G4VM02_SCHMA Loading...

Putative spfh domain / Band 7 family protein

AlphaFold DB , UniProt , Accession G4VM02, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 294 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	44	Very low	60.3	Low	237 Å²	237	134.4 Å²	134.4	100%	1.167	71%	0.708	S	S	*	*				0	61.3	0	-72.4	178	130.5	0	0	109.1
2	T	42.6	Very low	61.4	Low	140 Å²	140	129 Å²	129	86%	0.859	68%	0.684	S	S	*	*			trans	-108.7	82.8	-175.5	-16.7	0	0	0	0	107.7	R4	T2-R4 PolarHBondContact O-N 3.16Å
3	S	50.9	Low	62.5	Low	120 Å²	120	126.2 Å²	126.2	84%	0.839	67%	0.67	S	S	*	*			trans	-55.4	103.6	166.3	-59	0	0	0	0	107.6	E5	S3-E5 PolarHBondContact O-N 3.33Å
4	R	58.7	Low	63.1	Low	231 Å²	231	124.1 Å²	124.1	87%	0.872	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-66.8	127.3	175	-91.3	175	158.8	153.7	-6.5	108.2	T2 L6	T2-R4 PolarHBondContact O-N 3.16Å; R4-L6 PolarHBondContact O-N 3.4Å
5	E	57.6	Low	63.7	Low	191 Å²	191	123.4 Å²	123.4	89%	0.893	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-47.7	121.6	160.8	-68.5	171.8	136.6	0	0	107.8	S3 S7	S3-E5 PolarHBondContact O-N 3.33Å; E5-S7 PolarHBondContact O-N 3.4Å; E5-S7 VanDerWaalsContact O-N 3.13Å
6	L	58.9	Low	64.1	Low	97 Å²	97	120.7 Å²	120.7	51%	0.508	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-54.9	122.8	172.4	-85.1	104.7	0	0	0	107.2	R4 T8 E10 I11	R4-L6 PolarHBondContact O-N 3.4Å; L6-T8 PolarHBondContact O-N 3.45Å; L6-E10 HydrophobicContact CD2-CB 4.14Å; L6-I11 HydrophobicContact CB-CD1 4.25Å; L6-I11 HydrophobicContact CB-CG1 4.05Å
7	S	67.1	Low	64.2	Low	68 Å²	68	117.2 Å²	117.2	48%	0.476	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-59.1	138.5	176.1	60.8	0	0	0	0	109.1	E5 V9 E10 I11	E5-S7 PolarHBondContact O-N 3.4Å; E5-S7 VanDerWaalsContact O-N 3.13Å; S7-V9 PolarHBondContact O-N 3.26Å; S7-E10 PolarHBondContact O-N 3.27Å; S7-I11 PolarHBondContact O-N 3.03Å
8	T	71.3	Confident	64.2	Low	109 Å²	109	116 Å²	116	67%	0.669	61%	0.614	S	S	*	*	H	α-helix	trans	-49.1	-28	-177.8	-52	0	0	0	0	113.4	L6 I11 V12	L6-T8 PolarHBondContact O-N 3.45Å; T8-I11 PolarHBondContact O-N 3.4Å; T8-V12 HydrophobicContact CG2-CG2 4.41Å; T8-V12 VanDerWaalsContact O-CG2 3.24Å; T8-V12 WeakPolarHBondContact O-CG2 3.3Å; T8-V12 PolarHBondContact O-N 2.84Å
9	V	72.7	Confident	64.1	Low	100 Å²	100	116 Å²	116	61%	0.606	61%	0.61	S	S	*	*	H	α-helix	trans	-63.8	-44.1	175.7	-176.1	0	0	0	0	112.1	S7 I11 V12 D13	S7-V9 PolarHBondContact O-N 3.26Å; V9-I11 VanDerWaalsContact C-N 3.34Å; V9-I11 PolarHBondContact O-N 2.84Å; V9-V12 PolarHBondContact O-N 3.3Å; V9-D13 PolarHBondContact O-N 3.31Å
10	E	70.1	Confident	63.9	Low	105 Å²	105	117.9 Å²	117.9	49%	0.491	61%	0.609	S	S	.	*	H	α-helix	trans	-65.8	-37.5	177.3	-99.8	-177.1	152	0	0	111.8	L6 S7 V12 D13 I14	L6-E10 HydrophobicContact CD2-CB 4.14Å; S7-E10 PolarHBondContact O-N 3.27Å; E10-V12 VanDerWaalsContact C-N 3.35Å; E10-D13 PolarHBondContact O-N 3.44Å; E10-I14 WeakPolarHBondContact O-CB 3.49Å; E10-I14 VanDerWaalsContact O-CG1 3.23Å; E10-I14 WeakPolarHBondContact O-CG1 3.38Å; E10-I14 PolarHBondContact O-N 3.35Å
11	I	69	Low	63.7	Low	80 Å²	80	116.2 Å²	116.2	41%	0.41	60%	0.604	S	S	.	*	H	α-helix	trans	-65.3	-43.3	176.9	-58.7	177	0	0	0	109.5	L6 S7 T8 V9 I14 E15	L6-I11 HydrophobicContact CB-CD1 4.25Å; L6-I11 HydrophobicContact CB-CG1 4.05Å; S7-I11 PolarHBondContact O-N 3.03Å; T8-I11 PolarHBondContact O-N 3.4Å; V9-I11 VanDerWaalsContact C-N 3.34Å; V9-I11 PolarHBondContact O-N 2.84Å; I11-I14 PolarHBondContact O-N 2.81Å; I11-E15 WeakPolarHBondContact O-CB 3.37Å; I11-E15 PolarHBondContact O-N 3.14Å
12	V	73.9	Confident	64.3	Low	70 Å²	70	114.6 Å²	114.6	42%	0.424	59%	0.585	S	S	.	*	H	α-helix	trans	-65.2	-39.1	177.1	172.6	0	0	0	0	111.7	T8 V9 E10 E15 Q16	T8-V12 HydrophobicContact CG2-CG2 4.41Å; T8-V12 VanDerWaalsContact O-CG2 3.24Å; T8-V12 WeakPolarHBondContact O-CG2 3.3Å; T8-V12 PolarHBondContact O-N 2.84Å; V9-V12 PolarHBondContact O-N 3.3Å; E10-V12 VanDerWaalsContact C-N 3.35Å; V12-E15 PolarHBondContact O-N 3.48Å; V12-Q16 HydrophobicContact CG1-CG 4.4Å; V12-Q16 VanDerWaalsContact O-CB 3.32Å; V12-Q16 WeakPolarHBondContact O-CB 3.22Å; V12-Q16 WeakPolarHBondContact O-CG 3.12Å; V12-Q16 PolarHBondContact O-N 3Å
13	D	75.1	Confident	64.9	Low	92 Å²	92	115.7 Å²	115.7	49%	0.492	58%	0.58	S	S	.	*	H	α-helix	trans	-67.3	-38.8	176.5	-76.4	-30.9	0	0	0	111.9	V9 E10 S17	V9-D13 PolarHBondContact O-N 3.31Å; E10-D13 PolarHBondContact O-N 3.44Å; D13-S17 VanDerWaalsContact O-CB 3.31Å; D13-S17 WeakPolarHBondContact O-CB 3.38Å; D13-S17 PolarHBondContact O-N 3.04Å
14	I	71.5	Confident	65.1	Low	98 Å²	98	117.3 Å²	117.3	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-66.7	-46.1	174.6	-67.3	166.3	0	0	0	110.1	E10 I11 Q16 S17 N18	E10-I14 WeakPolarHBondContact O-CB 3.49Å; E10-I14 VanDerWaalsContact O-CG1 3.23Å; E10-I14 WeakPolarHBondContact O-CG1 3.38Å; E10-I14 PolarHBondContact O-N 3.35Å; I11-I14 PolarHBondContact O-N 2.81Å; I14-Q16 VanDerWaalsContact C-N 3.34Å; I14-Q16 PolarHBondContact O-N 3.14Å; I14-S17 PolarHBondContact O-N 3.32Å; I14-S17 PolarHBondContact O-OG 3.43Å; I14-N18 WeakPolarHBondContact O-CB 3.34Å; I14-N18 PolarHBondContact O-N 2.93Å
15	E	71.8	Confident	64.7	Low	113 Å²	113	115.7 Å²	115.7	53%	0.528	57%	0.568	S	S	.	*	H	α-helix	trans	-59.7	-45.6	177.2	-151.6	101.2	-138.8	0	0	110.4	I11 V12 S17 N18 E19	I11-E15 WeakPolarHBondContact O-CB 3.37Å; I11-E15 PolarHBondContact O-N 3.14Å; V12-E15 PolarHBondContact O-N 3.48Å; E15-S17 PolarHBondContact O-N 3.33Å; E15-N18 CarbonylContact O-C 3.6Å; E15-N18 PolarHBondContact O-N 3.42Å; E15-N18 VanDerWaalsContact O-N 3.16Å; E15-E19 WeakPolarHBondContact O-CB 3.25Å; E15-E19 WeakPolarHBondContact O-CG 3.41Å; E15-E19 PolarHBondContact O-N 3.24Å
16	Q	69.5	Low	64.5	Low	80 Å²	80	116.2 Å²	116.2	37%	0.374	56%	0.562	S	S	.	*	H	α-helix	trans	-65.2	-37.1	175.5	-78	-161	4.9	0	0	112.8	V12 I14 N18 R20	V12-Q16 HydrophobicContact CG1-CG 4.4Å; V12-Q16 VanDerWaalsContact O-CB 3.32Å; V12-Q16 WeakPolarHBondContact O-CB 3.22Å; V12-Q16 WeakPolarHBondContact O-CG 3.12Å; V12-Q16 PolarHBondContact O-N 3Å; I14-Q16 VanDerWaalsContact C-N 3.34Å; I14-Q16 PolarHBondContact O-N 3.14Å; Q16-N18 VanDerWaalsContact C-N 3.27Å; Q16-N18 PolarHBondContact O-N 3.11Å; Q16-R20 WeakPolarHBondContact O-CB 3.47Å; Q16-R20 WeakPolarHBondContact O-CG 3.36Å; Q16-R20 PolarHBondContact O-N 3.48Å
17	S	65.9	Low	64.4	Low	62 Å²	62	120.3 Å²	120.3	43%	0.434	58%	0.579	S	S	.	*	H	α-helix	trans	-66.1	-34.6	175.2	79.4	0	0	0	0	111.5	D13 I14 E15 T21	D13-S17 VanDerWaalsContact O-CB 3.31Å; D13-S17 WeakPolarHBondContact O-CB 3.38Å; D13-S17 PolarHBondContact O-N 3.04Å; I14-S17 PolarHBondContact O-N 3.32Å; I14-S17 PolarHBondContact O-OG 3.43Å; E15-S17 PolarHBondContact O-N 3.33Å; S17-T21 PolarHBondContact O-N 3.32Å; S17-T21 PolarHBondContact O-OG1 3.06Å
18	N	65.3	Low	63.8	Low	95 Å²	95	122.3 Å²	122.3	51%	0.508	59%	0.59	S	S	.	*	H	α-helix	trans	-77.8	-34.2	-180	-150.2	25.2	0	0	0	111.7	I14 E15 Q16 T21 R22	I14-N18 WeakPolarHBondContact O-CB 3.34Å; I14-N18 PolarHBondContact O-N 2.93Å; E15-N18 CarbonylContact O-C 3.6Å; E15-N18 PolarHBondContact O-N 3.42Å; E15-N18 VanDerWaalsContact O-N 3.16Å; Q16-N18 VanDerWaalsContact C-N 3.27Å; Q16-N18 PolarHBondContact O-N 3.11Å; N18-T21 VanDerWaalsContact CA-OG1 3.29Å; N18-T21 WeakPolarHBondContact CA-OG1 3.33Å; N18-T21 PolarHBondContact O-OG1 3.34Å; N18-R22 WeakPolarHBondContact O-CB 3.36Å; N18-R22 WeakPolarHBondContact O-CG 3.49Å; N18-R22 PolarHBondContact O-N 3.48Å
19	E	62.6	Low	63.1	Low	116 Å²	116	124.3 Å²	124.3	54%	0.542	60%	0.597	S	S	.	*	H	α-helix	trans	-66.6	-45.8	169.5	-74.9	-179.1	161.4	0	0	111.1	E15 T21 R22 E23	E15-E19 WeakPolarHBondContact O-CB 3.25Å; E15-E19 WeakPolarHBondContact O-CG 3.41Å; E15-E19 PolarHBondContact O-N 3.24Å; E19-T21 VanDerWaalsContact C-N 3.29Å; E19-T21 PolarHBondContact O-N 3.21Å; E19-R22 CarbonylContact O-C 3.59Å; E19-R22 WeakPolarHBondContact O-CA 3.24Å; E19-R22 WeakPolarHBondContact O-CB 3.4Å; E19-R22 PolarHBondContact O-N 3.22Å; E19-E23 PolarHBondContact O-N 3.39Å
20	R	58.9	Low	62.4	Low	153 Å²	153	128.3 Å²	128.3	58%	0.577	61%	0.609	S	S	*	*	H	α-helix	trans	-61.9	-35.5	175.9	-72.7	179.4	-145.3	-178.6	8.3	112.8	Q16 E23 Q24	Q16-R20 WeakPolarHBondContact O-CB 3.47Å; Q16-R20 WeakPolarHBondContact O-CG 3.36Å; Q16-R20 PolarHBondContact O-N 3.48Å; R20-E23 PolarHBondContact O-N 3.01Å; R20-Q24 PolarHBondContact O-N 2.94Å
21	T	59.3	Low	61.8	Low	83 Å²	83	132 Å²	132	51%	0.509	63%	0.626	S	S	.	*	H	α-helix	trans	-76	-26.1	174.8	38.2	0	0	0	0	112.8	S17 N18 E19	S17-T21 PolarHBondContact O-N 3.32Å; S17-T21 PolarHBondContact O-OG1 3.06Å; N18-T21 VanDerWaalsContact CA-OG1 3.29Å; N18-T21 WeakPolarHBondContact CA-OG1 3.33Å; N18-T21 PolarHBondContact O-OG1 3.34Å; E19-T21 VanDerWaalsContact C-N 3.29Å; E19-T21 PolarHBondContact O-N 3.21Å
22	R	56.5	Low	61.2	Low	204 Å²	204	130.8 Å²	130.8	77%	0.77	63%	0.633	S	S	*	*	H	α-helix	trans	-71.4	-32	168.2	-83.5	-177.1	153.3	-172.4	-4.8	112.9	N18 E19 Q24 R25	N18-R22 WeakPolarHBondContact O-CB 3.36Å; N18-R22 WeakPolarHBondContact O-CG 3.49Å; N18-R22 PolarHBondContact O-N 3.48Å; E19-R22 CarbonylContact O-C 3.59Å; E19-R22 WeakPolarHBondContact O-CA 3.24Å; E19-R22 WeakPolarHBondContact O-CB 3.4Å; E19-R22 PolarHBondContact O-N 3.22Å; R22-Q24 VanDerWaalsContact C-N 3.29Å; R22-Q24 PolarHBondContact O-N 3.3Å; R22-R25 WeakPolarHBondContact O-CB 3.49Å; R22-R25 PolarHBondContact O-N 3.36Å
23	E	56.7	Low	60.6	Low	162 Å²	162	133.9 Å²	133.9	76%	0.757	65%	0.646	S	S	*	*	H	α-helix	trans	-72.8	-19.7	175.4	-73	-176.8	163.4	0	0	113.1	E19 R20 R25	E19-E23 PolarHBondContact O-N 3.39Å; R20-E23 PolarHBondContact O-N 3.01Å; E23-R25 PolarHBondContact O-N 3.06Å
24	Q	54.4	Low	60.2	Low	155 Å²	155	131.7 Å²	131.7	72%	0.724	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	22.1	171.1	-73.2	-172.2	-24.9	0	0	114.1	R20 R22 W26	R20-Q24 PolarHBondContact O-N 2.94Å; R22-Q24 VanDerWaalsContact C-N 3.29Å; R22-Q24 PolarHBondContact O-N 3.3Å; Q24-W26 VanDerWaalsContact C-N 3.34Å; Q24-W26 PolarHBondContact O-N 3.35Å
25	R	49.5	Very low	60.3	Low	197 Å²	197	130.7 Å²	130.7	74%	0.743	65%	0.652	S	S	*	*	S	Bend	trans	-82.3	83.5	173.1	-170.8	76.9	-160.5	171.4	4.3	109.5	R22 E23	R22-R25 WeakPolarHBondContact O-CB 3.49Å; R22-R25 PolarHBondContact O-N 3.36Å; E23-R25 PolarHBondContact O-N 3.06Å
26	W	54.5	Low	60.7	Low	202 Å²	202	127.8 Å²	127.8	77%	0.765	65%	0.652	S	S	*	*			trans	39.3	81.4	155	-51.3	88.8	0	0	0	114.3	Q24 P28	Q24-W26 VanDerWaalsContact C-N 3.34Å; Q24-W26 PolarHBondContact O-N 3.35Å; W26-P28 WeakPolarHBondContact O-CD 3.4Å
27	E	56.2	Low	61.3	Low	182 Å²	182	125.5 Å²	125.5	85%	0.85	65%	0.65	S	S	*	*			trans	-70	112.4	156	-75.6	-179.6	128.7	0	0	106.6	D29	E27-D29 PolarHBondContact O-N 2.73Å
28	P	55	Low	62.4	Low	110 Å²	110	126.1 Å²	126.1	71%	0.714	65%	0.651	S	S	*	*			trans	-63.6	123.9	172.5	27.2	-29.4	0	0	0	106.4	W26 E30	W26-P28 WeakPolarHBondContact O-CD 3.4Å; P28-E30 PolarHBondContact O-N 3.42Å
29	D	57.1	Low	63.6	Low	152 Å²	152	127 Å²	127	81%	0.813	66%	0.655	S	S	*	*			trans	-51.2	106.1	171.8	-56.9	-56	0	0	0	107.2	E27 E31	E27-D29 PolarHBondContact O-N 2.73Å; D29-E31 PolarHBondContact O-N 2.88Å
30	E	57.5	Low	64.9	Low	184 Å²	184	126.4 Å²	126.4	86%	0.86	66%	0.655	S	S	*	*			trans	-68.1	79.2	166	-68.9	-146	177.8	0	0	105.9	P28 G32	P28-E30 PolarHBondContact O-N 3.42Å; E30-G32 PolarHBondContact O-N 3.42Å
31	E	57.3	Low	66.4	Low	181 Å²	181	126.1 Å²	126.1	85%	0.846	66%	0.658	S	S	*	*			trans	-59.5	78.9	152.2	-75.4	-168.2	167.7	0	0	105.5	D29 I33	D29-E31 PolarHBondContact O-N 2.88Å; E31-I33 PolarHBondContact O-N 3.38Å
32	G	56.6	Low	68	Low	55 Å²	55	126.4 Å²	126.4	57%	0.567	66%	0.655	S	S	*	*			trans	-49.3	117.8	175.9	0	0	0	0	0	105.7	E30 G34	E30-G32 PolarHBondContact O-N 3.42Å; G32-G34 VanDerWaalsContact C-N 3.28Å; G32-G34 VanDerWaalsContact O-CA 3.31Å; G32-G34 WeakPolarHBondContact O-CA 3.35Å; G32-G34 PolarHBondContact O-N 2.93Å
33	I	62	Low	69.8	Low	136 Å²	136	122 Å²	122	70%	0.697	65%	0.647	S	S	*	*			trans	-38.1	98.9	179	-61.5	166	0	0	0	106.4	E31 V38	E31-I33 PolarHBondContact O-N 3.38Å; I33-V38 HydrophobicContact CG2-CG2 4.04Å
34	G	66.1	Low	71.4	Confident	46 Å²	46	118.8 Å²	118.8	47%	0.474	63%	0.634	S	S	.	*			trans	-55.7	153.5	-167.7	0	0	0	0	0	108.4	G32 G36 G37 V38	G32-G34 VanDerWaalsContact C-N 3.28Å; G32-G34 VanDerWaalsContact O-CA 3.31Å; G32-G34 WeakPolarHBondContact O-CA 3.35Å; G32-G34 PolarHBondContact O-N 2.93Å; G34-G36 CarbonylContact O-C 3.49Å; G34-G36 PolarHBondContact O-N 3.17Å; G34-G37 WeakPolarHBondContact O-CA 3.2Å; G34-G37 PolarHBondContact O-N 2.95Å; G34-V38 PolarHBondContact O-N 3.42Å
35	A	73.9	Confident	73.2	Confident	77 Å²	77	114 Å²	114	64%	0.636	62%	0.615	S	S	*	*	H	α-helix	trans	-45.8	-31.3	179.8	0	0	0	0	0	112.8	V38 I39	A35-V38 PolarHBondContact O-N 3.41Å; A35-I39 WeakPolarHBondContact O-CB 3.31Å; A35-I39 WeakPolarHBondContact O-CD1 3.41Å; A35-I39 WeakPolarHBondContact O-CG1 3.48Å; A35-I39 PolarHBondContact O-N 2.91Å
36	G	79	Confident	75.4	Confident	52 Å²	52	109.5 Å²	109.5	54%	0.536	60%	0.604	S	S	.	*	H	α-helix	trans	-60	-40.5	170.2	0	0	0	0	0	116	G34 I39 L40	G34-G36 CarbonylContact O-C 3.49Å; G34-G36 PolarHBondContact O-N 3.17Å; G36-I39 PolarHBondContact O-N 3.3Å; G36-L40 WeakPolarHBondContact O-CB 3.42Å; G36-L40 PolarHBondContact O-N 2.85Å
37	G	83.9	Confident	77.2	Confident	32 Å²	32	105.2 Å²	105.2	33%	0.33	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-38.5	174.4	0	0	0	0	0	112.7	G34 L40 F41	G34-G37 WeakPolarHBondContact O-CA 3.2Å; G34-G37 PolarHBondContact O-N 2.95Å; G37-L40 PolarHBondContact O-N 3.12Å; G37-F41 WeakPolarHBondContact O-CB 3.39Å; G37-F41 PolarHBondContact O-N 3.27Å
38	V	87.7	Confident	78.9	Confident	74 Å²	74	103 Å²	103	45%	0.448	58%	0.584	S	S	.	*	H	α-helix	trans	-65.9	-44.4	173.4	-176.7	0	0	0	0	110.6	I33 G34 A35 L40 F41 I42	I33-V38 HydrophobicContact CG2-CG2 4.04Å; G34-V38 PolarHBondContact O-N 3.42Å; A35-V38 PolarHBondContact O-N 3.41Å; V38-L40 PolarHBondContact O-N 3.49Å; V38-F41 PolarHBondContact O-N 2.91Å; V38-I42 HydrophobicContact CG1-CD1 3.94Å; V38-I42 VanDerWaalsContact O-CG1 3.27Å; V38-I42 WeakPolarHBondContact O-CG1 3.43Å; V38-I42 PolarHBondContact O-N 3.36Å
39	I	90.1	Very high	80.8	Confident	115 Å²	115	103.1 Å²	103.1	59%	0.59	58%	0.577	S	S	*	*	H	α-helix	trans	-60.9	-43.6	175.6	-68.1	161.9	0	0	0	111	A35 G36 I42 L43	A35-I39 WeakPolarHBondContact O-CB 3.31Å; A35-I39 WeakPolarHBondContact O-CD1 3.41Å; A35-I39 WeakPolarHBondContact O-CG1 3.48Å; A35-I39 PolarHBondContact O-N 2.91Å; G36-I39 PolarHBondContact O-N 3.3Å; I39-I42 PolarHBondContact O-N 2.94Å; I39-L43 WeakPolarHBondContact O-CB 3.4Å; I39-L43 PolarHBondContact O-N 2.89Å
