; D12-R19 IonicContact OD1-NH2 3.06Å; D12-R19 PolarHBondContact OD1-NH2 3.09Å
13	E	76.3	Confident	72.1	Confident	124 Å²	124	95.4 Å²	95.4	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-67.8	-39	169.9	-75.9	176.3	-169.8	0	0	112.3	S9 L10 L11 R59	S9-E13 WeakPolarHBondContact O-CG 3.23Å; S9-E13 PolarHBondContact O-N 3.4Å; L10-E13 WeakPolarHBondContact O-CB 3.27Å; L10-E13 PolarHBondContact O-N 3.46Å; L11-E13 VanDerWaalsContact C-N 3.33Å; E13-R59 PolarHBondContact O-NH1 2.86Å; E13-R59 PolarHBondContact O-NH2 3.36Å
14	L	70.3	Confident	71.4	Confident	133 Å²	133	98.5 Å²	98.5	70%	0.696	53%	0.527	S	S	*	.	H	α-helix	trans	-81.6	-47.2	-177.6	-152.4	83.6	0	0	0	112.6	L10 L11	L10-L14 WeakPolarHBondContact O-CB 3.35Å; L10-L14 PolarHBondContact O-N 2.93Å; L11-L14 PolarHBondContact O-N 3.11Å
15	M	66.7	Low	70	Confident	131 Å²	131	99.9 Å²	99.9	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-109.4	-9.7	-167.3	-56.1	-65	-75.6	0	0	114.1	L11 R19	L11-M15 WeakPolarHBondContact O-CA 3.27Å; L11-M15 VanDerWaalsContact O-CB 3.31Å; L11-M15 WeakPolarHBondContact O-CB 3.5Å; L11-M15 PolarHBondContact O-N 3.49Å; M15-R19 HydrophobicContact CB-CB 4.13Å
16	G	65.6	Low	68.3	Low	18 Å²	18	94.6 Å²	94.6	19%	0.186	51%	0.513	C	S	.	.			trans	89.1	149.8	-174.4	0	0	0	0	0	113.4	D12 S18 R19	D12-G16 CarbonylContact O-C 3.37Å; D12-G16 WeakPolarHBondContact O-CA 3.35Å; D12-G16 PolarHBondContact O-N 2.99Å; G16-S18 VanDerWaalsContact C-N 3.26Å; G16-S18 PolarHBondContact O-N 3.37Å; G16-R19 VanDerWaalsContact O-CB 3.31Å; G16-R19 WeakPolarHBondContact O-CB 3.48Å; G16-R19 WeakPolarHBondContact O-CG 3.25Å; G16-R19 PolarHBondContact O-N 3.16Å; G16-R19 VanDerWaalsContact O-N 3.16Å
17	R	68	Low	66.4	Low	153 Å²	153	90.3 Å²	90.3	58%	0.577	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.1	-175.8	-68	160.5	179.5	175.8	-4.3	113.6	D12 R19 D57	D12-R17 HydrophobicContact CB-CG 3.98Å; R17-R19 VanDerWaalsContact C-N 3.28Å; R17-R19 PolarHBondContact O-N 3.38Å; R17-D57 WeakPolarHBondContact CD-OD1 3.25Å; R17-D57 IonicContact NH1-OD1 3.19Å; R17-D57 PolarHBondContact NH1-OD1 3.43Å
18	S	55.6	Low	64.5	Low	62 Å²	62	93.8 Å²	93.8	43%	0.434	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	18.4	177	61.3	0	0	0	0	113.5	G16 N20 A21	G16-S18 VanDerWaalsContact C-N 3.26Å; G16-S18 PolarHBondContact O-N 3.37Å; S18-N20 PolarHBondContact O-N 2.95Å; S18-N20 VanDerWaalsContact O-N 3.13Å; S18-A21 WeakPolarHBondContact O-CB 3.38Å; S18-A21 PolarHBondContact O-N 3.13Å
19	R	63.6	Low	62.6	Low	86 Å²	86	97.3 Å²	97.3	33%	0.325	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.5	179.5	61.4	-176.8	167.1	130.1	-5.5	114.7	A8 D12 M15 G16 R17	A8-R19 PolarHBondContact O-NH2 3.34Å; D12-R19 IonicContact OD1-CZ 3.36Å; D12-R19 IonicContact OD1-NE 2.83Å; D12-R19 PolarHBondContact OD1-NE 3.24Å; D12-R19 IonicContact OD1-NH2 3.06Å; D12-R19 PolarHBondContact OD1-NH2 3.09Å; M15-R19 HydrophobicContact CB-CB 4.13Å; G16-R19 VanDerWaalsContact O-CB 3.31Å; G16-R19 WeakPolarHBondContact O-CB 3.48Å; G16-R19 WeakPolarHBondContact O-CG 3.25Å; G16-R19 PolarHBondContact O-N 3.16Å; G16-R19 VanDerWaalsContact O-N 3.16Å; R17-R19 VanDerWaalsContact C-N 3.28Å; R17-R19 PolarHBondContact O-N 3.38Å
20	N	67.7	Low	60.8	Low	134 Å²	134	99.3 Å²	99.3	72%	0.717	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.5	179.9	-61.1	-28.4	0	0	0	113.2	S18	S18-N20 PolarHBondContact O-N 2.95Å; S18-N20 VanDerWaalsContact O-N 3.13Å
21	A	64.9	Low	58.6	Low	45 Å²	45	95.4 Å²	95.4	37%	0.372	50%	0.502	S	S	.	.			trans	-77.1	133.6	-179.1	0	0	0	0	0	110.6	S18	S18-A21 WeakPolarHBondContact O-CB 3.38Å; S18-A21 PolarHBondContact O-N 3.13Å
22	L	56.9	Low	56.9	Low	110 Å²	110	93.8 Å²	93.8	58%	0.576	49%	0.493	S	S	*	.			trans	-68.4	152.7	176.2	-71.1	164	0	0	0	110.7	T24 E25 A26	L22-T24 PolarHBondContact O-N 3.47Å; L22-T24 VanDerWaalsContact O-N 3.08Å; L22-E25 HydrophobicContact CB-CG 4.34Å; L22-E25 CarbonylContact O-C 3.58Å; L22-E25 WeakPolarHBondContact O-CA 3.27Å; L22-E25 WeakPolarHBondContact O-CB 3.42Å; L22-E25 PolarHBondContact O-N 3.47Å; L22-A26 PolarHBondContact O-N 3.42Å; L22-A26 VanDerWaalsContact O-N 3.15Å
23	P	56.2	Low	55.1	Low	116 Å²	116	91.6 Å²	91.6	75%	0.753	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.4	178.6	-26.2	34.4	0	0	0	114.5	A26	P23-A26 WeakPolarHBondContact O-CB 3.41Å
24	T	56.6	Low	53.3	Low	138 Å²	138	88.7 Å²	88.7	85%	0.847	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-28.1	174.9	-44.1	0	0	0	0	112.5	L22	L22-T24 PolarHBondContact O-N 3.47Å; L22-T24 VanDerWaalsContact O-N 3.08Å
25	E	50	Low	52	Low	129 Å²	129	83.9 Å²	83.9	60%	0.603	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.1	178.3	-62.8	-174.9	158.5	0	0	112.8	L22 P27	L22-E25 HydrophobicContact CB-CG 4.34Å; L22-E25 CarbonylContact O-C 3.58Å; L22-E25 WeakPolarHBondContact O-CA 3.27Å; L22-E25 WeakPolarHBondContact O-CB 3.42Å; L22-E25 PolarHBondContact O-N 3.47Å; E25-P27 WeakPolarHBondContact O-CD 3.45Å
26	A	47.2	Very low	50.7	Low	49 Å²	49	79.2 Å²	79.2	41%	0.405	43%	0.43	S	S	.	.			trans	-55.8	111.3	175.7	0	0	0	0	0	109.1	L22 P23 K28	L22-A26 PolarHBondContact O-N 3.42Å; L22-A26 VanDerWaalsContact O-N 3.15Å; P23-A26 WeakPolarHBondContact O-CB 3.41Å; A26-K28 PolarHBondContact O-N 3.27Å; A26-K28 VanDerWaalsContact O-N 3.15Å
27	P	44.2	Very low	49.7	Very low	52 Å²	52	79.6 Å²	79.6	34%	0.338	43%	0.427	S	S	.	.			trans	-71.2	117.9	-170.4	22.4	-25.3	0	0	0	109.1	E25 D29 M55	E25-P27 WeakPolarHBondContact O-CD 3.45Å; P27-D29 VanDerWaalsContact C-N 3.32Å; P27-D29 PolarHBondContact O-N 2.95Å; P27-M55 HydrophobicContact CB-CG 4.02Å; P27-M55 HydrophobicContact CG-CB 4.33Å; P27-M55 HydrophobicContact CG-CG 3.46Å; P27-M55 VanDerWaalsContact CG-CG 3.46Å; P27-M55 HydrophobicContact CG-SD 3.56Å; P27-M55 VanDerWaalsContact CG-SD 3.56Å
28	K	44.2	Very low	48.5	Very low	181 Å²	181	77.4 Å²	77.4	79%	0.787	43%	0.431	S	S	*	.			trans	-77.7	-11	-170.5	-68	178.2	-179.2	174.2	0	114.4	A26	A26-K28 PolarHBondContact O-N 3.27Å; A26-K28 VanDerWaalsContact O-N 3.15Å
29	D	38.8	Very low	47.7	Very low	107 Å²	107	77.9 Å²	77.9	57%	0.572	43%	0.429	S	S	*	.			trans	-120.7	104.3	-171.2	-65.3	-22.3	0	0	0	113.5	P27 K54	P27-D29 VanDerWaalsContact C-N 3.32Å; P27-D29 PolarHBondContact O-N 2.95Å; D29-K54 HydrophobicContact CB-CD 4.42Å; D29-K54 HydrophobicContact CB-CG 4.42Å
30	F	45.2	Very low	46.7	Very low	105 Å²	105	75 Å²	75	46%	0.461	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-81	143.7	179	-65.5	-88.6	0	0	0	112.2	M60 Y75	F30-M60 HydrophobicContact CE1-CE 4.07Å; F30-Y75 HydrophobicContact CB-CE1 4.11Å
31	F	38.3	Very low	45.5	Very low	22 Å²	22	72.9 Å²	72.9	10%	0.096	41%	0.414	C	S	.	.			trans	-147.2	130	171.1	-152.3	-126	0	0	0	114	S33 K54 D78 F79 F82	F31-S33 WeakPolarHBondContact CD1-OG 3.43Å; F31-S33 PolarHBondContact O-N 3.37Å; F31-K54 HydrophobicContact CB-CD 3.78Å; F31-K54 HydrophobicContact CG-CD 4.3Å; F31-D78 HydrophobicContact CE2-CB 3.88Å; F31-F79 AromaticContact CD1-CD2 3.99Å; F31-F79 HydrophobicContact CD1-CD2 3.99Å; F31-F79 HydrophobicContact CE1-CB 4.25Å; F31-F79 AromaticContact CE1-CD2 3.34Å; F31-F79 HydrophobicContact CE1-CD2 3.34Å; F31-F79 HydrophobicContact CE1-CE2 4.12Å; F31-F79 HydrophobicContact CE1-CG 4.23Å; F31-F79 VanDerWaalsContact CE2-CA 3.48Å; F31-F79 HydrophobicContact CE2-CB 3.91Å; F31-F79 VanDerWaalsContact CE2-N 3.34Å; F31-F79 HydrophobicContact CZ-CB 3.81Å; F31-F79 AromaticContact CZ-CD2 3.71Å; F31-F79 HydrophobicContact CZ-CD2 3.71Å; F31-F79 HydrophobicContact CZ-CG 4.25Å; F31-F82 HydrophobicContact CE1-CB 4.17Å; F31-F82 AromaticContact CE1-CD1 3.75Å; F31-F82 HydrophobicContact CE1-CD1 3.75Å; F31-F82 HydrophobicContact CE1-CE1 4.37Å; F31-F82 HydrophobicContact CE1-CG 4.06Å; F31-F82 HydrophobicContact CZ-CB 3.65Å; F31-F82 HydrophobicContact CZ-CD1 4.12Å; F31-F82 HydrophobicContact CZ-CG 4.01Å
32	L	40	Very low	44	Very low	24 Å²	24	78.2 Å²	78.2	13%	0.126	43%	0.432	C	S	.	.			trans	-74.8	19.6	-178.6	-87.8	116.9	0	0	0	115.1	T34 R61 Y64 K65 Y75	L32-T34 PolarHBondContact O-N 3.48Å; L32-T34 VanDerWaalsContact O-N 3.11Å; L32-R61 VanDerWaalsContact C-NE 3.29Å; L32-R61 HydrophobicContact CB-CG 4.31Å; L32-R61 HydrophobicContact CD2-CG 3.36Å; L32-R61 HydrophobicContact CG-CG 3.9Å; L32-R61 WeakPolarHBondContact O-CD 3.48Å; L32-R61 PolarHBondContact O-NE 2.91Å; L32-Y64 HydrophobicContact CD1-CD1 3.34Å; L32-Y64 HydrophobicContact CD1-CE1 3.22Å; L32-Y64 HydrophobicContact CD1-CG 4.02Å; L32-Y64 HydrophobicContact CD2-CD1 3.38Å; L32-Y64 HydrophobicContact CD2-CE1 3.86Å; L32-Y64 HydrophobicContact CD2-CG 4.31Å; L32-Y64 HydrophobicContact CG-CD1 3.86Å; L32-Y64 HydrophobicContact CG-CE1 4.14Å; L32-K65 HydrophobicContact CD2-CG 4.34Å; L32-Y75 HydrophobicContact CD1-CD2 4.21Å; L32-Y75 HydrophobicContact CD1-CG 4.2Å
33	S	41.2	Very low	43.1	Very low	4 Å²	4	75.6 Å²	75.6	3%	0.028	42%	0.42	C	S	.	.			trans	-81	97	178.6	69.3	0	0	0	0	111.7	F31 H56 R61	F31-S33 WeakPolarHBondContact CD1-OG 3.43Å; F31-S33 PolarHBondContact O-N 3.37Å; S33-H56 PolarHBondContact O-ND1 3.19Å; S33-H56 PolarHBondContact OG-CE1 3.46Å; S33-H56 PolarHBondContact OG-ND1 2.92Å; S33-H56 VanDerWaalsContact OG-ND1 3.17Å; S33-R61 PolarHBondContact O-NH2 2.9Å
34	T	38.3	Very low	42.6	Very low	63 Å²	63	82.4 Å²	82.4	39%	0.387	43%	0.431	S	S	.	.			trans	-83.9	9.4	158.1	-8.2	0	0	0	0	111.6	L32 A36 E58 R61	L32-T34 PolarHBondContact O-N 3.48Å; L32-T34 VanDerWaalsContact O-N 3.11Å; T34-A36 PolarHBondContact O-N 2.98Å; T34-E58 HydrophobicContact CG2-CG 3.75Å; T34-E58 WeakPolarHBondContact CG2-OE1 3.48Å; T34-R61 VanDerWaalsContact CA-NH2 3.29Å; T34-R61 VanDerWaalsContact N-NE 3.18Å; T34-R61 VanDerWaalsContact N-NH2 3.11Å; T34-R61 WeakPolarHBondContact OG1-CD 3.42Å; T34-R61 PolarHBondContact OG1-NE 3.42Å; T34-R61 PolarHBondContact OG1-NH1 2.88Å
35	I	42	Very low	41.9	Very low	33 Å²	33	81.1 Å²	81.1	17%	0.169	41%	0.413	C	S	.	.	S	Bend	trans	-69.8	95.4	165.9	-57.7	179.3	0	0	0	104.3	L37 F79 L83 I223	I35-L37 VanDerWaalsContact C-N 3.28Å; I35-L37 PolarHBondContact O-N 3.37Å; I35-F79 HydrophobicContact CD1-CE2 4.4Å; I35-F79 HydrophobicContact CD1-CZ 3.67Å; I35-F79 HydrophobicContact CG1-CZ 3.98Å; I35-L83 HydrophobicContact CD1-CD1 4.45Å; I35-L83 HydrophobicContact CD1-CD2 3.63Å; I35-I223 HydrophobicContact CD1-CG1 4.14Å
36	A	41.1	Very low	41.5	Very low	33 Å²	33	80 Å²	80	27%	0.273	42%	0.417	S	S	.	.			trans	-38.1	83.9	-174.4	0	0	0	0	0	113	T34 T38 N39	T34-A36 PolarHBondContact O-N 2.98Å; A36-T38 PolarHBondContact O-N 3.23Å; A36-N39 HydrophobicContact CB-CB 3.89Å; A36-N39 WeakPolarHBondContact CB-ND2 3.49Å; A36-N39 WeakPolarHBondContact O-CB 3.26Å; A36-N39 PolarHBondContact O-N 3.04Å
37	L	44.4	Very low	41.5	Very low	25 Å²	25	84.1 Å²	84.1	13%	0.131	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-64.5	-24.2	167.7	-73.2	164.2	0	0	0	109.6	I35 N39 F40 V49 C52 H56	I35-L37 VanDerWaalsContact C-N 3.28Å; I35-L37 PolarHBondContact O-N 3.37Å; L37-N39 PolarHBondContact O-N 2.98Å; L37-F40 PolarHBondContact O-N 2.99Å; L37-V49 HydrophobicContact CB-CG1 3.91Å; L37-V49 HydrophobicContact CD2-CB 4.38Å; L37-V49 HydrophobicContact CD2-CG1 3.8Å; L37-V49 HydrophobicContact CD2-CG2 3.59Å; L37-V49 HydrophobicContact CG-CG1 4.45Å; L37-V49 WeakPolarHBondContact O-CG1 3.45Å; L37-C52 HydrophobicContact CD1-CB 4.35Å; L37-H56 VanDerWaalsContact CD1-CE1 3.48Å; L37-H56 WeakPolarHBondContact CD1-CE1 3.3Å; L37-H56 VanDerWaalsContact CD1-NE2 3.3Å; L37-H56 WeakPolarHBondContact CD1-NE2 3.27Å
38	T	41.7	Very low	41.5	Very low	107 Å²	107	86.4 Å²	86.4	66%	0.656	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-58.4	-25	167.8	47.1	0	0	0	0	113.5	A36 S41	A36-T38 PolarHBondContact O-N 3.23Å; T38-S41 PolarHBondContact O-OG 3.41Å
39	N	39.3	Very low	41.7	Very low	73 Å²	73	79.4 Å²	79.4	39%	0.39	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-83.4	-12.1	-178.3	-78.8	-22.1	0	0	0	114.1	A36 L37 K215	A36-N39 HydrophobicContact CB-CB 3.89Å; A36-N39 WeakPolarHBondContact CB-ND2 3.49Å; A36-N39 WeakPolarHBondContact O-CB 3.26Å; A36-N39 PolarHBondContact O-N 3.04Å; L37-N39 PolarHBondContact O-N 2.98Å; N39-K215 HydrophobicContact CB-CB 4.39Å; N39-K215 HydrophobicContact CB-CD 3.9Å; N39-K215 HydrophobicContact CB-CG 4.38Å; N39-K215 WeakPolarHBondContact O-CD 3.3Å
40	F	43	Very low	42.1	Very low	26 Å²	26	84.5 Å²	84.5	11%	0.114	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-90.7	-7.5	-178.4	-79.6	-88.9	0	0	0	114.7	L37 Q42 T43 V49 Q216 F220	L37-F40 PolarHBondContact O-N 2.99Å; F40-Q42 PolarHBondContact O-N 3.49Å; F40-Q42 VanDerWaalsContact O-N 3.1Å; F40-T43 PolarHBondContact O-N 3.26Å; F40-T43 PolarHBondContact O-OG1 2.87Å; F40-V49 HydrophobicContact CB-CB 3.72Å; F40-V49 HydrophobicContact CB-CG1 4.21Å; F40-V49 HydrophobicContact CB-CG2 3.56Å; F40-V49 HydrophobicContact CD2-CG2 4.22Å; F40-V49 HydrophobicContact CG-CG2 3.87Å; F40-Q216 HydrophobicContact CD1-CG 4.32Å; F40-Q216 HydrophobicContact CE1-CB 4.32Å; F40-Q216 HydrophobicContact CE1-CG 3.98Å; F40-F220 HydrophobicContact CE1-CE2 4.27Å
41	S	41.4	Very low	42.4	Very low	88 Å²	88	86.8 Å²	86.8	62%	0.615	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.4	-171	60.1	0	0	0	0	115.4	T38	T38-S41 PolarHBondContact O-OG 3.41Å
42	Q	33.3	Very low	43.6	Very low	158 Å²	158	88.5 Å²	88.5	74%	0.738	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-0.9	-176.2	-68.8	-179.6	7.2	0	0	114.5	F40 R44	F40-Q42 PolarHBondContact O-N 3.49Å; F40-Q42 VanDerWaalsContact O-N 3.1Å; Q42-R44 PolarHBondContact O-N 3.09Å
43	T	38.4	Very low	44.8	Very low	54 Å²	54	94.6 Å²	94.6	33%	0.331	48%	0.475	S	S	.	.			trans	-88.8	113	-177.6	64.1	0	0	0	0	111	F40 K45 Q216	F40-T43 PolarHBondContact O-N 3.26Å; F40-T43 PolarHBondContact O-OG1 2.87Å; T43-K45 PolarHBondContact O-N 3.34Å; T43-Q216 VanDerWaalsContact CB-NE2 3.26Å; T43-Q216 HydrophobicContact CG2-CG 3.98Å; T43-Q216 VanDerWaalsContact CG2-NE2 3.32Å; T43-Q216 PolarHBondContact OG1-NE2 3.45Å
44	R	45.5	Very low	45.9	Very low	260 Å²	260	97.7 Å²	97.7	98%	0.981	49%	0.488	S	S	*	.			trans	-66.1	26.1	175.9	-70	-175.4	175.2	171.6	-1.2	114.3	Q42	Q42-R44 PolarHBondContact O-N 3.09Å
45	K	42.1	Very low	47.4	Very low	110 Å²	110	98.4 Å²	98.4	48%	0.478	49%	0.488	S	S	.	.	S	Bend	trans	-102.7	132.5	172.3	-68.6	-173.9	-178.4	174.2	0	108.8	T43	T43-K45 PolarHBondContact O-N 3.34Å
46	P	41.8	Very low	48.8	Very low	106 Å²	106	99.2 Å²	99.2	69%	0.688	49%	0.491	S	S	*	.			trans	-78.7	156.7	-168.2	31.7	-33	0	0	0	112.6
47	I	46.6	Very low	50.6	Low	136 Å²	136	99 Å²	99	70%	0.697	49%	0.486	S	S	*	.	S	Bend	trans	99	-50.1	164.7	-71.9	159.3	0	0	0	119.2	V49	I47-V49 PolarHBondContact O-N 3.4Å
48	W	45.9	Very low	52.1	Low	99 Å²	99	103 Å²	103	38%	0.375	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-31.5	-157.9	-58.1	103	0	0	0	116.8	L86 E89 M90	W48-L86 HydrophobicContact CE3-CD2 3.79Å; W48-L86 HydrophobicContact CZ3-CD2 4.36Å; W48-E89 HydrophobicContact CH2-CB 3.48Å; W48-E89 VanDerWaalsContact CH2-CB 3.48Å; W48-E89 HydrophobicContact CH2-CG 3.49Å; W48-E89 VanDerWaalsContact CH2-CG 3.49Å; W48-E89 WeakPolarHBondContact CH2-OE1 3.44Å; W48-E89 WeakPolarHBondContact CH2-OE2 3.46Å; W48-E89 HydrophobicContact CZ2-CB 3.87Å; W48-E89 HydrophobicContact CZ2-CG 4.33Å; W48-E89 HydrophobicContact CZ3-CB 4.1Å; W48-E89 HydrophobicContact CZ3-CG 4.02Å; W48-E89 WeakPolarHBondContact CZ3-OE1 3.43Å; W48-E89 WeakPolarHBondContact CZ3-OE2 3.18Å; W48-M90 HydrophobicContact CD2-CE 4Å; W48-M90 HydrophobicContact CG-CE 4.27Å; W48-M90 HydrophobicContact CZ2-CE 4.01Å
49	V	48.2	Very low	53.9	Low	34 Å²	34	104.7 Å²	104.7	21%	0.206	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146	53.2	-175.7	-163.4	0	0	0	0	110	L37 F40 I47	L37-V49 HydrophobicContact CB-CG1 3.91Å; L37-V49 HydrophobicContact CD2-CB 4.38Å; L37-V49 HydrophobicContact CD2-CG1 3.8Å; L37-V49 HydrophobicContact CD2-CG2 3.59Å; L37-V49 HydrophobicContact CG-CG1 4.45Å; L37-V49 WeakPolarHBondContact O-CG1 3.45Å; F40-V49 HydrophobicContact CB-CB 3.72Å; F40-V49 HydrophobicContact CB-CG1 4.21Å; F40-V49 HydrophobicContact CB-CG2 3.56Å; F40-V49 HydrophobicContact CD2-CG2 4.22Å; F40-V49 HydrophobicContact CG-CG2 3.87Å; I47-V49 PolarHBondContact O-N 3.4Å
50	R	45.6	Very low	55.6	Low	214 Å²	214	106.2 Å²	106.2	81%	0.808	50%	0.504	S	S	*	.	S	Bend	trans	-71.1	-48.8	172.5	-168.9	113.1	128.8	161.9	-2.5	109.8
51	H	53	Low	57.2	Low	154 Å²	154	105.8 Å²	105.8	71%	0.713	50%	0.501	S	S	*	.			trans	-154.7	117.9	171.9	-56.8	90.9	0	0	0	107.7