40	L	90.5	Very high	82.4	Confident	103 Å²	103	99.5 Å²	99.5	54%	0.539	56%	0.563	S	S	.	*	H	α-helix	trans	-62.4	-43.4	176.8	-169.9	92.9	0	0	0	111.6	G36 G37 V38 L43 I44	G36-L40 WeakPolarHBondContact O-CB 3.42Å; G36-L40 PolarHBondContact O-N 2.85Å; G37-L40 PolarHBondContact O-N 3.12Å; V38-L40 PolarHBondContact O-N 3.49Å; L40-L43 WeakPolarHBondContact O-CB 3.44Å; L40-L43 PolarHBondContact O-N 2.92Å; L40-I44 HydrophobicContact CD2-CD1 4.12Å; L40-I44 HydrophobicContact CG-CD1 4.09Å; L40-I44 WeakPolarHBondContact O-CG1 3.45Å; L40-I44 PolarHBondContact O-N 3.15Å
41	F	90.5	Very high	83.9	Confident	147 Å²	147	93.6 Å²	93.6	65%	0.645	54%	0.539	S	S	*	.	H	α-helix	trans	-63.1	-43.3	178.1	-173.1	-95.6	0	0	0	111.6	G37 V38 L43 I44 T45	G37-F41 WeakPolarHBondContact O-CB 3.39Å; G37-F41 PolarHBondContact O-N 3.27Å; V38-F41 PolarHBondContact O-N 2.91Å; F41-L43 VanDerWaalsContact C-N 3.34Å; F41-L43 PolarHBondContact O-N 3.37Å; F41-I44 PolarHBondContact O-N 3.37Å; F41-T45 WeakPolarHBondContact O-CB 3.28Å; F41-T45 PolarHBondContact O-N 3.4Å; F41-T45 PolarHBondContact O-OG1 3.29Å
42	I	92.7	Very high	85.5	Confident	88 Å²	88	90 Å²	90	45%	0.451	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-44.2	174.5	-68	165.9	0	0	0	110.3	V38 I39 T45 I46	V38-I42 HydrophobicContact CG1-CD1 3.94Å; V38-I42 VanDerWaalsContact O-CG1 3.27Å; V38-I42 WeakPolarHBondContact O-CG1 3.43Å; V38-I42 PolarHBondContact O-N 3.36Å; I39-I42 PolarHBondContact O-N 2.94Å; I42-T45 PolarHBondContact O-N 3.47Å; I42-I46 HydrophobicContact CG2-CD1 3.63Å; I42-I46 HydrophobicContact CG2-CG1 4.34Å; I42-I46 WeakPolarHBondContact O-CB 3.25Å; I42-I46 VanDerWaalsContact O-CG1 3.23Å; I42-I46 WeakPolarHBondContact O-CG1 3.42Å; I42-I46 PolarHBondContact O-N 3.31Å
43	L	93.8	Very high	87	Confident	113 Å²	113	90.7 Å²	90.7	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-61.1	-48	178.4	-173.4	84.1	0	0	0	112.3	I39 L40 F41 T45 I46 L47	I39-L43 WeakPolarHBondContact O-CB 3.4Å; I39-L43 PolarHBondContact O-N 2.89Å; L40-L43 WeakPolarHBondContact O-CB 3.44Å; L40-L43 PolarHBondContact O-N 2.92Å; F41-L43 VanDerWaalsContact C-N 3.34Å; F41-L43 PolarHBondContact O-N 3.37Å; L43-T45 VanDerWaalsContact C-N 3.32Å; L43-T45 PolarHBondContact O-N 2.89Å; L43-I46 PolarHBondContact O-N 3.34Å; L43-L47 WeakPolarHBondContact O-CB 3.38Å; L43-L47 PolarHBondContact O-N 3.06Å
44	I	91.9	Very high	88.3	Confident	94 Å²	94	88.4 Å²	88.4	48%	0.482	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-41.1	178.2	-68.3	167.1	0	0	0	110.5	L40 F41 L47 F48	L40-I44 HydrophobicContact CD2-CD1 4.12Å; L40-I44 HydrophobicContact CG-CD1 4.09Å; L40-I44 WeakPolarHBondContact O-CG1 3.45Å; L40-I44 PolarHBondContact O-N 3.15Å; F41-I44 PolarHBondContact O-N 3.37Å; I44-L47 WeakPolarHBondContact O-CB 3.42Å; I44-L47 PolarHBondContact O-N 3.1Å; I44-F48 WeakPolarHBondContact O-CB 3.47Å; I44-F48 PolarHBondContact O-N 2.93Å
45	T	92.1	Very high	89.2	Confident	53 Å²	53	89.4 Å²	89.4	33%	0.325	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-45.1	177.5	-56	0	0	0	0	111.1	F41 I42 L43 F48 I49	F41-T45 WeakPolarHBondContact O-CB 3.28Å; F41-T45 PolarHBondContact O-N 3.4Å; F41-T45 PolarHBondContact O-OG1 3.29Å; I42-T45 PolarHBondContact O-N 3.47Å; L43-T45 VanDerWaalsContact C-N 3.32Å; L43-T45 PolarHBondContact O-N 2.89Å; T45-F48 PolarHBondContact O-N 3.43Å; T45-I49 HydrophobicContact CG2-CD1 3.87Å; T45-I49 VanDerWaalsContact O-CG1 3.27Å; T45-I49 WeakPolarHBondContact O-CG1 3.4Å; T45-I49 PolarHBondContact O-N 3.42Å
46	I	94.4	Very high	89.9	Confident	103 Å²	103	89 Å²	89	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-61.8	-44.1	175.4	-70.8	167.8	0	0	0	110.9	I42 L43 F48 I49 C50	I42-I46 HydrophobicContact CG2-CD1 3.63Å; I42-I46 HydrophobicContact CG2-CG1 4.34Å; I42-I46 WeakPolarHBondContact O-CB 3.25Å; I42-I46 VanDerWaalsContact O-CG1 3.23Å; I42-I46 WeakPolarHBondContact O-CG1 3.42Å; I42-I46 PolarHBondContact O-N 3.31Å; L43-I46 PolarHBondContact O-N 3.34Å; I46-F48 VanDerWaalsContact C-N 3.35Å; I46-F48 PolarHBondContact O-N 3.46Å; I46-I49 PolarHBondContact O-N 2.99Å; I46-C50 VanDerWaalsContact O-CB 3.27Å; I46-C50 WeakPolarHBondContact O-CB 3.43Å; I46-C50 PolarHBondContact O-N 2.88Å
47	L	93.6	Very high	90.3	Very high	113 Å²	113	94.3 Å²	94.3	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-59.5	-45.3	176.4	-175.2	85.8	0	0	0	111.2	L43 I44 C50 T51	L43-L47 WeakPolarHBondContact O-CB 3.38Å; L43-L47 PolarHBondContact O-N 3.06Å; I44-L47 WeakPolarHBondContact O-CB 3.42Å; I44-L47 PolarHBondContact O-N 3.1Å; L47-C50 PolarHBondContact O-N 3.19Å; L47-T51 HydrophobicContact CG-CG2 4.41Å; L47-T51 WeakPolarHBondContact O-CB 3.24Å; L47-T51 VanDerWaalsContact O-CG2 3.26Å; L47-T51 WeakPolarHBondContact O-CG2 3.45Å; L47-T51 PolarHBondContact O-N 2.89Å; L47-T51 PolarHBondContact O-OG1 3.1Å
48	F	92.2	Very high	90.3	Very high	135 Å²	135	98.6 Å²	98.6	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-46.1	178.5	-169.9	-99	0	0	0	111.4	I44 T45 I46 C50 T51 F52	I44-F48 WeakPolarHBondContact O-CB 3.47Å; I44-F48 PolarHBondContact O-N 2.93Å; T45-F48 PolarHBondContact O-N 3.43Å; I46-F48 VanDerWaalsContact C-N 3.35Å; I46-F48 PolarHBondContact O-N 3.46Å; F48-C50 VanDerWaalsContact C-N 3.29Å; F48-C50 PolarHBondContact O-N 3.03Å; F48-T51 WeakPolarHBondContact CA-OG1 3.35Å; F48-T51 PolarHBondContact O-N 3.4Å; F48-T51 PolarHBondContact O-OG1 2.86Å; F48-F52 HydrophobicContact CE1-CD2 4.28Å; F48-F52 HydrophobicContact CZ-CD2 4.3Å; F48-F52 WeakPolarHBondContact O-CB 3.5Å; F48-F52 PolarHBondContact O-N 2.81Å
49	I	93.5	Very high	90.1	Very high	112 Å²	112	95.1 Å²	95.1	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-60.8	-38.6	176.5	-68.5	166.4	0	0	0	111.3	T45 I46 P53	T45-I49 HydrophobicContact CG2-CD1 3.87Å; T45-I49 VanDerWaalsContact O-CG1 3.27Å; T45-I49 WeakPolarHBondContact O-CG1 3.4Å; T45-I49 PolarHBondContact O-N 3.42Å; I46-I49 PolarHBondContact O-N 2.99Å; I49-P53 WeakPolarHBondContact O-CD 3.42Å
50	C	92	Very high	90	Very high	77 Å²	77	93.8 Å²	93.8	52%	0.52	48%	0.478	S	S	.	.	H	α-helix	trans	-72.3	-40.9	178.8	-172.8	0	0	0	0	112.3	I46 L47 F48 P53 I54	I46-C50 VanDerWaalsContact O-CB 3.27Å; I46-C50 WeakPolarHBondContact O-CB 3.43Å; I46-C50 PolarHBondContact O-N 2.88Å; L47-C50 PolarHBondContact O-N 3.19Å; F48-C50 VanDerWaalsContact C-N 3.29Å; F48-C50 PolarHBondContact O-N 3.03Å; C50-P53 WeakPolarHBondContact O-CD 3.27Å; C50-P53 WeakPolarHBondContact O-CG 3.47Å; C50-I54 WeakPolarHBondContact O-CD1 3.32Å
51	T	89	Confident	89.8	Confident	59 Å²	59	93.7 Å²	93.7	36%	0.362	47%	0.471	S	S	.	.	H	α-helix	trans	-78.2	-31.3	-178.2	53.3	0	0	0	0	113.1	L47 F48 I54 T55	L47-T51 HydrophobicContact CG-CG2 4.41Å; L47-T51 WeakPolarHBondContact O-CB 3.24Å; L47-T51 VanDerWaalsContact O-CG2 3.26Å; L47-T51 WeakPolarHBondContact O-CG2 3.45Å; L47-T51 PolarHBondContact O-N 2.89Å; L47-T51 PolarHBondContact O-OG1 3.1Å; F48-T51 WeakPolarHBondContact CA-OG1 3.35Å; F48-T51 PolarHBondContact O-N 3.4Å; F48-T51 PolarHBondContact O-OG1 2.86Å; T51-I54 WeakPolarHBondContact O-CB 3.3Å; T51-I54 PolarHBondContact O-N 3.32Å; T51-T55 WeakPolarHBondContact O-CG2 3.29Å; T51-T55 PolarHBondContact O-N 3.35Å
52	F	89.3	Confident	89.7	Confident	106 Å²	106	91 Å²	91	47%	0.465	47%	0.467	S	S	.	.	H	α-helix	trans	-53.9	-53.9	-179.5	-173.1	-104.1	0	0	0	114.7	F48 I54 T55 I56	F48-F52 HydrophobicContact CE1-CD2 4.28Å; F48-F52 HydrophobicContact CZ-CD2 4.3Å; F48-F52 WeakPolarHBondContact O-CB 3.5Å; F48-F52 PolarHBondContact O-N 2.81Å; F52-I54 VanDerWaalsContact C-N 3.27Å; F52-I54 PolarHBondContact O-N 3.48Å; F52-T55 PolarHBondContact O-N 3.44Å; F52-T55 PolarHBondContact O-OG1 2.9Å; F52-I56 HydrophobicContact CD1-CD1 3.82Å; F52-I56 HydrophobicContact CE1-CD1 3.32Å; F52-I56 HydrophobicContact CE2-CD1 4.19Å; F52-I56 HydrophobicContact CG-CD1 4.44Å; F52-I56 HydrophobicContact CZ-CD1 3.54Å; F52-I56 PolarHBondContact O-N 3.34Å; F52-I56 VanDerWaalsContact O-N 3.1Å
53	P	89.3	Confident	89.5	Confident	70 Å²	70	87.2 Å²	87.2	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-63.7	-35	179.2	25.8	-34.6	0	0	0	112.1	I49 C50 I56 F57	I49-P53 WeakPolarHBondContact O-CD 3.42Å; C50-P53 WeakPolarHBondContact O-CD 3.27Å; C50-P53 WeakPolarHBondContact O-CG 3.47Å; P53-I56 PolarHBondContact O-N 2.98Å; P53-F57 WeakPolarHBondContact O-CB 3.34Å; P53-F57 PolarHBondContact O-N 3.44Å
54	I	88.6	Confident	89.5	Confident	88 Å²	88	86.9 Å²	86.9	45%	0.451	44%	0.441	S	S	.	.	H	α-helix	trans	-62.2	-48.2	176.4	-59.4	172.8	0	0	0	109.3	C50 T51 F52 I56 F57 F58	C50-I54 WeakPolarHBondContact O-CD1 3.32Å; T51-I54 WeakPolarHBondContact O-CB 3.3Å; T51-I54 PolarHBondContact O-N 3.32Å; F52-I54 VanDerWaalsContact C-N 3.27Å; F52-I54 PolarHBondContact O-N 3.48Å; I54-I56 PolarHBondContact O-N 3.45Å; I54-F57 PolarHBondContact O-N 2.9Å; I54-F58 HydrophobicContact CG2-CD2 3.77Å; I54-F58 HydrophobicContact CG2-CE2 3.76Å; I54-F58 VanDerWaalsContact O-CD2 3.27Å; I54-F58 WeakPolarHBondContact O-CD2 3.45Å; I54-F58 PolarHBondContact O-N 2.91Å; I54-F58 VanDerWaalsContact O-N 3.08Å
55	T	86.2	Confident	89.4	Confident	67 Å²	67	87.9 Å²	87.9	41%	0.411	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-39.5	179.8	61.5	0	0	0	0	113.1	T51 F52 A59	T51-T55 WeakPolarHBondContact O-CG2 3.29Å; T51-T55 PolarHBondContact O-N 3.35Å; F52-T55 PolarHBondContact O-N 3.44Å; F52-T55 PolarHBondContact O-OG1 2.9Å; T55-A59 VanDerWaalsContact O-CB 3.32Å; T55-A59 WeakPolarHBondContact O-CB 3.5Å; T55-A59 PolarHBondContact O-N 2.67Å
56	I	87.2	Confident	89.4	Confident	68 Å²	68	88.8 Å²	88.8	35%	0.349	45%	0.45	S	S	.	.	H	α-helix	trans	-64.6	-45.6	176.4	-70	172.6	0	0	0	110.9	F52 P53 I54 F58 A59 I60	F52-I56 HydrophobicContact CD1-CD1 3.82Å; F52-I56 HydrophobicContact CE1-CD1 3.32Å; F52-I56 HydrophobicContact CE2-CD1 4.19Å; F52-I56 HydrophobicContact CG-CD1 4.44Å; F52-I56 HydrophobicContact CZ-CD1 3.54Å; F52-I56 PolarHBondContact O-N 3.34Å; F52-I56 VanDerWaalsContact O-N 3.1Å; P53-I56 PolarHBondContact O-N 2.98Å; I54-I56 PolarHBondContact O-N 3.45Å; I56-F58 VanDerWaalsContact C-N 3.33Å; I56-F58 PolarHBondContact O-N 3.13Å; I56-A59 WeakPolarHBondContact O-CB 3.4Å; I56-A59 PolarHBondContact O-N 2.71Å; I56-I60 HydrophobicContact CG2-CD1 4.25Å; I56-I60 PolarHBondContact O-N 2.93Å
57	F	87.1	Confident	89.3	Confident	163 Å²	163	85.3 Å²	85.3	72%	0.715	43%	0.431	S	S	*	.	H	α-helix	trans	-60.9	-43.3	-179.8	-175.9	-101.1	0	0	0	111.6	P53 I54 A59 I60	P53-F57 WeakPolarHBondContact O-CB 3.34Å; P53-F57 PolarHBondContact O-N 3.44Å; I54-F57 PolarHBondContact O-N 2.9Å; F57-A59 VanDerWaalsContact C-N 3.27Å; F57-A59 PolarHBondContact O-N 3.25Å; F57-I60 PolarHBondContact O-N 3Å
58	F	85.1	Confident	89.2	Confident	122 Å²	122	83.9 Å²	83.9	54%	0.535	42%	0.418	S	S	.	.	H	α-helix	trans	-68	-24.8	174.7	-83.2	-72.6	0	0	0	113.9	I54 I56	I54-F58 HydrophobicContact CG2-CD2 3.77Å; I54-F58 HydrophobicContact CG2-CE2 3.76Å; I54-F58 VanDerWaalsContact O-CD2 3.27Å; I54-F58 WeakPolarHBondContact O-CD2 3.45Å; I54-F58 PolarHBondContact O-N 2.91Å; I54-F58 VanDerWaalsContact O-N 3.08Å; I56-F58 VanDerWaalsContact C-N 3.33Å; I56-F58 PolarHBondContact O-N 3.13Å
59	A	83.7	Confident	89.1	Confident	2 Å²	2	77.4 Å²	77.4	2%	0.017	39%	0.39	C	S	.	.	H	α-helix	trans	-77.2	-24.3	-178.9	0	0	0	0	0	113.5	T55 I56 F57 R61 F92 V93	T55-A59 VanDerWaalsContact O-CB 3.32Å; T55-A59 WeakPolarHBondContact O-CB 3.5Å; T55-A59 PolarHBondContact O-N 2.67Å; I56-A59 WeakPolarHBondContact O-CB 3.4Å; I56-A59 PolarHBondContact O-N 2.71Å; F57-A59 VanDerWaalsContact C-N 3.27Å; F57-A59 PolarHBondContact O-N 3.25Å; A59-R61 PolarHBondContact O-N 3.38Å; A59-F92 HydrophobicContact CB-CD2 3.86Å; A59-F92 HydrophobicContact CB-CE1 4.47Å; A59-F92 HydrophobicContact CB-CE2 3.31Å; A59-F92 HydrophobicContact CB-CZ 3.67Å; A59-V93 WeakPolarHBondContact CA-O 3.46Å; A59-V93 VanDerWaalsContact CB-O 3.29Å; A59-V93 WeakPolarHBondContact CB-O 3.38Å; A59-V93 PolarHBondContact O-N 3.41Å
60	I	87.1	Confident	88.9	Confident	87 Å²	87	72.1 Å²	72.1	45%	0.446	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.5	178	-60.5	170.2	0	0	0	108.9	I56 F57 L90 F92	I56-I60 HydrophobicContact CG2-CD1 4.25Å; I56-I60 PolarHBondContact O-N 2.93Å; F57-I60 PolarHBondContact O-N 3Å; I60-L90 HydrophobicContact CG2-CD2 3.64Å; I60-F92 HydrophobicContact CG1-CD2 4.46Å
61	R	86.9	Confident	88.7	Confident	100 Å²	100	68.5 Å²	68.5	38%	0.377	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144	173.4	-74	-169.8	173.1	140.9	-0.2	111.5	A59 Q91 M100	A59-R61 PolarHBondContact O-N 3.38Å; R61-Q91 PolarHBondContact N-O 2.87Å; R61-Q91 PolarHBondContact O-N 3.22Å; R61-Q91 VanDerWaalsContact O-O 3.12Å; R61-M100 HydrophobicContact CB-CE 4.28Å; R61-M100 HydrophobicContact CB-SD 4.3Å
62	T	88.5	Confident	88.7	Confident	92 Å²	92	67 Å²	67	56%	0.564	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	141.3	177.7	54.7	0	0	0	0	111.4	L90	T62-L90 HydrophobicContact CG2-CD2 3.48Å; T62-L90 VanDerWaalsContact CG2-CD2 3.48Å; T62-L90 HydrophobicContact CG2-CG 4.38Å
63	V	89.1	Confident	88.5	Confident	7 Å²	7	66 Å²	66	4%	0.042	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.1	169.6	-179.9	0	0	0	0	108.8	E67 A69 G89 Q91 M100	V63-E67 HydrophobicContact CG1-CB 4.16Å; V63-A69 HydrophobicContact CG1-CB 4.23Å; V63-A69 HydrophobicContact CG2-CB 3.62Å; V63-G89 PolarHBondContact N-O 3.05Å; V63-G89 PolarHBondContact O-N 2.93Å; V63-Q91 HydrophobicContact CG2-CG 4.29Å; V63-M100 HydrophobicContact CG2-CE 3.87Å; V63-M100 HydrophobicContact CG2-SD 4.33Å
64	K	92	Very high	88.4	Confident	107 Å²	107	70.5 Å²	70.5	47%	0.465	33%	0.333	S	S	.	.			trans	-76.4	162.3	-176.9	-61	179.4	-175.3	168.1	0	111.4	Y66 E67 A88	K64-Y66 VanDerWaalsContact C-N 3.33Å; K64-Y66 HydrophobicContact CB-CD1 4.28Å; K64-Y66 HydrophobicContact CB-CE1 3.96Å; K64-Y66 HydrophobicContact CB-CE2 4.5Å; K64-Y66 HydrophobicContact CD-CE1 3.82Å; K64-Y66 HydrophobicContact CD-CE2 4.21Å; K64-Y66 VanDerWaalsContact CD-CZ 3.43Å; K64-Y66 WeakPolarHBondContact CD-OH 3.4Å; K64-Y66 PolarHBondContact NZ-OH 2.88Å; K64-Y66 VanDerWaalsContact NZ-OH 3.09Å; K64-Y66 PolarHBondContact O-N 3.48Å; K64-E67 HydrophobicContact CB-CB 4.45Å; K64-E67 HydrophobicContact CB-CG 4.36Å; K64-E67 PolarHBondContact O-N 2.88Å; K64-E67 VanDerWaalsContact O-N 3.16Å; K64-E67 VanDerWaalsContact O-O 3.08Å; K64-A88 WeakPolarHBondContact O-CB 3.39Å
65	T	90	Very high	88.1	Confident	114 Å²	114	69.4 Å²	69.4	70%	0.699	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.7	-176.9	48.2	0	0	0	0	114	E67 A88	T65-E67 VanDerWaalsContact C-N 3.29Å; T65-A88 HydrophobicContact CG2-CB 4.16Å
66	Y	92.2	Very high	88.1	Confident	73 Å²	73	76 Å²	76	29%	0.286	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.9	179.4	59.4	-98.2	0	0	0	113.5	K64 L105	K64-Y66 VanDerWaalsContact C-N 3.33Å; K64-Y66 HydrophobicContact CB-CD1 4.28Å; K64-Y66 HydrophobicContact CB-CE1 3.96Å; K64-Y66 HydrophobicContact CB-CE2 4.5Å; K64-Y66 HydrophobicContact CD-CE1 3.82Å; K64-Y66 HydrophobicContact CD-CE2 4.21Å; K64-Y66 VanDerWaalsContact CD-CZ 3.43Å; K64-Y66 WeakPolarHBondContact CD-OH 3.4Å; K64-Y66 PolarHBondContact NZ-OH 2.88Å; K64-Y66 VanDerWaalsContact NZ-OH 3.09Å; K64-Y66 PolarHBondContact O-N 3.48Å; Y66-L105 WeakPolarHBondContact O-CB 3.46Å; Y66-L105 PolarHBondContact O-N 3.41Å
67	E	92.8	Very high	87.8	Confident	30 Å²	30	75.3 Å²	75.3	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	153.8	178.9	-67.7	171.6	-167.9	0	0	110.3	V63 K64 T65 R102 I103	V63-E67 HydrophobicContact CG1-CB 4.16Å; K64-E67 HydrophobicContact CB-CB 4.45Å; K64-E67 HydrophobicContact CB-CG 4.36Å; K64-E67 PolarHBondContact O-N 2.88Å; K64-E67 VanDerWaalsContact O-N 3.16Å; K64-E67 VanDerWaalsContact O-O 3.08Å; T65-E67 VanDerWaalsContact C-N 3.29Å; E67-R102 WeakPolarHBondContact OE2-CD 3.42Å; E67-I103 CarbonylContact C-O 3.58Å; E67-I103 WeakPolarHBondContact CA-O 3.23Å
68	R	91.5	Very high	87.3	Confident	82 Å²	82	70.3 Å²	70.3	31%	0.309	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140.1	166.3	-66.9	-63.8	-170.9	-142.4	3.1	109.5	V85 L86 R102 I103 L105 P138	R68-V85 HydrophobicContact CB-CG1 3.7Å; R68-V85 HydrophobicContact CG-CG1 3.89Å; R68-L86 WeakPolarHBondContact CD-O 3.31Å; R68-R102 WeakPolarHBondContact O-CA 3.41Å; R68-I103 PolarHBondContact N-O 3.41Å; R68-I103 PolarHBondContact O-N 2.94Å; R68-L105 HydrophobicContact CB-CD2 4.49Å; R68-L105 HydrophobicContact CG-CD1 3.54Å; R68-L105 HydrophobicContact CG-CD2 3.89Å; R68-L105 HydrophobicContact CG-CG 3.9Å; R68-P138 HydrophobicContact CB-CB 4.35Å; R68-P138 HydrophobicContact CB-CG 3.88Å; R68-P138 HydrophobicContact CG-CG 4.27Å
69	A	90.3	Very high	86.6	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.8	176.5	0	0	0	0	0	110.9	V63 L86 M100 I101	V63-A69 HydrophobicContact CG1-CB 4.23Å; V63-A69 HydrophobicContact CG2-CB 3.62Å; A69-L86 PolarHBondContact N-O 3.21Å; A69-L86 WeakPolarHBondContact O-CD1 3.34Å; A69-L86 PolarHBondContact O-N 2.84Å; A69-M100 HydrophobicContact CB-CE 4.11Å; A69-M100 HydrophobicContact CB-CG 4.02Å; A69-M100 HydrophobicContact CB-SD 4.42Å; A69-I101 CarbonylContact C-O 3.53Å; A69-I101 VanDerWaalsContact CA-O 3.29Å; A69-I101 WeakPolarHBondContact CA-O 3.27Å
70	I	88.9	Confident	85.6	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.4	168.7	-58.4	168.8	0	0	0	106.6	L72 L77 I101 I103 P138 A139 L142	I70-L72 HydrophobicContact CG2-CD1 4.07Å; I70-L77 HydrophobicContact CG2-CD2 3.55Å; I70-I101 PolarHBondContact N-O 2.93Å; I70-I101 PolarHBondContact O-N 3.43Å; I70-I103 HydrophobicContact CD1-CD1 3.88Å; I70-P138 HydrophobicContact CD1-CB 4.17Å; I70-P138 VanDerWaalsContact CD1-O 3.3Å; I70-P138 WeakPolarHBondContact CD1-O 3.29Å; I70-A139 HydrophobicContact CD1-CB 4.35Å; I70-L142 HydrophobicContact CB-CD2 4.32Å; I70-L142 HydrophobicContact CD1-CB 4.19Å; I70-L142 HydrophobicContact CD1-CD2 3.9Å; I70-L142 HydrophobicContact CG2-CD2 4.18Å
71	I	88.5	Confident	84.5	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.8	178.3	-60.9	173.5	0	0	0	108.9	K78 L86 V93 D98 Q99	I71-K78 HydrophobicContact CG2-CD 4.43Å; I71-K78 PolarHBondContact O-N 2.95Å; I71-K78 VanDerWaalsContact O-N 3.08Å; I71-L86 HydrophobicContact CB-CD1 4.41Å; I71-L86 HydrophobicContact CD1-CD1 4.14Å; I71-L86 HydrophobicContact CD1-CD2 3.52Å; I71-L86 HydrophobicContact CD1-CG 4.5Å; I71-L86 HydrophobicContact CG1-CD1 4.03Å; I71-L86 HydrophobicContact CG1-CD2 4.29Å; I71-V93 HydrophobicContact CD1-CG2 3.96Å; I71-D98 HydrophobicContact CG2-CB 3.68Å; I71-Q99 WeakPolarHBondContact CA-O 3.43Å
72	L	87.7	Confident	83.6	Confident	28 Å²	28	73.2 Å²	73.2	15%	0.147	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.7	170.9	-66	89.9	0	0	0	108.4	I70 R76 L77 Q99 I101 L142	I70-L72 HydrophobicContact CG2-CD1 4.07Å; L72-R76 CarbonylContact C-O 3.54Å; L72-R76 WeakPolarHBondContact CA-O 3.49Å; L72-L77 HydrophobicContact CG-CD2 4.31Å; L72-Q99 PolarHBondContact N-O 3.39Å; L72-Q99 PolarHBondContact O-N 2.99Å; L72-I101 HydrophobicContact CD1-CD1 3.77Å; L72-I101 HydrophobicContact CD1-CG1 4.28Å; L72-L142 HydrophobicContact CD1-CD2 4.03Å
73	R	86.5	Confident	82.7	Confident	83 Å²	83	76 Å²	76	31%	0.313	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.9	175.3	-179.5	171.2	-66.4	-168.7	-8.5	108.9	G75 R76 A97 D98	R73-G75 PolarHBondContact O-N 3.37Å; R73-R76 PolarHBondContact N-O 3.41Å; R73-R76 WeakPolarHBondContact O-CB 3.42Å; R73-R76 PolarHBondContact O-N 3.45Å; R73-A97 WeakPolarHBondContact CA-O 3.46Å; R73-D98 VanDerWaalsContact CB-OD1 3.23Å; R73-D98 WeakPolarHBondContact CB-OD1 3.16Å; R73-D98 VanDerWaalsContact CG-OD1 3.28Å; R73-D98 WeakPolarHBondContact CG-OD1 3.2Å; R73-D98 IonicContact CZ-OD1 3.44Å; R73-D98 IonicContact CZ-OD2 3.71Å; R73-D98 IonicContact NE-OD1 2.7Å; R73-D98 PolarHBondContact NE-OD1 3.49Å; R73-D98 IonicContact NE-OD2 3.72Å; R73-D98 IonicContact NH2-OD1 3.33Å; R73-D98 PolarHBondContact NH2-OD1 2.92Å; R73-D98 IonicContact NH2-OD2 2.83Å; R73-D98 PolarHBondContact NH2-OD2 2.88Å
74	F	87	Confident	82.1	Confident	165 Å²	165	80.2 Å²	80.2	72%	0.724	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	44.1	-175.5	-56.6	-64	0	0	0	112.5	R76 A97	F74-R76 PolarHBondContact O-N 2.9Å; F74-A97 HydrophobicContact CD2-CB 4.5Å; F74-A97 HydrophobicContact CE1-CB 3.95Å; F74-A97 HydrophobicContact CE2-CB 3.76Å; F74-A97 HydrophobicContact CZ-CB 3.44Å; F74-A97 VanDerWaalsContact CZ-CB 3.44Å; F74-A97 PolarHBondContact N-O 3.42Å; F74-A97 VanDerWaalsContact N-O 3.12Å
75	G	82.7	Confident	81.6	Confident	66 Å²	66	77.1 Å²	77.1	68%	0.68	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-4.4	-178.3	0	0	0	0	0	115.7	R73	R73-G75 PolarHBondContact O-N 3.37Å
76	R	85.5	Confident	81.3	Confident	204 Å²	204	72.5 Å²	72.5	77%	0.77	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.9	177.4	-61.9	-178.4	-179.3	155.5	1	110.9	L72 R73 F74 K78	L72-R76 CarbonylContact C-O 3.54Å; L72-R76 WeakPolarHBondContact CA-O 3.49Å; R73-R76 PolarHBondContact N-O 3.41Å; R73-R76 WeakPolarHBondContact O-CB 3.42Å; R73-R76 PolarHBondContact O-N 3.45Å; F74-R76 PolarHBondContact O-N 2.9Å; R76-K78 PolarHBondContact O-N 3.42Å
77	L	80.9	Confident	81	Confident	54 Å²	54	70.8 Å²	70.8	28%	0.283	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	116.8	173.6	-67.9	158.3	0	0	0	109.9	I70 L72 Y84 L143	I70-L77 HydrophobicContact CG2-CD2 3.55Å; L72-L77 HydrophobicContact CG-CD2 4.31Å; L77-Y84 HydrophobicContact CB-CD1 4.1Å; L77-Y84 HydrophobicContact CB-CE1 4.43Å; L77-L143 HydrophobicContact CD1-CD1 3.3Å; L77-L143 HydrophobicContact CD1-CD2 3.74Å; L77-L143 HydrophobicContact CD1-CG 4.12Å; L77-L143 HydrophobicContact CD2-CD1 4.25Å; L77-L143 HydrophobicContact CD2-CD2 4.15Å; L77-L143 HydrophobicContact CG-CD1 4.35Å; L77-L143 HydrophobicContact CG-CD2 4.23Å
78	K	76.1	Confident	80.7	Confident	58 Å²	58	71.5 Å²	71.5	25%	0.252	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-78.1	125.1	175.8	-175.8	-179.8	174.7	-174.9	0	109.3	I71 R76 S80	I71-K78 HydrophobicContact CG2-CD 4.43Å; I71-K78 PolarHBondContact O-N 2.95Å; I71-K78 VanDerWaalsContact O-N 3.08Å; R76-K78 PolarHBondContact O-N 3.42Å; K78-S80 PolarHBondContact O-N 3.27Å
79	R	70	Confident	80.5	Confident	169 Å²	169	69.2 Å²	69.2	64%	0.638	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-77.2	118	163.9	-67.4	-174.4	-176.2	174.7	3.9	108.5	Y84	R79-Y84 HydrophobicContact CG-CD1 3.77Å; R79-Y84 HydrophobicContact CG-CE1 3.46Å; R79-Y84 VanDerWaalsContact CG-CE1 3.46Å; R79-Y84 VanDerWaalsContact CZ-OH 3.26Å; R79-Y84 VanDerWaalsContact NE-CZ 3.25Å; R79-Y84 PolarHBondContact NE-OH 3.14Å; R79-Y84 PolarHBondContact NH2-OH 2.93Å
80	S	63.9	Low	80.3	Confident	52 Å²	52	75.4 Å²	75.4	36%	0.364	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-109.9	119.9	171	-173.7	0	0	0	0	108.4	K78 G82 K83	K78-S80 PolarHBondContact O-N 3.27Å; S80-G82 PolarHBondContact O-N 3.44Å; S80-K83 PolarHBondContact N-O 3.46Å; S80-K83 PolarHBondContact O-N 3.03Å
81	G	63.6	Low	80	Confident	86 Å²	86	76.1 Å²	76.1	89%	0.887	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	32.2	-179.9	0	0	0	0	0	114.4	K83	G81-K83 VanDerWaalsContact C-N 3.26Å; G81-K83 PolarHBondContact O-N 3.4Å
82	G	68.3	Low	79.7	Confident	65 Å²	65	81.2 Å²	81.2	67%	0.67	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-7.1	-176.7	0	0	0	0	0	115.4	S80	S80-G82 PolarHBondContact O-N 3.44Å
83	K	69.8	Low	79.6	Confident	152 Å²	152	79.9 Å²	79.9	66%	0.661	44%	0.443	S	S	*	.	B	Isolated β-bridge	trans	-109.5	147.2	178.1	-64.9	-177.6	-177.6	178.9	0	111.4	S80 G81 V85	S80-K83 PolarHBondContact N-O 3.46Å; S80-K83 PolarHBondContact O-N 3.03Å; G81-K83 VanDerWaalsContact C-N 3.26Å; G81-K83 PolarHBondContact O-N 3.4Å; K83-V85 VanDerWaalsContact C-N 3.33Å
84	Y	75.8	Confident	79.6	Confident	95 Å²	95	80 Å²	80	37%	0.373	45%	0.447	S	S	.	.	S	Bend	trans	-81.4	-18	172.4	-62.2	-76.9	0	0	0	112.9	L77 R79	L77-Y84 HydrophobicContact CB-CD1 4.1Å; L77-Y84 HydrophobicContact CB-CE1 4.43Å; R79-Y84 HydrophobicContact CG-CD1 3.77Å; R79-Y84 HydrophobicContact CG-CE1 3.46Å; R79-Y84 VanDerWaalsContact CG-CE1 3.46Å; R79-Y84 VanDerWaalsContact CZ-OH 3.26Å; R79-Y84 VanDerWaalsContact NE-CZ 3.25Å; R79-Y84 PolarHBondContact NE-OH 3.14Å; R79-Y84 PolarHBondContact NH2-OH 2.93Å
85	V	81.5	Confident	79.2	Confident	41 Å²	41	75.3 Å²	75.3	25%	0.248	43%	0.434	C	S	.	.	S	Bend	trans	-109.2	122.6	-176	-175.8	0	0	0	0	108.2	R68 K83 P138 A139	R68-V85 HydrophobicContact CB-CG1 3.7Å; R68-V85 HydrophobicContact CG-CG1 3.89Å; K83-V85 VanDerWaalsContact C-N 3.33Å; V85-P138 HydrophobicContact CB-CG 4.41Å; V85-P138 HydrophobicContact CG1-CG 3.59Å; V85-P138 HydrophobicContact CG2-CG 3.86Å; V85-A139 HydrophobicContact CG2-CB 4.07Å
86	L	84.3	Confident	79.1	Confident	17 Å²	17	78.3 Å²	78.3	9%	0.089	44%	0.443	C	S	.	.	B	Isolated β-bridge	trans	-90.1	133.9	179.6	-63.6	84.9	0	0	0	110.4	R68 A69 I71 Q91	R68-L86 WeakPolarHBondContact CD-O 3.31Å; A69-L86 PolarHBondContact N-O 3.21Å; A69-L86 WeakPolarHBondContact O-CD1 3.34Å; A69-L86 PolarHBondContact O-N 2.84Å; I71-L86 HydrophobicContact CB-CD1 4.41Å; I71-L86 HydrophobicContact CD1-CD1 4.14Å; I71-L86 HydrophobicContact CD1-CD2 3.52Å; I71-L86 HydrophobicContact CD1-CG 4.5Å; I71-L86 HydrophobicContact CG1-CD1 4.03Å; I71-L86 HydrophobicContact CG1-CD2 4.29Å; L86-Q91 VanDerWaalsContact CB-CD 3.42Å; L86-Q91 HydrophobicContact CD2-CG 4.19Å
87	G	84.8	Confident	79.1	Confident	37 Å²	37	69.6 Å²	69.6	38%	0.381	42%	0.415	S	S	.	.			trans	-71.8	175.3	-179.6	0	0	0	0	0	113.3	Q91	G87-Q91 PolarHBondContact O-NE2 3.25Å
88	A	86.8	Confident	79.5	Confident	45 Å²	45	67.4 Å²	67.4	37%	0.372	40%	0.403	S	S	.	.	S	Bend	trans	-65	154.3	174.6	0	0	0	0	0	111.3	K64 T65	K64-A88 WeakPolarHBondContact O-CB 3.39Å; T65-A88 HydrophobicContact CG2-CB 4.16Å
89	G	88.7	Confident	80	Confident	35 Å²	35	71.3 Å²	71.3	36%	0.361	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.9	-166.8	179.8	0	0	0	0	0	113.7	V63	V63-G89 PolarHBondContact N-O 3.05Å; V63-G89 PolarHBondContact O-N 2.93Å
90	L	84.6	Confident	80.9	Confident	129 Å²	129	64.9 Å²	64.9	68%	0.675	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	127.2	179.1	-72	163.1	0	0	0	110.1	I60 T62	I60-L90 HydrophobicContact CG2-CD2 3.64Å; T62-L90 HydrophobicContact CG2-CD2 3.48Å; T62-L90 VanDerWaalsContact CG2-CD2 3.48Å; T62-L90 HydrophobicContact CG2-CG 4.38Å
91	Q	83.4	Confident	82.1	Confident	17 Å²	17	65.1 Å²	65.1	8%	0.079	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.7	178.9	-63	-178.8	14.8	0	0	110.2	R61 V63 L86 G87 M100	R61-Q91 PolarHBondContact N-O 2.87Å; R61-Q91 PolarHBondContact O-N 3.22Å; R61-Q91 VanDerWaalsContact O-O 3.12Å; V63-Q91 HydrophobicContact CG2-CG 4.29Å; L86-Q91 VanDerWaalsContact CB-CD 3.42Å; L86-Q91 HydrophobicContact CD2-CG 4.19Å; G87-Q91 PolarHBondContact O-NE2 3.25Å; Q91-M100 HydrophobicContact CB-CE 4.19Å
92	F	83	Confident	83.5	Confident	107 Å²	107	67.1 Å²	67.1	47%	0.469	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.5	177.2	-170.5	-97.7	0	0	0	110.6	A59 I60 M94	A59-F92 HydrophobicContact CB-CD2 3.86Å; A59-F92 HydrophobicContact CB-CE1 4.47Å; A59-F92 HydrophobicContact CB-CE2 3.31Å; A59-F92 HydrophobicContact CB-CZ 3.67Å; I60-F92 HydrophobicContact CG1-CD2 4.46Å; F92-M94 HydrophobicContact CE1-CE 3.84Å; F92-M94 HydrophobicContact CE1-CG 4.45Å; F92-M94 HydrophobicContact CE1-SD 3.82Å; F92-M94 HydrophobicContact CZ-CE 4.46Å; F92-M94 HydrophobicContact CZ-SD 4.25Å
93	V	85.5	Confident	84.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	35%	0.351	C	S	.	.			trans	-126	126.8	-174.9	-175.4	0	0	0	0	108.4	A59 I71 D98 M100	A59-V93 WeakPolarHBondContact CA-O 3.46Å; A59-V93 VanDerWaalsContact CB-O 3.29Å; A59-V93 WeakPolarHBondContact CB-O 3.38Å; A59-V93 PolarHBondContact O-N 3.41Å; I71-V93 HydrophobicContact CD1-CG2 3.96Å; V93-D98 HydrophobicContact CG1-CB 3.45Å; V93-D98 VanDerWaalsContact CG1-CB 3.45Å; V93-M100 HydrophobicContact CG2-CE 3.4Å; V93-M100 HydrophobicContact CG2-SD 4.46Å
94	M	85.1	Confident	85.8	Confident	84 Å²	84	60.8 Å²	60.8	41%	0.414	34%	0.335	S	S	.	.			trans	-75.4	121.5	176.1	-70.5	-67.6	-163.1	0	0	110.6	F92 C96 A97 D98	F92-M94 HydrophobicContact CE1-CE 3.84Å; F92-M94 HydrophobicContact CE1-CG 4.45Å; F92-M94 HydrophobicContact CE1-SD 3.82Å; F92-M94 HydrophobicContact CZ-CE 4.46Å; F92-M94 HydrophobicContact CZ-SD 4.25Å; M94-C96 VanDerWaalsContact C-N 3.27Å; M94-C96 PolarHBondContact O-N 2.91Å; M94-C96 VanDerWaalsContact O-N 3.13Å; M94-A97 HydrophobicContact CB-CB 4.1Å; M94-A97 PolarHBondContact O-N 3.47Å; M94-D98 HydrophobicContact CB-CB 4.36Å; M94-D98 PolarHBondContact N-OD2 3.14Å; M94-D98 WeakPolarHBondContact O-CB 3.45Å; M94-D98 PolarHBondContact O-N 3.35Å
95	P	79.4	Confident	86.6	Confident	67 Å²	67	58.1 Å²	58.1	44%	0.435	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-30.6	-169.9	21.2	-32.8	0	0	0	114.7
96	C	80.7	Confident	87.3	Confident	130 Å²	130	62.8 Å²	62.8	88%	0.878	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-25	-177.4	-55.4	0	0	0	0	114.2	M94	M94-C96 VanDerWaalsContact C-N 3.27Å; M94-C96 PolarHBondContact O-N 2.91Å; M94-C96 VanDerWaalsContact O-N 3.13Å
97	A	85.6	Confident	87.8	Confident	21 Å²	21	64.9 Å²	64.9	17%	0.174	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-28.2	-171.7	0	0	0	0	0	113.2	R73 F74 M94	R73-A97 WeakPolarHBondContact CA-O 3.46Å; F74-A97 HydrophobicContact CD2-CB 4.5Å; F74-A97 HydrophobicContact CE1-CB 3.95Å; F74-A97 HydrophobicContact CE2-CB 3.76Å; F74-A97 HydrophobicContact CZ-CB 3.44Å; F74-A97 VanDerWaalsContact CZ-CB 3.44Å; F74-A97 PolarHBondContact N-O 3.42Å; F74-A97 VanDerWaalsContact N-O 3.12Å; M94-A97 HydrophobicContact CB-CB 4.1Å; M94-A97 PolarHBondContact O-N 3.47Å