52	C	62.6	Low	59.1	Low	57 Å²	57	106.7 Å²	106.7	39%	0.385	50%	0.496	S	S	.	.			trans	-77.9	126.7	163.2	-165.8	0	0	0	0	107.1	L37 K54 H56	L37-C52 HydrophobicContact CD1-CB 4.35Å; C52-K54 PolarHBondContact O-N 2.83Å; C52-H56 WeakPolarHBondContact CB-NE2 3.46Å; C52-H56 PolarHBondContact SG-NE2 2.84Å
53	N	66.2	Low	61.6	Low	152 Å²	152	101.8 Å²	101.8	81%	0.813	48%	0.483	S	S	*	.	S	Bend	trans	-76	2.4	176	-61.2	-12.2	0	0	0	112.4
54	K	64	Low	63.7	Low	69 Å²	69	100.5 Å²	100.5	30%	0.3	47%	0.472	S	S	.	.	S	Bend	trans	-102.6	147.5	-177.4	-56.1	-167.4	179.7	-166.8	0	110.5	D29 F31 C52 H56	D29-K54 HydrophobicContact CB-CD 4.42Å; D29-K54 HydrophobicContact CB-CG 4.42Å; F31-K54 HydrophobicContact CB-CD 3.78Å; F31-K54 HydrophobicContact CG-CD 4.3Å; C52-K54 PolarHBondContact O-N 2.83Å; K54-H56 PolarHBondContact O-CD2 3.04Å
55	M	69.1	Low	65.5	Low	79 Å²	79	93.9 Å²	93.9	39%	0.389	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-79.2	129.9	174.9	-76.4	-143.5	66.7	0	0	111.9	P27 D57	P27-M55 HydrophobicContact CB-CG 4.02Å; P27-M55 HydrophobicContact CG-CB 4.33Å; P27-M55 HydrophobicContact CG-CG 3.46Å; P27-M55 VanDerWaalsContact CG-CG 3.46Å; P27-M55 HydrophobicContact CG-SD 3.56Å; P27-M55 VanDerWaalsContact CG-SD 3.56Å; M55-D57 VanDerWaalsContact CE-OD2 3.23Å; M55-D57 WeakPolarHBondContact CE-OD2 3.42Å
56	H	72	Confident	67.7	Low	49 Å²	49	97.3 Å²	97.3	23%	0.227	47%	0.465	C	S	.	.			trans	-112	57.6	-179	-65.6	-65.5	0	0	0	111.7	S33 L37 C52 K54	S33-H56 PolarHBondContact O-ND1 3.19Å; S33-H56 PolarHBondContact OG-CE1 3.46Å; S33-H56 PolarHBondContact OG-ND1 2.92Å; S33-H56 VanDerWaalsContact OG-ND1 3.17Å; L37-H56 VanDerWaalsContact CD1-CE1 3.48Å; L37-H56 WeakPolarHBondContact CD1-CE1 3.3Å; L37-H56 VanDerWaalsContact CD1-NE2 3.3Å; L37-H56 WeakPolarHBondContact CD1-NE2 3.27Å; C52-H56 WeakPolarHBondContact CB-NE2 3.46Å; C52-H56 PolarHBondContact SG-NE2 2.84Å; K54-H56 PolarHBondContact O-CD2 3.04Å
57	D	78.4	Confident	69.7	Low	30 Å²	30	94.2 Å²	94.2	16%	0.16	45%	0.446	C	S	.	.			trans	-84.1	124.6	175.7	-80.2	-39.8	0	0	0	112.4	R17 M55 M60 R61	R17-D57 WeakPolarHBondContact CD-OD1 3.25Å; R17-D57 IonicContact NH1-OD1 3.19Å; R17-D57 PolarHBondContact NH1-OD1 3.43Å; M55-D57 VanDerWaalsContact CE-OD2 3.23Å; M55-D57 WeakPolarHBondContact CE-OD2 3.42Å; D57-M60 HydrophobicContact CB-CB 4.18Å; D57-M60 HydrophobicContact CB-CG 3.93Å; D57-M60 PolarHBondContact O-N 3.22Å; D57-R61 PolarHBondContact O-N 3.47Å
58	E	75.2	Confident	71.5	Confident	109 Å²	109	92.6 Å²	92.6	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-65.2	-42.8	179.5	-71	-179.2	167.3	0	0	112.9	T34 M60 R61 E62	T34-E58 HydrophobicContact CG2-CG 3.75Å; T34-E58 WeakPolarHBondContact CG2-OE1 3.48Å; E58-M60 VanDerWaalsContact C-N 3.31Å; E58-M60 PolarHBondContact O-N 3.07Å; E58-R61 VanDerWaalsContact O-CB 3.32Å; E58-R61 WeakPolarHBondContact O-CB 3.5Å; E58-R61 PolarHBondContact O-N 2.83Å; E58-R61 VanDerWaalsContact O-N 3.09Å; E58-E62 PolarHBondContact O-N 2.68Å
59	R	80.8	Confident	73.2	Confident	141 Å²	141	95 Å²	95	53%	0.532	46%	0.456	S	S	.	.	H	α-helix	trans	-56.2	-44.4	176.8	-176.8	-178.7	178.5	177.3	4.6	112.4	E13 R61 E62 A63	E13-R59 PolarHBondContact O-NH1 2.86Å; E13-R59 PolarHBondContact O-NH2 3.36Å; R59-R61 VanDerWaalsContact C-N 3.3Å; R59-R61 PolarHBondContact O-N 3.44Å; R59-E62 PolarHBondContact O-N 3.27Å; R59-A63 PolarHBondContact O-N 2.82Å
60	M	74.6	Confident	74.7	Confident	106 Å²	106	99.3 Å²	99.3	52%	0.522	47%	0.469	S	S	.	.	H	α-helix	trans	-67.5	-34.8	179.7	-65.1	-65.9	-85.8	0	0	111.4	F30 D57 E58 Y64	F30-M60 HydrophobicContact CE1-CE 4.07Å; D57-M60 HydrophobicContact CB-CB 4.18Å; D57-M60 HydrophobicContact CB-CG 3.93Å; D57-M60 PolarHBondContact O-N 3.22Å; E58-M60 VanDerWaalsContact C-N 3.31Å; E58-M60 PolarHBondContact O-N 3.07Å; M60-Y64 PolarHBondContact O-N 3.05Å
61	R	76.7	Confident	76.1	Confident	16 Å²	16	91.5 Å²	91.5	6%	0.06	46%	0.455	C	S	.	.	H	α-helix	trans	-65.5	-43.7	174.6	-165.1	-175.1	-61.8	99.9	2.5	112.2	L32 S33 T34 D57 E58 R59 Y64 K65	L32-R61 VanDerWaalsContact C-NE 3.29Å; L32-R61 HydrophobicContact CB-CG 4.31Å; L32-R61 HydrophobicContact CD2-CG 3.36Å; L32-R61 HydrophobicContact CG-CG 3.9Å; L32-R61 WeakPolarHBondContact O-CD 3.48Å; L32-R61 PolarHBondContact O-NE 2.91Å; S33-R61 PolarHBondContact O-NH2 2.9Å; T34-R61 VanDerWaalsContact CA-NH2 3.29Å; T34-R61 VanDerWaalsContact N-NE 3.18Å; T34-R61 VanDerWaalsContact N-NH2 3.11Å; T34-R61 WeakPolarHBondContact OG1-CD 3.42Å; T34-R61 PolarHBondContact OG1-NE 3.42Å; T34-R61 PolarHBondContact OG1-NH1 2.88Å; D57-R61 PolarHBondContact O-N 3.47Å; E58-R61 VanDerWaalsContact O-CB 3.32Å; E58-R61 WeakPolarHBondContact O-CB 3.5Å; E58-R61 PolarHBondContact O-N 2.83Å; E58-R61 VanDerWaalsContact O-N 3.09Å; R59-R61 VanDerWaalsContact C-N 3.3Å; R59-R61 PolarHBondContact O-N 3.44Å; R61-Y64 PolarHBondContact O-N 3.35Å; R61-K65 WeakPolarHBondContact O-CG 3.23Å; R61-K65 PolarHBondContact O-N 3.05Å
62	E	81.9	Confident	77.3	Confident	108 Å²	108	92.1 Å²	92.1	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-65.6	-41.5	177.1	-70.6	179.4	-174.8	0	0	112.1	E58 R59 Y64 K65 K66	E58-E62 PolarHBondContact O-N 2.68Å; R59-E62 PolarHBondContact O-N 3.27Å; E62-Y64 VanDerWaalsContact C-N 3.33Å; E62-Y64 PolarHBondContact O-N 3.1Å; E62-K65 PolarHBondContact O-N 3.35Å; E62-K66 WeakPolarHBondContact O-CG 3.38Å; E62-K66 PolarHBondContact O-N 3.48Å
63	A	85.5	Confident	78	Confident	55 Å²	55	91.4 Å²	91.4	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-59.6	-43.4	173.3	0	0	0	0	0	111.5	R59 K66 S67	R59-A63 PolarHBondContact O-N 2.82Å; A63-K66 PolarHBondContact O-N 2.83Å; A63-S67 WeakPolarHBondContact O-CB 3.39Å; A63-S67 PolarHBondContact O-N 3.09Å
64	Y	81	Confident	78.7	Confident	27 Å²	27	85.5 Å²	85.5	11%	0.106	43%	0.426	C	S	.	.	H	α-helix	trans	-63	-43.1	175	176.2	-93	0	0	0	112.3	L32 M60 R61 E62 K66 S67 R69 Y70 G71 C73 Y75 E76	L32-Y64 HydrophobicContact CD1-CD1 3.34Å; L32-Y64 HydrophobicContact CD1-CE1 3.22Å; L32-Y64 HydrophobicContact CD1-CG 4.02Å; L32-Y64 HydrophobicContact CD2-CD1 3.38Å; L32-Y64 HydrophobicContact CD2-CE1 3.86Å; L32-Y64 HydrophobicContact CD2-CG 4.31Å; L32-Y64 HydrophobicContact CG-CD1 3.86Å; L32-Y64 HydrophobicContact CG-CE1 4.14Å; M60-Y64 PolarHBondContact O-N 3.05Å; R61-Y64 PolarHBondContact O-N 3.35Å; E62-Y64 VanDerWaalsContact C-N 3.33Å; E62-Y64 PolarHBondContact O-N 3.1Å; Y64-K66 VanDerWaalsContact C-N 3.27Å; Y64-K66 PolarHBondContact O-N 3.35Å; Y64-S67 WeakPolarHBondContact O-CB 3.44Å; Y64-S67 PolarHBondContact O-N 2.92Å; Y64-S67 VanDerWaalsContact O-N 3.09Å; Y64-S67 PolarHBondContact O-OG 3.4Å; Y64-R69 HydrophobicContact CE2-CB 4.26Å; Y64-R69 PolarHBondContact OH-O 2.82Å; Y64-Y70 AromaticContact CD1-CD2 3.77Å; Y64-Y70 HydrophobicContact CD1-CD2 3.77Å; Y64-Y70 HydrophobicContact CD1-CE2 4.43Å; Y64-Y70 AromaticContact CE1-CD2 3.43Å; Y64-Y70 HydrophobicContact CE1-CD2 3.43Å; Y64-Y70 VanDerWaalsContact CE1-CD2 3.43Å; Y64-Y70 HydrophobicContact CE1-CE2 4.07Å; Y64-Y70 HydrophobicContact CE1-CG 4.32Å; Y64-G71 PolarHBondContact OH-N 3.14Å; Y64-C73 HydrophobicContact CE2-CB 4.28Å; Y64-Y75 HydrophobicContact CD2-CD2 4.29Å; Y64-Y75 HydrophobicContact CD2-CE2 4.49Å; Y64-Y75 AromaticContact CE2-CD2 3.58Å; Y64-Y75 HydrophobicContact CE2-CD2 3.58Å; Y64-Y75 AromaticContact CE2-CE2 3.96Å; Y64-Y75 HydrophobicContact CE2-CE2 3.96Å; Y64-Y75 AromaticContact CZ-CD2 3.72Å; Y64-E76 WeakPolarHBondContact CE1-OE1 3.46Å; Y64-E76 PolarHBondContact OH-OE1 3.45Å; Y64-E76 PolarHBondContact OH-OE2 3.36Å
65	K	84.1	Confident	79.5	Confident	121 Å²	121	85 Å²	85	53%	0.526	42%	0.422	S	S	.	.	H	α-helix	trans	-60.2	-35.4	175.8	-75.9	-179.8	177.4	-175	0	112.8	L32 R61 E62 Y70	L32-K65 HydrophobicContact CD2-CG 4.34Å; R61-K65 WeakPolarHBondContact O-CG 3.23Å; R61-K65 PolarHBondContact O-N 3.05Å; E62-K65 PolarHBondContact O-N 3.35Å; K65-Y70 HydrophobicContact CG-CD2 4.38Å; K65-Y70 HydrophobicContact CG-CE2 4.16Å
66	K	88.1	Confident	80.2	Confident	181 Å²	181	83 Å²	83	79%	0.787	41%	0.412	S	S	*	.	H	α-helix	trans	-79.9	-17.4	176.4	-69.3	174	-179	174.5	0	113.2	E62 A63 Y64	E62-K66 WeakPolarHBondContact O-CG 3.38Å; E62-K66 PolarHBondContact O-N 3.48Å; A63-K66 PolarHBondContact O-N 2.83Å; Y64-K66 VanDerWaalsContact C-N 3.27Å; Y64-K66 PolarHBondContact O-N 3.35Å
67	S	85.1	Confident	80.8	Confident	41 Å²	41	85.7 Å²	85.7	29%	0.287	42%	0.424	S	S	.	.	S	Bend	trans	-79.8	154.2	-176	78.2	0	0	0	0	112.8	A63 Y64 R69 Y70	A63-S67 WeakPolarHBondContact O-CB 3.39Å; A63-S67 PolarHBondContact O-N 3.09Å; Y64-S67 WeakPolarHBondContact O-CB 3.44Å; Y64-S67 PolarHBondContact O-N 2.92Å; Y64-S67 VanDerWaalsContact O-N 3.09Å; Y64-S67 PolarHBondContact O-OG 3.4Å; S67-R69 PolarHBondContact O-N 3.32Å; S67-R69 PolarHBondContact OG-N 3.48Å; S67-Y70 PolarHBondContact O-N 2.88Å
68	S	84.3	Confident	81.1	Confident	102 Å²	102	88.3 Å²	88.3	71%	0.713	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-3.2	173.5	62.8	0	0	0	0	114.6	K72	S68-K72 PolarHBondContact O-NZ 2.79Å
69	R	81.2	Confident	81.6	Confident	150 Å²	150	84.9 Å²	84.9	57%	0.566	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.5	-179.7	-60.9	-177.7	68.2	171.6	1	113.2	Y64 S67 G71 K72 C73	Y64-R69 HydrophobicContact CE2-CB 4.26Å; Y64-R69 PolarHBondContact OH-O 2.82Å; S67-R69 PolarHBondContact O-N 3.32Å; S67-R69 PolarHBondContact OG-N 3.48Å; R69-G71 PolarHBondContact O-N 3.43Å; R69-K72 PolarHBondContact O-N 3.01Å; R69-C73 PolarHBondContact NE-SG 3.43Å; R69-C73 VanDerWaalsContact NE-SG 3.39Å; R69-C73 PolarHBondContact NH2-SG 2.93Å; R69-C73 VanDerWaalsContact NH2-SG 3.45Å
70	Y	79.1	Confident	81.8	Confident	125 Å²	125	79.4 Å²	79.4	49%	0.49	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	129	175.4	-171	-102.9	0	0	0	110.7	Y64 K65 S67 K72 E76	Y64-Y70 AromaticContact CD1-CD2 3.77Å; Y64-Y70 HydrophobicContact CD1-CD2 3.77Å; Y64-Y70 HydrophobicContact CD1-CE2 4.43Å; Y64-Y70 AromaticContact CE1-CD2 3.43Å; Y64-Y70 HydrophobicContact CE1-CD2 3.43Å; Y64-Y70 VanDerWaalsContact CE1-CD2 3.43Å; Y64-Y70 HydrophobicContact CE1-CE2 4.07Å; Y64-Y70 HydrophobicContact CE1-CG 4.32Å; K65-Y70 HydrophobicContact CG-CD2 4.38Å; K65-Y70 HydrophobicContact CG-CE2 4.16Å; S67-Y70 PolarHBondContact O-N 2.88Å; Y70-K72 PolarHBondContact O-N 3.5Å; Y70-E76 HydrophobicContact CE2-CG 4.43Å
71	G	76	Confident	82.4	Confident	50 Å²	50	76.1 Å²	76.1	52%	0.515	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-17	-176.9	0	0	0	0	0	116.4	Y64 R69 E76	Y64-G71 PolarHBondContact OH-N 3.14Å; R69-G71 PolarHBondContact O-N 3.43Å; G71-E76 WeakPolarHBondContact CA-OE1 3.49Å; G71-E76 WeakPolarHBondContact CA-OE2 3.32Å; G71-E76 PolarHBondContact N-OE1 3.29Å
72	K	77.9	Confident	82.9	Confident	167 Å²	167	78.6 Å²	78.6	73%	0.726	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-30	-174.1	-64.6	178.7	-176.1	165.3	0	113.4	S68 R69 Y70 G74	S68-K72 PolarHBondContact O-NZ 2.79Å; R69-K72 PolarHBondContact O-N 3.01Å; Y70-K72 PolarHBondContact O-N 3.5Å; K72-G74 VanDerWaalsContact C-N 3.3Å; K72-G74 PolarHBondContact O-N 3.3Å
73	C	76.3	Confident	83.2	Confident	42 Å²	42	73.8 Å²	73.8	28%	0.284	38%	0.377	S	S	.	.	S	Bend	trans	-81.5	-6	-177.1	-66.4	0	0	0	0	113.8	Y64 R69 Y75	Y64-C73 HydrophobicContact CE2-CB 4.28Å; R69-C73 PolarHBondContact NE-SG 3.43Å; R69-C73 VanDerWaalsContact NE-SG 3.39Å; R69-C73 PolarHBondContact NH2-SG 2.93Å; R69-C73 VanDerWaalsContact NH2-SG 3.45Å; C73-Y75 HydrophobicContact CB-CD2 3.44Å; C73-Y75 VanDerWaalsContact CB-CD2 3.44Å; C73-Y75 HydrophobicContact CB-CE2 3.36Å; C73-Y75 HydrophobicContact CB-CG 4.22Å; C73-Y75 PolarHBondContact O-N 2.88Å
74	G	81.5	Confident	83.4	Confident	27 Å²	27	77.8 Å²	77.8	28%	0.278	38%	0.381	S	S	.	.	S	Bend	trans	77	-2	179.9	0	0	0	0	0	115.3	K72 E76 H77 D78	K72-G74 VanDerWaalsContact C-N 3.3Å; K72-G74 PolarHBondContact O-N 3.3Å; G74-E76 PolarHBondContact O-N 3.3Å; G74-E76 VanDerWaalsContact O-N 3.16Å; G74-H77 WeakPolarHBondContact O-CB 3.36Å; G74-H77 PolarHBondContact O-N 2.83Å; G74-D78 PolarHBondContact O-N 3.44Å
75	Y	81.6	Confident	83.8	Confident	58 Å²	58	83 Å²	83	23%	0.227	40%	0.404	C	S	.	.	H	α-helix	trans	-59	-30.7	-179.8	-61.8	-54.1	0	0	0	113.2	F30 L32 Y64 C73 F79	F30-Y75 HydrophobicContact CB-CE1 4.11Å; L32-Y75 HydrophobicContact CD1-CD2 4.21Å; L32-Y75 HydrophobicContact CD1-CG 4.2Å; Y64-Y75 HydrophobicContact CD2-CD2 4.29Å; Y64-Y75 HydrophobicContact CD2-CE2 4.49Å; Y64-Y75 AromaticContact CE2-CD2 3.58Å; Y64-Y75 HydrophobicContact CE2-CD2 3.58Å; Y64-Y75 AromaticContact CE2-CE2 3.96Å; Y64-Y75 HydrophobicContact CE2-CE2 3.96Å; Y64-Y75 AromaticContact CZ-CD2 3.72Å; C73-Y75 HydrophobicContact CB-CD2 3.44Å; C73-Y75 VanDerWaalsContact CB-CD2 3.44Å; C73-Y75 HydrophobicContact CB-CE2 3.36Å; C73-Y75 HydrophobicContact CB-CG 4.22Å; C73-Y75 PolarHBondContact O-N 2.88Å; Y75-F79 VanDerWaalsContact O-CB 3.24Å; Y75-F79 WeakPolarHBondContact O-CB 3.36Å; Y75-F79 PolarHBondContact O-N 2.78Å
76	E	83.6	Confident	84	Confident	38 Å²	38	78.1 Å²	78.1	18%	0.178	38%	0.383	C	S	.	.	H	α-helix	trans	-69.9	-36.9	175.3	-54.4	82.5	-175.3	0	0	111.8	Y64 Y70 G71 G74 F79 Y80	Y64-E76 WeakPolarHBondContact CE1-OE1 3.46Å; Y64-E76 PolarHBondContact OH-OE1 3.45Å; Y64-E76 PolarHBondContact OH-OE2 3.36Å; Y70-E76 HydrophobicContact CE2-CG 4.43Å; G71-E76 WeakPolarHBondContact CA-OE1 3.49Å; G71-E76 WeakPolarHBondContact CA-OE2 3.32Å; G71-E76 PolarHBondContact N-OE1 3.29Å; G74-E76 PolarHBondContact O-N 3.3Å; G74-E76 VanDerWaalsContact O-N 3.16Å; E76-F79 PolarHBondContact O-N 3.28Å; E76-Y80 WeakPolarHBondContact O-CB 3.4Å; E76-Y80 PolarHBondContact O-N 2.86Å
77	H	84.3	Confident	84.2	Confident	105 Å²	105	72.8 Å²	72.8	49%	0.486	36%	0.361	S	S	.	.	H	α-helix	trans	-68.2	-46.2	177.1	-177.8	80	0	0	0	110.7	G74 F79 Y80 C81	G74-H77 WeakPolarHBondContact O-CB 3.36Å; G74-H77 PolarHBondContact O-N 2.83Å; H77-F79 VanDerWaalsContact C-N 3.27Å; H77-F79 PolarHBondContact O-N 3.25Å; H77-Y80 WeakPolarHBondContact O-CB 3.29Å; H77-Y80 PolarHBondContact O-N 2.84Å; H77-C81 PolarHBondContact NE2-SG 2.82Å; H77-C81 VanDerWaalsContact NE2-SG 3.35Å; H77-C81 WeakPolarHBondContact O-CB 3.25Å; H77-C81 PolarHBondContact O-N 3.32Å; H77-C81 PolarHBondContact O-SG 3.47Å
78	D	85.2	Confident	84.5	Confident	85 Å²	85	74.4 Å²	74.4	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-38.8	174.8	-69.6	-19	0	0	0	111.6	F31 G74 C81 F82	F31-D78 HydrophobicContact CE2-CB 3.88Å; G74-D78 PolarHBondContact O-N 3.44Å; D78-C81 PolarHBondContact O-N 3.35Å; D78-F82 WeakPolarHBondContact O-CB 3.43Å; D78-F82 PolarHBondContact O-N 3.34Å
79	F	83.8	Confident	84.7	Confident	37 Å²	37	71.9 Å²	71.9	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-46.5	173.9	-177.2	-129.4	0	0	0	112.6	F31 I35 Y75 E76 H77 F82 L83	F31-F79 AromaticContact CD1-CD2 3.99Å; F31-F79 HydrophobicContact CD1-CD2 3.99Å; F31-F79 HydrophobicContact CE1-CB 4.25Å; F31-F79 AromaticContact CE1-CD2 3.34Å; F31-F79 HydrophobicContact CE1-CD2 3.34Å; F31-F79 HydrophobicContact CE1-CE2 4.12Å; F31-F79 HydrophobicContact CE1-CG 4.23Å; F31-F79 VanDerWaalsContact CE2-CA 3.48Å; F31-F79 HydrophobicContact CE2-CB 3.91Å; F31-F79 VanDerWaalsContact CE2-N 3.34Å; F31-F79 HydrophobicContact CZ-CB 3.81Å; F31-F79 AromaticContact CZ-CD2 3.71Å; F31-F79 HydrophobicContact CZ-CD2 3.71Å; F31-F79 HydrophobicContact CZ-CG 4.25Å; I35-F79 HydrophobicContact CD1-CE2 4.4Å; I35-F79 HydrophobicContact CD1-CZ 3.67Å; I35-F79 HydrophobicContact CG1-CZ 3.98Å; Y75-F79 VanDerWaalsContact O-CB 3.24Å; Y75-F79 WeakPolarHBondContact O-CB 3.36Å; Y75-F79 PolarHBondContact O-N 2.78Å; E76-F79 PolarHBondContact O-N 3.28Å; H77-F79 VanDerWaalsContact C-N 3.27Å; H77-F79 PolarHBondContact O-N 3.25Å; F79-F82 WeakPolarHBondContact O-CB 3.32Å; F79-F82 PolarHBondContact O-N 3.09Å; F79-L83 HydrophobicContact CD1-CD1 4.05Å; F79-L83 HydrophobicContact CD2-CD1 4.36Å; F79-L83 HydrophobicContact CD2-CG 4.2Å; F79-L83 HydrophobicContact CE1-CD1 3.69Å; F79-L83 HydrophobicContact CE1-CG 4.46Å; F79-L83 HydrophobicContact CE2-CD1 4.02Å; F79-L83 HydrophobicContact CE2-CD2 3.86Å; F79-L83 HydrophobicContact CE2-CG 3.89Å; F79-L83 HydrophobicContact CG-CD1 4.4Å; F79-L83 HydrophobicContact CZ-CD1 3.7Å; F79-L83 HydrophobicContact CZ-CD2 4Å; F79-L83 HydrophobicContact CZ-CG 4.06Å; F79-L83 VanDerWaalsContact O-CG 3.29Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.06Å