98	D	88.7	Confident	88.3	Confident	8 Å²	8	71 Å²	71	4%	0.043	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.5	-170.6	-67.8	-17.7	0	0	0	110.7	I71 R73 V93 M94	I71-D98 HydrophobicContact CG2-CB 3.68Å; R73-D98 VanDerWaalsContact CB-OD1 3.23Å; R73-D98 WeakPolarHBondContact CB-OD1 3.16Å; R73-D98 VanDerWaalsContact CG-OD1 3.28Å; R73-D98 WeakPolarHBondContact CG-OD1 3.2Å; R73-D98 IonicContact CZ-OD1 3.44Å; R73-D98 IonicContact CZ-OD2 3.71Å; R73-D98 IonicContact NE-OD1 2.7Å; R73-D98 PolarHBondContact NE-OD1 3.49Å; R73-D98 IonicContact NE-OD2 3.72Å; R73-D98 IonicContact NH2-OD1 3.33Å; R73-D98 PolarHBondContact NH2-OD1 2.92Å; R73-D98 IonicContact NH2-OD2 2.83Å; R73-D98 PolarHBondContact NH2-OD2 2.88Å; V93-D98 HydrophobicContact CG1-CB 3.45Å; V93-D98 VanDerWaalsContact CG1-CB 3.45Å; M94-D98 HydrophobicContact CB-CB 4.36Å; M94-D98 PolarHBondContact N-OD2 3.14Å; M94-D98 WeakPolarHBondContact O-CB 3.45Å; M94-D98 PolarHBondContact O-N 3.35Å
99	Q	87.6	Confident	88.7	Confident	140 Å²	140	72.1 Å²	72.1	65%	0.654	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.5	168.2	-63.3	-177.8	8.2	0	0	109.1	I71 L72	I71-Q99 WeakPolarHBondContact CA-O 3.43Å; L72-Q99 PolarHBondContact N-O 3.39Å; L72-Q99 PolarHBondContact O-N 2.99Å
100	M	87.7	Confident	89	Confident	33 Å²	33	71 Å²	71	16%	0.163	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.2	177.9	175.4	-176.7	-93	0	0	109.7	R61 V63 A69 Q91 V93 R102	R61-M100 HydrophobicContact CB-CE 4.28Å; R61-M100 HydrophobicContact CB-SD 4.3Å; V63-M100 HydrophobicContact CG2-CE 3.87Å; V63-M100 HydrophobicContact CG2-SD 4.33Å; A69-M100 HydrophobicContact CB-CE 4.11Å; A69-M100 HydrophobicContact CB-CG 4.02Å; A69-M100 HydrophobicContact CB-SD 4.42Å; Q91-M100 HydrophobicContact CB-CE 4.19Å; V93-M100 HydrophobicContact CG2-CE 3.4Å; V93-M100 HydrophobicContact CG2-SD 4.46Å; M100-R102 HydrophobicContact CG-CG 4.3Å; M100-R102 HydrophobicContact SD-CG 4.43Å
101	I	90.2	Very high	89.5	Confident	58 Å²	58	70 Å²	70	30%	0.297	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.9	173.1	-60.8	176.5	0	0	0	108.1	A69 I70 L72 I103 L142	A69-I101 CarbonylContact C-O 3.53Å; A69-I101 VanDerWaalsContact CA-O 3.29Å; A69-I101 WeakPolarHBondContact CA-O 3.27Å; I70-I101 PolarHBondContact N-O 2.93Å; I70-I101 PolarHBondContact O-N 3.43Å; L72-I101 HydrophobicContact CD1-CD1 3.77Å; L72-I101 HydrophobicContact CD1-CG1 4.28Å; I101-I103 HydrophobicContact CG2-CG1 4.31Å; I101-L142 HydrophobicContact CB-CD2 4.49Å; I101-L142 HydrophobicContact CD1-CD1 3.85Å; I101-L142 HydrophobicContact CD1-CD2 3.77Å; I101-L142 HydrophobicContact CD1-CG 4.46Å; I101-L142 HydrophobicContact CG2-CD1 4.39Å; I101-L142 HydrophobicContact CG2-CD2 4.49Å
102	R	91.7	Very high	90.1	Very high	127 Å²	127	69.5 Å²	69.5	48%	0.479	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.8	178.1	-58.8	-175.5	-171.8	118.4	-3.9	109.7	E67 R68 M100	E67-R102 WeakPolarHBondContact OE2-CD 3.42Å; R68-R102 WeakPolarHBondContact O-CA 3.41Å; M100-R102 HydrophobicContact CG-CG 4.3Å; M100-R102 HydrophobicContact SD-CG 4.43Å
103	I	92.2	Very high	90.7	Very high	25 Å²	25	67.5 Å²	67.5	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.5	179.7	-62.9	168.5	0	0	0	108	E67 R68 I70 I101 V135 P138 L142	E67-I103 CarbonylContact C-O 3.58Å; E67-I103 WeakPolarHBondContact CA-O 3.23Å; R68-I103 PolarHBondContact N-O 3.41Å; R68-I103 PolarHBondContact O-N 2.94Å; I70-I103 HydrophobicContact CD1-CD1 3.88Å; I101-I103 HydrophobicContact CG2-CG1 4.31Å; I103-V135 HydrophobicContact CG2-CB 4.09Å; I103-V135 HydrophobicContact CG2-CG1 3.97Å; I103-V135 HydrophobicContact CG2-CG2 4.1Å; I103-P138 HydrophobicContact CB-CB 4.03Å; I103-P138 HydrophobicContact CD1-CB 3.65Å; I103-P138 WeakPolarHBondContact CD1-O 3.45Å; I103-P138 HydrophobicContact CG1-CB 4.42Å; I103-P138 HydrophobicContact CG2-CB 4.09Å; I103-L142 HydrophobicContact CD1-CB 4.33Å
104	D	93.8	Very high	91.1	Very high	60 Å²	60	71.9 Å²	71.9	32%	0.321	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	133.7	177.6	-159.8	-29.7	0	0	0	110.2	R106	D104-R106 VanDerWaalsContact OD1-CB 3.28Å; D104-R106 WeakPolarHBondContact OD1-CB 3.43Å; D104-R106 VanDerWaalsContact OD1-CG 3.26Å; D104-R106 WeakPolarHBondContact OD1-CG 3.31Å; D104-R106 PolarHBondContact OD1-N 3Å; D104-R106 IonicContact OD1-NE 3.86Å; D104-R106 PolarHBondContact OD1-NE 3.14Å; D104-R106 IonicContact OD2-CZ 2.67Å; D104-R106 VanDerWaalsContact OD2-CZ 3.25Å; D104-R106 IonicContact OD2-NE 2.74Å; D104-R106 PolarHBondContact OD2-NE 2.92Å; D104-R106 IonicContact OD2-NH2 3.99Å; D104-R106 PolarHBondContact OD2-NH2 3.47Å
105	L	93.5	Very high	91.6	Very high	38 Å²	38	69.4 Å²	69.4	20%	0.199	36%	0.36	C	S	.	.			trans	-95.3	-4	178.9	-59.9	-178.3	0	0	0	113.2	Y66 R68 V135	Y66-L105 WeakPolarHBondContact O-CB 3.46Å; Y66-L105 PolarHBondContact O-N 3.41Å; R68-L105 HydrophobicContact CB-CD2 4.49Å; R68-L105 HydrophobicContact CG-CD1 3.54Å; R68-L105 HydrophobicContact CG-CD2 3.89Å; R68-L105 HydrophobicContact CG-CG 3.9Å; L105-V135 VanDerWaalsContact CD2-O 3.27Å; L105-V135 WeakPolarHBondContact CD2-O 3.39Å
106	R	96.1	Very high	92.3	Very high	140 Å²	140	73.9 Å²	73.9	53%	0.528	38%	0.376	S	S	.	.	S	Bend	trans	-71.1	155.2	-179.8	-66.8	178.3	-70.2	167.3	-1.6	111.5	D104 R108	D104-R106 VanDerWaalsContact OD1-CB 3.28Å; D104-R106 WeakPolarHBondContact OD1-CB 3.43Å; D104-R106 VanDerWaalsContact OD1-CG 3.26Å; D104-R106 WeakPolarHBondContact OD1-CG 3.31Å; D104-R106 PolarHBondContact OD1-N 3Å; D104-R106 IonicContact OD1-NE 3.86Å; D104-R106 PolarHBondContact OD1-NE 3.14Å; D104-R106 IonicContact OD2-CZ 2.67Å; D104-R106 VanDerWaalsContact OD2-CZ 3.25Å; D104-R106 IonicContact OD2-NE 2.74Å; D104-R106 PolarHBondContact OD2-NE 2.92Å; D104-R106 IonicContact OD2-NH2 3.99Å; D104-R106 PolarHBondContact OD2-NH2 3.47Å; R106-R108 PolarHBondContact O-N 2.98Å
107	T	95.8	Very high	93	Very high	60 Å²	60	68 Å²	68	37%	0.368	34%	0.336	S	S	.	.			trans	-63.7	122.2	171	-52.1	0	0	0	0	109.8	F132 E199	T107-F132 HydrophobicContact CG2-CB 3.9Å; T107-F132 HydrophobicContact CG2-CD1 4.32Å; T107-E199 WeakPolarHBondContact CB-OE2 3.34Å; T107-E199 WeakPolarHBondContact CG2-OE2 3.26Å; T107-E199 VanDerWaalsContact OG1-CD 3.31Å; T107-E199 PolarHBondContact OG1-OE1 2.91Å; T107-E199 PolarHBondContact OG1-OE2 2.88Å
108	R	94.7	Very high	93.5	Very high	167 Å²	167	71.7 Å²	71.7	63%	0.63	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	136.1	172.3	179.9	176.1	171.2	160.9	-2.9	108.8	R106 M133	R106-R108 PolarHBondContact O-N 2.98Å; R108-M133 PolarHBondContact N-O 3.32Å; R108-M133 PolarHBondContact O-N 3.4Å
109	T	95.3	Very high	93.8	Very high	67 Å²	67	71.6 Å²	71.6	41%	0.411	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.5	172.3	-54.3	0	0	0	0	109.2	V130 F132	T109-V130 HydrophobicContact CG2-CG1 3.16Å; T109-F132 HydrophobicContact CG2-CD1 4.4Å; T109-F132 HydrophobicContact CG2-CE1 4.06Å; T109-F132 HydrophobicContact CG2-CZ 4.37Å; T109-F132 WeakPolarHBondContact OG1-CD1 3.27Å; T109-F132 WeakPolarHBondContact OG1-CE1 3.34Å
110	V	94.1	Very high	94.2	Very high	11 Å²	11	68.5 Å²	68.5	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.4	174.5	-180	0	0	0	0	107.8	I112 V131 M133 E153	V110-I112 HydrophobicContact CG1-CD1 4.29Å; V110-V131 PolarHBondContact N-O 3.1Å; V110-V131 PolarHBondContact O-N 2.93Å; V110-M133 HydrophobicContact CG2-CG 4.18Å; V110-M133 HydrophobicContact CG2-SD 3.93Å; V110-E153 HydrophobicContact CG1-CB 3.94Å; V110-E153 HydrophobicContact CG1-CG 3.69Å
111	N	95.9	Very high	94.5	Very high	110 Å²	110	70.3 Å²	70.3	59%	0.588	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	118.4	177.6	-67.2	-28.1	0	0	0	108.7
112	I	95.1	Very high	94.6	Very high	5 Å²	5	71.2 Å²	71.2	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.8	173.7	-54.4	-60.7	0	0	0	107.7	V110 A129 V131 E153 A156 V157 L160	V110-I112 HydrophobicContact CG1-CD1 4.29Å; I112-A129 HydrophobicContact CB-CB 4.41Å; I112-A129 WeakPolarHBondContact CB-O 3.18Å; I112-A129 PolarHBondContact N-O 3.06Å; I112-V131 HydrophobicContact CD1-CG2 4.42Å; I112-V131 HydrophobicContact CG1-CG2 4.09Å; I112-E153 HydrophobicContact CD1-CG 3.83Å; I112-A156 HydrophobicContact CD1-CB 3.67Å; I112-A156 HydrophobicContact CG1-CB 4.27Å; I112-V157 HydrophobicContact CD1-CG2 4.43Å; I112-V157 HydrophobicContact CG2-CG2 3.72Å; I112-L160 HydrophobicContact CG2-CD2 4.26Å
113	P	95.3	Very high	94.6	Very high	65 Å²	65	66 Å²	66	42%	0.422	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	155.1	179	27.8	-34.2	0	0	0	111	Q115	P113-Q115 PolarHBondContact O-N 2.98Å; P113-Q115 PolarHBondContact O-NE2 3.26Å
114	P	95.3	Very high	94.7	Very high	94 Å²	94	68.3 Å²	68.3	61%	0.61	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-50.7	129.5	178.7	-24.6	31.2	0	0	0	112.4	V127 D128	P114-V127 WeakPolarHBondContact CA-O 3.45Å; P114-D128 HydrophobicContact CB-CB 4.31Å; P114-D128 HydrophobicContact CG-CB 3.98Å
115	Q	94.7	Very high	94.7	Very high	31 Å²	31	65.6 Å²	65.6	15%	0.145	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.4	177.9	-61.6	-56.9	-64.4	0	0	110.2	P113 I117 G126 V127 V157 L160 R161	P113-Q115 PolarHBondContact O-N 2.98Å; P113-Q115 PolarHBondContact O-NE2 3.26Å; Q115-I117 HydrophobicContact CB-CD1 3.89Å; Q115-I117 HydrophobicContact CB-CG1 4Å; Q115-I117 PolarHBondContact O-N 2.85Å; Q115-G126 CarbonylContact O-C 3.36Å; Q115-G126 WeakPolarHBondContact O-CA 3.37Å; Q115-V127 PolarHBondContact N-O 3.48Å; Q115-V127 PolarHBondContact O-N 3.12Å; Q115-V157 HydrophobicContact CG-CG1 4.27Å; Q115-L160 HydrophobicContact CG-CD2 4.37Å; Q115-R161 VanDerWaalsContact OE1-NH2 3.07Å
116	E	95.2	Very high	94.8	Very high	162 Å²	162	64.6 Å²	64.6	76%	0.757	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	116.7	168.9	-65.9	-176.7	177.6	0	0	109.5	V125	E116-V125 WeakPolarHBondContact CA-O 3.36Å
117	I	94.8	Very high	94.8	Very high	7 Å²	7	58 Å²	58	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.1	-175.3	-58.2	163.9	0	0	0	108.6	Q115 V125 L160 R161 L164	Q115-I117 HydrophobicContact CB-CD1 3.89Å; Q115-I117 HydrophobicContact CB-CG1 4Å; Q115-I117 PolarHBondContact O-N 2.85Å; I117-V125 PolarHBondContact N-O 3.35Å; I117-V125 PolarHBondContact O-N 2.9Å; I117-L160 HydrophobicContact CD1-CG 4.41Å; I117-R161 HydrophobicContact CG1-CB 4.47Å; I117-R161 HydrophobicContact CG1-CG 4.37Å; I117-L164 HydrophobicContact CD1-CB 4.24Å; I117-L164 HydrophobicContact CD1-CD1 3.86Å; I117-L164 HydrophobicContact CG2-CB 4.42Å
118	L	95.6	Very high	94.8	Very high	98 Å²	98	56 Å²	56	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.6	170.2	-170.5	70.3	0	0	0	108.8	A122 G165	L118-A122 HydrophobicContact CD1-CB 4.41Å; L118-G165 WeakPolarHBondContact O-CA 3.3Å
119	T	94.6	Very high	94.8	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.031	29%	0.286	C	S	.	.			trans	-75.4	172	174.9	65.1	0	0	0	0	111.7	D121 A122 V123 V125 Y167 L172	T119-D121 PolarHBondContact O-N 2.91Å; T119-D121 VanDerWaalsContact O-N 3.13Å; T119-D121 PolarHBondContact OG1-N 3.1Å; T119-A122 PolarHBondContact O-N 3.34Å; T119-V123 PolarHBondContact N-O 3.5Å; T119-V123 PolarHBondContact OG1-N 3.44Å; T119-V123 PolarHBondContact OG1-O 2.84Å; T119-V125 HydrophobicContact CG2-CG1 4.33Å; T119-V125 HydrophobicContact CG2-CG2 3.63Å; T119-Y167 WeakPolarHBondContact CB-O 3.34Å; T119-L172 HydrophobicContact CG2-CD1 3.65Å
120	S	95.6	Very high	94.9	Very high	76 Å²	76	45.7 Å²	45.7	53%	0.531	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.8	175.3	-170.8	0	0	0	0	113.1	A122 G165 Y167	S120-A122 PolarHBondContact O-N 3.4Å; S120-G165 PolarHBondContact N-O 3.43Å; S120-Y167 PolarHBondContact N-O 2.91Å; S120-Y167 VanDerWaalsContact N-O 3.1Å
121	D	94	Very high	95.1	Very high	71 Å²	71	45.4 Å²	45.4	38%	0.38	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	11.5	178.3	-54.9	-41.7	0	0	0	113.3	T119 V123 E168 L169	T119-D121 PolarHBondContact O-N 2.91Å; T119-D121 VanDerWaalsContact O-N 3.13Å; T119-D121 PolarHBondContact OG1-N 3.1Å; D121-V123 HydrophobicContact CB-CG2 4.12Å; D121-V123 PolarHBondContact O-N 2.96Å; D121-E168 VanDerWaalsContact OD1-CG 3.31Å; D121-E168 WeakPolarHBondContact OD1-CG 3.03Å; D121-E168 WeakPolarHBondContact OD2-CA 3.31Å; D121-E168 WeakPolarHBondContact OD2-CB 3.47Å; D121-L169 PolarHBondContact OD2-N 3.41Å
122	A	92.7	Very high	95.2	Very high	76 Å²	76	41.7 Å²	41.7	63%	0.628	25%	0.248	S	C	*	.	S	Bend	trans	56.6	31.6	-172.6	0	0	0	0	0	113.6	L118 T119 S120	L118-A122 HydrophobicContact CD1-CB 4.41Å; T119-A122 PolarHBondContact O-N 3.34Å; S120-A122 PolarHBondContact O-N 3.4Å
123	V	92.2	Very high	95.2	Very high	19 Å²	19	42 Å²	42	12%	0.115	25%	0.25	C	C	.	.			trans	-99	126.1	173.6	-179.3	0	0	0	0	109.8	T119 D121 V125 L169 M212	T119-V123 PolarHBondContact N-O 3.5Å; T119-V123 PolarHBondContact OG1-N 3.44Å; T119-V123 PolarHBondContact OG1-O 2.84Å; D121-V123 HydrophobicContact CB-CG2 4.12Å; D121-V123 PolarHBondContact O-N 2.96Å; V123-V125 HydrophobicContact CG1-CG1 3.97Å; V123-V125 PolarHBondContact O-N 3.2Å; V123-L169 HydrophobicContact CG1-CD2 4.3Å; V123-M212 HydrophobicContact CG1-CE 3.96Å; V123-M212 HydrophobicContact CG1-SD 3.46Å; V123-M212 WeakPolarHBondContact CG1-SD 3.47Å; V123-M212 HydrophobicContact CG2-CE 4.18Å; V123-M212 HydrophobicContact CG2-SD 4.38Å
124	T	94	Very high	95.2	Very high	73 Å²	73	43.1 Å²	43.1	45%	0.448	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.8	172.3	-48	0	0	0	0	109.8	P209	T124-P209 WeakPolarHBondContact O-CD 3.27Å
125	V	94.5	Very high	95.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	145.5	176.7	-64.7	0	0	0	0	111	E116 I117 T119 V123 V127 L169 L172 V206 L208	E116-V125 WeakPolarHBondContact CA-O 3.36Å; I117-V125 PolarHBondContact N-O 3.35Å; I117-V125 PolarHBondContact O-N 2.9Å; T119-V125 HydrophobicContact CG2-CG1 4.33Å; T119-V125 HydrophobicContact CG2-CG2 3.63Å; V123-V125 HydrophobicContact CG1-CG1 3.97Å; V123-V125 PolarHBondContact O-N 3.2Å; V125-V127 HydrophobicContact CB-CG2 4.45Å; V125-V127 HydrophobicContact CG2-CG2 3.86Å; V125-L169 HydrophobicContact CG1-CD1 3.88Å; V125-L172 HydrophobicContact CG2-CD1 4.21Å; V125-V206 HydrophobicContact CB-CG1 4.3Å; V125-V206 HydrophobicContact CG1-CG1 4.5Å; V125-L208 HydrophobicContact CG1-CG 4.43Å
126	G	95.5	Very high	95.2	Very high	17 Å²	17	42.4 Å²	42.4	18%	0.175	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.7	169.3	0	0	0	0	0	110	Q115 V206 S207	Q115-G126 CarbonylContact O-C 3.36Å; Q115-G126 WeakPolarHBondContact O-CA 3.37Å; G126-V206 CarbonylContact O-C 3.59Å; G126-V206 WeakPolarHBondContact O-CA 3.3Å; G126-S207 PolarHBondContact N-O 3.47Å; G126-S207 PolarHBondContact O-N 3.18Å
127	V	95.5	Very high	95	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128	179.6	-173.7	0	0	0	0	110.7	P114 Q115 V125 L164 I203 D205 V206	P114-V127 WeakPolarHBondContact CA-O 3.45Å; Q115-V127 PolarHBondContact N-O 3.48Å; Q115-V127 PolarHBondContact O-N 3.12Å; V125-V127 HydrophobicContact CB-CG2 4.45Å; V125-V127 HydrophobicContact CG2-CG2 3.86Å; V127-L164 HydrophobicContact CB-CD1 3.73Å; V127-L164 HydrophobicContact CG1-CD1 3.53Å; V127-L164 HydrophobicContact CG2-CD1 3.91Å; V127-I203 HydrophobicContact CG1-CG2 3.93Å; V127-D205 WeakPolarHBondContact CA-O 3.37Å; V127-V206 HydrophobicContact CG1-CG2 4.31Å; V127-V206 HydrophobicContact CG2-CG1 4.22Å; V127-V206 HydrophobicContact CG2-CG2 4.21Å