80	Y	85.7	Confident	85.1	Confident	27 Å²	27	65 Å²	65	11%	0.106	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-43.8	175.3	179.1	-104	0	0	0	113.1	E76 H77 F82 L83 R84 L227 R230	E76-Y80 WeakPolarHBondContact O-CB 3.4Å; E76-Y80 PolarHBondContact O-N 2.86Å; H77-Y80 WeakPolarHBondContact O-CB 3.29Å; H77-Y80 PolarHBondContact O-N 2.84Å; Y80-F82 PolarHBondContact O-N 3Å; Y80-L83 PolarHBondContact O-N 3.4Å; Y80-L83 VanDerWaalsContact O-N 3.12Å; Y80-R84 WeakPolarHBondContact O-CB 3.49Å; Y80-R84 PolarHBondContact O-N 2.77Å; Y80-L227 HydrophobicContact CD2-CD2 3.59Å; Y80-L227 HydrophobicContact CE2-CD2 3.24Å; Y80-R230 HydrophobicContact CD2-CB 4.41Å; Y80-R230 HydrophobicContact CD2-CG 4.44Å; Y80-R230 HydrophobicContact CE2-CB 3.9Å; Y80-R230 HydrophobicContact CE2-CG 4.11Å
81	C	87.7	Confident	85.7	Confident	36 Å²	36	60.9 Å²	60.9	24%	0.243	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-38.2	176.4	-78.3	0	0	0	0	111.4	H77 D78 K85	H77-C81 PolarHBondContact NE2-SG 2.82Å; H77-C81 VanDerWaalsContact NE2-SG 3.35Å; H77-C81 WeakPolarHBondContact O-CB 3.25Å; H77-C81 PolarHBondContact O-N 3.32Å; H77-C81 PolarHBondContact O-SG 3.47Å; D78-C81 PolarHBondContact O-N 3.35Å; C81-K85 VanDerWaalsContact O-CG 3.28Å; C81-K85 WeakPolarHBondContact O-CG 3.17Å; C81-K85 PolarHBondContact O-N 2.82Å; C81-K85 VanDerWaalsContact O-N 3.12Å
82	F	86.6	Confident	86.5	Confident	68 Å²	68	65.5 Å²	65.5	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-46.5	171.8	177.4	-106.4	0	0	0	112.7	F31 D78 F79 Y80 R84 K85 L86	F31-F82 HydrophobicContact CE1-CB 4.17Å; F31-F82 AromaticContact CE1-CD1 3.75Å; F31-F82 HydrophobicContact CE1-CD1 3.75Å; F31-F82 HydrophobicContact CE1-CE1 4.37Å; F31-F82 HydrophobicContact CE1-CG 4.06Å; F31-F82 HydrophobicContact CZ-CB 3.65Å; F31-F82 HydrophobicContact CZ-CD1 4.12Å; F31-F82 HydrophobicContact CZ-CG 4.01Å; D78-F82 WeakPolarHBondContact O-CB 3.43Å; D78-F82 PolarHBondContact O-N 3.34Å; F79-F82 WeakPolarHBondContact O-CB 3.32Å; F79-F82 PolarHBondContact O-N 3.09Å; Y80-F82 PolarHBondContact O-N 3Å; F82-R84 VanDerWaalsContact C-N 3.32Å; F82-R84 PolarHBondContact O-N 3.35Å; F82-K85 WeakPolarHBondContact O-CB 3.39Å; F82-K85 PolarHBondContact O-N 3.27Å; F82-L86 HydrophobicContact CD1-CD1 3.97Å; F82-L86 HydrophobicContact CE1-CD1 3.4Å; F82-L86 VanDerWaalsContact CE1-CD1 3.4Å; F82-L86 HydrophobicContact CE1-CG 4.23Å; F82-L86 HydrophobicContact CE2-CD1 4.36Å; F82-L86 HydrophobicContact CE2-CG 4.39Å; F82-L86 HydrophobicContact CZ-CD1 3.63Å; F82-L86 HydrophobicContact CZ-CD2 4.38Å; F82-L86 HydrophobicContact CZ-CG 4.12Å; F82-L86 PolarHBondContact O-N 3.48Å
83	L	88.4	Confident	87.1	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-40.9	176.9	-67.9	173.7	0	0	0	112.2	I35 F79 Y80 L86 H87 I223 L227	I35-L83 HydrophobicContact CD1-CD1 4.45Å; I35-L83 HydrophobicContact CD1-CD2 3.63Å; F79-L83 HydrophobicContact CD1-CD1 4.05Å; F79-L83 HydrophobicContact CD2-CD1 4.36Å; F79-L83 HydrophobicContact CD2-CG 4.2Å; F79-L83 HydrophobicContact CE1-CD1 3.69Å; F79-L83 HydrophobicContact CE1-CG 4.46Å; F79-L83 HydrophobicContact CE2-CD1 4.02Å; F79-L83 HydrophobicContact CE2-CD2 3.86Å; F79-L83 HydrophobicContact CE2-CG 3.89Å; F79-L83 HydrophobicContact CG-CD1 4.4Å; F79-L83 HydrophobicContact CZ-CD1 3.7Å; F79-L83 HydrophobicContact CZ-CD2 4Å; F79-L83 HydrophobicContact CZ-CG 4.06Å; F79-L83 VanDerWaalsContact O-CG 3.29Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.06Å; Y80-L83 PolarHBondContact O-N 3.4Å; Y80-L83 VanDerWaalsContact O-N 3.12Å; L83-L86 PolarHBondContact O-N 3.37Å; L83-H87 WeakPolarHBondContact O-CB 3.45Å; L83-H87 PolarHBondContact O-N 3.03Å; L83-I223 HydrophobicContact CB-CG2 4.25Å; L83-I223 HydrophobicContact CD2-CB 4.44Å; L83-I223 HydrophobicContact CD2-CD1 4.38Å; L83-I223 HydrophobicContact CD2-CG1 3.79Å; L83-I223 HydrophobicContact CD2-CG2 4.09Å; L83-L227 HydrophobicContact CB-CD2 3.97Å; L83-L227 HydrophobicContact CB-CG 4.44Å
84	R	90.4	Very high	87.9	Confident	139 Å²	139	58.1 Å²	58.1	53%	0.525	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-41	177.4	-164.3	176.9	88.7	175.2	6	111.5	Y80 F82 H87 N88 L227	Y80-R84 WeakPolarHBondContact O-CB 3.49Å; Y80-R84 PolarHBondContact O-N 2.77Å; F82-R84 VanDerWaalsContact C-N 3.32Å; F82-R84 PolarHBondContact O-N 3.35Å; R84-H87 PolarHBondContact O-N 3.47Å; R84-N88 WeakPolarHBondContact O-CB 3.15Å; R84-N88 PolarHBondContact O-N 2.94Å; R84-N88 PolarHBondContact O-ND2 3.34Å; R84-L227 HydrophobicContact CB-CD2 4.45Å
85	K	89.4	Confident	88.4	Confident	138 Å²	138	60.4 Å²	60.4	60%	0.6	28%	0.284	S	S	*	.	H	α-helix	trans	-58.7	-51.2	173.4	-73.5	171.9	-177	-177.3	0	110.7	C81 F82 H87 N88 E89	C81-K85 VanDerWaalsContact O-CG 3.28Å; C81-K85 WeakPolarHBondContact O-CG 3.17Å; C81-K85 PolarHBondContact O-N 2.82Å; C81-K85 VanDerWaalsContact O-N 3.12Å; F82-K85 WeakPolarHBondContact O-CB 3.39Å; F82-K85 PolarHBondContact O-N 3.27Å; K85-H87 VanDerWaalsContact C-N 3.35Å; K85-H87 PolarHBondContact O-N 3.24Å; K85-N88 PolarHBondContact O-N 2.76Å; K85-E89 VanDerWaalsContact O-CG 3.32Å; K85-E89 WeakPolarHBondContact O-CG 3.45Å; K85-E89 PolarHBondContact O-N 3.09Å
86	L	88.4	Confident	88.8	Confident	17 Å²	17	64.9 Å²	64.9	9%	0.089	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-42.9	178	-71.6	179.2	0	0	0	112.9	W48 F82 L83 E89 M90 I223	W48-L86 HydrophobicContact CE3-CD2 3.79Å; W48-L86 HydrophobicContact CZ3-CD2 4.36Å; F82-L86 HydrophobicContact CD1-CD1 3.97Å; F82-L86 HydrophobicContact CE1-CD1 3.4Å; F82-L86 VanDerWaalsContact CE1-CD1 3.4Å; F82-L86 HydrophobicContact CE1-CG 4.23Å; F82-L86 HydrophobicContact CE2-CD1 4.36Å; F82-L86 HydrophobicContact CE2-CG 4.39Å; F82-L86 HydrophobicContact CZ-CD1 3.63Å; F82-L86 HydrophobicContact CZ-CD2 4.38Å; F82-L86 HydrophobicContact CZ-CG 4.12Å; F82-L86 PolarHBondContact O-N 3.48Å; L83-L86 PolarHBondContact O-N 3.37Å; L86-E89 WeakPolarHBondContact CA-OE2 3.32Å; L86-E89 PolarHBondContact O-N 2.8Å; L86-M90 PolarHBondContact O-N 2.9Å; L86-I223 HydrophobicContact CD1-CD1 4.13Å
87	H	91.1	Very high	89.2	Confident	69 Å²	69	64.4 Å²	64.4	32%	0.319	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-45.6	177.8	180	-92.9	0	0	0	111.9	L83 R84 K85 E89 M90 A91 I223 L227	L83-H87 WeakPolarHBondContact O-CB 3.45Å; L83-H87 PolarHBondContact O-N 3.03Å; R84-H87 PolarHBondContact O-N 3.47Å; K85-H87 VanDerWaalsContact C-N 3.35Å; K85-H87 PolarHBondContact O-N 3.24Å; H87-E89 VanDerWaalsContact C-N 3.29Å; H87-E89 PolarHBondContact O-N 2.8Å; H87-M90 PolarHBondContact O-N 3.5Å; H87-A91 WeakPolarHBondContact O-CB 3.34Å; H87-A91 PolarHBondContact O-N 3.04Å; H87-I223 HydrophobicContact CB-CG2 4.33Å; H87-L227 HydrophobicContact CB-CD1 3.3Å
88	N	91.5	Very high	89.3	Confident	76 Å²	76	64.4 Å²	64.4	41%	0.406	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-33.7	178.3	-69.1	-11.7	0	0	0	112.3	R84 K85 R92	R84-N88 WeakPolarHBondContact O-CB 3.15Å; R84-N88 PolarHBondContact O-N 2.94Å; R84-N88 PolarHBondContact O-ND2 3.34Å; K85-N88 PolarHBondContact O-N 2.76Å; N88-R92 WeakPolarHBondContact O-CB 3.48Å; N88-R92 VanDerWaalsContact O-CG 3.27Å; N88-R92 WeakPolarHBondContact O-CG 3.15Å; N88-R92 PolarHBondContact O-N 2.72Å; N88-R92 PolarHBondContact O-NE 3.43Å
89	E	89.9	Confident	89.5	Confident	48 Å²	48	65.4 Å²	65.4	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-40.2	174.2	-72	161.8	152.6	0	0	112.1	W48 K85 L86 H87 R92 K93	W48-E89 HydrophobicContact CH2-CB 3.48Å; W48-E89 VanDerWaalsContact CH2-CB 3.48Å; W48-E89 HydrophobicContact CH2-CG 3.49Å; W48-E89 VanDerWaalsContact CH2-CG 3.49Å; W48-E89 WeakPolarHBondContact CH2-OE1 3.44Å; W48-E89 WeakPolarHBondContact CH2-OE2 3.46Å; W48-E89 HydrophobicContact CZ2-CB 3.87Å; W48-E89 HydrophobicContact CZ2-CG 4.33Å; W48-E89 HydrophobicContact CZ3-CB 4.1Å; W48-E89 HydrophobicContact CZ3-CG 4.02Å; W48-E89 WeakPolarHBondContact CZ3-OE1 3.43Å; W48-E89 WeakPolarHBondContact CZ3-OE2 3.18Å; K85-E89 VanDerWaalsContact O-CG 3.32Å; K85-E89 WeakPolarHBondContact O-CG 3.45Å; K85-E89 PolarHBondContact O-N 3.09Å; L86-E89 WeakPolarHBondContact CA-OE2 3.32Å; L86-E89 PolarHBondContact O-N 2.8Å; H87-E89 VanDerWaalsContact C-N 3.29Å; H87-E89 PolarHBondContact O-N 2.8Å; E89-R92 PolarHBondContact O-N 3.21Å; E89-K93 WeakPolarHBondContact O-CB 3.31Å; E89-K93 PolarHBondContact O-N 2.84Å
90	M	88.7	Confident	89.7	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.025	32%	0.318	C	S	.	.	H	α-helix	trans	-68	-42.3	173	-72.3	-45.9	112.5	0	0	112.9	W48 L86 H87 R92 K93 I94 F220	W48-M90 HydrophobicContact CD2-CE 4Å; W48-M90 HydrophobicContact CG-CE 4.27Å; W48-M90 HydrophobicContact CZ2-CE 4.01Å; L86-M90 PolarHBondContact O-N 2.9Å; H87-M90 PolarHBondContact O-N 3.5Å; M90-R92 VanDerWaalsContact C-N 3.29Å; M90-R92 PolarHBondContact O-N 3.09Å; M90-K93 CarbonylContact O-C 3.52Å; M90-K93 WeakPolarHBondContact O-CA 3.08Å; M90-K93 WeakPolarHBondContact O-CB 3.25Å; M90-K93 PolarHBondContact O-N 3.02Å; M90-K93 HydrophobicContact SD-CD 3.89Å; M90-I94 WeakPolarHBondContact O-CG1 3.35Å; M90-I94 PolarHBondContact O-N 2.89Å; M90-F220 HydrophobicContact CB-CD1 4.39Å; M90-F220 HydrophobicContact CB-CE1 4.37Å; M90-F220 HydrophobicContact CE-CE1 4.05Å; M90-F220 HydrophobicContact CE-CE2 4.44Å; M90-F220 HydrophobicContact CE-CZ 3.62Å; M90-F220 HydrophobicContact CG-CD1 3.4Å; M90-F220 VanDerWaalsContact CG-CD1 3.4Å; M90-F220 HydrophobicContact CG-CD2 4.17Å; M90-F220 HydrophobicContact CG-CE1 3.05Å; M90-F220 HydrophobicContact CG-CE2 3.87Å; M90-F220 HydrophobicContact CG-CG 3.98Å; M90-F220 HydrophobicContact CG-CZ 3.32Å; M90-F220 HydrophobicContact SD-CD1 4.43Å; M90-F220 HydrophobicContact SD-CD2 4.32Å; M90-F220 HydrophobicContact SD-CE1 3.75Å; M90-F220 HydrophobicContact SD-CE2 3.6Å; M90-F220 VanDerWaalsContact SD-CE2 3.6Å; M90-F220 HydrophobicContact SD-CZ 3.28Å; M90-F220 WeakPolarHBondContact SD-CZ 3.38Å
91	A	91.4	Very high	89.5	Confident	40 Å²	40	70.8 Å²	70.8	33%	0.331	32%	0.317	S	S	.	.	H	α-helix	trans	-57.9	-43.7	175.1	0	0	0	0	0	111.3	H87 K93 I94 T95	H87-A91 WeakPolarHBondContact O-CB 3.34Å; H87-A91 PolarHBondContact O-N 3.04Å; A91-K93 VanDerWaalsContact C-N 3.32Å; A91-K93 PolarHBondContact O-N 2.82Å; A91-I94 PolarHBondContact O-N 3.29Å; A91-T95 PolarHBondContact O-N 3.41Å; A91-T95 PolarHBondContact O-OG1 3.26Å
92	R	92.5	Very high	89.2	Confident	147 Å²	147	73.9 Å²	73.9	56%	0.555	33%	0.328	S	S	*	.	H	α-helix	trans	-63.1	-35.4	173	-74.9	-176.2	-70.6	179.8	0.1	112.8	N88 E89 M90 R96	N88-R92 WeakPolarHBondContact O-CB 3.48Å; N88-R92 VanDerWaalsContact O-CG 3.27Å; N88-R92 WeakPolarHBondContact O-CG 3.15Å; N88-R92 PolarHBondContact O-N 2.72Å; N88-R92 PolarHBondContact O-NE 3.43Å; E89-R92 PolarHBondContact O-N 3.21Å; M90-R92 VanDerWaalsContact C-N 3.29Å; M90-R92 PolarHBondContact O-N 3.09Å; R92-R96 WeakPolarHBondContact O-CG 3.47Å; R92-R96 PolarHBondContact O-N 2.99Å; R92-R96 PolarHBondContact O-NE 3.26Å; R92-R96 VanDerWaalsContact O-NE 3.17Å
93	K	90.8	Very high	88.7	Confident	36 Å²	36	77.7 Å²	77.7	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-70.3	-43	176	-178.7	-170.9	168.1	-149.4	0	111.6	E89 M90 A91 R96 N97 C195	E89-K93 WeakPolarHBondContact O-CB 3.31Å; E89-K93 PolarHBondContact O-N 2.84Å; M90-K93 CarbonylContact O-C 3.52Å; M90-K93 WeakPolarHBondContact O-CA 3.08Å; M90-K93 WeakPolarHBondContact O-CB 3.25Å; M90-K93 PolarHBondContact O-N 3.02Å; M90-K93 HydrophobicContact SD-CD 3.89Å; A91-K93 VanDerWaalsContact C-N 3.32Å; A91-K93 PolarHBondContact O-N 2.82Å; K93-R96 PolarHBondContact O-N 2.97Å; K93-N97 WeakPolarHBondContact O-CB 3.36Å; K93-N97 VanDerWaalsContact O-CG 3.29Å; K93-N97 PolarHBondContact O-N 2.93Å; K93-C195 PolarHBondContact NZ-O 3.09Å
94	I	92.6	Very high	88.2	Confident	18 Å²	18	82.1 Å²	82.1	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-49.1	176.6	-68.1	158.7	0	0	0	109.5	M90 A91 R96 N97 R98 V191 D193	M90-I94 WeakPolarHBondContact O-CG1 3.35Å; M90-I94 PolarHBondContact O-N 2.89Å; A91-I94 PolarHBondContact O-N 3.29Å; I94-R96 PolarHBondContact O-N 3.25Å; I94-N97 PolarHBondContact O-N 2.95Å; I94-N97 VanDerWaalsContact O-N 3.14Å; I94-R98 HydrophobicContact CG2-CG 4.35Å; I94-R98 WeakPolarHBondContact O-CG 3.17Å; I94-R98 PolarHBondContact O-N 3.19Å; I94-V191 HydrophobicContact CG2-CG1 4.39Å; I94-D193 VanDerWaalsContact CD1-O 3.23Å; I94-D193 WeakPolarHBondContact CD1-O 3.34Å
95	T	92.2	Very high	87.1	Confident	74 Å²	74	78.2 Å²	78.2	45%	0.454	37%	0.366	S	S	.	.	H	α-helix	trans	-56.6	-49.1	178.5	-52.4	0	0	0	0	111.6	A91 N97 R98 Q99	A91-T95 PolarHBondContact O-N 3.41Å; A91-T95 PolarHBondContact O-OG1 3.26Å; T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 2.94Å; T95-R98 PolarHBondContact O-N 3.47Å; T95-Q99 WeakPolarHBondContact O-CG 3.24Å; T95-Q99 PolarHBondContact O-N 3.16Å
96	R	91.4	Very high	85.3	Confident	152 Å²	152	76 Å²	76	57%	0.574	37%	0.366	S	S	*	.	H	α-helix	trans	-62.6	-38.5	177.1	-75.5	-177.6	-69	155.9	-5.2	113.1	R92 K93 I94 R100	R92-R96 WeakPolarHBondContact O-CG 3.47Å; R92-R96 PolarHBondContact O-N 2.99Å; R92-R96 PolarHBondContact O-NE 3.26Å; R92-R96 VanDerWaalsContact O-NE 3.17Å; K93-R96 PolarHBondContact O-N 2.97Å; I94-R96 PolarHBondContact O-N 3.25Å; R96-R100 WeakPolarHBondContact O-CB 3.46Å; R96-R100 PolarHBondContact O-N 3.22Å
97	N	90.5	Very high	83.6	Confident	29 Å²	29	75.7 Å²	75.7	16%	0.155	37%	0.366	C	S	.	.	H	α-helix	trans	-71.2	-35.5	179.2	-75.4	-2.6	0	0	0	111.9	K93 I94 T95 R100 L101 V191 G196 F198	K93-N97 WeakPolarHBondContact O-CB 3.36Å; K93-N97 VanDerWaalsContact O-CG 3.29Å; K93-N97 PolarHBondContact O-N 2.93Å; I94-N97 PolarHBondContact O-N 2.95Å; I94-N97 VanDerWaalsContact O-N 3.14Å; T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 2.94Å; N97-R100 PolarHBondContact O-N 2.58Å; N97-L101 WeakPolarHBondContact O-CB 3.5Å; N97-L101 PolarHBondContact O-N 2.9Å; N97-V191 HydrophobicContact CB-CG1 3.94Å; N97-V191 HydrophobicContact CB-CG2 3.99Å; N97-G196 PolarHBondContact ND2-O 2.77Å; N97-F198 HydrophobicContact CB-CE1 4.17Å; N97-F198 HydrophobicContact CB-CZ 3.99Å
98	R	88.2	Confident	81.5	Confident	105 Å²	105	72.4 Å²	72.4	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-49.5	172.8	-72.4	179.7	-179.7	-179.6	-1.4	111.2	I94 T95 R100 L101 E102 V191 D193	I94-R98 HydrophobicContact CG2-CG 4.35Å; I94-R98 WeakPolarHBondContact O-CG 3.17Å; I94-R98 PolarHBondContact O-N 3.19Å; T95-R98 PolarHBondContact O-N 3.47Å; R98-R100 VanDerWaalsContact C-N 3.28Å; R98-R100 PolarHBondContact O-N 3.04Å; R98-L101 WeakPolarHBondContact O-CA 3.5Å; R98-L101 WeakPolarHBondContact O-CB 3.19Å; R98-L101 PolarHBondContact O-N 2.92Å; R98-E102 WeakPolarHBondContact O-CG 3.32Å; R98-E102 PolarHBondContact O-N 3.43Å; R98-V191 HydrophobicContact CG-CB 4.04Å; R98-V191 HydrophobicContact CG-CG1 4.41Å; R98-V191 HydrophobicContact CG-CG2 4.25Å; R98-D193 IonicContact CZ-OD1 3.71Å; R98-D193 IonicContact NH2-OD1 2.62Å; R98-D193 PolarHBondContact NH2-OD1 2.64Å; R98-D193 IonicContact NH2-OD2 3.97Å
99	Q	88.1	Confident	79.4	Confident	105 Å²	105	73.3 Å²	73.3	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-57.4	-41.7	174.2	-71.9	175.2	-19.4	0	0	112.3	T95 L101 E102 L103	T95-Q99 WeakPolarHBondContact O-CG 3.24Å; T95-Q99 PolarHBondContact O-N 3.16Å; Q99-L101 VanDerWaalsContact C-N 3.31Å; Q99-L101 PolarHBondContact O-N 2.89Å; Q99-E102 PolarHBondContact O-N 2.82Å; Q99-L103 WeakPolarHBondContact O-CG 3.06Å; Q99-L103 PolarHBondContact O-N 2.95Å
100	R	87.2	Confident	77.4	Confident	160 Å²	160	72.7 Å²	72.7	60%	0.604	36%	0.359	S	S	*	.	H	α-helix	trans	-62.3	-40.2	175.1	-178.2	177.6	176.5	176.9	0.5	111.8	R96 N97 R98 T104	R96-R100 WeakPolarHBondContact O-CB 3.46Å; R96-R100 PolarHBondContact O-N 3.22Å; N97-R100 PolarHBondContact O-N 2.58Å; R98-R100 VanDerWaalsContact C-N 3.28Å; R98-R100 PolarHBondContact O-N 3.04Å; R100-T104 WeakPolarHBondContact O-CB 3.37Å; R100-T104 PolarHBondContact O-N 3.3Å; R100-T104 PolarHBondContact O-OG1 3.24Å
101	L	83.5	Confident	75.3	Confident	17 Å²	17	75.2 Å²	75.2	9%	0.089	38%	0.377	C	S	.	.	H	α-helix	trans	-67.2	-44.6	178.8	178.9	66.7	0	0	0	111.1	N97 R98 Q99 L103 T104 Q105 M189 V191	N97-L101 WeakPolarHBondContact O-CB 3.5Å; N97-L101 PolarHBondContact O-N 2.9Å; R98-L101 WeakPolarHBondContact O-CA 3.5Å; R98-L101 WeakPolarHBondContact O-CB 3.19Å; R98-L101 PolarHBondContact O-N 2.92Å; Q99-L101 VanDerWaalsContact C-N 3.31Å; Q99-L101 PolarHBondContact O-N 2.89Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.01Å; L101-T104 PolarHBondContact O-N 3.02Å; L101-Q105 HydrophobicContact CD1-CB 4.47Å; L101-Q105 HydrophobicContact CD1-CG 4.45Å; L101-Q105 CarbonylContact O-C 3.5Å; L101-Q105 WeakPolarHBondContact O-CA 3.23Å; L101-Q105 PolarHBondContact O-N 3.37Å; L101-M189 HydrophobicContact CD1-CB 3.68Å; L101-M189 WeakPolarHBondContact CD1-O 3.44Å; L101-M189 WeakPolarHBondContact CD2-O 3.22Å; L101-V191 HydrophobicContact CB-CG2 4.4Å; L101-V191 HydrophobicContact CD2-CG2 4.01Å