128	D	95.4	Very high	94.9	Very high	18 Å²	18	39.5 Å²	39.5	10%	0.096	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	153.3	168.5	75.9	-16.4	0	0	0	111.1	P114 K204 D205	P114-D128 HydrophobicContact CB-CB 4.31Å; P114-D128 HydrophobicContact CG-CB 3.98Å; D128-K204 PolarHBondContact O-N 3.37Å; D128-K204 VanDerWaalsContact OD1-CB 3.31Å; D128-K204 WeakPolarHBondContact OD1-CB 3.48Å; D128-K204 WeakPolarHBondContact OD2-CD 3.32Å; D128-K204 IonicContact OD2-NZ 3.63Å; D128-K204 PolarHBondContact OD2-NZ 3.23Å; D128-D205 PolarHBondContact N-O 2.83Å; D128-D205 WeakPolarHBondContact OD1-CA 3.18Å; D128-D205 VanDerWaalsContact OD1-CB 3.3Å; D128-D205 WeakPolarHBondContact OD1-CB 3.32Å; D128-D205 PolarHBondContact OD1-N 3.18Å
129	A	96.4	Very high	94.6	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.017	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.6	-173.8	0	0	0	0	0	111	I112 L160 E202	I112-A129 HydrophobicContact CB-CB 4.41Å; I112-A129 WeakPolarHBondContact CB-O 3.18Å; I112-A129 PolarHBondContact N-O 3.06Å; A129-L160 HydrophobicContact CB-CD1 4.2Å; A129-L160 HydrophobicContact CB-CD2 4.12Å; A129-E202 CarbonylContact C-O 3.56Å; A129-E202 VanDerWaalsContact CA-O 3.3Å; A129-E202 WeakPolarHBondContact CA-O 3.02Å
130	V	97	Very high	94.4	Very high	16 Å²	16	35.9 Å²	35.9	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.4	178.9	-179.5	0	0	0	0	109	T109 F132 V201 E202 K204	T109-V130 HydrophobicContact CG2-CG1 3.16Å; V130-F132 HydrophobicContact CG1-CD2 4.38Å; V130-F132 HydrophobicContact CG1-CE2 3.87Å; V130-F132 HydrophobicContact CG1-CZ 4.06Å; V130-V201 WeakPolarHBondContact O-CA 3.3Å; V130-E202 PolarHBondContact N-O 3.45Å; V130-E202 PolarHBondContact O-N 2.86Å; V130-K204 HydrophobicContact CG2-CB 4.27Å; V130-K204 HydrophobicContact CG2-CD 4.04Å
131	V	97.4	Very high	94.2	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.4	-179.8	-179.8	0	0	0	0	108.6	V110 I112 M133 A156 L187 V198 V201	V110-V131 PolarHBondContact N-O 3.1Å; V110-V131 PolarHBondContact O-N 2.93Å; I112-V131 HydrophobicContact CD1-CG2 4.42Å; I112-V131 HydrophobicContact CG1-CG2 4.09Å; V131-M133 HydrophobicContact CG1-CB 4.38Å; V131-M133 HydrophobicContact CG1-CG 4.34Å; V131-M133 HydrophobicContact CG1-SD 4.38Å; V131-A156 HydrophobicContact CG2-CB 4.02Å; V131-L187 HydrophobicContact CG2-CD1 4.42Å; V131-V198 HydrophobicContact CG1-CG1 3.97Å; V131-V198 HydrophobicContact CG1-CG2 4.5Å; V131-V201 HydrophobicContact CG1-CG2 4.4Å; V131-V201 HydrophobicContact CG2-CG1 4.29Å; V131-V201 HydrophobicContact CG2-CG2 4.29Å
132	F	97.8	Very high	94	Very high	32 Å²	32	31.8 Å²	31.8	14%	0.14	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.3	172.9	-62.2	-95	0	0	0	108.7	T107 T109 V130 E199 R200 E202	T107-F132 HydrophobicContact CG2-CB 3.9Å; T107-F132 HydrophobicContact CG2-CD1 4.32Å; T109-F132 HydrophobicContact CG2-CD1 4.4Å; T109-F132 HydrophobicContact CG2-CE1 4.06Å; T109-F132 HydrophobicContact CG2-CZ 4.37Å; T109-F132 WeakPolarHBondContact OG1-CD1 3.27Å; T109-F132 WeakPolarHBondContact OG1-CE1 3.34Å; V130-F132 HydrophobicContact CG1-CD2 4.38Å; V130-F132 HydrophobicContact CG1-CE2 3.87Å; V130-F132 HydrophobicContact CG1-CZ 4.06Å; F132-E199 HydrophobicContact CB-CB 4.49Å; F132-E199 PolarHBondContact O-N 3.34Å; F132-R200 HydrophobicContact CB-CG 3.95Å; F132-R200 HydrophobicContact CD2-CG 3.31Å; F132-R200 HydrophobicContact CE2-CG 4.04Å; F132-R200 HydrophobicContact CG-CG 3.89Å; F132-R200 PolarHBondContact N-O 2.91Å; F132-R200 PolarHBondContact O-N 3.1Å; F132-E202 HydrophobicContact CE2-CG 4.28Å
133	M	95.7	Very high	93.9	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.059	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152.7	-174.5	52.6	177.6	-86.3	0	0	111.6	R108 V110 V131 A152 I196 K197 V198	R108-M133 PolarHBondContact N-O 3.32Å; R108-M133 PolarHBondContact O-N 3.4Å; V110-M133 HydrophobicContact CG2-CG 4.18Å; V110-M133 HydrophobicContact CG2-SD 3.93Å; V131-M133 HydrophobicContact CG1-CB 4.38Å; V131-M133 HydrophobicContact CG1-CG 4.34Å; V131-M133 HydrophobicContact CG1-SD 4.38Å; M133-A152 HydrophobicContact CE-CB 3.7Å; M133-A152 HydrophobicContact SD-CB 3.85Å; M133-I196 HydrophobicContact CB-CG2 4.04Å; M133-I196 HydrophobicContact CE-CB 4.43Å; M133-I196 HydrophobicContact CE-CD1 3.76Å; M133-I196 HydrophobicContact CE-CG1 4.13Å; M133-I196 HydrophobicContact CE-CG2 3.46Å; M133-I196 VanDerWaalsContact CE-CG2 3.46Å; M133-I196 HydrophobicContact SD-CG2 4.26Å; M133-K197 CarbonylContact C-O 3.52Å; M133-K197 WeakPolarHBondContact CA-O 3.41Å; M133-K197 WeakPolarHBondContact CB-O 3.35Å; M133-V198 HydrophobicContact CB-CG2 4.46Å
134	R	95.8	Very high	93.9	Very high	89 Å²	89	39 Å²	39	34%	0.336	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	155.2	174.6	65.1	-177	176.6	97.2	3.3	111.5	K197 E199	R134-K197 HydrophobicContact CG-CB 4.43Å; R134-K197 PolarHBondContact N-O 3.22Å; R134-K197 PolarHBondContact O-N 3.06Å; R134-E199 WeakPolarHBondContact CD-OE1 3.29Å; R134-E199 IonicContact CZ-OE1 3.06Å; R134-E199 IonicContact NE-OE1 3.89Å; R134-E199 PolarHBondContact NE-OE1 3.02Å
135	V	95.5	Very high	93.7	Very high	24 Å²	24	36.6 Å²	36.6	15%	0.145	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	123.9	174.7	-176.2	0	0	0	0	109	I103 L105 P138 A141 I196	I103-V135 HydrophobicContact CG2-CB 4.09Å; I103-V135 HydrophobicContact CG2-CG1 3.97Å; I103-V135 HydrophobicContact CG2-CG2 4.1Å; L105-V135 VanDerWaalsContact CD2-O 3.27Å; L105-V135 WeakPolarHBondContact CD2-O 3.39Å; V135-P138 HydrophobicContact CG1-CB 4.29Å; V135-A141 HydrophobicContact CG1-CB 3.89Å; V135-I196 HydrophobicContact CG2-CG1 4.39Å
136	I	93.4	Very high	93.5	Very high	85 Å²	85	46.2 Å²	46.2	44%	0.436	23%	0.228	S	C	.	.	S	Bend	trans	-98.2	-44.6	172.1	-63.5	-171.3	0	0	0	110	P138 G195 K197	I136-P138 WeakPolarHBondContact O-CD 3.41Å; I136-G195 PolarHBondContact N-O 2.93Å; I136-K197 HydrophobicContact CD1-CB 3.36Å; I136-K197 HydrophobicContact CD1-CD 3.95Å; I136-K197 HydrophobicContact CD1-CG 3.74Å; I136-K197 HydrophobicContact CG1-CB 3.68Å
137	E	92.7	Very high	93.4	Very high	103 Å²	103	49.3 Å²	49.3	48%	0.481	24%	0.24	S	C	.	.			trans	-110	89.6	-179.6	-64.6	-174	-178.4	0	0	110.7	A139 A140 A141 G195	E137-A139 PolarHBondContact O-N 3.09Å; E137-A140 HydrophobicContact CB-CB 3.93Å; E137-A140 PolarHBondContact O-N 3.19Å; E137-A141 PolarHBondContact O-N 3.08Å; E137-A141 VanDerWaalsContact O-N 3.12Å; E137-G195 PolarHBondContact N-O 3.27Å; E137-G195 VanDerWaalsContact N-O 3.11Å
138	P	90.8	Very high	93.1	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-29.8	-176	25	-34.7	0	0	0	112.7	R68 I70 V85 I103 V135 I136 A141 L142	R68-P138 HydrophobicContact CB-CB 4.35Å; R68-P138 HydrophobicContact CB-CG 3.88Å; R68-P138 HydrophobicContact CG-CG 4.27Å; I70-P138 HydrophobicContact CD1-CB 4.17Å; I70-P138 VanDerWaalsContact CD1-O 3.3Å; I70-P138 WeakPolarHBondContact CD1-O 3.29Å; V85-P138 HydrophobicContact CB-CG 4.41Å; V85-P138 HydrophobicContact CG1-CG 3.59Å; V85-P138 HydrophobicContact CG2-CG 3.86Å; I103-P138 HydrophobicContact CB-CB 4.03Å; I103-P138 HydrophobicContact CD1-CB 3.65Å; I103-P138 WeakPolarHBondContact CD1-O 3.45Å; I103-P138 HydrophobicContact CG1-CB 4.42Å; I103-P138 HydrophobicContact CG2-CB 4.09Å; V135-P138 HydrophobicContact CG1-CB 4.29Å; I136-P138 WeakPolarHBondContact O-CD 3.41Å; P138-A141 PolarHBondContact O-N 3.33Å; P138-L142 PolarHBondContact O-N 2.82Å
139	A	89.9	Confident	92.9	Very high	20 Å²	20	50.5 Å²	50.5	17%	0.165	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-43.7	177.3	0	0	0	0	0	111.8	I70 V85 E137 L142 L143	I70-A139 HydrophobicContact CD1-CB 4.35Å; V85-A139 HydrophobicContact CG2-CB 4.07Å; E137-A139 PolarHBondContact O-N 3.09Å; A139-L142 PolarHBondContact O-N 2.88Å; A139-L143 WeakPolarHBondContact O-CB 3.39Å; A139-L143 WeakPolarHBondContact O-CD1 3.49Å; A139-L143 WeakPolarHBondContact O-CG 3.25Å; A139-L143 PolarHBondContact O-N 2.83Å; A139-L143 VanDerWaalsContact O-N 3.1Å
140	A	90.8	Very high	92.7	Very high	6 Å²	6	56.4 Å²	56.4	5%	0.05	28%	0.278	C	S	.	.	H	α-helix	trans	-63.2	-44	175.5	0	0	0	0	0	111.4	E137 L142 L143 R144 W194	E137-A140 HydrophobicContact CB-CB 3.93Å; E137-A140 PolarHBondContact O-N 3.19Å; A140-L142 PolarHBondContact O-N 3.41Å; A140-L143 PolarHBondContact O-N 2.99Å; A140-R144 VanDerWaalsContact CB-NH1 3.29Å; A140-R144 WeakPolarHBondContact O-CB 3.33Å; A140-R144 PolarHBondContact O-N 3.31Å; A140-W194 CarbonylContact C-O 3.56Å
141	A	91.4	Very high	92.6	Very high	10 Å²	10	57.4 Å²	57.4	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-31.2	-178.9	0	0	0	0	0	113.5	V135 E137 P138 A148 W194	V135-A141 HydrophobicContact CG1-CB 3.89Å; E137-A141 PolarHBondContact O-N 3.08Å; E137-A141 VanDerWaalsContact O-N 3.12Å; P138-A141 PolarHBondContact O-N 3.33Å; A141-A148 HydrophobicContact CB-CB 4.13Å; A141-W194 WeakPolarHBondContact CA-O 3.2Å; A141-W194 WeakPolarHBondContact CB-O 3.27Å; A141-W194 PolarHBondContact N-O 2.99Å
142	L	89.9	Confident	92.4	Very high	52 Å²	52	57.3 Å²	57.3	27%	0.272	29%	0.286	S	S	.	.	H	α-helix	trans	-85.8	-35.5	177.9	-179.1	65.2	0	0	0	113.2	I70 L72 I101 I103 P138 A139 A140	I70-L142 HydrophobicContact CB-CD2 4.32Å; I70-L142 HydrophobicContact CD1-CB 4.19Å; I70-L142 HydrophobicContact CD1-CD2 3.9Å; I70-L142 HydrophobicContact CG2-CD2 4.18Å; L72-L142 HydrophobicContact CD1-CD2 4.03Å; I101-L142 HydrophobicContact CB-CD2 4.49Å; I101-L142 HydrophobicContact CD1-CD1 3.85Å; I101-L142 HydrophobicContact CD1-CD2 3.77Å; I101-L142 HydrophobicContact CD1-CG 4.46Å; I101-L142 HydrophobicContact CG2-CD1 4.39Å; I101-L142 HydrophobicContact CG2-CD2 4.49Å; I103-L142 HydrophobicContact CD1-CB 4.33Å; P138-L142 PolarHBondContact O-N 2.82Å; A139-L142 PolarHBondContact O-N 2.88Å; A140-L142 PolarHBondContact O-N 3.41Å
143	L	90.2	Very high	92.2	Very high	95 Å²	95	59.2 Å²	59.2	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-94.7	-30.7	-167.7	-65.1	168	0	0	0	113.9	L77 A139 A140	L77-L143 HydrophobicContact CD1-CD1 3.3Å; L77-L143 HydrophobicContact CD1-CD2 3.74Å; L77-L143 HydrophobicContact CD1-CG 4.12Å; L77-L143 HydrophobicContact CD2-CD1 4.25Å; L77-L143 HydrophobicContact CD2-CD2 4.15Å; L77-L143 HydrophobicContact CG-CD1 4.35Å; L77-L143 HydrophobicContact CG-CD2 4.23Å; A139-L143 WeakPolarHBondContact O-CB 3.39Å; A139-L143 WeakPolarHBondContact O-CD1 3.49Å; A139-L143 WeakPolarHBondContact O-CG 3.25Å; A139-L143 PolarHBondContact O-N 2.83Å; A139-L143 VanDerWaalsContact O-N 3.1Å; A140-L143 PolarHBondContact O-N 2.99Å
144	R	91.6	Very high	92.2	Very high	152 Å²	152	63.4 Å²	63.4	57%	0.574	32%	0.317	S	S	*	.	S	Bend	trans	-89.1	-26.5	-174.8	-65.1	176.4	179.8	152.3	2.5	112.3	A140 E193	A140-R144 VanDerWaalsContact CB-NH1 3.29Å; A140-R144 WeakPolarHBondContact O-CB 3.33Å; A140-R144 PolarHBondContact O-N 3.31Å; R144-E193 WeakPolarHBondContact CD-O 3.45Å; R144-E193 PolarHBondContact NH1-O 3.36Å
145	V	91.2	Very high	92.2	Very high	22 Å²	22	61.5 Å²	61.5	13%	0.133	31%	0.313	C	S	.	.			trans	-140.2	139.5	-176.4	-177.5	0	0	0	0	110	S151 W194	V145-S151 VanDerWaalsContact CG1-OG 3.26Å; V145-S151 WeakPolarHBondContact CG1-OG 3.34Å; V145-W194 HydrophobicContact CG2-CB 4.26Å; V145-W194 HydrophobicContact CG2-CD2 3.74Å; V145-W194 HydrophobicContact CG2-CG 3.47Å; V145-W194 VanDerWaalsContact CG2-CG 3.47Å; V145-W194 HydrophobicContact CG2-CZ2 4.44Å; V145-W194 VanDerWaalsContact CG2-NE1 3.29Å
146	E	90.5	Very high	92.2	Very high	203 Å²	203	60.6 Å²	60.6	95%	0.949	31%	0.309	S	S	*	.	S	Bend	trans	-59.3	-51.2	177.7	-174.9	-173.1	173.4	0	0	112.1
147	N	91.7	Very high	92.4	Very high	82 Å²	82	57.6 Å²	57.6	44%	0.439	29%	0.294	S	S	.	.			trans	-132.8	90.8	175.7	-171.4	-29.2	0	0	0	110.7	A149 K150 S151	N147-A149 VanDerWaalsContact C-N 3.27Å; N147-A149 PolarHBondContact O-N 2.7Å; N147-A149 PolarHBondContact OD1-N 2.74Å; N147-K150 HydrophobicContact CB-CB 4.05Å; N147-K150 PolarHBondContact O-N 2.82Å; N147-K150 PolarHBondContact OD1-N 3.4Å; N147-S151 PolarHBondContact O-N 2.8Å; N147-S151 PolarHBondContact O-OG 3.4Å
148	A	90.9	Very high	92.5	Very high	12 Å²	12	56.6 Å²	56.6	10%	0.099	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-37.1	-176.1	0	0	0	0	0	113.2	A141 A152 I196	A141-A148 HydrophobicContact CB-CB 4.13Å; A148-A152 VanDerWaalsContact O-CB 3.29Å; A148-A152 WeakPolarHBondContact O-CB 3.49Å; A148-A152 PolarHBondContact O-N 3.5Å; A148-I196 HydrophobicContact CB-CD1 3.55Å; A148-I196 HydrophobicContact CB-CG1 4.46Å; A148-I196 WeakPolarHBondContact O-CD1 3.48Å
149	A	90	Very high	92.7	Very high	32 Å²	32	56.6 Å²	56.6	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-46.1	179.1	0	0	0	0	0	112.1	N147 A152 E153	N147-A149 VanDerWaalsContact C-N 3.27Å; N147-A149 PolarHBondContact O-N 2.7Å; N147-A149 PolarHBondContact OD1-N 2.74Å; A149-A152 PolarHBondContact O-N 2.74Å; A149-E153 PolarHBondContact O-N 2.84Å
150	K	93.4	Very high	93	Very high	127 Å²	127	55.9 Å²	55.9	55%	0.552	29%	0.289	S	S	*	.	H	α-helix	trans	-66.1	-40.2	178	-173.2	179.4	-180	-176.5	0	111.7	N147 E153 L154	N147-K150 HydrophobicContact CB-CB 4.05Å; N147-K150 PolarHBondContact O-N 2.82Å; N147-K150 PolarHBondContact OD1-N 3.4Å; K150-E153 WeakPolarHBondContact O-CB 3.16Å; K150-E153 PolarHBondContact O-N 2.93Å; K150-L154 WeakPolarHBondContact O-CG 3.32Å; K150-L154 PolarHBondContact O-N 3.18Å
151	S	94.6	Very high	93.2	Very high	36 Å²	36	60.8 Å²	60.8	25%	0.252	31%	0.306	S	S	.	.	H	α-helix	trans	-66.3	-38.7	176.8	-64.3	0	0	0	0	112.2	V145 N147 E153 L154 L155	V145-S151 VanDerWaalsContact CG1-OG 3.26Å; V145-S151 WeakPolarHBondContact CG1-OG 3.34Å; N147-S151 PolarHBondContact O-N 2.8Å; N147-S151 PolarHBondContact O-OG 3.4Å; S151-E153 VanDerWaalsContact C-N 3.34Å; S151-L154 PolarHBondContact O-N 2.94Å; S151-L155 VanDerWaalsContact O-CB 3.3Å; S151-L155 WeakPolarHBondContact O-CB 3.46Å; S151-L155 PolarHBondContact O-N 3.24Å
152	A	93.5	Very high	93.3	Very high	4 Å²	4	64.2 Å²	64.2	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-39	173.6	0	0	0	0	0	112.4	M133 A148 A149 L155 A156 T191 W194 I196	M133-A152 HydrophobicContact CE-CB 3.7Å; M133-A152 HydrophobicContact SD-CB 3.85Å; A148-A152 VanDerWaalsContact O-CB 3.29Å; A148-A152 WeakPolarHBondContact O-CB 3.49Å; A148-A152 PolarHBondContact O-N 3.5Å; A149-A152 PolarHBondContact O-N 2.74Å; A152-L155 PolarHBondContact O-N 2.9Å; A152-A156 VanDerWaalsContact O-CB 3.31Å; A152-A156 WeakPolarHBondContact O-CB 3.44Å; A152-A156 PolarHBondContact O-N 3.09Å; A152-T191 HydrophobicContact CB-CG2 4.1Å; A152-W194 HydrophobicContact CB-CZ3 4.3Å; A152-I196 HydrophobicContact CB-CD1 4.13Å
153	E	93.6	Very high	93.5	Very high	71 Å²	71	62 Å²	62	33%	0.332	32%	0.318	S	S	.	.	H	α-helix	trans	-61.3	-47.7	173.8	-171.9	-177.9	160.5	0	0	112	V110 I112 A149 K150 S151 L155 A156 V157	V110-E153 HydrophobicContact CG1-CB 3.94Å; V110-E153 HydrophobicContact CG1-CG 3.69Å; I112-E153 HydrophobicContact CD1-CG 3.83Å; A149-E153 PolarHBondContact O-N 2.84Å; K150-E153 WeakPolarHBondContact O-CB 3.16Å; K150-E153 PolarHBondContact O-N 2.93Å; S151-E153 VanDerWaalsContact C-N 3.34Å; E153-L155 PolarHBondContact O-N 3.47Å; E153-A156 WeakPolarHBondContact O-CB 3.24Å; E153-A156 PolarHBondContact O-N 3.02Å; E153-V157 WeakPolarHBondContact O-CG2 3.44Å; E153-V157 PolarHBondContact O-N 2.85Å
154	L	95.6	Very high	93.7	Very high	101 Å²	101	57.5 Å²	57.5	53%	0.529	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-37.6	178.4	-68	172.7	0	0	0	112.7	K150 S151 V157 T158	K150-L154 WeakPolarHBondContact O-CG 3.32Å; K150-L154 PolarHBondContact O-N 3.18Å; S151-L154 PolarHBondContact O-N 2.94Å; L154-V157 PolarHBondContact O-N 3.23Å; L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 VanDerWaalsContact O-N 3.09Å; L154-T158 PolarHBondContact O-OG1 3.25Å
155	L	95.7	Very high	93.8	Very high	48 Å²	48	51.5 Å²	51.5	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-42.7	173.8	-177.4	66.4	0	0	0	110.8	S151 A152 E153 V157 T158 A159 L187 A190 T191 W194	S151-L155 VanDerWaalsContact O-CB 3.3Å; S151-L155 WeakPolarHBondContact O-CB 3.46Å; S151-L155 PolarHBondContact O-N 3.24Å; A152-L155 PolarHBondContact O-N 2.9Å; E153-L155 PolarHBondContact O-N 3.47Å; L155-V157 PolarHBondContact O-N 3.1Å; L155-T158 PolarHBondContact O-N 3.13Å; L155-A159 WeakPolarHBondContact O-CB 3.5Å; L155-A159 PolarHBondContact O-N 3.38Å; L155-L187 HydrophobicContact CD2-CD2 4.38Å; L155-L187 HydrophobicContact CG-CD2 4.03Å; L155-A190 HydrophobicContact CD2-CB 3.68Å; L155-T191 HydrophobicContact CD2-CG2 3.83Å; L155-W194 HydrophobicContact CB-CH2 4.23Å; L155-W194 HydrophobicContact CB-CZ3 4.38Å; L155-W194 HydrophobicContact CD2-CH2 3.85Å; L155-W194 HydrophobicContact CD2-CZ3 3.93Å
156	A	95.7	Very high	94	Very high	6 Å²	6	54.5 Å²	54.5	5%	0.05	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-44.2	173.7	0	0	0	0	0	112.1	I112 V131 A152 E153 T158 A159 L160 L187	I112-A156 HydrophobicContact CD1-CB 3.67Å; I112-A156 HydrophobicContact CG1-CB 4.27Å; V131-A156 HydrophobicContact CG2-CB 4.02Å; A152-A156 VanDerWaalsContact O-CB 3.31Å; A152-A156 WeakPolarHBondContact O-CB 3.44Å; A152-A156 PolarHBondContact O-N 3.09Å; E153-A156 WeakPolarHBondContact O-CB 3.24Å; E153-A156 PolarHBondContact O-N 3.02Å; A156-T158 VanDerWaalsContact C-N 3.32Å; A156-T158 PolarHBondContact O-N 3.45Å; A156-A159 PolarHBondContact O-N 2.9Å; A156-L160 WeakPolarHBondContact O-CB 3.26Å; A156-L160 PolarHBondContact O-N 3.44Å; A156-L187 HydrophobicContact CB-CD1 3.85Å; A156-L187 HydrophobicContact CB-CD2 4.26Å
157	V	96.8	Very high	94.2	Very high	21 Å²	21	46 Å²	46	13%	0.127	26%	0.258	C	S	.	.	H	α-helix	trans	-57.1	-45.7	173.9	170.7	0	0	0	0	111.6	I112 Q115 E153 L154 L155 R161	I112-V157 HydrophobicContact CD1-CG2 4.43Å; I112-V157 HydrophobicContact CG2-CG2 3.72Å; Q115-V157 HydrophobicContact CG-CG1 4.27Å; E153-V157 WeakPolarHBondContact O-CG2 3.44Å; E153-V157 PolarHBondContact O-N 2.85Å; L154-V157 PolarHBondContact O-N 3.23Å; L155-V157 PolarHBondContact O-N 3.1Å; V157-R161 PolarHBondContact O-N 3.28Å; V157-R161 VanDerWaalsContact O-N 3.12Å
158	T	95.4	Very high	94.4	Very high	82 Å²	82	46 Å²	46	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-70.9	-42.6	-177	-54.6	0	0	0	0	111.8	L154 L155 A156 R161 S162	L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 VanDerWaalsContact O-N 3.09Å; L154-T158 PolarHBondContact O-OG1 3.25Å; L155-T158 PolarHBondContact O-N 3.13Å; A156-T158 VanDerWaalsContact C-N 3.32Å; A156-T158 PolarHBondContact O-N 3.45Å; T158-R161 PolarHBondContact O-N 2.87Å; T158-S162 PolarHBondContact O-N 3.39Å
159	A	95	Very high	94.6	Very high	7 Å²	7	46 Å²	46	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-41.9	175.2	0	0	0	0	0	111.8	L155 A156 R161 S162 V163 L186 L187	L155-A159 WeakPolarHBondContact O-CB 3.5Å; L155-A159 PolarHBondContact O-N 3.38Å; A156-A159 PolarHBondContact O-N 2.9Å; A159-R161 PolarHBondContact O-N 2.91Å; A159-S162 PolarHBondContact O-N 2.85Å; A159-V163 WeakPolarHBondContact O-CB 3.14Å; A159-V163 WeakPolarHBondContact O-CG2 3.42Å; A159-V163 PolarHBondContact O-N 2.9Å; A159-L186 HydrophobicContact CB-CD2 3.7Å; A159-L187 HydrophobicContact CB-CD2 3.6Å; A159-L187 HydrophobicContact CB-CG 4.18Å
160	L	95.2	Very high	94.7	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-49.2	176.1	-168.7	70.4	0	0	0	110.4	I112 Q115 I117 A129 A156 S162 V163 L164 L183	I112-L160 HydrophobicContact CG2-CD2 4.26Å; Q115-L160 HydrophobicContact CG-CD2 4.37Å; I117-L160 HydrophobicContact CD1-CG 4.41Å; A129-L160 HydrophobicContact CB-CD1 4.2Å; A129-L160 HydrophobicContact CB-CD2 4.12Å; A156-L160 WeakPolarHBondContact O-CB 3.26Å; A156-L160 PolarHBondContact O-N 3.44Å; L160-S162 VanDerWaalsContact C-N 3.35Å; L160-S162 PolarHBondContact O-N 3Å; L160-V163 PolarHBondContact O-N 3.07Å; L160-L164 HydrophobicContact CD1-CD1 3.52Å; L160-L164 HydrophobicContact CD1-CD2 4.41Å; L160-L164 HydrophobicContact CD1-CG 3.85Å; L160-L164 HydrophobicContact CD2-CD1 4.35Å; L160-L164 HydrophobicContact CG-CD1 3.6Å; L160-L164 HydrophobicContact CG-CG 4.12Å; L160-L164 VanDerWaalsContact O-CB 3.26Å; L160-L164 WeakPolarHBondContact O-CB 3.38Å; L160-L164 VanDerWaalsContact O-CG 3.24Å; L160-L164 WeakPolarHBondContact O-CG 3.37Å; L160-L164 PolarHBondContact O-N 3.2Å; L160-L183 HydrophobicContact CD1-CD1 3.72Å; L160-L183 HydrophobicContact CD1-CD2 4.38Å
161	R	94.8	Very high	94.8	Very high	109 Å²	109	44.4 Å²	44.4	41%	0.411	25%	0.25	S	C	.	.	H	α-helix	trans	-58.1	-45.5	175.9	-174.3	179.5	-65.9	103.5	4.9	112.2	Q115 I117 V157 T158 A159 G165	Q115-R161 VanDerWaalsContact OE1-NH2 3.07Å; I117-R161 HydrophobicContact CG1-CB 4.47Å; I117-R161 HydrophobicContact CG1-CG 4.37Å; V157-R161 PolarHBondContact O-N 3.28Å; V157-R161 VanDerWaalsContact O-N 3.12Å; T158-R161 PolarHBondContact O-N 2.87Å; A159-R161 PolarHBondContact O-N 2.91Å; R161-G165 PolarHBondContact O-N 2.82Å
162	S	93.7	Very high	94.7	Very high	81 Å²	81	42.8 Å²	42.8	57%	0.566	24%	0.238	S	C	*	.	H	α-helix	trans	-68.8	-40.3	-177.8	-175	0	0	0	0	112.8	T158 A159 L160 T166	T158-S162 PolarHBondContact O-N 3.39Å; A159-S162 PolarHBondContact O-N 2.85Å; L160-S162 VanDerWaalsContact C-N 3.35Å; L160-S162 PolarHBondContact O-N 3Å; S162-T166 WeakPolarHBondContact O-CG2 3.21Å
163	V	94.6	Very high	94.5	Very high	6 Å²	6	46.1 Å²	46.1	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-78.4	-50.8	-177.1	175.3	0	0	0	0	109.8	A159 L160 G165 T166 Y167 I179 K182 L183 L186	A159-V163 WeakPolarHBondContact O-CB 3.14Å; A159-V163 WeakPolarHBondContact O-CG2 3.42Å; A159-V163 PolarHBondContact O-N 2.9Å; L160-V163 PolarHBondContact O-N 3.07Å; V163-G165 VanDerWaalsContact C-N 3.26Å; V163-G165 PolarHBondContact O-N 2.89Å; V163-T166 PolarHBondContact O-N 2.92Å; V163-T166 PolarHBondContact O-OG1 3.46Å; V163-Y167 HydrophobicContact CG1-CD2 4.26Å; V163-Y167 HydrophobicContact CG1-CE2 3.81Å; V163-Y167 VanDerWaalsContact O-CD2 3.29Å; V163-Y167 WeakPolarHBondContact O-CD2 3.46Å; V163-I179 HydrophobicContact CG1-CG2 4.43Å; V163-K182 HydrophobicContact CG1-CD 4.32Å; V163-L183 HydrophobicContact CB-CD2 3.76Å; V163-L183 HydrophobicContact CB-CG 4.41Å; V163-L183 HydrophobicContact CG1-CD2 4.11Å; V163-L183 HydrophobicContact CG1-CG 4.22Å; V163-L183 HydrophobicContact CG2-CD2 3.82Å; V163-L186 HydrophobicContact CG2-CD1 3.91Å
164	L	93.9	Very high	94.5	Very high	1 Å²	1	48 Å²	48	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-31.1	-177	-61.9	-173.4	0	0	0	112.7	I117 V127 L160 T166 Y167 L172 I179 I203	I117-L164 HydrophobicContact CD1-CB 4.24Å; I117-L164 HydrophobicContact CD1-CD1 3.86Å; I117-L164 HydrophobicContact CG2-CB 4.42Å; V127-L164 HydrophobicContact CB-CD1 3.73Å; V127-L164 HydrophobicContact CG1-CD1 3.53Å; V127-L164 HydrophobicContact CG2-CD1 3.91Å; L160-L164 HydrophobicContact CD1-CD1 3.52Å; L160-L164 HydrophobicContact CD1-CD2 4.41Å; L160-L164 HydrophobicContact CD1-CG 3.85Å; L160-L164 HydrophobicContact CD2-CD1 4.35Å; L160-L164 HydrophobicContact CG-CD1 3.6Å; L160-L164 HydrophobicContact CG-CG 4.12Å; L160-L164 VanDerWaalsContact O-CB 3.26Å; L160-L164 WeakPolarHBondContact O-CB 3.38Å; L160-L164 VanDerWaalsContact O-CG 3.24Å; L160-L164 WeakPolarHBondContact O-CG 3.37Å; L160-L164 PolarHBondContact O-N 3.2Å; L164-T166 PolarHBondContact O-N 2.71Å; L164-Y167 PolarHBondContact O-N 3.46Å; L164-Y167 VanDerWaalsContact O-N 3.17Å; L164-L172 HydrophobicContact CD2-CD2 3.67Å; L164-I179 HydrophobicContact CD2-CG2 3.53Å; L164-I203 HydrophobicContact CD2-CD1 4.32Å
165	G	94.5	Very high	94.3	Very high	25 Å²	25	46.4 Å²	46.4	26%	0.258	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18	173.2	0	0	0	0	0	114.4	L118 S120 R161 V163	L118-G165 WeakPolarHBondContact O-CA 3.3Å; S120-G165 PolarHBondContact N-O 3.43Å; R161-G165 PolarHBondContact O-N 2.82Å; V163-G165 VanDerWaalsContact C-N 3.26Å; V163-G165 PolarHBondContact O-N 2.89Å
166	T	94.2	Very high	94.2	Very high	86 Å²	86	47.9 Å²	47.9	53%	0.528	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.7	176.7	65.8	0	0	0	0	114.1	S162 V163 L164	S162-T166 WeakPolarHBondContact O-CG2 3.21Å; V163-T166 PolarHBondContact O-N 2.92Å; V163-T166 PolarHBondContact O-OG1 3.46Å; L164-T166 PolarHBondContact O-N 2.71Å
167	Y	95.8	Very high	94.2	Very high	25 Å²	25	54 Å²	54	10%	0.098	30%	0.297	C	S	.	.	S	Bend	trans	-104	150.8	-179.6	-74.3	-88.7	0	0	0	111	T119 S120 V163 L164 Q171 L172 I179 K182	T119-Y167 WeakPolarHBondContact CB-O 3.34Å; S120-Y167 PolarHBondContact N-O 2.91Å; S120-Y167 VanDerWaalsContact N-O 3.1Å; V163-Y167 HydrophobicContact CG1-CD2 4.26Å; V163-Y167 HydrophobicContact CG1-CE2 3.81Å; V163-Y167 VanDerWaalsContact O-CD2 3.29Å; V163-Y167 WeakPolarHBondContact O-CD2 3.46Å; L164-Y167 PolarHBondContact O-N 3.46Å; L164-Y167 VanDerWaalsContact O-N 3.17Å; Y167-Q171 HydrophobicContact CD1-CB 4.07Å; Y167-Q171 VanDerWaalsContact CD1-OE1 3.29Å; Y167-L172 HydrophobicContact CG-CD2 4.45Å; Y167-I179 HydrophobicContact CD1-CD1 4.38Å; Y167-I179 HydrophobicContact CD1-CG1 4.21Å; Y167-I179 HydrophobicContact CD2-CG1 4.24Å; Y167-I179 HydrophobicContact CE1-CG1 4.13Å; Y167-I179 HydrophobicContact CE2-CG1 4.18Å; Y167-I179 HydrophobicContact CG-CD1 4.33Å; Y167-I179 HydrophobicContact CG-CG1 4.28Å; Y167-K182 HydrophobicContact CE2-CD 4.3Å; Y167-K182 VanDerWaalsContact OH-CD 3.25Å; Y167-K182 WeakPolarHBondContact OH-CD 3.44Å; Y167-K182 PolarHBondContact OH-NZ 3.49Å
168	E	96.2	Very high	94	Very high	81 Å²	81	58 Å²	58	38%	0.379	32%	0.315	S	S	.	.			trans	-75.9	155.6	171.3	-64.6	-173.3	-179.7	0	0	110.9	D121 S170 Q171 L172	D121-E168 VanDerWaalsContact OD1-CG 3.31Å; D121-E168 WeakPolarHBondContact OD1-CG 3.03Å; D121-E168 WeakPolarHBondContact OD2-CA 3.31Å; D121-E168 WeakPolarHBondContact OD2-CB 3.47Å; E168-S170 PolarHBondContact O-N 3.43Å; E168-Q171 HydrophobicContact CB-CG 4.17Å; E168-Q171 WeakPolarHBondContact O-CB 3.22Å; E168-Q171 PolarHBondContact O-N 2.8Å; E168-Q171 VanDerWaalsContact O-N 3.09Å; E168-L172 WeakPolarHBondContact O-CG 3.48Å; E168-L172 PolarHBondContact O-N 3.17Å
169	L	94.2	Very high	94.1	Very high	12 Å²	12	54.1 Å²	54.1	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-57	-41.2	177.6	173.3	63.1	0	0	0	111.6	D121 V123 V125 Q171 L172 L173 L208 M216	D121-L169 PolarHBondContact OD2-N 3.41Å; V123-L169 HydrophobicContact CG1-CD2 4.3Å; V125-L169 HydrophobicContact CG1-CD1 3.88Å; L169-Q171 PolarHBondContact O-N 2.91Å; L169-L172 PolarHBondContact O-N 2.8Å; L169-L173 HydrophobicContact CD1-CD1 4.2Å; L169-L173 HydrophobicContact CD1-CG 4.24Å; L169-L173 HydrophobicContact CG-CD1 4.23Å; L169-L173 WeakPolarHBondContact O-CG 3.26Å; L169-L173 PolarHBondContact O-N 2.89Å; L169-L173 VanDerWaalsContact O-N 3.1Å; L169-L208 HydrophobicContact CD1-CD2 4.08Å; L169-L208 HydrophobicContact CD2-CD2 3.81Å; L169-M216 HydrophobicContact CD2-CE 3.46Å; L169-M216 VanDerWaalsContact CD2-CE 3.46Å
170	S	92.7	Very high	94.1	Very high	63 Å²	63	55 Å²	55	44%	0.441	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-38.5	179.3	68.5	0	0	0	0	112	E168 L173 T174	E168-S170 PolarHBondContact O-N 3.43Å; S170-L173 PolarHBondContact O-N 3.21Å; S170-T174 WeakPolarHBondContact O-CB 3.28Å; S170-T174 PolarHBondContact O-N 2.92Å; S170-T174 VanDerWaalsContact O-N 3.12Å; S170-T174 PolarHBondContact O-OG1 3.47Å
171	Q	94.4	Very high	94.1	Very high	63 Å²	63	57.6 Å²	57.6	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-74.3	-38.2	178.6	-63.7	175	-26.3	0	0	111.3	Y167 E168 L169 L173 T174 N175	Y167-Q171 HydrophobicContact CD1-CB 4.07Å; Y167-Q171 VanDerWaalsContact CD1-OE1 3.29Å; E168-Q171 HydrophobicContact CB-CG 4.17Å; E168-Q171 WeakPolarHBondContact O-CB 3.22Å; E168-Q171 PolarHBondContact O-N 2.8Å; E168-Q171 VanDerWaalsContact O-N 3.09Å; L169-Q171 PolarHBondContact O-N 2.91Å; Q171-L173 PolarHBondContact O-N 3.38Å; Q171-T174 PolarHBondContact O-N 3.39Å; Q171-N175 WeakPolarHBondContact O-CA 3.47Å; Q171-N175 WeakPolarHBondContact O-CB 3.42Å; Q171-N175 PolarHBondContact O-N 2.67Å
172	L	93.3	Very high	94.2	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-33.5	173.8	-63.1	-172.1	0	0	0	112.5	T119 V125 L164 Y167 E168 L169 R176 I179	T119-L172 HydrophobicContact CG2-CD1 3.65Å; V125-L172 HydrophobicContact CG2-CD1 4.21Å; L164-L172 HydrophobicContact CD2-CD2 3.67Å; Y167-L172 HydrophobicContact CG-CD2 4.45Å; E168-L172 WeakPolarHBondContact O-CG 3.48Å; E168-L172 PolarHBondContact O-N 3.17Å; L169-L172 PolarHBondContact O-N 2.8Å; L172-R176 WeakPolarHBondContact O-CG 3.42Å; L172-I179 HydrophobicContact CD2-CD1 3.53Å
173	L	90.4	Very high	94.3	Very high	73 Å²	73	53 Å²	53	38%	0.382	29%	0.286	S	S	.	.	H	α-helix	trans	-81.4	-30.9	179.4	-64.9	177.4	0	0	0	113.2	L169 S170 Q171 V206	L169-L173 HydrophobicContact CD1-CD1 4.2Å; L169-L173 HydrophobicContact CD1-CG 4.24Å; L169-L173 HydrophobicContact CG-CD1 4.23Å; L169-L173 WeakPolarHBondContact O-CG 3.26Å; L169-L173 PolarHBondContact O-N 2.89Å; L169-L173 VanDerWaalsContact O-N 3.1Å; S170-L173 PolarHBondContact O-N 3.21Å; Q171-L173 PolarHBondContact O-N 3.38Å; L173-V206 HydrophobicContact CD2-CB 4.46Å; L173-V206 HydrophobicContact CD2-CG1 4.41Å
174	T	92.1	Very high	94.4	Very high	111 Å²	111	53.6 Å²	53.6	68%	0.681	29%	0.292	S	S	*	.	H	α-helix	trans	-104.8	-39	-171.9	-46.2	0	0	0	0	113.4	S170 Q171	S170-T174 WeakPolarHBondContact O-CB 3.28Å; S170-T174 PolarHBondContact O-N 2.92Å; S170-T174 VanDerWaalsContact O-N 3.12Å; S170-T174 PolarHBondContact O-OG1 3.47Å; Q171-T174 PolarHBondContact O-N 3.39Å
175	N	92.8	Very high	94.5	Very high	68 Å²	68	59.1 Å²	59.1	36%	0.364	32%	0.32	S	S	.	.			trans	-109	45	-168.6	-68.9	-1.8	0	0	0	112.8	Q171 D177 Q178 I179	Q171-N175 WeakPolarHBondContact O-CA 3.47Å; Q171-N175 WeakPolarHBondContact O-CB 3.42Å; Q171-N175 PolarHBondContact O-N 2.67Å; N175-D177 PolarHBondContact O-N 2.62Å; N175-Q178 HydrophobicContact CB-CB 4.45Å; N175-Q178 PolarHBondContact O-N 3.49Å; N175-I179 WeakPolarHBondContact O-CG1 3.21Å; N175-I179 PolarHBondContact O-N 2.98Å