102	E	79.5	Confident	72.9	Confident	101 Å²	101	77.9 Å²	77.9	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-58.2	-42.2	174.8	-70.4	161.5	-164.2	0	0	111.9	R98 Q99 Q105 P106	R98-E102 WeakPolarHBondContact O-CG 3.32Å; R98-E102 PolarHBondContact O-N 3.43Å; Q99-E102 PolarHBondContact O-N 2.82Å; E102-Q105 CarbonylContact O-C 3.49Å; E102-P106 WeakPolarHBondContact O-CA 3.28Å; E102-P106 VanDerWaalsContact O-N 3.15Å
103	L	78	Confident	70.8	Confident	149 Å²	149	75.7 Å²	75.7	78%	0.78	39%	0.385	S	S	*	.	H	α-helix	trans	-72.3	-34.5	177.6	-69.1	172	0	0	0	113.5	Q99 L101	Q99-L103 WeakPolarHBondContact O-CG 3.06Å; Q99-L103 PolarHBondContact O-N 2.95Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.01Å
104	T	76.4	Confident	69	Low	100 Å²	100	81.6 Å²	81.6	61%	0.613	41%	0.413	S	S	*	.	H	α-helix	trans	-84.3	-31.8	-176.8	-50.5	0	0	0	0	111.7	R100 L101	R100-T104 WeakPolarHBondContact O-CB 3.37Å; R100-T104 PolarHBondContact O-N 3.3Å; R100-T104 PolarHBondContact O-OG1 3.24Å; L101-T104 PolarHBondContact O-N 3.02Å
105	Q	67	Low	67	Low	56 Å²	56	86.2 Å²	86.2	26%	0.262	43%	0.433	S	S	.	.			trans	-132.2	80.4	176.7	-63.2	-175.4	-3.5	0	0	108.2	L101 E102 G107 G108	L101-Q105 HydrophobicContact CD1-CB 4.47Å; L101-Q105 HydrophobicContact CD1-CG 4.45Å; L101-Q105 CarbonylContact O-C 3.5Å; L101-Q105 WeakPolarHBondContact O-CA 3.23Å; L101-Q105 PolarHBondContact O-N 3.37Å; E102-Q105 CarbonylContact O-C 3.49Å; Q105-G107 PolarHBondContact O-N 3.29Å; Q105-G108 PolarHBondContact O-N 3.12Å
106	P	52.2	Low	65.5	Low	93 Å²	93	85.5 Å²	85.5	60%	0.604	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	4.7	179.1	23.3	-31.6	0	0	0	114.9	E102 F173	E102-P106 WeakPolarHBondContact O-CA 3.28Å; E102-P106 VanDerWaalsContact O-N 3.15Å; P106-F173 HydrophobicContact CG-CE1 4.05Å; P106-F173 HydrophobicContact CG-CZ 4.14Å
107	G	52.2	Low	64.3	Low	9 Å²	9	80.9 Å²	80.9	9%	0.093	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	7.3	170.4	0	0	0	0	0	114	Q105 V109 V110 F173	Q105-G107 PolarHBondContact O-N 3.29Å; G107-V109 VanDerWaalsContact C-N 3.25Å; G107-V109 PolarHBondContact O-N 3.43Å; G107-V110 VanDerWaalsContact O-CG2 3.28Å; G107-V110 WeakPolarHBondContact O-CG2 3.41Å; G107-F173 VanDerWaalsContact N-CE1 3.32Å
108	G	48.4	Very low	63.4	Low	1 Å²	1	84.1 Å²	84.1	1%	0.01	43%	0.429	C	S	.	.			trans	-78.7	-6.3	-178.3	0	0	0	0	0	113.9	Q105 V110	Q105-G108 PolarHBondContact O-N 3.12Å; G108-V110 PolarHBondContact O-N 2.96Å
109	V	46.5	Very low	63	Low	94 Å²	94	83.5 Å²	83.5	57%	0.57	43%	0.429	S	S	*	.			trans	-72.4	57.9	161.7	-102.8	0	0	0	0	109.5	G107 S111	G107-V109 VanDerWaalsContact C-N 3.25Å; G107-V109 PolarHBondContact O-N 3.43Å; V109-S111 PolarHBondContact O-N 2.9Å
110	V	47.4	Very low	62.5	Low	36 Å²	36	80 Å²	80	22%	0.218	41%	0.413	C	S	.	.			trans	-88.1	50.9	158	-161	0	0	0	0	106.8	G107 G108 N112 F117 V188	G107-V110 VanDerWaalsContact O-CG2 3.28Å; G107-V110 WeakPolarHBondContact O-CG2 3.41Å; G108-V110 PolarHBondContact O-N 2.96Å; V110-N112 VanDerWaalsContact C-N 3.35Å; V110-N112 PolarHBondContact O-N 3.41Å; V110-F117 HydrophobicContact CG1-CE2 3.88Å; V110-F117 HydrophobicContact CG1-CZ 3.98Å; V110-V188 HydrophobicContact CB-CG1 4.31Å; V110-V188 HydrophobicContact CB-CG2 4.46Å; V110-V188 HydrophobicContact CG2-CG1 3.83Å
111	S	44.9	Very low	62.4	Low	58 Å²	58	77 Å²	77	41%	0.406	41%	0.406	S	S	.	.			trans	-70	102.8	163.9	-79.4	0	0	0	0	107.9	V109 E190	V109-S111 PolarHBondContact O-N 2.9Å; S111-E190 WeakPolarHBondContact CA-OE1 3.25Å; S111-E190 VanDerWaalsContact CB-OE1 3.32Å; S111-E190 WeakPolarHBondContact CB-OE1 3.28Å; S111-E190 VanDerWaalsContact OG-CD 3.24Å; S111-E190 PolarHBondContact OG-OE1 2.82Å
112	N	40.8	Very low	62.5	Low	95 Å²	95	81.5 Å²	81.5	51%	0.508	43%	0.427	S	S	.	.	S	Bend	trans	41.3	89.7	140.9	-60.1	-33.9	0	0	0	113.5	V110	V110-N112 VanDerWaalsContact C-N 3.35Å; V110-N112 PolarHBondContact O-N 3.41Å
113	N	49.2	Very low	62.8	Low	101 Å²	101	82.7 Å²	82.7	54%	0.54	43%	0.431	S	S	.	.				159.4	139.2	113.6	-71.4	-23.7	0	0	0	105.2	F115 C116 F117	N113-F115 HydrophobicContact CB-CB 3.57Å; N113-F115 PolarHBondContact O-N 3.31Å; N113-C116 PolarHBondContact O-N 3.43Å; N113-F117 PolarHBondContact O-N 2.62Å
114	E	52.1	Low	63.4	Low	161 Å²	161	76.9 Å²	76.9	75%	0.752	40%	0.4	S	S	*	.	H	α-helix	trans	-44	-30.5	159.4	-87.1	162.1	126.2	0	0	111.3	C116 F117 Q118	E114-C116 VanDerWaalsContact C-N 3.35Å; E114-C116 PolarHBondContact O-N 2.99Å; E114-F117 PolarHBondContact O-N 3.14Å; E114-Q118 WeakPolarHBondContact O-CB 3.28Å; E114-Q118 VanDerWaalsContact O-CG 3.25Å; E114-Q118 WeakPolarHBondContact O-CG 3.41Å; E114-Q118 PolarHBondContact O-N 2.86Å
115	F	51.3	Low	64.1	Low	114 Å²	114	77.6 Å²	77.6	50%	0.5	40%	0.396	S	S	.	.	H	α-helix	trans	-58.2	-33.6	171.7	-165.2	-120.1	0	0	0	115.6	N113 K119	N113-F115 HydrophobicContact CB-CB 3.57Å; N113-F115 PolarHBondContact O-N 3.31Å; F115-K119 HydrophobicContact CD1-CD 4.15Å; F115-K119 HydrophobicContact CE1-CD 4.07Å; F115-K119 HydrophobicContact CZ-CD 4.43Å; F115-K119 VanDerWaalsContact O-CB 3.31Å; F115-K119 WeakPolarHBondContact O-CB 3.15Å; F115-K119 WeakPolarHBondContact O-CD 3.4Å; F115-K119 WeakPolarHBondContact O-CG 3.45Å; F115-K119 PolarHBondContact O-N 2.86Å; F115-K119 VanDerWaalsContact O-N 3.09Å
116	C	60.3	Low	65.3	Low	59 Å²	59	78 Å²	78	40%	0.399	40%	0.402	S	S	.	.	H	α-helix	trans	-76	-40.3	175.8	-165.3	0	0	0	0	111	N113 E114 K119 L120	N113-C116 PolarHBondContact O-N 3.43Å; E114-C116 VanDerWaalsContact C-N 3.35Å; E114-C116 PolarHBondContact O-N 2.99Å; C116-K119 PolarHBondContact O-N 2.99Å; C116-L120 WeakPolarHBondContact O-CB 3.28Å; C116-L120 WeakPolarHBondContact O-CG 3.49Å; C116-L120 PolarHBondContact O-N 2.95Å
117	F	66.3	Low	67.2	Low	56 Å²	56	74.6 Å²	74.6	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-63.9	-48.1	174.2	-74.6	-75.1	0	0	0	111.5	V110 N113 E114 K119 L120 E121 S174	V110-F117 HydrophobicContact CG1-CE2 3.88Å; V110-F117 HydrophobicContact CG1-CZ 3.98Å; N113-F117 PolarHBondContact O-N 2.62Å; E114-F117 PolarHBondContact O-N 3.14Å; F117-K119 VanDerWaalsContact C-N 3.29Å; F117-K119 PolarHBondContact O-N 3.3Å; F117-L120 CarbonylContact O-C 3.56Å; F117-L120 WeakPolarHBondContact O-CA 2.91Å; F117-L120 WeakPolarHBondContact O-CB 3.44Å; F117-L120 PolarHBondContact O-N 3.46Å; F117-E121 WeakPolarHBondContact O-CG 3.47Å; F117-E121 PolarHBondContact O-N 3.41Å; F117-S174 WeakPolarHBondContact CE1-OG 3.28Å; F117-S174 WeakPolarHBondContact CZ-OG 3.24Å
118	Q	72.9	Confident	69.1	Low	97 Å²	97	76.2 Å²	76.2	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-56	-44.6	173.6	-73.5	170.4	4.7	0	0	111.2	E114 L120 E121 E122	E114-Q118 WeakPolarHBondContact O-CB 3.28Å; E114-Q118 VanDerWaalsContact O-CG 3.25Å; E114-Q118 WeakPolarHBondContact O-CG 3.41Å; E114-Q118 PolarHBondContact O-N 2.86Å; Q118-L120 VanDerWaalsContact C-N 3.32Å; Q118-L120 PolarHBondContact O-N 3.03Å; Q118-E121 PolarHBondContact O-N 3.43Å; Q118-E122 WeakPolarHBondContact O-CB 3.25Å; Q118-E122 VanDerWaalsContact O-CG 3.25Å; Q118-E122 WeakPolarHBondContact O-CG 3.42Å; Q118-E122 PolarHBondContact O-N 2.7Å
119	K	78.2	Confident	71.2	Confident	91 Å²	91	82.1 Å²	82.1	40%	0.396	42%	0.416	S	S	.	.	H	α-helix	trans	-64.3	-33.7	174.6	-79.5	177	174.2	-172.5	0	113.8	F115 C116 F117 K123	F115-K119 HydrophobicContact CD1-CD 4.15Å; F115-K119 HydrophobicContact CE1-CD 4.07Å; F115-K119 HydrophobicContact CZ-CD 4.43Å; F115-K119 VanDerWaalsContact O-CB 3.31Å; F115-K119 WeakPolarHBondContact O-CB 3.15Å; F115-K119 WeakPolarHBondContact O-CD 3.4Å; F115-K119 WeakPolarHBondContact O-CG 3.45Å; F115-K119 PolarHBondContact O-N 2.86Å; F115-K119 VanDerWaalsContact O-N 3.09Å; C116-K119 PolarHBondContact O-N 2.99Å; F117-K119 VanDerWaalsContact C-N 3.29Å; F117-K119 PolarHBondContact O-N 3.3Å; K119-K123 WeakPolarHBondContact O-CB 3.41Å; K119-K123 WeakPolarHBondContact O-CD 2.98Å; K119-K123 WeakPolarHBondContact O-CG 3.42Å; K119-K123 PolarHBondContact O-N 2.94Å
120	L	78.8	Confident	73.5	Confident	32 Å²	32	82.7 Å²	82.7	17%	0.168	41%	0.411	C	S	.	.	H	α-helix	trans	-71.8	-40.9	175	-83	159.4	0	0	0	110.7	C116 F117 Q118 K123 I124 I171	C116-L120 WeakPolarHBondContact O-CB 3.28Å; C116-L120 WeakPolarHBondContact O-CG 3.49Å; C116-L120 PolarHBondContact O-N 2.95Å; F117-L120 CarbonylContact O-C 3.56Å; F117-L120 WeakPolarHBondContact O-CA 2.91Å; F117-L120 WeakPolarHBondContact O-CB 3.44Å; F117-L120 PolarHBondContact O-N 3.46Å; Q118-L120 VanDerWaalsContact C-N 3.32Å; Q118-L120 PolarHBondContact O-N 3.03Å; L120-K123 WeakPolarHBondContact O-CB 3.34Å; L120-K123 PolarHBondContact O-N 3.25Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.88Å; L120-I171 HydrophobicContact CB-CD1 3.88Å; L120-I171 HydrophobicContact CB-CG1 4.18Å
121	E	83.7	Confident	75.7	Confident	97 Å²	97	81.2 Å²	81.2	45%	0.453	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-46.2	174	-71.2	177.8	174.7	0	0	111.5	F117 Q118 K123 I124 Q125 I171	F117-E121 WeakPolarHBondContact O-CG 3.47Å; F117-E121 PolarHBondContact O-N 3.41Å; Q118-E121 PolarHBondContact O-N 3.43Å; E121-K123 VanDerWaalsContact C-N 3.32Å; E121-K123 PolarHBondContact O-N 3.37Å; E121-I124 WeakPolarHBondContact O-CB 3.49Å; E121-I124 PolarHBondContact O-N 2.76Å; E121-I124 VanDerWaalsContact O-N 3.14Å; E121-Q125 WeakPolarHBondContact O-CG 3.46Å; E121-Q125 PolarHBondContact O-N 3.45Å; E121-I171 HydrophobicContact CG-CD1 3.71Å
122	E	86.5	Confident	78	Confident	112 Å²	112	82.5 Å²	82.5	52%	0.523	41%	0.408	S	S	.	.	H	α-helix	trans	-58.1	-43.1	172.3	-75.2	172.1	-177.3	0	0	111.2	Q118 I124 Q125 V126	Q118-E122 WeakPolarHBondContact O-CB 3.25Å; Q118-E122 VanDerWaalsContact O-CG 3.25Å; Q118-E122 WeakPolarHBondContact O-CG 3.42Å; Q118-E122 PolarHBondContact O-N 2.7Å; E122-I124 PolarHBondContact O-N 2.77Å; E122-Q125 PolarHBondContact O-N 3Å; E122-V126 VanDerWaalsContact O-CG2 3.3Å; E122-V126 WeakPolarHBondContact O-CG2 3.4Å; E122-V126 PolarHBondContact O-N 2.9Å
123	K	86.2	Confident	80.5	Confident	126 Å²	126	80.2 Å²	80.2	55%	0.548	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-41.2	174.7	-79.1	172	-178.4	-173.6	0	112	K119 L120 E121 Q125 V126 L127	K119-K123 WeakPolarHBondContact O-CB 3.41Å; K119-K123 WeakPolarHBondContact O-CD 2.98Å; K119-K123 WeakPolarHBondContact O-CG 3.42Å; K119-K123 PolarHBondContact O-N 2.94Å; L120-K123 WeakPolarHBondContact O-CB 3.34Å; L120-K123 PolarHBondContact O-N 3.25Å; E121-K123 VanDerWaalsContact C-N 3.32Å; E121-K123 PolarHBondContact O-N 3.37Å; K123-Q125 VanDerWaalsContact C-N 3.34Å; K123-V126 PolarHBondContact O-N 3.5Å; K123-L127 VanDerWaalsContact O-CB 3.32Å; K123-L127 WeakPolarHBondContact O-CB 3.29Å; K123-L127 VanDerWaalsContact O-CG 3.23Å; K123-L127 WeakPolarHBondContact O-CG 3.36Å; K123-L127 PolarHBondContact O-N 3.34Å
124	I	90.3	Very high	82.6	Confident	27 Å²	27	77.1 Å²	77.1	14%	0.138	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-43	176.2	-72	165.9	0	0	0	110.2	L120 E121 E122 L127 S128 R164 C167 Q168 I171	L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.88Å; E121-I124 WeakPolarHBondContact O-CB 3.49Å; E121-I124 PolarHBondContact O-N 2.76Å; E121-I124 VanDerWaalsContact O-N 3.14Å; E122-I124 PolarHBondContact O-N 2.77Å; I124-L127 PolarHBondContact O-N 3.44Å; I124-S128 VanDerWaalsContact O-CB 3.25Å; I124-S128 WeakPolarHBondContact O-CB 3.46Å; I124-S128 PolarHBondContact O-N 2.99Å; I124-S128 PolarHBondContact O-OG 2.91Å; I124-R164 HydrophobicContact CG2-CG 4.27Å; I124-C167 HydrophobicContact CD1-CB 4.01Å; I124-C167 HydrophobicContact CG1-CB 3.64Å; I124-Q168 HydrophobicContact CD1-CB 4.25Å; I124-I171 HydrophobicContact CD1-CD1 3.34Å; I124-I171 HydrophobicContact CD1-CG1 4.19Å
125	Q	90.1	Very high	84.6	Confident	114 Å²	114	73.3 Å²	73.3	53%	0.533	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-52.2	175.2	-71.6	176.7	7	0	0	110.8	E121 E122 K123 L127 S128 E129	E121-Q125 WeakPolarHBondContact O-CG 3.46Å; E121-Q125 PolarHBondContact O-N 3.45Å; E122-Q125 PolarHBondContact O-N 3Å; K123-Q125 VanDerWaalsContact C-N 3.34Å; Q125-L127 VanDerWaalsContact C-N 3.34Å; Q125-L127 PolarHBondContact O-N 2.96Å; Q125-S128 WeakPolarHBondContact CA-OG 3.37Å; Q125-S128 PolarHBondContact O-N 3.43Å; Q125-S128 VanDerWaalsContact O-N 3.1Å; Q125-S128 PolarHBondContact O-OG 3.05Å; Q125-E129 WeakPolarHBondContact O-CG 3.33Å; Q125-E129 PolarHBondContact O-N 3.39Å
126	V	92.7	Very high	86.6	Confident	65 Å²	65	70 Å²	70	39%	0.394	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-40.5	178.7	171.6	0	0	0	0	112.3	E122 K123 K130	E122-V126 VanDerWaalsContact O-CG2 3.3Å; E122-V126 WeakPolarHBondContact O-CG2 3.4Å; E122-V126 PolarHBondContact O-N 2.9Å; K123-V126 PolarHBondContact O-N 3.5Å; V126-K130 HydrophobicContact CG1-CD 4.26Å; V126-K130 VanDerWaalsContact O-CG 3.27Å; V126-K130 WeakPolarHBondContact O-CG 3.06Å; V126-K130 PolarHBondContact O-N 2.84Å; V126-K130 VanDerWaalsContact O-N 3.07Å
127	L	91.7	Very high	88.1	Confident	21 Å²	21	72 Å²	72	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-42.1	175.2	-73.3	172	0	0	0	111	K123 I124 Q125 E129 K130 V131 L160 E163 R164	K123-L127 VanDerWaalsContact O-CB 3.32Å; K123-L127 WeakPolarHBondContact O-CB 3.29Å; K123-L127 VanDerWaalsContact O-CG 3.23Å; K123-L127 WeakPolarHBondContact O-CG 3.36Å; K123-L127 PolarHBondContact O-N 3.34Å; I124-L127 PolarHBondContact O-N 3.44Å; Q125-L127 VanDerWaalsContact C-N 3.34Å; Q125-L127 PolarHBondContact O-N 2.96Å; L127-E129 PolarHBondContact O-N 3.15Å; L127-K130 PolarHBondContact O-N 3.43Å; L127-V131 VanDerWaalsContact O-CG2 3.26Å; L127-V131 WeakPolarHBondContact O-CG2 3.44Å; L127-V131 PolarHBondContact O-N 2.97Å; L127-L160 HydrophobicContact CD2-CD2 4.05Å; L127-E163 HydrophobicContact CD1-CB 4.38Å; L127-R164 HydrophobicContact CB-CB 4.05Å; L127-R164 HydrophobicContact CD1-CB 4.27Å
128	S	91.9	Very high	89.4	Confident	44 Å²	44	69.5 Å²	69.5	31%	0.308	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-41.2	178	73.2	0	0	0	0	112.1	I124 Q125 V131 T132	I124-S128 VanDerWaalsContact O-CB 3.25Å; I124-S128 WeakPolarHBondContact O-CB 3.46Å; I124-S128 PolarHBondContact O-N 2.99Å; I124-S128 PolarHBondContact O-OG 2.91Å; Q125-S128 WeakPolarHBondContact CA-OG 3.37Å; Q125-S128 PolarHBondContact O-N 3.43Å; Q125-S128 VanDerWaalsContact O-N 3.1Å; Q125-S128 PolarHBondContact O-OG 3.05Å; S128-V131 PolarHBondContact O-N 3.01Å; S128-T132 WeakPolarHBondContact O-CG2 3.31Å; S128-T132 PolarHBondContact O-N 3.17Å; S128-T132 PolarHBondContact O-OG1 3.17Å
129	E	94.1	Very high	90.3	Very high	124 Å²	124	71.4 Å²	71.4	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-64.6	-38.7	174.4	-71.1	174.4	-177.5	0	0	112.2	Q125 L127 T132 A133	Q125-E129 WeakPolarHBondContact O-CG 3.33Å; Q125-E129 PolarHBondContact O-N 3.39Å; L127-E129 PolarHBondContact O-N 3.15Å; E129-T132 PolarHBondContact O-OG1 3.21Å; E129-A133 VanDerWaalsContact O-CB 3.27Å; E129-A133 WeakPolarHBondContact O-CB 3.44Å; E129-A133 PolarHBondContact O-N 3.5Å
130	K	93.3	Very high	91.1	Very high	107 Å²	107	72 Å²	72	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-67.5	-42	175.1	-74.5	173.3	-178.8	-180	0	112.1	V126 L127 A133 L134 L160	V126-K130 HydrophobicContact CG1-CD 4.26Å; V126-K130 VanDerWaalsContact O-CG 3.27Å; V126-K130 WeakPolarHBondContact O-CG 3.06Å; V126-K130 PolarHBondContact O-N 2.84Å; V126-K130 VanDerWaalsContact O-N 3.07Å; L127-K130 PolarHBondContact O-N 3.43Å; K130-A133 PolarHBondContact O-N 3.37Å; K130-L134 WeakPolarHBondContact O-CB 3.22Å; K130-L134 WeakPolarHBondContact O-CG 3.29Å; K130-L134 PolarHBondContact O-N 2.96Å; K130-L160 HydrophobicContact CB-CD1 4.28Å
131	V	94.1	Very high	91.7	Very high	4 Å²	4	71.9 Å²	71.9	2%	0.024	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-47.1	177.1	170.6	0	0	0	0	110	L127 S128 A133 L134 Q135 L160 A161	L127-V131 VanDerWaalsContact O-CG2 3.26Å; L127-V131 WeakPolarHBondContact O-CG2 3.44Å; L127-V131 PolarHBondContact O-N 2.97Å; S128-V131 PolarHBondContact O-N 3.01Å; V131-A133 PolarHBondContact O-N 3.35Å; V131-L134 PolarHBondContact O-N 3.43Å; V131-Q135 HydrophobicContact CG1-CG 4.41Å; V131-Q135 WeakPolarHBondContact O-CB 3.16Å; V131-Q135 VanDerWaalsContact O-CG 3.25Å; V131-Q135 WeakPolarHBondContact O-CG 3.44Å; V131-Q135 PolarHBondContact O-N 3.4Å; V131-L160 HydrophobicContact CG2-CB 3.74Å; V131-A161 HydrophobicContact CG1-CB 4.4Å; V131-A161 HydrophobicContact CG2-CB 4.27Å