176	R	93.2	Very high	94.5	Very high	78 Å²	78	61.1 Å²	61.1	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-44.9	-178.4	-66.4	-174	-179	-165.1	1.1	112.5	L172 Q178 I179 D180	L172-R176 WeakPolarHBondContact O-CG 3.42Å; R176-Q178 VanDerWaalsContact C-N 3.27Å; R176-Q178 PolarHBondContact O-N 3.09Å; R176-I179 PolarHBondContact O-N 3.3Å; R176-D180 WeakPolarHBondContact O-CB 3.31Å; R176-D180 VanDerWaalsContact O-CG 3.31Å; R176-D180 PolarHBondContact O-N 2.84Å
177	D	94.2	Very high	94.6	Very high	135 Å²	135	57.2 Å²	57.2	72%	0.722	30%	0.3	S	S	*	.	H	α-helix	trans	-57.5	-37.3	-179.1	-58.8	-18.3	0	0	0	113.5	N175 S181	N175-D177 PolarHBondContact O-N 2.62Å; D177-S181 WeakPolarHBondContact O-CB 3.17Å; D177-S181 PolarHBondContact O-N 3.26Å; D177-S181 VanDerWaalsContact O-N 3.08Å; D177-S181 PolarHBondContact O-OG 3.11Å
178	Q	94.5	Very high	94.6	Very high	106 Å²	106	57.9 Å²	57.9	50%	0.495	31%	0.305	S	S	.	.	H	α-helix	trans	-69.9	-37.8	177.9	-172.9	-179.4	43.2	0	0	111.4	N175 R176 S181 K182	N175-Q178 HydrophobicContact CB-CB 4.45Å; N175-Q178 PolarHBondContact O-N 3.49Å; R176-Q178 VanDerWaalsContact C-N 3.27Å; R176-Q178 PolarHBondContact O-N 3.09Å; Q178-S181 PolarHBondContact O-OG 2.79Å; Q178-K182 WeakPolarHBondContact O-CB 3.5Å; Q178-K182 PolarHBondContact O-N 3.29Å
179	I	95.8	Very high	94.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-72.9	-44.5	179.4	-61.5	162	0	0	0	109.9	V163 L164 Y167 L172 N175 R176 S181 K182 L183 I203	V163-I179 HydrophobicContact CG1-CG2 4.43Å; L164-I179 HydrophobicContact CD2-CG2 3.53Å; Y167-I179 HydrophobicContact CD1-CD1 4.38Å; Y167-I179 HydrophobicContact CD1-CG1 4.21Å; Y167-I179 HydrophobicContact CD2-CG1 4.24Å; Y167-I179 HydrophobicContact CE1-CG1 4.13Å; Y167-I179 HydrophobicContact CE2-CG1 4.18Å; Y167-I179 HydrophobicContact CG-CD1 4.33Å; Y167-I179 HydrophobicContact CG-CG1 4.28Å; L172-I179 HydrophobicContact CD2-CD1 3.53Å; N175-I179 WeakPolarHBondContact O-CG1 3.21Å; N175-I179 PolarHBondContact O-N 2.98Å; R176-I179 PolarHBondContact O-N 3.3Å; I179-S181 PolarHBondContact O-N 3.06Å; I179-K182 PolarHBondContact O-N 2.96Å; I179-L183 HydrophobicContact CG2-CD1 3.86Å; I179-L183 HydrophobicContact CG2-CG 4.35Å; I179-L183 WeakPolarHBondContact O-CB 3.36Å; I179-L183 WeakPolarHBondContact O-CG 3.46Å; I179-L183 PolarHBondContact O-N 3.3Å; I179-I203 HydrophobicContact CB-CD1 4.14Å; I179-I203 HydrophobicContact CG2-CD1 3.81Å
180	D	95.8	Very high	94.6	Very high	24 Å²	24	62.7 Å²	62.7	13%	0.128	33%	0.334	C	S	.	.	H	α-helix	trans	-58	-46.6	178.2	-75.6	-14.7	0	0	0	111.5	R176 L183 A184 V201 I203	R176-D180 WeakPolarHBondContact O-CB 3.31Å; R176-D180 VanDerWaalsContact O-CG 3.31Å; R176-D180 PolarHBondContact O-N 2.84Å; D180-L183 PolarHBondContact O-N 2.68Å; D180-A184 WeakPolarHBondContact O-CB 3.45Å; D180-A184 PolarHBondContact O-N 3.03Å; D180-V201 VanDerWaalsContact CB-O 3.27Å; D180-V201 WeakPolarHBondContact CB-O 3.33Å; D180-I203 WeakPolarHBondContact OD1-CG1 3.44Å; D180-I203 PolarHBondContact OD1-N 2.91Å; D180-I203 VanDerWaalsContact OD1-N 3.09Å
181	S	95.6	Very high	94.7	Very high	61 Å²	61	59.8 Å²	59.8	43%	0.427	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-41.3	176.4	55	0	0	0	0	112.8	D177 Q178 I179 A184 I185	D177-S181 WeakPolarHBondContact O-CB 3.17Å; D177-S181 PolarHBondContact O-N 3.26Å; D177-S181 VanDerWaalsContact O-N 3.08Å; D177-S181 PolarHBondContact O-OG 3.11Å; Q178-S181 PolarHBondContact O-OG 2.79Å; I179-S181 PolarHBondContact O-N 3.06Å; S181-A184 PolarHBondContact O-N 3.47Å; S181-I185 WeakPolarHBondContact O-CG1 3.16Å; S181-I185 PolarHBondContact O-N 2.93Å; S181-I185 VanDerWaalsContact O-N 3.07Å
182	K	95.5	Very high	94.7	Very high	92 Å²	92	58.6 Å²	58.6	40%	0.4	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-42.4	176.3	-173.5	176	178.7	-177	0	111.9	V163 Y167 Q178 I179 I185 L186	V163-K182 HydrophobicContact CG1-CD 4.32Å; Y167-K182 HydrophobicContact CE2-CD 4.3Å; Y167-K182 VanDerWaalsContact OH-CD 3.25Å; Y167-K182 WeakPolarHBondContact OH-CD 3.44Å; Y167-K182 PolarHBondContact OH-NZ 3.49Å; Q178-K182 WeakPolarHBondContact O-CB 3.5Å; Q178-K182 PolarHBondContact O-N 3.29Å; I179-K182 PolarHBondContact O-N 2.96Å; K182-I185 PolarHBondContact O-N 2.96Å; K182-L186 WeakPolarHBondContact O-CB 3.42Å; K182-L186 PolarHBondContact O-N 3.4Å; K182-L186 VanDerWaalsContact O-N 3.11Å
183	L	96.1	Very high	94.7	Very high	1 Å²	1	65 Å²	65	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-44.1	175	-78.6	169.1	0	0	0	111.6	L160 V163 I179 D180 I185 L186 L187 V201	L160-L183 HydrophobicContact CD1-CD1 3.72Å; L160-L183 HydrophobicContact CD1-CD2 4.38Å; V163-L183 HydrophobicContact CB-CD2 3.76Å; V163-L183 HydrophobicContact CB-CG 4.41Å; V163-L183 HydrophobicContact CG1-CD2 4.11Å; V163-L183 HydrophobicContact CG1-CG 4.22Å; V163-L183 HydrophobicContact CG2-CD2 3.82Å; I179-L183 HydrophobicContact CG2-CD1 3.86Å; I179-L183 HydrophobicContact CG2-CG 4.35Å; I179-L183 WeakPolarHBondContact O-CB 3.36Å; I179-L183 WeakPolarHBondContact O-CG 3.46Å; I179-L183 PolarHBondContact O-N 3.3Å; D180-L183 PolarHBondContact O-N 2.68Å; L183-I185 PolarHBondContact O-N 3.03Å; L183-L186 PolarHBondContact O-N 3.38Å; L183-L187 WeakPolarHBondContact O-CB 3.45Å; L183-L187 WeakPolarHBondContact O-CG 3.41Å; L183-L187 PolarHBondContact O-N 2.92Å; L183-V201 HydrophobicContact CB-CB 4.23Å; L183-V201 HydrophobicContact CB-CG1 4.11Å; L183-V201 HydrophobicContact CB-CG2 4.39Å; L183-V201 HydrophobicContact CD1-CG1 4.2Å
184	A	96.5	Very high	94.8	Very high	18 Å²	18	64 Å²	64	15%	0.149	34%	0.34	C	S	.	.	H	α-helix	trans	-60	-45.1	178.4	0	0	0	0	0	111.8	D180 S181 D188 V201	D180-A184 WeakPolarHBondContact O-CB 3.45Å; D180-A184 PolarHBondContact O-N 3.03Å; S181-A184 PolarHBondContact O-N 3.47Å; A184-D188 WeakPolarHBondContact O-CB 3.49Å; A184-D188 PolarHBondContact O-N 3.4Å; A184-V201 HydrophobicContact CB-CG2 4.16Å
185	I	96.4	Very high	94.9	Very high	117 Å²	117	58.9 Å²	58.9	60%	0.6	31%	0.309	S	S	*	.	H	α-helix	trans	-63.6	-47.6	178.5	-66.9	164.9	0	0	0	111.2	S181 K182 L183 D188 Q189	S181-I185 WeakPolarHBondContact O-CG1 3.16Å; S181-I185 PolarHBondContact O-N 2.93Å; S181-I185 VanDerWaalsContact O-N 3.07Å; K182-I185 PolarHBondContact O-N 2.96Å; L183-I185 PolarHBondContact O-N 3.03Å; I185-D188 PolarHBondContact O-N 3.02Å; I185-Q189 WeakPolarHBondContact O-CB 3.3Å; I185-Q189 PolarHBondContact O-N 3.01Å
186	L	95.7	Very high	95.1	Very high	68 Å²	68	55.9 Å²	55.9	36%	0.356	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-46.2	-178.6	-174.7	159.3	0	0	0	111.2	A159 V163 K182 L183 A190	A159-L186 HydrophobicContact CB-CD2 3.7Å; V163-L186 HydrophobicContact CG2-CD1 3.91Å; K182-L186 WeakPolarHBondContact O-CB 3.42Å; K182-L186 PolarHBondContact O-N 3.4Å; K182-L186 VanDerWaalsContact O-N 3.11Å; L183-L186 PolarHBondContact O-N 3.38Å; L186-A190 PolarHBondContact O-N 3.44Å
187	L	96	Very high	95.2	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-68	-43.2	179.2	-72.1	177.1	0	0	0	112.1	V131 L155 A156 A159 L183 Q189 A190 T191 V198 V201	V131-L187 HydrophobicContact CG2-CD1 4.42Å; L155-L187 HydrophobicContact CD2-CD2 4.38Å; L155-L187 HydrophobicContact CG-CD2 4.03Å; A156-L187 HydrophobicContact CB-CD1 3.85Å; A156-L187 HydrophobicContact CB-CD2 4.26Å; A159-L187 HydrophobicContact CB-CD2 3.6Å; A159-L187 HydrophobicContact CB-CG 4.18Å; L183-L187 WeakPolarHBondContact O-CB 3.45Å; L183-L187 WeakPolarHBondContact O-CG 3.41Å; L183-L187 PolarHBondContact O-N 2.92Å; L187-Q189 VanDerWaalsContact C-N 3.31Å; L187-Q189 PolarHBondContact O-N 2.85Å; L187-A190 PolarHBondContact O-N 3.38Å; L187-T191 WeakPolarHBondContact O-CB 3.36Å; L187-T191 WeakPolarHBondContact O-CG2 3.34Å; L187-T191 PolarHBondContact O-N 3.12Å; L187-T191 PolarHBondContact O-OG1 3.48Å; L187-V198 HydrophobicContact CB-CG2 4.04Å; L187-V201 HydrophobicContact CD1-CG2 3.97Å
188	D	96.2	Very high	95.4	Very high	38 Å²	38	49.8 Å²	49.8	20%	0.203	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-41.5	178.7	-171	61.1	0	0	0	112.2	A184 I185 A190 G192 K197 V198	A184-D188 WeakPolarHBondContact O-CB 3.49Å; A184-D188 PolarHBondContact O-N 3.4Å; I185-D188 PolarHBondContact O-N 3.02Å; D188-A190 VanDerWaalsContact C-N 3.34Å; D188-A190 PolarHBondContact O-N 3.18Å; D188-G192 WeakPolarHBondContact O-CA 3.29Å; D188-G192 PolarHBondContact O-N 2.85Å; D188-K197 VanDerWaalsContact CG-NZ 3.26Å; D188-K197 WeakPolarHBondContact OD1-CD 3.44Å; D188-K197 WeakPolarHBondContact OD1-CE 3.42Å; D188-K197 IonicContact OD1-NZ 3.63Å; D188-K197 PolarHBondContact OD1-NZ 3.39Å; D188-K197 IonicContact OD2-NZ 3.7Å; D188-K197 PolarHBondContact OD2-NZ 2.92Å; D188-V198 HydrophobicContact CB-CB 4.11Å; D188-V198 PolarHBondContact OD1-N 3.16Å
189	Q	95.9	Very high	95.4	Very high	155 Å²	155	48.4 Å²	48.4	72%	0.724	26%	0.256	S	S	*	.	H	α-helix	trans	-61.9	-42.9	177.2	-175.3	177.1	2.2	0	0	111.7	I185 L187	I185-Q189 WeakPolarHBondContact O-CB 3.3Å; I185-Q189 PolarHBondContact O-N 3.01Å; L187-Q189 VanDerWaalsContact C-N 3.31Å; L187-Q189 PolarHBondContact O-N 2.85Å
190	A	93.9	Very high	95.4	Very high	39 Å²	39	54 Å²	54	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-78.5	-38.5	-177.8	0	0	0	0	0	112.9	L155 L186 L187 D188 G192	L155-A190 HydrophobicContact CD2-CB 3.68Å; L186-A190 PolarHBondContact O-N 3.44Å; L187-A190 PolarHBondContact O-N 3.38Å; D188-A190 VanDerWaalsContact C-N 3.34Å; D188-A190 PolarHBondContact O-N 3.18Å; A190-G192 VanDerWaalsContact C-N 3.32Å
191	T	94.8	Very high	95.4	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-78.9	-16	178	64.4	0	0	0	0	113.3	A152 L155 L187 E193 W194 G195 I196 V198	A152-T191 HydrophobicContact CB-CG2 4.1Å; L155-T191 HydrophobicContact CD2-CG2 3.83Å; L187-T191 WeakPolarHBondContact O-CB 3.36Å; L187-T191 WeakPolarHBondContact O-CG2 3.34Å; L187-T191 PolarHBondContact O-N 3.12Å; L187-T191 PolarHBondContact O-OG1 3.48Å; T191-E193 PolarHBondContact O-N 3.47Å; T191-W194 HydrophobicContact CG2-CE3 4.23Å; T191-W194 HydrophobicContact CG2-CZ3 4.23Å; T191-W194 WeakPolarHBondContact O-CA 3.35Å; T191-W194 PolarHBondContact O-N 2.81Å; T191-G195 PolarHBondContact O-N 3.22Å; T191-I196 CarbonylContact C-O 3.3Å; T191-I196 PolarHBondContact O-N 3.46Å; T191-I196 PolarHBondContact OG1-O 3.25Å; T191-I196 VanDerWaalsContact OG1-O 3.09Å; T191-V198 HydrophobicContact CG2-CG2 4.44Å
192	G	93.7	Very high	95.5	Very high	38 Å²	38	54.2 Å²	54.2	39%	0.392	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-56.6	-35	176.6	0	0	0	0	0	112.6	D188 A190 W194 G195	D188-G192 WeakPolarHBondContact O-CA 3.29Å; D188-G192 PolarHBondContact O-N 2.85Å; A190-G192 VanDerWaalsContact C-N 3.32Å; G192-W194 PolarHBondContact O-N 3.39Å; G192-G195 PolarHBondContact O-N 3.23Å
193	E	92.4	Very high	95.5	Very high	138 Å²	138	50.5 Å²	50.5	65%	0.645	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-63.1	-23.5	173.8	-65.3	-165.9	164.1	0	0	112.9	R144 T191 G195	R144-E193 WeakPolarHBondContact CD-O 3.45Å; R144-E193 PolarHBondContact NH1-O 3.36Å; T191-E193 PolarHBondContact O-N 3.47Å; E193-G195 VanDerWaalsContact C-N 3.35Å
194	W	94.2	Very high	95.4	Very high	51 Å²	51	56.7 Å²	56.7	19%	0.193	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-93.6	4.3	176.5	-52.4	-24.4	0	0	0	112.5	A140 A141 V145 A152 L155 T191 G192 I196	A140-W194 CarbonylContact C-O 3.56Å; A141-W194 WeakPolarHBondContact CA-O 3.2Å; A141-W194 WeakPolarHBondContact CB-O 3.27Å; A141-W194 PolarHBondContact N-O 2.99Å; V145-W194 HydrophobicContact CG2-CB 4.26Å; V145-W194 HydrophobicContact CG2-CD2 3.74Å; V145-W194 HydrophobicContact CG2-CG 3.47Å; V145-W194 VanDerWaalsContact CG2-CG 3.47Å; V145-W194 HydrophobicContact CG2-CZ2 4.44Å; V145-W194 VanDerWaalsContact CG2-NE1 3.29Å; A152-W194 HydrophobicContact CB-CZ3 4.3Å; L155-W194 HydrophobicContact CB-CH2 4.23Å; L155-W194 HydrophobicContact CB-CZ3 4.38Å; L155-W194 HydrophobicContact CD2-CH2 3.85Å; L155-W194 HydrophobicContact CD2-CZ3 3.93Å; T191-W194 HydrophobicContact CG2-CE3 4.23Å; T191-W194 HydrophobicContact CG2-CZ3 4.23Å; T191-W194 WeakPolarHBondContact O-CA 3.35Å; T191-W194 PolarHBondContact O-N 2.81Å; G192-W194 PolarHBondContact O-N 3.39Å; W194-I196 VanDerWaalsContact C-N 3.26Å; W194-I196 HydrophobicContact CB-CD1 4.31Å; W194-I196 HydrophobicContact CE3-CD1 4.5Å; W194-I196 PolarHBondContact O-N 3.04Å
195	G	93.4	Very high	95.2	Very high	4 Å²	4	60 Å²	60	4%	0.041	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	17.6	-176.1	0	0	0	0	0	113.9	I136 E137 T191 G192 E193	I136-G195 PolarHBondContact N-O 2.93Å; E137-G195 PolarHBondContact N-O 3.27Å; E137-G195 VanDerWaalsContact N-O 3.11Å; T191-G195 PolarHBondContact O-N 3.22Å; G192-G195 PolarHBondContact O-N 3.23Å; E193-G195 VanDerWaalsContact C-N 3.35Å
196	I	96.4	Very high	95.1	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.5	176.5	-70.8	163.5	0	0	0	108.9	M133 V135 A148 A152 T191 W194	M133-I196 HydrophobicContact CB-CG2 4.04Å; M133-I196 HydrophobicContact CE-CB 4.43Å; M133-I196 HydrophobicContact CE-CD1 3.76Å; M133-I196 HydrophobicContact CE-CG1 4.13Å; M133-I196 HydrophobicContact CE-CG2 3.46Å; M133-I196 VanDerWaalsContact CE-CG2 3.46Å; M133-I196 HydrophobicContact SD-CG2 4.26Å; V135-I196 HydrophobicContact CG2-CG1 4.39Å; A148-I196 HydrophobicContact CB-CD1 3.55Å; A148-I196 HydrophobicContact CB-CG1 4.46Å; A148-I196 WeakPolarHBondContact O-CD1 3.48Å; A152-I196 HydrophobicContact CB-CD1 4.13Å; T191-I196 CarbonylContact C-O 3.3Å; T191-I196 PolarHBondContact O-N 3.46Å; T191-I196 PolarHBondContact OG1-O 3.25Å; T191-I196 VanDerWaalsContact OG1-O 3.09Å; W194-I196 VanDerWaalsContact C-N 3.26Å; W194-I196 HydrophobicContact CB-CD1 4.31Å; W194-I196 HydrophobicContact CE3-CD1 4.5Å; W194-I196 PolarHBondContact O-N 3.04Å
197	K	96.8	Very high	95	Very high	77 Å²	77	55 Å²	55	34%	0.335	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.9	170.8	-178.5	79.4	-159.6	169.8	0	109.5	M133 R134 I136 D188	M133-K197 CarbonylContact C-O 3.52Å; M133-K197 WeakPolarHBondContact CA-O 3.41Å; M133-K197 WeakPolarHBondContact CB-O 3.35Å; R134-K197 HydrophobicContact CG-CB 4.43Å; R134-K197 PolarHBondContact N-O 3.22Å; R134-K197 PolarHBondContact O-N 3.06Å; I136-K197 HydrophobicContact CD1-CB 3.36Å; I136-K197 HydrophobicContact CD1-CD 3.95Å; I136-K197 HydrophobicContact CD1-CG 3.74Å; I136-K197 HydrophobicContact CG1-CB 3.68Å; D188-K197 VanDerWaalsContact CG-NZ 3.26Å; D188-K197 WeakPolarHBondContact OD1-CD 3.44Å; D188-K197 WeakPolarHBondContact OD1-CE 3.42Å; D188-K197 IonicContact OD1-NZ 3.63Å; D188-K197 PolarHBondContact OD1-NZ 3.39Å; D188-K197 IonicContact OD2-NZ 3.7Å; D188-K197 PolarHBondContact OD2-NZ 2.92Å