132	T	93.9	Very high	92.1	Very high	86 Å²	86	69.1 Å²	69.1	53%	0.528	37%	0.368	S	S	.	.	H	α-helix	trans	-65.7	-37.3	177.8	56.6	0	0	0	0	112.4	S128 E129 Q135 A136	S128-T132 WeakPolarHBondContact O-CG2 3.31Å; S128-T132 PolarHBondContact O-N 3.17Å; S128-T132 PolarHBondContact O-OG1 3.17Å; E129-T132 PolarHBondContact O-OG1 3.21Å; T132-Q135 PolarHBondContact O-N 3.19Å; T132-A136 WeakPolarHBondContact O-CB 3.46Å; T132-A136 PolarHBondContact O-N 3.33Å
133	A	94	Very high	92.3	Very high	46 Å²	46	70 Å²	70	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-65.1	-43	175.3	0	0	0	0	0	112.7	E129 K130 V131 A136 Q137	E129-A133 VanDerWaalsContact O-CB 3.27Å; E129-A133 WeakPolarHBondContact O-CB 3.44Å; E129-A133 PolarHBondContact O-N 3.5Å; K130-A133 PolarHBondContact O-N 3.37Å; V131-A133 PolarHBondContact O-N 3.35Å; A133-A136 PolarHBondContact O-N 3.45Å; A133-Q137 WeakPolarHBondContact O-CG 3.4Å; A133-Q137 PolarHBondContact O-N 2.96Å; A133-Q137 VanDerWaalsContact O-N 3.09Å
134	L	93.1	Very high	92.6	Very high	36 Å²	36	70.5 Å²	70.5	19%	0.188	39%	0.385	C	S	.	.	H	α-helix	trans	-68.6	-38.5	176.5	-71.1	172.5	0	0	0	111.8	K130 V131 Q137 A138 I153 A157 L160	K130-L134 WeakPolarHBondContact O-CB 3.22Å; K130-L134 WeakPolarHBondContact O-CG 3.29Å; K130-L134 PolarHBondContact O-N 2.96Å; V131-L134 PolarHBondContact O-N 3.43Å; L134-Q137 PolarHBondContact O-N 2.87Å; L134-A138 PolarHBondContact O-N 2.86Å; L134-I153 HydrophobicContact CB-CG2 4.01Å; L134-I153 HydrophobicContact CD2-CG2 4.07Å; L134-I153 VanDerWaalsContact O-CG2 3.23Å; L134-I153 WeakPolarHBondContact O-CG2 3.45Å; L134-A157 HydrophobicContact CB-CB 3.92Å; L134-A157 HydrophobicContact CD1-CB 4.38Å; L134-L160 HydrophobicContact CD1-CD1 3.6Å
135	Q	93.3	Very high	92.7	Very high	82 Å²	82	71.6 Å²	71.6	38%	0.383	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-44.3	174.6	-75.7	173.4	-14.1	0	0	111.5	V131 T132 Q137 A138 E139 A157	V131-Q135 HydrophobicContact CG1-CG 4.41Å; V131-Q135 WeakPolarHBondContact O-CB 3.16Å; V131-Q135 VanDerWaalsContact O-CG 3.25Å; V131-Q135 WeakPolarHBondContact O-CG 3.44Å; V131-Q135 PolarHBondContact O-N 3.4Å; T132-Q135 PolarHBondContact O-N 3.19Å; Q135-Q137 VanDerWaalsContact C-N 3.32Å; Q135-Q137 PolarHBondContact O-N 3.22Å; Q135-A138 WeakPolarHBondContact O-CB 3.4Å; Q135-A138 PolarHBondContact O-N 3.26Å; Q135-E139 WeakPolarHBondContact O-CG 3.48Å; Q135-E139 PolarHBondContact O-N 3.47Å; Q135-A157 HydrophobicContact CG-CB 4.26Å
136	A	93.6	Very high	92.7	Very high	43 Å²	43	69.5 Å²	69.5	36%	0.355	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-36.6	175.1	0	0	0	0	0	112.7	T132 A133 E139 N140	T132-A136 WeakPolarHBondContact O-CB 3.46Å; T132-A136 PolarHBondContact O-N 3.33Å; A133-A136 PolarHBondContact O-N 3.45Å; A136-E139 PolarHBondContact O-N 2.79Å; A136-N140 PolarHBondContact O-N 2.94Å; A136-N140 VanDerWaalsContact O-N 3.11Å; A136-N140 PolarHBondContact O-ND2 2.71Å
137	Q	92.5	Very high	92.6	Very high	101 Å²	101	70.5 Å²	70.5	47%	0.472	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-41.7	173.6	-72.8	175.1	20.5	0	0	111.8	A133 L134 Q135 E139 N140 L141	A133-Q137 WeakPolarHBondContact O-CG 3.4Å; A133-Q137 PolarHBondContact O-N 2.96Å; A133-Q137 VanDerWaalsContact O-N 3.09Å; L134-Q137 PolarHBondContact O-N 2.87Å; Q135-Q137 VanDerWaalsContact C-N 3.32Å; Q135-Q137 PolarHBondContact O-N 3.22Å; Q137-E139 VanDerWaalsContact C-N 3.35Å; Q137-N140 PolarHBondContact O-N 2.99Å; Q137-L141 WeakPolarHBondContact O-CG 3.27Å; Q137-L141 PolarHBondContact O-N 3.37Å
138	A	93.4	Very high	92.6	Very high	5 Å²	5	76.4 Å²	76.4	4%	0.041	43%	0.428	C	S	.	.	H	α-helix	trans	-64.5	-38.2	176.1	0	0	0	0	0	112.5	L134 Q135 G142 I153 I154	L134-A138 PolarHBondContact O-N 2.86Å; Q135-A138 WeakPolarHBondContact O-CB 3.4Å; Q135-A138 PolarHBondContact O-N 3.26Å; A138-G142 PolarHBondContact O-N 2.92Å; A138-I153 HydrophobicContact CB-CB 4.3Å; A138-I153 HydrophobicContact CB-CG2 4.02Å; A138-I154 HydrophobicContact CB-CD1 4.14Å; A138-I154 HydrophobicContact CB-CG1 3.58Å
139	E	91.8	Very high	92.6	Very high	137 Å²	137	79.2 Å²	79.2	64%	0.64	44%	0.436	S	S	*	.	H	α-helix	trans	-62.7	-46	174.9	-73.6	176.3	-179.1	0	0	111.8	Q135 A136 Q137 G142 V143	Q135-E139 WeakPolarHBondContact O-CG 3.48Å; Q135-E139 PolarHBondContact O-N 3.47Å; A136-E139 PolarHBondContact O-N 2.79Å; Q137-E139 VanDerWaalsContact C-N 3.35Å; E139-G142 WeakPolarHBondContact O-CA 3.43Å; E139-G142 PolarHBondContact O-N 2.9Å; E139-G142 VanDerWaalsContact O-N 3.17Å; E139-V143 WeakPolarHBondContact O-CG2 3.33Å; E139-V143 PolarHBondContact O-N 3.45Å
140	N	93.4	Very high	92.5	Very high	103 Å²	103	73.7 Å²	73.7	55%	0.551	41%	0.412	S	S	*	.	H	α-helix	trans	-61.8	-46.5	178.1	-70.3	-30.2	0	0	0	111.9	A136 Q137 G142 V143 E144	A136-N140 PolarHBondContact O-N 2.94Å; A136-N140 VanDerWaalsContact O-N 3.11Å; A136-N140 PolarHBondContact O-ND2 2.71Å; Q137-N140 PolarHBondContact O-N 2.99Å; N140-G142 PolarHBondContact O-N 2.79Å; N140-V143 PolarHBondContact O-N 3.32Å; N140-E144 WeakPolarHBondContact O-CG 2.94Å; N140-E144 PolarHBondContact O-N 2.83Å
141	L	92.3	Very high	92.4	Very high	30 Å²	30	74.6 Å²	74.6	16%	0.157	42%	0.418	C	S	.	.	H	α-helix	trans	-64.8	-31.4	175.8	-71.6	165.4	0	0	0	112.2	Q137 E144 G145 N146 A150 I153	Q137-L141 WeakPolarHBondContact O-CG 3.27Å; Q137-L141 PolarHBondContact O-N 3.37Å; L141-E144 PolarHBondContact O-N 2.84Å; L141-G145 PolarHBondContact O-N 3.21Å; L141-N146 HydrophobicContact CB-CB 4.42Å; L141-N146 HydrophobicContact CD2-CB 4.35Å; L141-N146 PolarHBondContact O-N 3.36Å; L141-A150 HydrophobicContact CB-CB 4.16Å; L141-I153 HydrophobicContact CD1-CD1 3.28Å
142	G	92.2	Very high	92.4	Very high	39 Å²	39	80.7 Å²	80.7	40%	0.402	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-41	172.6	0	0	0	0	0	112.8	A138 E139 N140 G145	A138-G142 PolarHBondContact O-N 2.92Å; E139-G142 WeakPolarHBondContact O-CA 3.43Å; E139-G142 PolarHBondContact O-N 2.9Å; E139-G142 VanDerWaalsContact O-N 3.17Å; N140-G142 PolarHBondContact O-N 2.79Å; G142-G145 PolarHBondContact O-N 3.47Å
143	V	91.2	Very high	92.4	Very high	131 Å²	131	78 Å²	78	79%	0.794	43%	0.426	S	S	*	.	H	α-helix	trans	-68	-36.3	175.1	175.3	0	0	0	0	111.6	E139 N140 G145	E139-V143 WeakPolarHBondContact O-CG2 3.33Å; E139-V143 PolarHBondContact O-N 3.45Å; N140-V143 PolarHBondContact O-N 3.32Å; V143-G145 PolarHBondContact O-N 3.41Å
144	E	92.5	Very high	92.3	Very high	136 Å²	136	79.4 Å²	79.4	64%	0.636	43%	0.426	S	S	*	.	H	α-helix	trans	-68.5	-14.2	174.4	-69.4	176.6	-178.2	0	0	113.3	N140 L141	N140-E144 WeakPolarHBondContact O-CG 2.94Å; N140-E144 PolarHBondContact O-N 2.83Å; L141-E144 PolarHBondContact O-N 2.84Å
145	G	91.7	Very high	92.4	Very high	50 Å²	50	80 Å²	80	52%	0.515	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	6	-179.3	0	0	0	0	0	114.6	L141 G142 V143 V147	L141-G145 PolarHBondContact O-N 3.21Å; G142-G145 PolarHBondContact O-N 3.47Å; V143-G145 PolarHBondContact O-N 3.41Å; G145-V147 VanDerWaalsContact C-N 3.29Å; G145-V147 PolarHBondContact O-N 3.2Å
146	N	91.3	Very high	92.3	Very high	69 Å²	69	81.3 Å²	81.3	37%	0.369	44%	0.444	S	S	.	.			trans	-84	66.3	179.9	-65.9	-30.6	0	0	0	111.4	L141 E148 E149 A150	L141-N146 HydrophobicContact CB-CB 4.42Å; L141-N146 HydrophobicContact CD2-CB 4.35Å; L141-N146 PolarHBondContact O-N 3.36Å; N146-E148 PolarHBondContact O-N 3.02Å; N146-E149 HydrophobicContact CB-CB 4.44Å; N146-E149 PolarHBondContact O-N 2.9Å; N146-A150 WeakPolarHBondContact O-CB 3.23Å; N146-A150 PolarHBondContact O-N 3.49Å
147	V	89.5	Confident	92.3	Very high	86 Å²	86	79.3 Å²	79.3	52%	0.521	43%	0.427	S	S	.	.	H	α-helix	trans	-61.2	-40.1	-173.8	-178.9	0	0	0	0	112.7	G145 E149 A150 Q151	G145-V147 VanDerWaalsContact C-N 3.29Å; G145-V147 PolarHBondContact O-N 3.2Å; V147-E149 PolarHBondContact O-N 3.25Å; V147-A150 PolarHBondContact O-N 3.18Å; V147-Q151 HydrophobicContact CG1-CG 4.36Å; V147-Q151 WeakPolarHBondContact O-CB 3.33Å; V147-Q151 VanDerWaalsContact O-CG 3.27Å; V147-Q151 WeakPolarHBondContact O-CG 3.29Å; V147-Q151 PolarHBondContact O-N 3.3Å
148	E	91.5	Very high	92.4	Very high	146 Å²	146	78.3 Å²	78.3	68%	0.682	43%	0.425	S	S	*	.	H	α-helix	trans	-66.4	-36.2	-178.5	-63.5	-172.6	174.3	0	0	113	N146 K152	N146-E148 PolarHBondContact O-N 3.02Å; E148-K152 WeakPolarHBondContact O-CG 3.35Å; E148-K152 PolarHBondContact O-N 3.2Å
149	E	91.8	Very high	92.3	Very high	103 Å²	103	84.1 Å²	84.1	48%	0.481	45%	0.452	S	S	.	.	H	α-helix	trans	-76.4	-42.1	177.6	-64.4	-174	167	0	0	110.9	N146 V147 Q151 K152 I153	N146-E149 HydrophobicContact CB-CB 4.44Å; N146-E149 PolarHBondContact O-N 2.9Å; V147-E149 PolarHBondContact O-N 3.25Å; E149-Q151 VanDerWaalsContact C-N 3.3Å; E149-Q151 PolarHBondContact O-N 3.41Å; E149-K152 PolarHBondContact O-N 2.92Å; E149-K152 VanDerWaalsContact O-N 3.16Å; E149-I153 PolarHBondContact O-N 3.16Å; E149-I153 VanDerWaalsContact O-N 3.13Å
150	A	92.2	Very high	92.3	Very high	7 Å²	7	79.6 Å²	79.6	6%	0.058	43%	0.432	C	S	.	.	H	α-helix	trans	-56.9	-43.4	173.8	0	0	0	0	0	111.6	L141 N146 V147 K152 I153 I154	L141-A150 HydrophobicContact CB-CB 4.16Å; N146-A150 WeakPolarHBondContact O-CB 3.23Å; N146-A150 PolarHBondContact O-N 3.49Å; V147-A150 PolarHBondContact O-N 3.18Å; A150-K152 VanDerWaalsContact C-N 3.35Å; A150-K152 PolarHBondContact O-N 3.4Å; A150-I153 PolarHBondContact O-N 3.06Å; A150-I154 VanDerWaalsContact O-CG1 3.27Å; A150-I154 WeakPolarHBondContact O-CG1 3.37Å; A150-I154 PolarHBondContact O-N 3.01Å
151	Q	92.1	Very high	92.2	Very high	126 Å²	126	75.3 Å²	75.3	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-39.5	176.7	-78.6	178.5	-16.9	0	0	113.2	V147 E149 I154 A155	V147-Q151 HydrophobicContact CG1-CG 4.36Å; V147-Q151 WeakPolarHBondContact O-CB 3.33Å; V147-Q151 VanDerWaalsContact O-CG 3.27Å; V147-Q151 WeakPolarHBondContact O-CG 3.29Å; V147-Q151 PolarHBondContact O-N 3.3Å; E149-Q151 VanDerWaalsContact C-N 3.3Å; E149-Q151 PolarHBondContact O-N 3.41Å; Q151-I154 PolarHBondContact O-N 3.2Å; Q151-A155 PolarHBondContact O-N 2.94Å
152	K	93.7	Very high	92.2	Very high	132 Å²	132	80.6 Å²	80.6	57%	0.574	43%	0.434	S	S	*	.	H	α-helix	trans	-66.1	-40.5	177.2	-69.6	169.2	-171.7	166.6	0	111.8	E148 E149 A150 A155 M156	E148-K152 WeakPolarHBondContact O-CG 3.35Å; E148-K152 PolarHBondContact O-N 3.2Å; E149-K152 PolarHBondContact O-N 2.92Å; E149-K152 VanDerWaalsContact O-N 3.16Å; A150-K152 VanDerWaalsContact C-N 3.35Å; A150-K152 PolarHBondContact O-N 3.4Å; K152-A155 PolarHBondContact O-N 2.9Å; K152-M156 WeakPolarHBondContact O-CG 3.44Å; K152-M156 PolarHBondContact O-N 3.12Å; K152-M156 VanDerWaalsContact O-N 3.09Å
153	I	93.3	Very high	92	Very high	30 Å²	30	84 Å²	84	15%	0.154	44%	0.44	C	S	.	.	H	α-helix	trans	-69.2	-39	178.9	-66.2	173.2	0	0	0	110.9	L134 A138 L141 E149 A150 A155 M156 A157	L134-I153 HydrophobicContact CB-CG2 4.01Å; L134-I153 HydrophobicContact CD2-CG2 4.07Å; L134-I153 VanDerWaalsContact O-CG2 3.23Å; L134-I153 WeakPolarHBondContact O-CG2 3.45Å; A138-I153 HydrophobicContact CB-CB 4.3Å; A138-I153 HydrophobicContact CB-CG2 4.02Å; L141-I153 HydrophobicContact CD1-CD1 3.28Å; E149-I153 PolarHBondContact O-N 3.16Å; E149-I153 VanDerWaalsContact O-N 3.13Å; A150-I153 PolarHBondContact O-N 3.06Å; I153-A155 VanDerWaalsContact C-N 3.35Å; I153-M156 PolarHBondContact O-N 3.32Å; I153-A157 WeakPolarHBondContact O-CB 3.37Å; I153-A157 PolarHBondContact O-N 3.21Å
154	I	93.1	Very high	91.8	Very high	76 Å²	76	81 Å²	81	39%	0.39	41%	0.414	S	S	.	.	H	α-helix	trans	-60.7	-45.7	173.8	-67.7	164.4	0	0	0	110.2	A138 A150 Q151 M156 A157 D158	A138-I154 HydrophobicContact CB-CD1 4.14Å; A138-I154 HydrophobicContact CB-CG1 3.58Å; A150-I154 VanDerWaalsContact O-CG1 3.27Å; A150-I154 WeakPolarHBondContact O-CG1 3.37Å; A150-I154 PolarHBondContact O-N 3.01Å; Q151-I154 PolarHBondContact O-N 3.2Å; I154-M156 VanDerWaalsContact C-N 3.3Å; I154-M156 PolarHBondContact O-N 3.43Å; I154-A157 CarbonylContact O-C 3.58Å; I154-A157 WeakPolarHBondContact O-CA 3.38Å; I154-A157 WeakPolarHBondContact O-CB 3.33Å; I154-A157 PolarHBondContact O-N 3.03Å; I154-D158 PolarHBondContact O-N 3.3Å
155	A	93.5	Very high	91.5	Very high	49 Å²	49	77.5 Å²	77.5	41%	0.405	40%	0.4	S	S	.	.	H	α-helix	trans	-58.6	-41.3	176.4	0	0	0	0	0	112.3	Q151 K152 I153 D158 E159	Q151-A155 PolarHBondContact O-N 2.94Å; K152-A155 PolarHBondContact O-N 2.9Å; I153-A155 VanDerWaalsContact C-N 3.35Å; A155-D158 PolarHBondContact O-N 2.81Å; A155-E159 WeakPolarHBondContact O-CG 3.4Å; A155-E159 PolarHBondContact O-N 3.41Å
156	M	92.1	Very high	91.1	Very high	108 Å²	108	81 Å²	81	53%	0.532	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-37.1	173.7	-69.1	-179.7	-179.1	0	0	112.7	K152 I153 I154 D158 L160	K152-M156 WeakPolarHBondContact O-CG 3.44Å; K152-M156 PolarHBondContact O-N 3.12Å; K152-M156 VanDerWaalsContact O-N 3.09Å; I153-M156 PolarHBondContact O-N 3.32Å; I154-M156 VanDerWaalsContact C-N 3.3Å; I154-M156 PolarHBondContact O-N 3.43Å; M156-D158 VanDerWaalsContact C-N 3.33Å; M156-L160 WeakPolarHBondContact O-CG 3.39Å; M156-L160 PolarHBondContact O-N 2.86Å
157	A	93.2	Very high	90.6	Very high	1 Å²	1	78.8 Å²	78.8	1%	0.008	39%	0.392	C	S	.	.	H	α-helix	trans	-67	-36.5	175.8	0	0	0	0	0	111.6	L134 Q135 I153 I154 L160 A161	L134-A157 HydrophobicContact CB-CB 3.92Å; L134-A157 HydrophobicContact CD1-CB 4.38Å; Q135-A157 HydrophobicContact CG-CB 4.26Å; I153-A157 WeakPolarHBondContact O-CB 3.37Å; I153-A157 PolarHBondContact O-N 3.21Å; I154-A157 CarbonylContact O-C 3.58Å; I154-A157 WeakPolarHBondContact O-CA 3.38Å; I154-A157 WeakPolarHBondContact O-CB 3.33Å; I154-A157 PolarHBondContact O-N 3.03Å; A157-L160 PolarHBondContact O-N 3.39Å; A157-A161 VanDerWaalsContact O-CB 3.3Å; A157-A161 WeakPolarHBondContact O-CB 3.17Å; A157-A161 PolarHBondContact O-N 3.31Å
158	D	93.8	Very high	90.1	Very high	81 Å²	81	79.3 Å²	79.3	43%	0.433	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-43.2	176.2	-70.7	-21.4	0	0	0	111.2	I154 A155 M156 L160 A161 E162	I154-D158 PolarHBondContact O-N 3.3Å; A155-D158 PolarHBondContact O-N 2.81Å; M156-D158 VanDerWaalsContact C-N 3.33Å; D158-L160 VanDerWaalsContact C-N 3.33Å; D158-L160 PolarHBondContact O-N 3.38Å; D158-A161 CarbonylContact O-C 3.58Å; D158-A161 WeakPolarHBondContact O-CB 3.28Å; D158-A161 PolarHBondContact O-N 3.02Å; D158-A161 VanDerWaalsContact O-N 3.09Å; D158-E162 WeakPolarHBondContact O-CG 3.3Å; D158-E162 PolarHBondContact O-N 3.24Å
159	E	93.1	Very high	89.5	Confident	127 Å²	127	78.9 Å²	78.9	59%	0.593	39%	0.385	S	S	*	.	H	α-helix	trans	-56.7	-45.9	172.9	-72.8	176.3	-177.1	0	0	111.6	A155 A161 E162 E163	A155-E159 WeakPolarHBondContact O-CG 3.4Å; A155-E159 PolarHBondContact O-N 3.41Å; E159-A161 VanDerWaalsContact C-N 3.33Å; E159-A161 PolarHBondContact O-N 3.12Å; E159-E162 PolarHBondContact O-N 2.99Å; E159-E163 WeakPolarHBondContact O-CG 3.31Å; E159-E163 PolarHBondContact O-N 3Å
160	L	91.8	Very high	88.5	Confident	42 Å²	42	77 Å²	77	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-68.6	-31.6	175.9	-67.2	178.4	0	0	0	112.7	L127 K130 V131 L134 M156 A157 D158 E163 R164	L127-L160 HydrophobicContact CD2-CD2 4.05Å; K130-L160 HydrophobicContact CB-CD1 4.28Å; V131-L160 HydrophobicContact CG2-CB 3.74Å; L134-L160 HydrophobicContact CD1-CD1 3.6Å; M156-L160 WeakPolarHBondContact O-CG 3.39Å; M156-L160 PolarHBondContact O-N 2.86Å; A157-L160 PolarHBondContact O-N 3.39Å; D158-L160 VanDerWaalsContact C-N 3.33Å; D158-L160 PolarHBondContact O-N 3.38Å; L160-E163 PolarHBondContact O-N 3.25Å; L160-R164 WeakPolarHBondContact O-CB 3.33Å; L160-R164 PolarHBondContact O-N 3.3Å
161	A	91.3	Very high	87.6	Confident	13 Å²	13	78 Å²	78	11%	0.107	38%	0.384	C	S	.	.	H	α-helix	trans	-68.7	-38.6	174.9	0	0	0	0	0	111.3	V131 A157 D158 E159 R164 D165	V131-A161 HydrophobicContact CG1-CB 4.4Å; V131-A161 HydrophobicContact CG2-CB 4.27Å; A157-A161 VanDerWaalsContact O-CB 3.3Å; A157-A161 WeakPolarHBondContact O-CB 3.17Å; A157-A161 PolarHBondContact O-N 3.31Å; D158-A161 CarbonylContact O-C 3.58Å; D158-A161 WeakPolarHBondContact O-CB 3.28Å; D158-A161 PolarHBondContact O-N 3.02Å; D158-A161 VanDerWaalsContact O-N 3.09Å; E159-A161 VanDerWaalsContact C-N 3.33Å; E159-A161 PolarHBondContact O-N 3.12Å; A161-R164 WeakPolarHBondContact O-CB 3.4Å; A161-R164 PolarHBondContact O-N 3.05Å; A161-D165 WeakPolarHBondContact O-CB 3.07Å; A161-D165 PolarHBondContact O-N 2.89Å
162	E	91.6	Very high	86.4	Confident	141 Å²	141	78.1 Å²	78.1	66%	0.659	38%	0.383	S	S	*	.	H	α-helix	trans	-63.4	-42.7	172.6	-72.5	-176	178.8	0	0	111.5	D158 E159 D165 H166	D158-E162 WeakPolarHBondContact O-CG 3.3Å; D158-E162 PolarHBondContact O-N 3.24Å; E159-E162 PolarHBondContact O-N 2.99Å; E162-D165 PolarHBondContact O-N 3Å; E162-H166 VanDerWaalsContact O-CB 3.32Å; E162-H166 WeakPolarHBondContact O-CB 3.38Å; E162-H166 PolarHBondContact O-N 2.98Å
163	E	86.9	Confident	84.9	Confident	111 Å²	111	75.7 Å²	75.7	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-43.9	173	-72	-174.9	175.1	0	0	111.6	L127 E159 L160 H166 C167	L127-E163 HydrophobicContact CD1-CB 4.38Å; E159-E163 WeakPolarHBondContact O-CG 3.31Å; E159-E163 PolarHBondContact O-N 3Å; L160-E163 PolarHBondContact O-N 3.25Å; E163-H166 WeakPolarHBondContact O-CB 3.43Å; E163-H166 PolarHBondContact O-N 3.05Å; E163-C167 PolarHBondContact O-N 3.08Å; E163-C167 PolarHBondContact O-SG 3.39Å
164	R	88.2	Confident	83.4	Confident	67 Å²	67	74.9 Å²	74.9	25%	0.253	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-46.1	175.1	171	-89.9	-57.6	-128.7	-7.1	111.5	I124 L127 L160 A161 H166 C167 Q168	I124-R164 HydrophobicContact CG2-CG 4.27Å; L127-R164 HydrophobicContact CB-CB 4.05Å; L127-R164 HydrophobicContact CD1-CB 4.27Å; L160-R164 WeakPolarHBondContact O-CB 3.33Å; L160-R164 PolarHBondContact O-N 3.3Å; A161-R164 WeakPolarHBondContact O-CB 3.4Å; A161-R164 PolarHBondContact O-N 3.05Å; R164-H166 VanDerWaalsContact C-N 3.28Å; R164-H166 PolarHBondContact O-N 3.34Å; R164-C167 PolarHBondContact O-N 2.99Å; R164-Q168 WeakPolarHBondContact O-CB 3.45Å; R164-Q168 PolarHBondContact O-N 2.96Å
165	D	86.5	Confident	81.8	Confident	62 Å²	62	74.4 Å²	74.4	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-34.8	178.7	-78.6	-0.2	0	0	0	111.1	A161 E162 Q168 K169	A161-D165 WeakPolarHBondContact O-CB 3.07Å; A161-D165 PolarHBondContact O-N 2.89Å; E162-D165 PolarHBondContact O-N 3Å; D165-Q168 PolarHBondContact O-N 3.02Å; D165-K169 WeakPolarHBondContact O-CB 3.36Å; D165-K169 WeakPolarHBondContact O-CD 3.36Å; D165-K169 WeakPolarHBondContact O-CG 3.48Å; D165-K169 PolarHBondContact O-N 3.49Å
166	H	82.8	Confident	80.1	Confident	124 Å²	124	74 Å²	74	57%	0.574	36%	0.364	S	S	*	.	H	α-helix	trans	-63.1	-49.1	172.1	-173.6	76.3	0	0	0	111	E162 E163 R164 Q168 K169 V170	E162-H166 VanDerWaalsContact O-CB 3.32Å; E162-H166 WeakPolarHBondContact O-CB 3.38Å; E162-H166 PolarHBondContact O-N 2.98Å; E163-H166 WeakPolarHBondContact O-CB 3.43Å; E163-H166 PolarHBondContact O-N 3.05Å; R164-H166 VanDerWaalsContact C-N 3.28Å; R164-H166 PolarHBondContact O-N 3.34Å; H166-Q168 VanDerWaalsContact C-N 3.34Å; H166-Q168 PolarHBondContact O-N 3.13Å; H166-K169 PolarHBondContact O-N 2.88Å; H166-V170 WeakPolarHBondContact O-CG2 3.32Å; H166-V170 PolarHBondContact O-N 3.24Å
167	C	79.6	Confident	78.3	Confident	23 Å²	23	70.5 Å²	70.5	16%	0.155	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-42.6	174.8	-70.1	0	0	0	0	112.3	I124 E163 R164 V170 I171	I124-C167 HydrophobicContact CD1-CB 4.01Å; I124-C167 HydrophobicContact CG1-CB 3.64Å; E163-C167 PolarHBondContact O-N 3.08Å; E163-C167 PolarHBondContact O-SG 3.39Å; R164-C167 PolarHBondContact O-N 2.99Å; C167-V170 WeakPolarHBondContact O-CB 3.48Å; C167-V170 PolarHBondContact O-N 3.48Å; C167-I171 PolarHBondContact O-N 3.4Å
168	Q	81.1	Confident	76.3	Confident	97 Å²	97	74.3 Å²	74.3	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-39.1	178.7	-171.8	177.1	-24.9	0	0	111.8	I124 R164 D165 H166 V170 I171 F172	I124-Q168 HydrophobicContact CD1-CB 4.25Å; R164-Q168 WeakPolarHBondContact O-CB 3.45Å; R164-Q168 PolarHBondContact O-N 2.96Å; D165-Q168 PolarHBondContact O-N 3.02Å; H166-Q168 VanDerWaalsContact C-N 3.34Å; H166-Q168 PolarHBondContact O-N 3.13Å; Q168-V170 VanDerWaalsContact C-N 3.31Å; Q168-V170 PolarHBondContact O-N 3.03Å; Q168-I171 PolarHBondContact O-N 3.06Å; Q168-F172 WeakPolarHBondContact O-CB 3.43Å; Q168-F172 PolarHBondContact O-N 2.95Å
169	K	76.8	Confident	74.3	Confident	137 Å²	137	79.1 Å²	79.1	60%	0.596	39%	0.391	S	S	*	.	H	α-helix	trans	-62.4	-37.6	172.7	-76	165.5	-170.6	165.9	0	111.6	D165 H166 F173	D165-K169 WeakPolarHBondContact O-CB 3.36Å; D165-K169 WeakPolarHBondContact O-CD 3.36Å; D165-K169 WeakPolarHBondContact O-CG 3.48Å; D165-K169 PolarHBondContact O-N 3.49Å; H166-K169 PolarHBondContact O-N 2.88Å; K169-F173 WeakPolarHBondContact O-CB 3.42Å; K169-F173 PolarHBondContact O-N 3.18Å
170	V	72.8	Confident	72.2	Confident	62 Å²	62	80.2 Å²	80.2	38%	0.376	40%	0.396	S	S	.	.	H	α-helix	trans	-63.7	-47.6	175.5	171.7	0	0	0	0	111	H166 C167 Q168 S174	H166-V170 WeakPolarHBondContact O-CG2 3.32Å; H166-V170 PolarHBondContact O-N 3.24Å; C167-V170 WeakPolarHBondContact O-CB 3.48Å; C167-V170 PolarHBondContact O-N 3.48Å; Q168-V170 VanDerWaalsContact C-N 3.31Å; Q168-V170 PolarHBondContact O-N 3.03Å; V170-S174 WeakPolarHBondContact O-CB 3.44Å; V170-S174 PolarHBondContact O-N 3.35Å
171	I	71.5	Confident	70.2	Confident	28 Å²	28	80.2 Å²	80.2	14%	0.144	40%	0.398	C	S	.	.	H	α-helix	trans	-64.7	-47.9	176.3	-62.8	-175.3	0	0	0	111	L120 E121 I124 C167 Q168 F173 S174 S175	L120-I171 HydrophobicContact CB-CD1 3.88Å; L120-I171 HydrophobicContact CB-CG1 4.18Å; E121-I171 HydrophobicContact CG-CD1 3.71Å; I124-I171 HydrophobicContact CD1-CD1 3.34Å; I124-I171 HydrophobicContact CD1-CG1 4.19Å; C167-I171 PolarHBondContact O-N 3.4Å; Q168-I171 PolarHBondContact O-N 3.06Å; I171-F173 PolarHBondContact O-N 3.37Å; I171-S174 CarbonylContact O-C 3.45Å; I171-S174 WeakPolarHBondContact O-CB 3.27Å; I171-S174 PolarHBondContact O-N 2.84Å; I171-S175 WeakPolarHBondContact O-CB 3.13Å; I171-S175 PolarHBondContact O-N 2.76Å
172	F	67.8	Low	68	Low	130 Å²	130	83.6 Å²	83.6	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-62.6	-45.4	-178.4	-179.9	-109.3	0	0	0	111.2	Q168 S174 S175 L176	Q168-F172 WeakPolarHBondContact O-CB 3.43Å; Q168-F172 PolarHBondContact O-N 2.95Å; F172-S174 VanDerWaalsContact C-N 3.29Å; F172-S174 PolarHBondContact O-N 3.45Å; F172-S175 CarbonylContact O-C 3.6Å; F172-S175 WeakPolarHBondContact O-CA 3.45Å; F172-S175 WeakPolarHBondContact O-CB 3.26Å; F172-S175 PolarHBondContact O-N 3.23Å; F172-S175 VanDerWaalsContact O-N 3.09Å; F172-L176 HydrophobicContact CD1-CD1 4.19Å; F172-L176 HydrophobicContact CE1-CD1 3.49Å; F172-L176 VanDerWaalsContact CE1-CD1 3.49Å; F172-L176 HydrophobicContact CZ-CD1 3.82Å; F172-L176 WeakPolarHBondContact O-CB 3.41Å; F172-L176 PolarHBondContact O-N 2.92Å
173	F	62.8	Low	66.1	Low	81 Å²	81	83.3 Å²	83.3	36%	0.355	43%	0.429	S	S	.	.	H	α-helix	trans	-63	-38.1	176.3	-170.2	-106.7	0	0	0	111.4	P106 G107 K169 I171 L176 I177	P106-F173 HydrophobicContact CG-CE1 4.05Å; P106-F173 HydrophobicContact CG-CZ 4.14Å; G107-F173 VanDerWaalsContact N-CE1 3.32Å; K169-F173 WeakPolarHBondContact O-CB 3.42Å; K169-F173 PolarHBondContact O-N 3.18Å; I171-F173 PolarHBondContact O-N 3.37Å; F173-L176 PolarHBondContact O-N 3.45Å; F173-I177 HydrophobicContact CD1-CD1 3.72Å; F173-I177 HydrophobicContact CD1-CG1 4.45Å; F173-I177 HydrophobicContact CE1-CD1 3.49Å; F173-I177 VanDerWaalsContact CE1-CD1 3.49Å; F173-I177 HydrophobicContact CE1-CG1 4.22Å; F173-I177 HydrophobicContact CZ-CD1 4.14Å; F173-I177 HydrophobicContact CZ-CG1 4.45Å; F173-I177 WeakPolarHBondContact O-CB 3.39Å; F173-I177 VanDerWaalsContact O-CG1 3.23Å; F173-I177 WeakPolarHBondContact O-CG1 3.49Å; F173-I177 PolarHBondContact O-N 2.92Å
174	S	60.6	Low	64.4	Low	12 Å²	12	81 Å²	81	8%	0.084	44%	0.435	C	S	.	.	H	α-helix	trans	-62.1	-41.2	170.7	-174.7	0	0	0	0	112.7	F117 V170 I171 F172 S178	F117-S174 WeakPolarHBondContact CE1-OG 3.28Å; F117-S174 WeakPolarHBondContact CZ-OG 3.24Å; V170-S174 WeakPolarHBondContact O-CB 3.44Å; V170-S174 PolarHBondContact O-N 3.35Å; I171-S174 CarbonylContact O-C 3.45Å; I171-S174 WeakPolarHBondContact O-CB 3.27Å; I171-S174 PolarHBondContact O-N 2.84Å; F172-S174 VanDerWaalsContact C-N 3.29Å; F172-S174 PolarHBondContact O-N 3.45Å; S174-S178 PolarHBondContact O-N 3.34Å; S174-S178 PolarHBondContact O-OG 3.41Å
175	S	60.6	Low	62.9	Low	67 Å²	67	85.1 Å²	85.1	47%	0.469	46%	0.457	S	S	.	.	H	α-helix	trans	-70.5	-33.5	175.9	-175.8	0	0	0	0	112.5	I171 F172 S178 F179	I171-S175 WeakPolarHBondContact O-CB 3.13Å; I171-S175 PolarHBondContact O-N 2.76Å; F172-S175 CarbonylContact O-C 3.6Å; F172-S175 WeakPolarHBondContact O-CA 3.45Å; F172-S175 WeakPolarHBondContact O-CB 3.26Å; F172-S175 PolarHBondContact O-N 3.23Å; F172-S175 VanDerWaalsContact O-N 3.09Å; S175-S178 CarbonylContact O-C 3.54Å; S175-S178 WeakPolarHBondContact O-CA 3.16Å; S175-S178 VanDerWaalsContact O-CB 3.24Å; S175-S178 WeakPolarHBondContact O-CB 3.45Å; S175-S178 PolarHBondContact O-N 3.48Å; S175-S178 VanDerWaalsContact O-N 3.09Å; S175-F179 WeakPolarHBondContact O-CB 3.35Å; S175-F179 PolarHBondContact O-N 2.71Å
176	L	56.3	Low	61.6	Low	41 Å²	41	86.6 Å²	86.6	22%	0.215	47%	0.465	C	S	.	.	H	α-helix	trans	-74.3	-41	-178.2	-163.2	168.9	0	0	0	110	F172 F173 S178 F179 E180	F172-L176 HydrophobicContact CD1-CD1 4.19Å; F172-L176 HydrophobicContact CE1-CD1 3.49Å; F172-L176 VanDerWaalsContact CE1-CD1 3.49Å; F172-L176 HydrophobicContact CZ-CD1 3.82Å; F172-L176 WeakPolarHBondContact O-CB 3.41Å; F172-L176 PolarHBondContact O-N 2.92Å; F173-L176 PolarHBondContact O-N 3.45Å; L176-S178 PolarHBondContact O-N 2.96Å; L176-F179 PolarHBondContact O-N 2.92Å; L176-E180 HydrophobicContact CD2-CB 3.95Å; L176-E180 HydrophobicContact CD2-CG 3.61Å; L176-E180 VanDerWaalsContact CD2-OE2 3.25Å; L176-E180 WeakPolarHBondContact CD2-OE2 3.42Å; L176-E180 HydrophobicContact CG-CG 4.22Å; L176-E180 PolarHBondContact O-N 3.3Å
177	I	54.4	Low	60.9	Low	34 Å²	34	86.2 Å²	86.2	17%	0.174	46%	0.461	C	S	.	.	H	α-helix	trans	-51.9	-36.1	164.1	-73.8	169.1	0	0	0	110.7	F173 T181 L186	F173-I177 HydrophobicContact CD1-CD1 3.72Å; F173-I177 HydrophobicContact CD1-CG1 4.45Å; F173-I177 HydrophobicContact CE1-CD1 3.49Å; F173-I177 VanDerWaalsContact CE1-CD1 3.49Å; F173-I177 HydrophobicContact CE1-CG1 4.22Å; F173-I177 HydrophobicContact CZ-CD1 4.14Å; F173-I177 HydrophobicContact CZ-CG1 4.45Å; F173-I177 WeakPolarHBondContact O-CB 3.39Å; F173-I177 VanDerWaalsContact O-CG1 3.23Å; F173-I177 WeakPolarHBondContact O-CG1 3.49Å; F173-I177 PolarHBondContact O-N 2.92Å; I177-T181 PolarHBondContact O-OG1 3.37Å; I177-L186 HydrophobicContact CB-CD1 4.34Å; I177-L186 HydrophobicContact CG2-CB 4.29Å; I177-L186 HydrophobicContact CG2-CD1 3.69Å
178	S	52.9	Low	60.8	Low	80 Å²	80	86.4 Å²	86.4	56%	0.559	46%	0.462	S	S	*	.	H	α-helix	trans	-78.7	-20.2	177.7	-51.5	0	0	0	0	114.2	S174 S175 L176	S174-S178 PolarHBondContact O-N 3.34Å; S174-S178 PolarHBondContact O-OG 3.41Å; S175-S178 CarbonylContact O-C 3.54Å; S175-S178 WeakPolarHBondContact O-CA 3.16Å; S175-S178 VanDerWaalsContact O-CB 3.24Å; S175-S178 WeakPolarHBondContact O-CB 3.45Å; S175-S178 PolarHBondContact O-N 3.48Å; S175-S178 VanDerWaalsContact O-N 3.09Å; L176-S178 PolarHBondContact O-N 2.96Å
179	F	50.5	Low	60.9	Low	182 Å²	182	84 Å²	84	80%	0.798	45%	0.451	S	S	*	.	H	α-helix	trans	-108.1	-44.6	-170.4	-173.1	-99.4	0	0	0	114.5	S175 L176 T181	S175-F179 WeakPolarHBondContact O-CB 3.35Å; S175-F179 PolarHBondContact O-N 2.71Å; L176-F179 PolarHBondContact O-N 2.92Å; F179-T181 VanDerWaalsContact C-N 3.3Å; F179-T181 PolarHBondContact O-N 3.25Å
180	E	50.1	Low	61.3	Low	151 Å²	151	79.2 Å²	79.2	71%	0.706	43%	0.431	S	S	*	.	S	Bend	trans	-79.7	-13.9	-175.7	-75	-170	176.7	0	0	113.8	L176	L176-E180 HydrophobicContact CD2-CB 3.95Å; L176-E180 HydrophobicContact CD2-CG 3.61Å; L176-E180 VanDerWaalsContact CD2-OE2 3.25Å; L176-E180 WeakPolarHBondContact CD2-OE2 3.42Å; L176-E180 HydrophobicContact CG-CG 4.22Å; L176-E180 PolarHBondContact O-N 3.3Å
181	T	49.3	Very low	62.1	Low	41 Å²	41	76.9 Å²	76.9	25%	0.252	42%	0.417	S	S	.	.	S	Bend	trans	-112.6	132.3	172.6	12.5	0	0	0	0	108.3	I177 F179 L186	I177-T181 PolarHBondContact O-OG1 3.37Å; F179-T181 VanDerWaalsContact C-N 3.3Å; F179-T181 PolarHBondContact O-N 3.25Å; T181-L186 HydrophobicContact CG2-CD1 3.99Å; T181-L186 HydrophobicContact CG2-CD2 4.08Å; T181-L186 HydrophobicContact CG2-CG 3.78Å; T181-L186 WeakPolarHBondContact OG1-CD1 3.28Å; T181-L186 VanDerWaalsContact OG1-CG 3.28Å; T181-L186 WeakPolarHBondContact OG1-CG 3.43Å
182	P	45.9	Very low	63	Low	85 Å²	85	76.1 Å²	76.1	55%	0.552	41%	0.413	S	S	*	.			trans	-50.6	141.1	-179.9	20	-31.2	0	0	0	109.3	G184 E185	P182-G184 PolarHBondContact O-N 3.19Å; P182-E185 PolarHBondContact O-N 3.48Å
183	P	50	Low	64.1	Low	135 Å²	135	74.7 Å²	74.7	88%	0.877	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	8.8	-168	-26.7	32.8	0	0	0	117.9
184	G	52.2	Low	65.4	Low	63 Å²	63	73 Å²	73	65%	0.649	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-8.5	-173.9	0	0	0	0	0	117.3	P182	P182-G184 PolarHBondContact O-N 3.19Å
185	E	56.7	Low	66.7	Low	153 Å²	153	72.4 Å²	72.4	72%	0.715	40%	0.402	S	S	*	.	S	Bend	trans	-119.6	-20.7	-168.1	-72.8	-173.3	172.1	0	0	117.3	P182 K187	P182-E185 PolarHBondContact O-N 3.48Å; E185-K187 VanDerWaalsContact C-N 3.29Å; E185-K187 PolarHBondContact O-N 3.26Å
186	L	58.9	Low	68	Low	93 Å²	93	69.2 Å²	69.2	49%	0.487	38%	0.38	S	S	.	.			trans	-81.7	81.3	173.9	-68.2	-164.9	0	0	0	111.7	I177 T181 V188	I177-L186 HydrophobicContact CB-CD1 4.34Å; I177-L186 HydrophobicContact CG2-CB 4.29Å; I177-L186 HydrophobicContact CG2-CD1 3.69Å; T181-L186 HydrophobicContact CG2-CD1 3.99Å; T181-L186 HydrophobicContact CG2-CD2 4.08Å; T181-L186 HydrophobicContact CG2-CG 3.78Å; T181-L186 WeakPolarHBondContact OG1-CD1 3.28Å; T181-L186 VanDerWaalsContact OG1-CG 3.28Å; T181-L186 WeakPolarHBondContact OG1-CG 3.43Å; L186-V188 PolarHBondContact O-N 2.96Å
187	K	68.1	Low	69.6	Low	116 Å²	116	68.1 Å²	68.1	50%	0.504	38%	0.375	S	S	.	.			trans	-66.6	97.2	167	-75	177.1	-178.1	-172	0	109.2	E185 I200	E185-K187 VanDerWaalsContact C-N 3.29Å; E185-K187 PolarHBondContact O-N 3.26Å; K187-I200 HydrophobicContact CB-CG1 4.28Å; K187-I200 HydrophobicContact CB-CG2 3.56Å; K187-I200 HydrophobicContact CD-CD1 4.18Å; K187-I200 HydrophobicContact CD-CG2 4.01Å; K187-I200 HydrophobicContact CG-CG2 3.79Å
188	V	77.2	Confident	71.3	Confident	26 Å²	26	70.5 Å²	70.5	16%	0.158	39%	0.385	C	S	.	.			trans	-59.8	136.1	171.4	-72.5	0	0	0	0	109.6	V110 L186 I200 V201	V110-V188 HydrophobicContact CB-CG1 4.31Å; V110-V188 HydrophobicContact CB-CG2 4.46Å; V110-V188 HydrophobicContact CG2-CG1 3.83Å; L186-V188 PolarHBondContact O-N 2.96Å; V188-I200 WeakPolarHBondContact O-CA 3.36Å; V188-V201 HydrophobicContact CG2-CB 3.68Å; V188-V201 HydrophobicContact CG2-CG2 3.89Å; V188-V201 PolarHBondContact O-N 3.16Å
189	M	83.3	Confident	72.9	Confident	47 Å²	47	68.3 Å²	68.3	23%	0.232	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.4	-176.2	-57.2	-71.1	-56.7	0	0	109.2	L101 F198 L199 I200	L101-M189 HydrophobicContact CD1-CB 3.68Å; L101-M189 WeakPolarHBondContact CD1-O 3.44Å; L101-M189 WeakPolarHBondContact CD2-O 3.22Å; M189-F198 HydrophobicContact CE-CB 3.69Å; M189-L199 CarbonylContact C-O 3.57Å; M189-L199 WeakPolarHBondContact CA-O 3.47Å; M189-I200 HydrophobicContact CE-CG1 3.8Å; M189-I200 HydrophobicContact SD-CB 4.28Å; M189-I200 HydrophobicContact SD-CD1 4.09Å; M189-I200 HydrophobicContact SD-CG1 3.16Å; M189-I200 WeakPolarHBondContact SD-CG1 3.38Å
190	E	84.8	Confident	74.5	Confident	37 Å²	37	60.8 Å²	60.8	17%	0.173	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	164.1	172	-79.9	-179.1	176.2	0	0	110.9	S111 F198 L199 V201	S111-E190 WeakPolarHBondContact CA-OE1 3.25Å; S111-E190 VanDerWaalsContact CB-OE1 3.32Å; S111-E190 WeakPolarHBondContact CB-OE1 3.28Å; S111-E190 VanDerWaalsContact OG-CD 3.24Å; S111-E190 PolarHBondContact OG-OE1 2.82Å; E190-F198 CarbonylContact O-C 3.46Å; E190-F198 VanDerWaalsContact O-CA 3.29Å; E190-F198 WeakPolarHBondContact O-CA 3.16Å; E190-L199 PolarHBondContact N-O 3.35Å; E190-L199 PolarHBondContact O-N 3.17Å; E190-V201 HydrophobicContact CB-CG2 4.08Å; E190-V201 HydrophobicContact CG-CG2 3.37Å; E190-V201 WeakPolarHBondContact OE1-CG2 3.22Å
191	V	90	Very high	76	Confident	13 Å²	13	55.5 Å²	55.5	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.6	174.9	-179.6	0	0	0	0	109	I94 N97 R98 L101 D193 F198	I94-V191 HydrophobicContact CG2-CG1 4.39Å; N97-V191 HydrophobicContact CB-CG1 3.94Å; N97-V191 HydrophobicContact CB-CG2 3.99Å; R98-V191 HydrophobicContact CG-CB 4.04Å; R98-V191 HydrophobicContact CG-CG1 4.41Å; R98-V191 HydrophobicContact CG-CG2 4.25Å; L101-V191 HydrophobicContact CB-CG2 4.4Å; L101-V191 HydrophobicContact CD2-CG2 4.01Å; V191-D193 PolarHBondContact O-N 3.05Å; V191-F198 HydrophobicContact CG2-CD1 3.8Å; V191-F198 HydrophobicContact CG2-CE1 3.74Å
192	C	91.6	Very high	77.3	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.074	34%	0.338	C	S	.	.			trans	-58.8	129.9	174.1	174.9	0	0	0	0	112	I194 G196 C197 L199 H211 H217	C192-I194 PolarHBondContact O-N 3.29Å; C192-I194 PolarHBondContact SG-N 3.35Å; C192-I194 VanDerWaalsContact SG-N 3.41Å; C192-G196 WeakPolarHBondContact O-CA 3.29Å; C192-G196 PolarHBondContact O-N 3.01Å; C192-C197 PolarHBondContact N-O 3.04Å; C192-L199 HydrophobicContact CB-CD1 3.87Å; C192-L199 HydrophobicContact CB-CG 4.34Å; C192-H211 PolarHBondContact SG-NE2 3.43Å; C192-H217 PolarHBondContact SG-ND1 3.39Å
193	D	89.3	Confident	79	Confident	100 Å²	100	54 Å²	54	54%	0.535	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.4	-178.4	-66.8	-13	0	0	0	115	I94 R98 V191	I94-D193 VanDerWaalsContact CD1-O 3.23Å; I94-D193 WeakPolarHBondContact CD1-O 3.34Å; R98-D193 IonicContact CZ-OD1 3.71Å; R98-D193 IonicContact NH2-OD1 2.62Å; R98-D193 PolarHBondContact NH2-OD1 2.64Å; R98-D193 IonicContact NH2-OD2 3.97Å; V191-D193 PolarHBondContact O-N 3.05Å
194	I	90.4	Very high	80.6	Confident	45 Å²	45	50.4 Å²	50.4	23%	0.231	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-50.9	-174.9	-65.2	167	0	0	0	110.8	C192 H217 F220 A221	C192-I194 PolarHBondContact O-N 3.29Å; C192-I194 PolarHBondContact SG-N 3.35Å; C192-I194 VanDerWaalsContact SG-N 3.41Å; I194-H217 VanDerWaalsContact CD1-CE1 3.44Å; I194-H217 WeakPolarHBondContact CD1-CE1 3.44Å; I194-H217 VanDerWaalsContact CD1-NE2 3.31Å; I194-H217 WeakPolarHBondContact CD1-NE2 3.41Å; I194-F220 HydrophobicContact CG2-CB 3.81Å; I194-F220 WeakPolarHBondContact O-CB 3.24Å; I194-A221 HydrophobicContact CG2-CB 4.04Å
195	C	88.1	Confident	82.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-6.6	-175.3	69.3	0	0	0	0	114.5	K93 C197 H211 Q216 F220	K93-C195 PolarHBondContact NZ-O 3.09Å; C195-C197 VanDerWaalsContact C-N 3.26Å; C195-C197 PolarHBondContact O-N 2.71Å; C195-H211 PolarHBondContact SG-CE1 2.71Å; C195-Q216 HydrophobicContact CB-CB 4.4Å; C195-F220 HydrophobicContact CB-CD2 4.06Å
196	G	88.6	Confident	83.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.			trans	65.9	24.3	-179	0	0	0	0	0	114	N97 C192	N97-G196 PolarHBondContact ND2-O 2.77Å; C192-G196 WeakPolarHBondContact O-CA 3.29Å; C192-G196 PolarHBondContact O-N 3.01Å
197	C	89.6	Confident	85.2	Confident	18 Å²	18	54.1 Å²	54.1	12%	0.122	29%	0.287	C	S	.	.			trans	-82	146.7	173.3	-69.3	0	0	0	0	110	C192 C195	C192-C197 PolarHBondContact N-O 3.04Å; C195-C197 VanDerWaalsContact C-N 3.26Å; C195-C197 PolarHBondContact O-N 2.71Å
198	F	89.1	Confident	86.2	Confident	84 Å²	84	50.8 Å²	50.8	37%	0.368	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.1	171.9	-60.6	-72.9	0	0	0	109.4	N97 M189 E190 V191	N97-F198 HydrophobicContact CB-CE1 4.17Å; N97-F198 HydrophobicContact CB-CZ 3.99Å; M189-F198 HydrophobicContact CE-CB 3.69Å; E190-F198 CarbonylContact O-C 3.46Å; E190-F198 VanDerWaalsContact O-CA 3.29Å; E190-F198 WeakPolarHBondContact O-CA 3.16Å; V191-F198 HydrophobicContact CG2-CD1 3.8Å; V191-F198 HydrophobicContact CG2-CE1 3.74Å
199	L	87.4	Confident	86.8	Confident	33 Å²	33	53.6 Å²	53.6	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	153	173.7	-67.5	176.6	0	0	0	108.1	M189 E190 C192 L208 H211	M189-L199 CarbonylContact C-O 3.57Å; M189-L199 WeakPolarHBondContact CA-O 3.47Å; E190-L199 PolarHBondContact N-O 3.35Å; E190-L199 PolarHBondContact O-N 3.17Å; C192-L199 HydrophobicContact CB-CD1 3.87Å; C192-L199 HydrophobicContact CB-CG 4.34Å; L199-L208 HydrophobicContact CD2-CD2 4.35Å; L199-H211 HydrophobicContact CD2-CB 4.11Å
200	I	85.1	Confident	87.2	Confident	25 Å²	25	57.1 Å²	57.1	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.3	169.4	-70.9	154.7	0	0	0	106.8	K187 V188 M189 D203	K187-I200 HydrophobicContact CB-CG1 4.28Å; K187-I200 HydrophobicContact CB-CG2 3.56Å; K187-I200 HydrophobicContact CD-CD1 4.18Å; K187-I200 HydrophobicContact CD-CG2 4.01Å; K187-I200 HydrophobicContact CG-CG2 3.79Å; V188-I200 WeakPolarHBondContact O-CA 3.36Å; M189-I200 HydrophobicContact CE-CG1 3.8Å; M189-I200 HydrophobicContact SD-CB 4.28Å; M189-I200 HydrophobicContact SD-CD1 4.09Å; M189-I200 HydrophobicContact SD-CG1 3.16Å; M189-I200 WeakPolarHBondContact SD-CG1 3.38Å; I200-D203 HydrophobicContact CB-CB 3.91Å; I200-D203 WeakPolarHBondContact CD1-OD2 2.8Å; I200-D203 HydrophobicContact CG2-CB 3.95Å; I200-D203 PolarHBondContact O-N 3.03Å
201	V	80.1	Confident	87.5	Confident	39 Å²	39	56.8 Å²	56.8	24%	0.236	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	133.1	171.9	-163.8	0	0	0	0	108.3	V188 E190 D203	V188-V201 HydrophobicContact CG2-CB 3.68Å; V188-V201 HydrophobicContact CG2-CG2 3.89Å; V188-V201 PolarHBondContact O-N 3.16Å; E190-V201 HydrophobicContact CB-CG2 4.08Å; E190-V201 HydrophobicContact CG-CG2 3.37Å; E190-V201 WeakPolarHBondContact OE1-CG2 3.22Å; V201-D203 VanDerWaalsContact C-N 3.33Å
202	G	77.1	Confident	87.5	Confident	78 Å²	78	60.1 Å²	60.1	80%	0.804	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	14.2	-176.2	0	0	0	0	0	114.9
203	D	81.5	Confident	87.4	Confident	17 Å²	17	64.8 Å²	64.8	9%	0.091	35%	0.347	C	S	.	.			trans	-67.3	168	170.2	-147.9	-32.2	0	0	0	111.5	I200 V201 Q205 R207	I200-D203 HydrophobicContact CB-CB 3.91Å; I200-D203 WeakPolarHBondContact CD1-OD2 2.8Å; I200-D203 HydrophobicContact CG2-CB 3.95Å; I200-D203 PolarHBondContact O-N 3.03Å; V201-D203 VanDerWaalsContact C-N 3.33Å; D203-Q205 PolarHBondContact O-N 3.17Å; D203-R207 IonicContact OD1-CZ 3.19Å; D203-R207 IonicContact OD1-NE 3.03Å; D203-R207 WeakPolarHBondContact OD2-CD 3.38Å; D203-R207 IonicContact OD2-CZ 3.8Å; D203-R207 IonicContact OD2-NE 3.2Å; D203-R207 PolarHBondContact OD2-NE 3Å; D203-R207 IonicContact OD2-NH1 2.71Å; D203-R207 PolarHBondContact OD2-NH1 3.29Å
204	S	84.5	Confident	87.3	Confident	60 Å²	60	61.1 Å²	61.1	42%	0.42	33%	0.333	S	S	.	.			trans	-46.5	128.8	168.2	53	0	0	0	0	111.9	H206 R207 L208	S204-H206 PolarHBondContact O-N 2.96Å; S204-H206 VanDerWaalsContact O-N 3.15Å; S204-R207 PolarHBondContact O-N 3.11Å; S204-L208 PolarHBondContact O-N 3Å
205	Q	86.9	Confident	87	Confident	136 Å²	136	63.2 Å²	63.2	64%	0.636	34%	0.341	S	S	*	.	H	α-helix	trans	-51.7	-38.9	176	-69.9	-65.3	-43.2	0	0	111.7	D203 R207 L208 D209	D203-Q205 PolarHBondContact O-N 3.17Å; Q205-R207 VanDerWaalsContact C-N 3.28Å; Q205-R207 PolarHBondContact O-N 3.37Å; Q205-L208 WeakPolarHBondContact O-CB 3.49Å; Q205-L208 PolarHBondContact O-N 3.25Å; Q205-D209 PolarHBondContact O-N 3.47Å
206	H	89.3	Confident	86.9	Confident	125 Å²	125	64.8 Å²	64.8	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-54.1	-39.9	176.2	-175.1	58.7	0	0	0	113.7	S204 D209 E210	S204-H206 PolarHBondContact O-N 2.96Å; S204-H206 VanDerWaalsContact O-N 3.15Å; H206-D209 PolarHBondContact O-N 3.36Å; H206-E210 IonicContact CD2-OE1 3.96Å; H206-E210 IonicContact CE1-OE1 3.79Å; H206-E210 IonicContact NE2-OE1 3.24Å; H206-E210 PolarHBondContact NE2-OE1 2.86Å; H206-E210 WeakPolarHBondContact O-CG 3.38Å; H206-E210 PolarHBondContact O-N 2.82Å
207	R	87.1	Confident	86.8	Confident	126 Å²	126	65.7 Å²	65.7	48%	0.475	35%	0.352	S	S	.	.	H	α-helix	trans	-72	-35.5	178.7	-170.3	-176.1	-60.2	-150.9	-7.2	112.3	D203 S204 Q205 D209 H211	D203-R207 IonicContact OD1-CZ 3.19Å; D203-R207 IonicContact OD1-NE 3.03Å; D203-R207 WeakPolarHBondContact OD2-CD 3.38Å; D203-R207 IonicContact OD2-CZ 3.8Å; D203-R207 IonicContact OD2-NE 3.2Å; D203-R207 PolarHBondContact OD2-NE 3Å; D203-R207 IonicContact OD2-NH1 2.71Å; D203-R207 PolarHBondContact OD2-NH1 3.29Å; S204-R207 PolarHBondContact O-N 3.11Å; Q205-R207 VanDerWaalsContact C-N 3.28Å; Q205-R207 PolarHBondContact O-N 3.37Å; R207-D209 VanDerWaalsContact C-N 3.34Å; R207-H211 WeakPolarHBondContact O-CB 3.48Å; R207-H211 PolarHBondContact O-N 2.95Å
208	L	89	Confident	86.8	Confident	46 Å²	46	68.4 Å²	68.4	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-42.2	173.5	-61.6	177.6	0	0	0	110.1	L199 S204 Q205 H211 L212	L199-L208 HydrophobicContact CD2-CD2 4.35Å; S204-L208 PolarHBondContact O-N 3Å; Q205-L208 WeakPolarHBondContact O-CB 3.49Å; Q205-L208 PolarHBondContact O-N 3.25Å; L208-H211 WeakPolarHBondContact O-CB 3.34Å; L208-H211 PolarHBondContact O-N 2.95Å; L208-L212 VanDerWaalsContact O-CG 3.3Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 3.33Å
209	D	91.1	Very high	86.7	Confident	85 Å²	85	64.7 Å²	64.7	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-46.4	176.3	-66.8	-28.7	0	0	0	112	Q205 H206 R207 H211 L212 V213	Q205-D209 PolarHBondContact O-N 3.47Å; H206-D209 PolarHBondContact O-N 3.36Å; R207-D209 VanDerWaalsContact C-N 3.34Å; D209-H211 PolarHBondContact O-N 2.77Å; D209-L212 PolarHBondContact O-N 3.21Å; D209-L212 VanDerWaalsContact O-N 3.16Å; D209-V213 WeakPolarHBondContact O-CB 3.41Å; D209-V213 WeakPolarHBondContact O-CG2 3.3Å; D209-V213 PolarHBondContact O-N 2.83Å
210	E	90.9	Very high	86.8	Confident	120 Å²	120	64 Å²	64	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-58.1	-37.3	173.8	-76.5	-173.2	160.3	0	0	112.1	H206 G214	H206-E210 IonicContact CD2-OE1 3.96Å; H206-E210 IonicContact CE1-OE1 3.79Å; H206-E210 IonicContact NE2-OE1 3.24Å; H206-E210 PolarHBondContact NE2-OE1 2.86Å; H206-E210 WeakPolarHBondContact O-CG 3.38Å; H206-E210 PolarHBondContact O-N 2.82Å; E210-G214 WeakPolarHBondContact O-CA 3.01Å; E210-G214 PolarHBondContact O-N 3.36Å
211	H	90.5	Very high	87.1	Confident	30 Å²	30	64.3 Å²	64.3	14%	0.139	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-47.1	174.9	170.9	89.7	0	0	0	112	C192 C195 L199 R207 L208 D209 G214 H217	C192-H211 PolarHBondContact SG-NE2 3.43Å; C195-H211 PolarHBondContact SG-CE1 2.71Å; L199-H211 HydrophobicContact CD2-CB 4.11Å; R207-H211 WeakPolarHBondContact O-CB 3.48Å; R207-H211 PolarHBondContact O-N 2.95Å; L208-H211 WeakPolarHBondContact O-CB 3.34Å; L208-H211 PolarHBondContact O-N 2.95Å; D209-H211 PolarHBondContact O-N 2.77Å; H211-G214 WeakPolarHBondContact O-CA 3.37Å; H211-G214 PolarHBondContact O-N 3.23Å; H211-H217 AromaticContact CD2-ND1 3.56Å; H211-H217 AromaticContact CE1-ND1 3.91Å; H211-H217 AromaticContact NE2-CE1 3.72Å; H211-H217 AromaticContact NE2-CG 3.99Å; H211-H217 AromaticContact NE2-ND1 3.02Å; H211-H217 PolarHBondContact NE2-ND1 3.25Å; H211-H217 WeakPolarHBondContact O-CB 3.34Å
212	L	89.9	Confident	87.5	Confident	84 Å²	84	68 Å²	68	44%	0.44	37%	0.366	S	S	.	.	H	α-helix	trans	-66.5	-40.1	-178.6	-68.5	174.7	0	0	0	112.1	L208 D209 G214 L218	L208-L212 VanDerWaalsContact O-CG 3.3Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 3.33Å; D209-L212 PolarHBondContact O-N 3.21Å; D209-L212 VanDerWaalsContact O-N 3.16Å; L212-G214 PolarHBondContact O-N 3.28Å; L212-L218 VanDerWaalsContact O-CD2 3.31Å; L212-L218 WeakPolarHBondContact O-CD2 3.4Å; L212-L218 WeakPolarHBondContact O-CG 3.44Å
213	V	89.8	Confident	88.1	Confident	108 Å²	108	64.6 Å²	64.6	66%	0.655	33%	0.329	S	S	*	.	S	Bend	trans	-77.8	-7.7	173.5	-176.2	0	0	0	0	111.5	D209 K215 L218	D209-V213 WeakPolarHBondContact O-CB 3.41Å; D209-V213 WeakPolarHBondContact O-CG2 3.3Å; D209-V213 PolarHBondContact O-N 2.83Å; V213-K215 PolarHBondContact O-N 2.98Å; V213-L218 WeakPolarHBondContact O-CD1 3.17Å
214	G	87.3	Confident	88.5	Confident	23 Å²	23	67.5 Å²	67.5	24%	0.237	34%	0.341	C	S	.	.	S	Bend	trans	-58.1	136	178.6	0	0	0	0	0	112.5	E210 H211 L212 Q216 H217 L218	E210-G214 WeakPolarHBondContact O-CA 3.01Å; E210-G214 PolarHBondContact O-N 3.36Å; H211-G214 WeakPolarHBondContact O-CA 3.37Å; H211-G214 PolarHBondContact O-N 3.23Å; L212-G214 PolarHBondContact O-N 3.28Å; G214-Q216 PolarHBondContact O-N 3.1Å; G214-Q216 VanDerWaalsContact O-N 3.13Å; G214-H217 PolarHBondContact O-N 3.45Å; G214-L218 PolarHBondContact O-N 3.41Å
215	K	84.8	Confident	88.8	Confident	90 Å²	90	69.5 Å²	69.5	39%	0.391	34%	0.343	S	S	.	.	H	α-helix	trans	-56.4	-34.7	-178.1	-59.6	-178	-174.6	-178.4	0	112.9	N39 V213 G219	N39-K215 HydrophobicContact CB-CB 4.39Å; N39-K215 HydrophobicContact CB-CD 3.9Å; N39-K215 HydrophobicContact CB-CG 4.38Å; N39-K215 WeakPolarHBondContact O-CD 3.3Å; V213-K215 PolarHBondContact O-N 2.98Å; K215-G219 PolarHBondContact O-N 3.36Å
216	Q	84.7	Confident	88.8	Confident	34 Å²	34	65 Å²	65	16%	0.159	33%	0.325	C	S	.	.	H	α-helix	trans	-67.9	-47.7	176	-64.1	-170.4	-16.5	0	0	111.5	F40 T43 C195 G214 G219 F220	F40-Q216 HydrophobicContact CD1-CG 4.32Å; F40-Q216 HydrophobicContact CE1-CB 4.32Å; F40-Q216 HydrophobicContact CE1-CG 3.98Å; T43-Q216 VanDerWaalsContact CB-NE2 3.26Å; T43-Q216 HydrophobicContact CG2-CG 3.98Å; T43-Q216 VanDerWaalsContact CG2-NE2 3.32Å; T43-Q216 PolarHBondContact OG1-NE2 3.45Å; C195-Q216 HydrophobicContact CB-CB 4.4Å; G214-Q216 PolarHBondContact O-N 3.1Å; G214-Q216 VanDerWaalsContact O-N 3.13Å; Q216-G219 PolarHBondContact O-N 3.23Å; Q216-F220 WeakPolarHBondContact O-CD2 3.35Å; Q216-F220 PolarHBondContact O-N 2.98Å
217	H	88	Confident	88.8	Confident	18 Å²	18	59.7 Å²	59.7	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-63	-52.2	-178.9	-169.4	99.4	0	0	0	110.7	C192 I194 H211 G214 G219 F220 A221	C192-H217 PolarHBondContact SG-ND1 3.39Å; I194-H217 VanDerWaalsContact CD1-CE1 3.44Å; I194-H217 WeakPolarHBondContact CD1-CE1 3.44Å; I194-H217 VanDerWaalsContact CD1-NE2 3.31Å; I194-H217 WeakPolarHBondContact CD1-NE2 3.41Å; H211-H217 AromaticContact CD2-ND1 3.56Å; H211-H217 AromaticContact CE1-ND1 3.91Å; H211-H217 AromaticContact NE2-CE1 3.72Å; H211-H217 AromaticContact NE2-CG 3.99Å; H211-H217 AromaticContact NE2-ND1 3.02Å; H211-H217 PolarHBondContact NE2-ND1 3.25Å; H211-H217 WeakPolarHBondContact O-CB 3.34Å; G214-H217 PolarHBondContact O-N 3.45Å; H217-G219 VanDerWaalsContact C-N 3.3Å; H217-G219 PolarHBondContact O-N 2.98Å; H217-F220 PolarHBondContact O-N 3.34Å; H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 2.96Å; H217-A221 PolarHBondContact O-N 3.09Å
218	L	89.4	Confident	88.8	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.393	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-37.5	177.5	-65.4	179.7	0	0	0	112.9	L212 V213 G214 K222	L212-L218 VanDerWaalsContact O-CD2 3.31Å; L212-L218 WeakPolarHBondContact O-CD2 3.4Å; L212-L218 WeakPolarHBondContact O-CG 3.44Å; V213-L218 WeakPolarHBondContact O-CD1 3.17Å; G214-L218 PolarHBondContact O-N 3.41Å; L218-K222 WeakPolarHBondContact O-CB 3.42Å; L218-K222 VanDerWaalsContact O-CG 3.26Å; L218-K222 WeakPolarHBondContact O-CG 3.45Å; L218-K222 PolarHBondContact O-N 3.47Å; L218-K222 VanDerWaalsContact O-N 3.08Å
219	G	86.9	Confident	88.7	Confident	7 Å²	7	60.2 Å²	60.2	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-52.5	176.5	0	0	0	0	0	111.6	K215 Q216 H217 K222 I223	K215-G219 PolarHBondContact O-N 3.36Å; Q216-G219 PolarHBondContact O-N 3.23Å; H217-G219 VanDerWaalsContact C-N 3.3Å; H217-G219 PolarHBondContact O-N 2.98Å; G219-K222 PolarHBondContact O-N 3.41Å; G219-I223 VanDerWaalsContact O-CG1 3.27Å; G219-I223 WeakPolarHBondContact O-CG1 3.23Å; G219-I223 PolarHBondContact O-N 3.15Å
220	F	89.6	Confident	88.3	Confident	18 Å²	18	60 Å²	60	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-72.1	-32.9	-179.7	-70.6	-59.9	0	0	0	113.5	F40 M90 I194 C195 Q216 H217 K222 I223 K224	F40-F220 HydrophobicContact CE1-CE2 4.27Å; M90-F220 HydrophobicContact CB-CD1 4.39Å; M90-F220 HydrophobicContact CB-CE1 4.37Å; M90-F220 HydrophobicContact CE-CE1 4.05Å; M90-F220 HydrophobicContact CE-CE2 4.44Å; M90-F220 HydrophobicContact CE-CZ 3.62Å; M90-F220 HydrophobicContact CG-CD1 3.4Å; M90-F220 VanDerWaalsContact CG-CD1 3.4Å; M90-F220 HydrophobicContact CG-CD2 4.17Å; M90-F220 HydrophobicContact CG-CE1 3.05Å; M90-F220 HydrophobicContact CG-CE2 3.87Å; M90-F220 HydrophobicContact CG-CG 3.98Å; M90-F220 HydrophobicContact CG-CZ 3.32Å; M90-F220 HydrophobicContact SD-CD1 4.43Å; M90-F220 HydrophobicContact SD-CD2 4.32Å; M90-F220 HydrophobicContact SD-CE1 3.75Å; M90-F220 HydrophobicContact SD-CE2 3.6Å; M90-F220 VanDerWaalsContact SD-CE2 3.6Å; M90-F220 HydrophobicContact SD-CZ 3.28Å; M90-F220 WeakPolarHBondContact SD-CZ 3.38Å; I194-F220 HydrophobicContact CG2-CB 3.81Å; I194-F220 WeakPolarHBondContact O-CB 3.24Å; C195-F220 HydrophobicContact CB-CD2 4.06Å; Q216-F220 WeakPolarHBondContact O-CD2 3.35Å; Q216-F220 PolarHBondContact O-N 2.98Å; H217-F220 PolarHBondContact O-N 3.34Å; F220-K222 VanDerWaalsContact C-N 3.33Å; F220-K222 PolarHBondContact O-N 2.98Å; F220-I223 HydrophobicContact CD1-CD1 3.79Å; F220-I223 HydrophobicContact CE1-CD1 4.02Å; F220-I223 PolarHBondContact O-N 3.47Å; F220-K224 WeakPolarHBondContact O-CB 3.43Å; F220-K224 PolarHBondContact O-N 3.29Å
221	A	90.4	Very high	87.9	Confident	31 Å²	31	56.6 Å²	56.6	26%	0.256	28%	0.284	S	S	.	.	H	α-helix	trans	-57.9	-47.4	171.8	0	0	0	0	0	110.7	I194 H217 I223 K224 E225	I194-A221 HydrophobicContact CG2-CB 4.04Å; H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 2.96Å; H217-A221 PolarHBondContact O-N 3.09Å; A221-I223 PolarHBondContact O-N 3.25Å; A221-K224 PolarHBondContact O-N 3.34Å; A221-E225 WeakPolarHBondContact O-CB 3.4Å; A221-E225 PolarHBondContact O-N 2.8Å
222	K	89.3	Confident	87.5	Confident	118 Å²	118	62.3 Å²	62.3	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-39	175.4	-72.5	175.3	-178.5	-176.6	0	112.5	L218 G219 F220 T226	L218-K222 WeakPolarHBondContact O-CB 3.42Å; L218-K222 VanDerWaalsContact O-CG 3.26Å; L218-K222 WeakPolarHBondContact O-CG 3.45Å; L218-K222 PolarHBondContact O-N 3.47Å; L218-K222 VanDerWaalsContact O-N 3.08Å; G219-K222 PolarHBondContact O-N 3.41Å; F220-K222 VanDerWaalsContact C-N 3.33Å; F220-K222 PolarHBondContact O-N 2.98Å; K222-T226 WeakPolarHBondContact O-CB 3.36Å; K222-T226 VanDerWaalsContact O-CG2 3.24Å; K222-T226 WeakPolarHBondContact O-CG2 3.17Å; K222-T226 PolarHBondContact O-N 2.83Å; K222-T226 PolarHBondContact O-OG1 3.06Å
223	I	89.8	Confident	86.9	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-48.8	176	-65.9	168.2	0	0	0	110	I35 L83 L86 H87 G219 F220 A221 E225 T226 L227	I35-I223 HydrophobicContact CD1-CG1 4.14Å; L83-I223 HydrophobicContact CB-CG2 4.25Å; L83-I223 HydrophobicContact CD2-CB 4.44Å; L83-I223 HydrophobicContact CD2-CD1 4.38Å; L83-I223 HydrophobicContact CD2-CG1 3.79Å; L83-I223 HydrophobicContact CD2-CG2 4.09Å; L86-I223 HydrophobicContact CD1-CD1 4.13Å; H87-I223 HydrophobicContact CB-CG2 4.33Å; G219-I223 VanDerWaalsContact O-CG1 3.27Å; G219-I223 WeakPolarHBondContact O-CG1 3.23Å; G219-I223 PolarHBondContact O-N 3.15Å; F220-I223 HydrophobicContact CD1-CD1 3.79Å; F220-I223 HydrophobicContact CE1-CD1 4.02Å; F220-I223 PolarHBondContact O-N 3.47Å; A221-I223 PolarHBondContact O-N 3.25Å; I223-E225 PolarHBondContact O-N 3.19Å; I223-T226 WeakPolarHBondContact CA-OG1 3.2Å; I223-T226 PolarHBondContact O-N 3.32Å; I223-T226 PolarHBondContact O-OG1 2.68Å; I223-L227 HydrophobicContact CG2-CD1 4.03Å; I223-L227 HydrophobicContact CG2-CG 4.45Å; I223-L227 WeakPolarHBondContact O-CG 3.4Å; I223-L227 PolarHBondContact O-N 2.91Å
224	K	90.2	Very high	86.1	Confident	78 Å²	78	65.8 Å²	65.8	34%	0.339	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-49.3	177.7	-174.6	177.4	175.6	-177.5	0	111.1	F220 A221 T226 L227 E228	F220-K224 WeakPolarHBondContact O-CB 3.43Å; F220-K224 PolarHBondContact O-N 3.29Å; A221-K224 PolarHBondContact O-N 3.34Å; K224-T226 VanDerWaalsContact C-N 3.34Å; K224-T226 PolarHBondContact O-N 3.06Å; K224-L227 PolarHBondContact O-N 3.3Å; K224-E228 WeakPolarHBondContact CE-OE1 3.38Å; K224-E228 HydrophobicContact CG-CG 4.46Å; K224-E228 WeakPolarHBondContact CG-OE1 3.48Å; K224-E228 WeakPolarHBondContact O-CB 3.31Å; K224-E228 WeakPolarHBondContact O-CG 3.4Å; K224-E228 PolarHBondContact O-N 2.92Å
225	E	89.9	Confident	85.5	Confident	101 Å²	101	70.1 Å²	70.1	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-40.1	178.1	-166.5	-162.2	168.6	0	0	112.5	A221 I223 R229	A221-E225 WeakPolarHBondContact O-CB 3.4Å; A221-E225 PolarHBondContact O-N 2.8Å; I223-E225 PolarHBondContact O-N 3.19Å; E225-R229 VanDerWaalsContact O-CB 3.29Å; E225-R229 WeakPolarHBondContact O-CB 3.4Å; E225-R229 PolarHBondContact O-N 2.86Å; E225-R229 IonicContact OE1-CZ 3.91Å; E225-R229 IonicContact OE1-NH2 3.59Å; E225-R229 PolarHBondContact OE1-NH2 3.19Å; E225-R229 IonicContact OE2-NH2 3.93Å
226	T	87.2	Confident	84.4	Confident	41 Å²	41	68.6 Å²	68.6	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-67.9	-36.1	177	51.9	0	0	0	0	113.3	K222 I223 K224 R230	K222-T226 WeakPolarHBondContact O-CB 3.36Å; K222-T226 VanDerWaalsContact O-CG2 3.24Å; K222-T226 WeakPolarHBondContact O-CG2 3.17Å; K222-T226 PolarHBondContact O-N 2.83Å; K222-T226 PolarHBondContact O-OG1 3.06Å; I223-T226 WeakPolarHBondContact CA-OG1 3.2Å; I223-T226 PolarHBondContact O-N 3.32Å; I223-T226 PolarHBondContact O-OG1 2.68Å; K224-T226 VanDerWaalsContact C-N 3.34Å; K224-T226 PolarHBondContact O-N 3.06Å; T226-R230 PolarHBondContact O-N 2.86Å
227	L	89.4	Confident	83.1	Confident	14 Å²	14	77.5 Å²	77.5	7%	0.073	37%	0.368	C	S	.	.	H	α-helix	trans	-71.4	-44.5	174.3	-67.7	176.5	0	0	0	111.9	Y80 L83 R84 H87 I223 K224 R229 R230 T231	Y80-L227 HydrophobicContact CD2-CD2 3.59Å; Y80-L227 HydrophobicContact CE2-CD2 3.24Å; L83-L227 HydrophobicContact CB-CD2 3.97Å; L83-L227 HydrophobicContact CB-CG 4.44Å; R84-L227 HydrophobicContact CB-CD2 4.45Å; H87-L227 HydrophobicContact CB-CD1 3.3Å; I223-L227 HydrophobicContact CG2-CD1 4.03Å; I223-L227 HydrophobicContact CG2-CG 4.45Å; I223-L227 WeakPolarHBondContact O-CG 3.4Å; I223-L227 PolarHBondContact O-N 2.91Å; K224-L227 PolarHBondContact O-N 3.3Å; L227-R229 VanDerWaalsContact C-N 3.33Å; L227-R229 PolarHBondContact O-N 3.47Å; L227-R230 PolarHBondContact O-N 3.32Å; L227-T231 WeakPolarHBondContact O-CG2 3.46Å; L227-T231 PolarHBondContact O-N 3.32Å; L227-T231 PolarHBondContact O-OG1 2.9Å
228	E	88.1	Confident	81.1	Confident	84 Å²	84	81.3 Å²	81.3	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-40.5	176.8	-75.9	177.4	-175.4	0	0	112.1	K224 R230 T231 K232	K224-E228 WeakPolarHBondContact CE-OE1 3.38Å; K224-E228 HydrophobicContact CG-CG 4.46Å; K224-E228 WeakPolarHBondContact CG-OE1 3.48Å; K224-E228 WeakPolarHBondContact O-CB 3.31Å; K224-E228 WeakPolarHBondContact O-CG 3.4Å; K224-E228 PolarHBondContact O-N 2.92Å; E228-R230 VanDerWaalsContact C-N 3.31Å; E228-R230 PolarHBondContact O-N 3.26Å; E228-T231 VanDerWaalsContact CA-OG1 3.25Å; E228-T231 WeakPolarHBondContact CA-OG1 3.41Å; E228-T231 PolarHBondContact O-OG1 3.34Å; E228-K232 VanDerWaalsContact O-CG 3.29Å; E228-K232 WeakPolarHBondContact O-CG 3.5Å; E228-K232 PolarHBondContact O-N 3.15Å; E228-K232 VanDerWaalsContact O-N 3.12Å
229	R	85.9	Confident	79	Confident	100 Å²	100	82.2 Å²	82.2	38%	0.377	41%	0.407	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.1	-166.7	-174.6	-59.4	96.5	-1.4	111.4	E225 L227 Y233	E225-R229 VanDerWaalsContact O-CB 3.29Å; E225-R229 WeakPolarHBondContact O-CB 3.4Å; E225-R229 PolarHBondContact O-N 2.86Å; E225-R229 IonicContact OE1-CZ 3.91Å; E225-R229 IonicContact OE1-NH2 3.59Å; E225-R229 PolarHBondContact OE1-NH2 3.19Å; E225-R229 IonicContact OE2-NH2 3.93Å; L227-R229 VanDerWaalsContact C-N 3.33Å; L227-R229 PolarHBondContact O-N 3.47Å; R229-Y233 HydrophobicContact CG-CD2 4.32Å; R229-Y233 HydrophobicContact CG-CE2 3.73Å; R229-Y233 WeakPolarHBondContact O-CD2 3.48Å; R229-Y233 PolarHBondContact O-N 3.08Å
230	R	82.5	Confident	77.2	Confident	79 Å²	79	88 Å²	88	30%	0.298	45%	0.447	S	S	.	.	H	α-helix	trans	-74.5	-42.7	-179.1	-163.2	-179.5	-157.2	-162.8	5.1	112.8	Y80 T226 L227 E228 K232 Y233 E234	Y80-R230 HydrophobicContact CD2-CB 4.41Å; Y80-R230 HydrophobicContact CD2-CG 4.44Å; Y80-R230 HydrophobicContact CE2-CB 3.9Å; Y80-R230 HydrophobicContact CE2-CG 4.11Å; T226-R230 PolarHBondContact O-N 2.86Å; L227-R230 PolarHBondContact O-N 3.32Å; E228-R230 VanDerWaalsContact C-N 3.31Å; E228-R230 PolarHBondContact O-N 3.26Å; R230-K232 VanDerWaalsContact C-N 3.3Å; R230-K232 PolarHBondContact O-N 2.85Å; R230-Y233 WeakPolarHBondContact O-CA 3.4Å; R230-Y233 WeakPolarHBondContact O-CB 3.31Å; R230-Y233 PolarHBondContact O-N 3.13Å; R230-E234 PolarHBondContact O-N 3.16Å
231	T	82.6	Confident	74.9	Confident	50 Å²	50	91.2 Å²	91.2	31%	0.307	49%	0.486	S	S	.	.	H	α-helix	trans	-58.6	-43.1	176.3	44.3	0	0	0	0	111	L227 E228 Y233 E234 D235	L227-T231 WeakPolarHBondContact O-CG2 3.46Å; L227-T231 PolarHBondContact O-N 3.32Å; L227-T231 PolarHBondContact O-OG1 2.9Å; E228-T231 VanDerWaalsContact CA-OG1 3.25Å; E228-T231 WeakPolarHBondContact CA-OG1 3.41Å; E228-T231 PolarHBondContact O-OG1 3.34Å; T231-Y233 VanDerWaalsContact C-N 3.29Å; T231-Y233 PolarHBondContact O-N 3.44Å; T231-E234 CarbonylContact O-C 3.55Å; T231-E234 WeakPolarHBondContact O-CA 3.24Å; T231-E234 WeakPolarHBondContact O-CB 3.32Å; T231-E234 PolarHBondContact O-N 3.03Å; T231-D235 PolarHBondContact O-N 2.94Å
232	K	81.4	Confident	73	Confident	149 Å²	149	95 Å²	95	65%	0.648	51%	0.51	S	S	*	.	H	α-helix	trans	-58.2	-36.4	171.6	-72.1	175.2	-177.8	178.7	0	113.8	E228 R230 G236	E228-K232 VanDerWaalsContact O-CG 3.29Å; E228-K232 WeakPolarHBondContact O-CG 3.5Å; E228-K232 PolarHBondContact O-N 3.15Å; E228-K232 VanDerWaalsContact O-N 3.12Å; R230-K232 VanDerWaalsContact C-N 3.3Å; R230-K232 PolarHBondContact O-N 2.85Å; K232-G236 PolarHBondContact O-N 2.99Å
233	Y	77.7	Confident	70.8	Confident	170 Å²	170	100.4 Å²	100.4	67%	0.667	53%	0.527	S	S	*	.	H	α-helix	trans	-70.8	-33.1	173.9	-73.7	-62.1	0	0	0	112.7	R229 R230 T231 R237	R229-Y233 HydrophobicContact CG-CD2 4.32Å; R229-Y233 HydrophobicContact CG-CE2 3.73Å; R229-Y233 WeakPolarHBondContact O-CD2 3.48Å; R229-Y233 PolarHBondContact O-N 3.08Å; R230-Y233 WeakPolarHBondContact O-CA 3.4Å; R230-Y233 WeakPolarHBondContact O-CB 3.31Å; R230-Y233 PolarHBondContact O-N 3.13Å; T231-Y233 VanDerWaalsContact C-N 3.29Å; T231-Y233 PolarHBondContact O-N 3.44Å; Y233-R237 WeakPolarHBondContact O-CB 3.37Å; Y233-R237 PolarHBondContact O-N 3.05Å
234	E	73.6	Confident	68.7	Low	95 Å²	95	106.4 Å²	106.4	44%	0.444	56%	0.559	S	S	.	*	H	α-helix	trans	-71.1	-44.5	175.2	-70.2	175.2	173.9	0	0	110.9	R230 T231 R237	R230-E234 PolarHBondContact O-N 3.16Å; T231-E234 CarbonylContact O-C 3.55Å; T231-E234 WeakPolarHBondContact O-CA 3.24Å; T231-E234 WeakPolarHBondContact O-CB 3.32Å; T231-E234 PolarHBondContact O-N 3.03Å; E234-R237 PolarHBondContact O-N 3.39Å
235	D	74.7	Confident	66.5	Low	114 Å²	114	114.4 Å²	114.4	61%	0.61	59%	0.589	S	S	*	*	H	α-helix	trans	-66.3	-43.9	176.6	-64.8	-25.8	0	0	0	111.4	T231 R237 S238	T231-D235 PolarHBondContact O-N 2.94Å; D235-R237 PolarHBondContact O-N 3.46Å; D235-S238 VanDerWaalsContact O-CB 3.28Å; D235-S238 WeakPolarHBondContact O-CB 3.2Å; D235-S238 PolarHBondContact O-N 3.44Å
236	G	62	Low	64.7	Low	58 Å²	58	116.3 Å²	116.3	60%	0.598	60%	0.603	S	S	*	*	H	α-helix	trans	-68	-16.1	177.1	0	0	0	0	0	114.4	K232 S238	K232-G236 PolarHBondContact O-N 2.99Å; G236-S238 VanDerWaalsContact C-N 3.26Å
237	R	56.8	Low	63.1	Low	221 Å²	221	126 Å²	126	83%	0.834	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-3	170.9	-150.6	175.5	-169.5	-174.2	2.2	112.8	Y233 E234 D235 P239	Y233-R237 WeakPolarHBondContact O-CB 3.37Å; Y233-R237 PolarHBondContact O-N 3.05Å; E234-R237 PolarHBondContact O-N 3.39Å; D235-R237 PolarHBondContact O-N 3.46Å; R237-P239 VanDerWaalsContact O-CD 3.28Å; R237-P239 WeakPolarHBondContact O-CD 3.39Å
238	S	45	Very low	61.2	Low	98 Å²	98	128.6 Å²	128.6	69%	0.685	66%	0.664	S	S	*	*			trans	-91.8	76.9	169.1	-53.8	0	0	0	0	110.6	D235 G236	D235-S238 VanDerWaalsContact O-CB 3.28Å; D235-S238 WeakPolarHBondContact O-CB 3.2Å; D235-S238 PolarHBondContact O-N 3.44Å; G236-S238 VanDerWaalsContact C-N 3.26Å
239	P	46.3	Very low	59.3	Low	94 Å²	94	131.8 Å²	131.8	61%	0.61	68%	0.684	S	S	*	*	S	Bend	trans	-129.5	136.7	142.3	28.1	-11.7	0	0	0	111.8	R237	R237-P239 VanDerWaalsContact O-CD 3.28Å; R237-P239 WeakPolarHBondContact O-CD 3.39Å
240	S	50.1	Low	57.4	Low	128 Å²	128	138.4 Å²	138.4	90%	0.895	71%	0.709	S	S	*	*	S	Bend	trans	69.7	62.5	173.1	48.4	0	0	0	0	117.8
241	G	40.6	Very low	55.9	Low	87 Å²	87	142.4 Å²	142.4	90%	0.897	73%	0.733	S	S	*	*			trans	-126.8	10.8	158	0	0	0	0	0	113.8
242	S	49.3	Very low	54.2	Low	109 Å²	109	145.2 Å²	145.2	76%	0.762	75%	0.753	S	S	*	*			trans	-108.4	100.8	167.5	-179.4	0	0	0	0	107.6
243	R	43.8	Very low	52.5	Low	233 Å²	233	149.9 Å²	149.9	88%	0.879	77%	0.766	S	S	*	*	S	Bend	trans	179.1	122.1	149	-96.2	158.2	-166.9	-162.9	3.6	110.4
244	D	45.9	Very low	51.3	Low	132 Å²	132	145.9 Å²	145.9	71%	0.706	77%	0.768	S	S	*	*			trans	66.5	72.4	159.4	-63.9	-26.9	0	0	0	119.3
245	Y	44.9	Very low	50.1	Low	245 Å²	245	148.2 Å²	148.2	96%	0.961	78%	0.784	S	S	*	*			trans	-122.8	48.5	135.7	-91.6	-85.5	0	0	0	110
246	D	50.7	Low	48.7	Very low	142 Å²	142	154.8 Å²	154.8	76%	0.759	80%	0.8	S	S	*	*	S	Bend	trans	-125.4	65	159.5	-149.2	-40.4	0	0	0	108.9
247	R	54.4	Low	47.9	Very low	244 Å²	244	161.2 Å²	161.2	92%	0.921	81%	0.808	S	S	*	*	S	Bend	trans	-175.5	99.1	161.4	-110.4	174.8	-173.9	-179.2	2.5	109
248	G	49.9	Very low	47.6	Very low	68 Å²	68	156.3 Å²	156.3	70%	0.701	80%	0.798	S	S	*	*	S	Bend	trans	174.3	-38.7	164.9	0	0	0	0	0	118.8
249	N	46.9	Very low	47.9	Very low	152 Å²	152	156.5 Å²	156.5	81%	0.813	80%	0.8	S	S	*	*			trans	-136.1	54	-174	-88.9	-26.8	0	0	0	113.3	M251	N249-M251 PolarHBondContact O-N 3.12Å
250	R	46.6	Very low	48.1	Very low	238 Å²	238	158.2 Å²	158.2	90%	0.898	80%	0.804	S	S	*	*			trans	-75.4	81.8	137.8	-76.8	-176.5	-178.5	175.6	1.7	106.7	P252	R250-P252 WeakPolarHBondContact O-CD 3.42Å
251	M	51.6	Low	48.1	Very low	163 Å²	163	163.1 Å²	163.1	80%	0.803	80%	0.802	S	S	*	*			trans	-70.8	116	160.1	-88.9	-122.1	124.3	0	0	107.1	N249	N249-M251 PolarHBondContact O-N 3.12Å
252	P	45.4	Very low	48.3	Very low	110 Å²	110	169.7 Å²	169.7	71%	0.714	80%	0.8	S	S	*	*			trans	-71.9	147.7	-177.1	-15.6	31.9	0	0	0	111.1	R250 A254	R250-P252 WeakPolarHBondContact O-CD 3.42Å; P252-A254 PolarHBondContact O-N 3.49Å; P252-A254 VanDerWaalsContact O-N 3.16Å
253	R	47	Very low	48.4	Very low	246 Å²	246	175.8 Å²	175.8	93%	0.928	81%	0.806	S	S	*	*			trans	-44.8	118.7	166.3	-68.6	174	172.1	170.5	-3.8	110
254	A	51	Low	48.6	Very low	87 Å²	87	168.9 Å²	168.9	72%	0.719	79%	0.794	S	S	*	*			trans	-125.1	90.9	160.4	0	0	0	0	0	106.9	P252 R256	P252-A254 PolarHBondContact O-N 3.49Å; P252-A254 VanDerWaalsContact O-N 3.16Å; A254-R256 PolarHBondContact O-N 2.96Å
255	D	48.7	Very low	48.5	Very low	144 Å²	144	169.6 Å²	169.6	77%	0.77	80%	0.798	S	S	*	*			trans	16.1	91.9	141.5	-59.7	-58.1	0	0	0	115.7	Y257	D255-Y257 VanDerWaalsContact C-N 3.26Å
256	R	47	Very low	48.7	Very low	252 Å²	252	173.2 Å²	173.2	95%	0.951	81%	0.81	S	S	*	*			trans	-99	66.6	143.1	-77.4	-174.2	178.8	172.6	0.5	107.9	A254	A254-R256 PolarHBondContact O-N 2.96Å
257	Y	45.1	Very low	48.6	Very low	193 Å²	193	174.8 Å²	174.8	76%	0.757	81%	0.812	S	S	*	*			trans	-75.2	148.5	158.6	-158.5	-97.3	0	0	0	108.7	D255	D255-Y257 VanDerWaalsContact C-N 3.26Å
258	N	49.7	Very low	48.3	Very low	117 Å²	117	171.2 Å²	171.2	63%	0.626	81%	0.807	S	S	*	*			trans	71.6	74.5	175.4	-81.3	-15.8	0	0	0	118.1
259	S	51.1	Low	48.2	Very low	103 Å²	103	176.9 Å²	176.9	72%	0.72	81%	0.812	S	S	*	*			trans	-122.6	82.2	130.4	-167.3	0	0	0	0	108.6	R261	S259-R261 VanDerWaalsContact C-N 3.31Å; S259-R261 PolarHBondContact O-N 3.23Å
260	D	50.6	Low	48.3	Very low	130 Å²	130	178.4 Å²	178.4	70%	0.695	81%	0.812	S	S	*	*			trans	-47	100.2	146.9	-95.7	-49.6	0	0	0	109.5
261	R	49.6	Very low	48.4	Very low	230 Å²	230	174.6 Å²	174.6	87%	0.868	81%	0.807	S	S	*	*			trans	-136.6	71.7	149.7	-71.7	-166.5	-179.3	168.4	0.9	109.1	S259	S259-R261 VanDerWaalsContact C-N 3.31Å; S259-R261 PolarHBondContact O-N 3.23Å
262	R	46.1	Very low	48.2	Very low	225 Å²	225	175.4 Å²	175.4	85%	0.849	81%	0.807	S	S	*	*			trans	-66.7	122.4	141.2	-71.1	-175.3	176.6	-152.3	0.1	108.1
263	R	50.8	Low	48.4	Very low	237 Å²	237	180.1 Å²	180.1	89%	0.894	81%	0.814	S	S	*	*			trans	171.7	133.7	151.9	-102.3	-174.5	171.5	177	-0.7	106.4
264	S	47.4	Very low	48.5	Very low	89 Å²	89	175 Å²	175	62%	0.622	81%	0.805	S	S	*	*			cis	-174.7	148.5	-2.8	-111.6	0	0	0	0	105.1	R266	S264-R266 PolarHBondContact O-N 3.1Å
265	D	44.2	Very low	48.3	Very low	146 Å²	146	182.3 Å²	182.3	78%	0.781	81%	0.812	S	S	*	*			trans	9	105.7	142.5	-53.2	-57.5	0	0	0	117.8
266	R	48.9	Very low	48.2	Very low	322 Å²	322	185.8 Å²	185.8	100%	1.215	82%	0.816	S	S	*	*				160.3	0	114.6	-88.3	-176.7	-178.9	-172.9	0.8	109.9	S264	S264-R266 PolarHBondContact O-N 3.1Å

Retrieved 266 of 266 residues in 561.2 ms (Link to these results)

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