198	V	97.2	Very high	94.9	Very high	8 Å²	8	56 Å²	56	5%	0.048	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	119.7	169	-179.1	0	0	0	0	107.7	V131 M133 L187 D188 T191 V201	V131-V198 HydrophobicContact CG1-CG1 3.97Å; V131-V198 HydrophobicContact CG1-CG2 4.5Å; M133-V198 HydrophobicContact CB-CG2 4.46Å; L187-V198 HydrophobicContact CB-CG2 4.04Å; D188-V198 HydrophobicContact CB-CB 4.11Å; D188-V198 PolarHBondContact OD1-N 3.16Å; T191-V198 HydrophobicContact CG2-CG2 4.44Å; V198-V201 HydrophobicContact CG1-CG2 3.86Å
199	E	95.5	Very high	94.7	Very high	77 Å²	77	57.2 Å²	57.2	36%	0.36	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-43.8	-179.2	-62.9	-167.9	145.6	0	0	111.3	T107 F132 R134	T107-E199 WeakPolarHBondContact CB-OE2 3.34Å; T107-E199 WeakPolarHBondContact CG2-OE2 3.26Å; T107-E199 VanDerWaalsContact OG1-CD 3.31Å; T107-E199 PolarHBondContact OG1-OE1 2.91Å; T107-E199 PolarHBondContact OG1-OE2 2.88Å; F132-E199 HydrophobicContact CB-CB 4.49Å; F132-E199 PolarHBondContact O-N 3.34Å; R134-E199 WeakPolarHBondContact CD-OE1 3.29Å; R134-E199 IonicContact CZ-OE1 3.06Å; R134-E199 IonicContact NE-OE1 3.89Å; R134-E199 PolarHBondContact NE-OE1 3.02Å
200	R	95.4	Very high	94.5	Very high	118 Å²	118	55.6 Å²	55.6	45%	0.445	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	159.2	174	74.9	-171.2	93.2	116.7	2.5	110.8	F132 E202	F132-R200 HydrophobicContact CB-CG 3.95Å; F132-R200 HydrophobicContact CD2-CG 3.31Å; F132-R200 HydrophobicContact CE2-CG 4.04Å; F132-R200 HydrophobicContact CG-CG 3.89Å; F132-R200 PolarHBondContact N-O 2.91Å; F132-R200 PolarHBondContact O-N 3.1Å; R200-E202 WeakPolarHBondContact CD-OE1 2.85Å; R200-E202 HydrophobicContact CG-CG 4.49Å; R200-E202 IonicContact NH1-OE1 3.03Å
201	V	96.8	Very high	94.5	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.2	171.5	-178.4	0	0	0	0	106.6	V130 V131 D180 L183 A184 L187 V198	V130-V201 WeakPolarHBondContact O-CA 3.3Å; V131-V201 HydrophobicContact CG1-CG2 4.4Å; V131-V201 HydrophobicContact CG2-CG1 4.29Å; V131-V201 HydrophobicContact CG2-CG2 4.29Å; D180-V201 VanDerWaalsContact CB-O 3.27Å; D180-V201 WeakPolarHBondContact CB-O 3.33Å; L183-V201 HydrophobicContact CB-CB 4.23Å; L183-V201 HydrophobicContact CB-CG1 4.11Å; L183-V201 HydrophobicContact CB-CG2 4.39Å; L183-V201 HydrophobicContact CD1-CG1 4.2Å; A184-V201 HydrophobicContact CB-CG2 4.16Å; L187-V201 HydrophobicContact CD1-CG2 3.97Å; V198-V201 HydrophobicContact CG1-CG2 3.86Å
202	E	95.9	Very high	94.3	Very high	83 Å²	83	65.1 Å²	65.1	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.4	179.4	-67.7	176.3	-169.8	0	0	109.4	A129 V130 F132 R200 K204	A129-E202 CarbonylContact C-O 3.56Å; A129-E202 VanDerWaalsContact CA-O 3.3Å; A129-E202 WeakPolarHBondContact CA-O 3.02Å; V130-E202 PolarHBondContact N-O 3.45Å; V130-E202 PolarHBondContact O-N 2.86Å; F132-E202 HydrophobicContact CE2-CG 4.28Å; R200-E202 WeakPolarHBondContact CD-OE1 2.85Å; R200-E202 HydrophobicContact CG-CG 4.49Å; R200-E202 IonicContact NH1-OE1 3.03Å; E202-K204 PolarHBondContact O-N 2.98Å
203	I	95.6	Very high	94.3	Very high	13 Å²	13	68.6 Å²	68.6	7%	0.067	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	120.6	167.4	-65.6	159.2	0	0	0	108.6	V127 L164 I179 D180 V206	V127-I203 HydrophobicContact CG1-CG2 3.93Å; L164-I203 HydrophobicContact CD2-CD1 4.32Å; I179-I203 HydrophobicContact CB-CD1 4.14Å; I179-I203 HydrophobicContact CG2-CD1 3.81Å; D180-I203 WeakPolarHBondContact OD1-CG1 3.44Å; D180-I203 PolarHBondContact OD1-N 2.91Å; D180-I203 VanDerWaalsContact OD1-N 3.09Å; I203-V206 HydrophobicContact CG2-CG2 3.93Å
204	K	94.2	Very high	94.4	Very high	131 Å²	131	69.6 Å²	69.6	57%	0.57	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	-54.5	-175.9	172.6	169.6	164.1	-109.9	0	111.1	D128 V130 E202	D128-K204 PolarHBondContact O-N 3.37Å; D128-K204 VanDerWaalsContact OD1-CB 3.31Å; D128-K204 WeakPolarHBondContact OD1-CB 3.48Å; D128-K204 WeakPolarHBondContact OD2-CD 3.32Å; D128-K204 IonicContact OD2-NZ 3.63Å; D128-K204 PolarHBondContact OD2-NZ 3.23Å; V130-K204 HydrophobicContact CG2-CB 4.27Å; V130-K204 HydrophobicContact CG2-CD 4.04Å; E202-K204 PolarHBondContact O-N 2.98Å
205	D	93.9	Very high	94.4	Very high	87 Å²	87	70 Å²	70	47%	0.465	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	154	178.7	-167	27.3	0	0	0	112.5	V127 D128	V127-D205 WeakPolarHBondContact CA-O 3.37Å; D128-D205 PolarHBondContact N-O 2.83Å; D128-D205 WeakPolarHBondContact OD1-CA 3.18Å; D128-D205 VanDerWaalsContact OD1-CB 3.3Å; D128-D205 WeakPolarHBondContact OD1-CB 3.32Å; D128-D205 PolarHBondContact OD1-N 3.18Å
206	V	93.7	Very high	94.3	Very high	11 Å²	11	73.3 Å²	73.3	7%	0.067	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	101.3	174.9	-179.4	0	0	0	0	107.5	V125 G126 V127 L173 I203 L208	V125-V206 HydrophobicContact CB-CG1 4.3Å; V125-V206 HydrophobicContact CG1-CG1 4.5Å; G126-V206 CarbonylContact O-C 3.59Å; G126-V206 WeakPolarHBondContact O-CA 3.3Å; V127-V206 HydrophobicContact CG1-CG2 4.31Å; V127-V206 HydrophobicContact CG2-CG1 4.22Å; V127-V206 HydrophobicContact CG2-CG2 4.21Å; L173-V206 HydrophobicContact CD2-CB 4.46Å; L173-V206 HydrophobicContact CD2-CG1 4.41Å; I203-V206 HydrophobicContact CG2-CG2 3.93Å; V206-L208 HydrophobicContact CG1-CD1 4.49Å
207	S	93.4	Very high	94.2	Very high	69 Å²	69	76 Å²	76	48%	0.483	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.2	179.3	178.4	0	0	0	0	110.7	G126	G126-S207 PolarHBondContact N-O 3.47Å; G126-S207 PolarHBondContact O-N 3.18Å
208	L	93.3	Very high	94.1	Very high	25 Å²	25	75.3 Å²	75.3	13%	0.131	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-97.8	153.1	172.7	-62.6	88.8	0	0	0	110	V125 L169 V206 Q210 Q213 M216	V125-L208 HydrophobicContact CG1-CG 4.43Å; L169-L208 HydrophobicContact CD1-CD2 4.08Å; L169-L208 HydrophobicContact CD2-CD2 3.81Å; V206-L208 HydrophobicContact CG1-CD1 4.49Å; L208-Q210 PolarHBondContact O-N 3.09Å; L208-Q213 HydrophobicContact CB-CB 4.43Å; L208-M216 HydrophobicContact CD2-CE 4.09Å; L208-M216 HydrophobicContact CD2-SD 4.45Å
209	P	92.4	Very high	94	Very high	64 Å²	64	81.2 Å²	81.2	42%	0.416	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-53.9	135.5	168.6	-24.5	33.9	0	0	0	111.1	T124 E211 M212 Q213	T124-P209 WeakPolarHBondContact O-CD 3.27Å; P209-E211 PolarHBondContact O-N 3.11Å; P209-M212 HydrophobicContact CB-CB 4.5Å; P209-M212 PolarHBondContact O-N 3.02Å; P209-M212 VanDerWaalsContact O-N 3.1Å; P209-Q213 PolarHBondContact O-N 3.26Å
210	Q	92.6	Very high	93.9	Very high	121 Å²	121	79.6 Å²	79.6	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-58.4	-36.3	-172.2	-171.8	176.9	41.3	0	0	113	L208 R214	L208-Q210 PolarHBondContact O-N 3.09Å; Q210-R214 VanDerWaalsContact O-CG 3.31Å; Q210-R214 WeakPolarHBondContact O-CG 3.45Å; Q210-R214 PolarHBondContact O-N 2.87Å; Q210-R214 VanDerWaalsContact O-N 3.1Å
211	E	93.4	Very high	93.9	Very high	169 Å²	169	79.8 Å²	79.8	79%	0.79	42%	0.422	S	S	*	.	H	α-helix	trans	-63.2	-47.4	177.6	-63.1	-174	163.1	0	0	111.7	P209 R214 A215	P209-E211 PolarHBondContact O-N 3.11Å; E211-R214 PolarHBondContact O-N 3.09Å; E211-A215 PolarHBondContact O-N 3.48Å
212	M	91.3	Very high	93.9	Very high	72 Å²	72	82 Å²	82	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-66.3	-42	177.4	179.6	176.5	-79.8	0	0	111.6	V123 P209 R214 A215 M216	V123-M212 HydrophobicContact CG1-CE 3.96Å; V123-M212 HydrophobicContact CG1-SD 3.46Å; V123-M212 WeakPolarHBondContact CG1-SD 3.47Å; V123-M212 HydrophobicContact CG2-CE 4.18Å; V123-M212 HydrophobicContact CG2-SD 4.38Å; P209-M212 HydrophobicContact CB-CB 4.5Å; P209-M212 PolarHBondContact O-N 3.02Å; P209-M212 VanDerWaalsContact O-N 3.1Å; M212-R214 VanDerWaalsContact C-N 3.27Å; M212-R214 PolarHBondContact O-N 2.89Å; M212-A215 PolarHBondContact O-N 3.27Å; M212-M216 WeakPolarHBondContact O-CB 3.12Å; M212-M216 PolarHBondContact O-N 3.48Å
213	Q	92.6	Very high	93.9	Very high	112 Å²	112	81.1 Å²	81.1	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-58.2	-42.3	178	-170.9	-174.2	15.4	0	0	111.4	L208 P209 A217	L208-Q213 HydrophobicContact CB-CB 4.43Å; P209-Q213 PolarHBondContact O-N 3.26Å; Q213-A217 VanDerWaalsContact O-CB 3.27Å; Q213-A217 WeakPolarHBondContact O-CB 3.37Å; Q213-A217 PolarHBondContact O-N 3.04Å
214	R	95.1	Very high	93.9	Very high	159 Å²	159	88.9 Å²	88.9	60%	0.6	47%	0.47	S	S	*	.	H	α-helix	trans	-66.5	-44	176.3	-71.6	174.8	-176.2	176.5	4.8	112	Q210 E211 M212 A217 A218	Q210-R214 VanDerWaalsContact O-CG 3.31Å; Q210-R214 WeakPolarHBondContact O-CG 3.45Å; Q210-R214 PolarHBondContact O-N 2.87Å; Q210-R214 VanDerWaalsContact O-N 3.1Å; E211-R214 PolarHBondContact O-N 3.09Å; M212-R214 VanDerWaalsContact C-N 3.27Å; M212-R214 PolarHBondContact O-N 2.89Å; R214-A217 PolarHBondContact O-N 3.26Å; R214-A218 WeakPolarHBondContact O-CB 3.41Å; R214-A218 PolarHBondContact O-N 3.33Å
215	A	93.6	Very high	94.1	Very high	60 Å²	60	84.9 Å²	84.9	50%	0.496	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-47	177.5	0	0	0	0	0	111.7	E211 M212 A217 A218 E219	E211-A215 PolarHBondContact O-N 3.48Å; M212-A215 PolarHBondContact O-N 3.27Å; A215-A217 PolarHBondContact O-N 3.34Å; A215-A218 PolarHBondContact O-N 3.07Å; A215-E219 WeakPolarHBondContact O-CB 3.29Å; A215-E219 PolarHBondContact O-N 2.67Å
216	M	92.1	Very high	94.2	Very high	73 Å²	73	84.1 Å²	84.1	36%	0.36	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-40.9	177.9	-173.5	-177.8	-69.8	0	0	112.2	L169 L208 M212 A218 E219 A220	L169-M216 HydrophobicContact CD2-CE 3.46Å; L169-M216 VanDerWaalsContact CD2-CE 3.46Å; L208-M216 HydrophobicContact CD2-CE 4.09Å; L208-M216 HydrophobicContact CD2-SD 4.45Å; M212-M216 WeakPolarHBondContact O-CB 3.12Å; M212-M216 PolarHBondContact O-N 3.48Å; M216-A218 VanDerWaalsContact C-N 3.35Å; M216-E219 PolarHBondContact O-N 3.22Å; M216-A220 VanDerWaalsContact O-CB 3.23Å; M216-A220 WeakPolarHBondContact O-CB 3.37Å; M216-A220 PolarHBondContact O-N 2.89Å
217	A	93.6	Very high	94.3	Very high	59 Å²	59	89.9 Å²	89.9	49%	0.488	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-41	175.4	0	0	0	0	0	111.8	Q213 R214 A215 Q221	Q213-A217 VanDerWaalsContact O-CB 3.27Å; Q213-A217 WeakPolarHBondContact O-CB 3.37Å; Q213-A217 PolarHBondContact O-N 3.04Å; R214-A217 PolarHBondContact O-N 3.26Å; A215-A217 PolarHBondContact O-N 3.34Å; A217-Q221 VanDerWaalsContact O-CB 3.3Å; A217-Q221 WeakPolarHBondContact O-CB 3.45Å; A217-Q221 PolarHBondContact O-N 2.83Å
218	A	95.6	Very high	94.5	Very high	64 Å²	64	89.3 Å²	89.3	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.9	0	0	0	0	0	111.9	R214 A215 M216 Q221 A222	R214-A218 WeakPolarHBondContact O-CB 3.41Å; R214-A218 PolarHBondContact O-N 3.33Å; A215-A218 PolarHBondContact O-N 3.07Å; M216-A218 VanDerWaalsContact C-N 3.35Å; A218-Q221 PolarHBondContact O-N 3.26Å; A218-A222 WeakPolarHBondContact O-CB 3.39Å; A218-A222 PolarHBondContact O-N 3.19Å
219	E	94.8	Very high	94.7	Very high	132 Å²	132	95.7 Å²	95.7	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-61.7	-49.3	175.8	-174.1	-175.2	170.9	0	0	111.5	A215 M216 Q221 A222 V223	A215-E219 WeakPolarHBondContact O-CB 3.29Å; A215-E219 PolarHBondContact O-N 2.67Å; M216-E219 PolarHBondContact O-N 3.22Å; E219-Q221 VanDerWaalsContact C-N 3.28Å; E219-Q221 PolarHBondContact O-N 3.23Å; E219-A222 PolarHBondContact O-N 3.47Å; E219-A222 VanDerWaalsContact O-N 3.14Å; E219-V223 WeakPolarHBondContact O-CG2 3.37Å; E219-V223 PolarHBondContact O-N 3Å
220	A	93.6	Very high	94.9	Very high	43 Å²	43	97.5 Å²	97.5	36%	0.355	52%	0.523	S	S	.	.	H	α-helix	trans	-60.1	-39.3	178.8	0	0	0	0	0	111.9	M216 V223 R224	M216-A220 VanDerWaalsContact O-CB 3.23Å; M216-A220 WeakPolarHBondContact O-CB 3.37Å; M216-A220 PolarHBondContact O-N 2.89Å; A220-V223 PolarHBondContact O-N 3.47Å; A220-R224 WeakPolarHBondContact O-CB 3.32Å; A220-R224 VanDerWaalsContact O-CG 3.29Å; A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 3.04Å
221	Q	95	Very high	95.1	Very high	121 Å²	121	97.6 Å²	97.6	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-67.6	-40.1	176.8	-172.4	64.5	-1.9	0	0	111.9	A217 A218 E219 R224 A225	A217-Q221 VanDerWaalsContact O-CB 3.3Å; A217-Q221 WeakPolarHBondContact O-CB 3.45Å; A217-Q221 PolarHBondContact O-N 2.83Å; A218-Q221 PolarHBondContact O-N 3.26Å; E219-Q221 VanDerWaalsContact C-N 3.28Å; E219-Q221 PolarHBondContact O-N 3.23Å; Q221-R224 PolarHBondContact O-N 2.95Å; Q221-A225 WeakPolarHBondContact O-CB 3.28Å; Q221-A225 PolarHBondContact O-N 3.23Å
222	A	96.3	Very high	95.3	Very high	55 Å²	55	92 Å²	92	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-41.3	175.2	0	0	0	0	0	112.3	A218 E219 S226	A218-A222 WeakPolarHBondContact O-CB 3.39Å; A218-A222 PolarHBondContact O-N 3.19Å; E219-A222 PolarHBondContact O-N 3.47Å; E219-A222 VanDerWaalsContact O-N 3.14Å; A222-S226 WeakPolarHBondContact O-CB 3.23Å; A222-S226 PolarHBondContact O-N 2.69Å; A222-S226 PolarHBondContact O-OG 3Å
223	V	95.4	Very high	95.5	Very high	63 Å²	63	91.2 Å²	91.2	38%	0.382	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-43.5	176.1	172.3	0	0	0	0	111.1	E219 A220 S226 K227	E219-V223 WeakPolarHBondContact O-CG2 3.37Å; E219-V223 PolarHBondContact O-N 3Å; A220-V223 PolarHBondContact O-N 3.47Å; V223-S226 PolarHBondContact O-N 2.85Å; V223-K227 HydrophobicContact CG1-CD 4.12Å; V223-K227 HydrophobicContact CG1-CG 4.48Å; V223-K227 WeakPolarHBondContact O-CB 3.43Å; V223-K227 WeakPolarHBondContact O-CG 2.93Å; V223-K227 PolarHBondContact O-N 2.93Å
224	R	96.9	Very high	95.7	Very high	176 Å²	176	90.3 Å²	90.3	66%	0.664	51%	0.51	S	S	*	.	H	α-helix	trans	-62.6	-44.6	176.1	-76.8	176.3	-179.7	179.7	0.8	112	A220 Q221 S226 K227 A228	A220-R224 WeakPolarHBondContact O-CB 3.32Å; A220-R224 VanDerWaalsContact O-CG 3.29Å; A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 3.04Å; Q221-R224 PolarHBondContact O-N 2.95Å; R224-S226 VanDerWaalsContact C-N 3.35Å; R224-S226 PolarHBondContact O-N 3.12Å; R224-K227 PolarHBondContact O-N 3.2Å; R224-A228 WeakPolarHBondContact O-CB 3.49Å; R224-A228 PolarHBondContact O-N 2.94Å
225	A	97.2	Very high	95.8	Very high	47 Å²	47	84.4 Å²	84.4	39%	0.388	50%	0.498	S	S	.	.	H	α-helix	trans	-62.7	-41.8	177.5	0	0	0	0	0	111.9	Q221 A228 K229	Q221-A225 WeakPolarHBondContact O-CB 3.28Å; Q221-A225 PolarHBondContact O-N 3.23Å; A225-A228 PolarHBondContact O-N 3.27Å; A225-K229 WeakPolarHBondContact O-CG 3.27Å; A225-K229 PolarHBondContact O-N 2.98Å; A225-K229 VanDerWaalsContact O-N 3.14Å
226	S	96.2	Very high	95.9	Very high	72 Å²	72	87.9 Å²	87.9	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-44.2	176.2	-59.7	0	0	0	0	111.9	A222 V223 R224 A228 K229 V230	A222-S226 WeakPolarHBondContact O-CB 3.23Å; A222-S226 PolarHBondContact O-N 2.69Å; A222-S226 PolarHBondContact O-OG 3Å; V223-S226 PolarHBondContact O-N 2.85Å; R224-S226 VanDerWaalsContact C-N 3.35Å; R224-S226 PolarHBondContact O-N 3.12Å; S226-A228 PolarHBondContact O-N 3.1Å; S226-K229 PolarHBondContact O-N 2.91Å; S226-V230 WeakPolarHBondContact O-CG2 3.39Å; S226-V230 PolarHBondContact O-N 3.48Å; S226-V230 VanDerWaalsContact O-N 3.14Å
227	K	96.2	Very high	96.1	Very high	131 Å²	131	89.5 Å²	89.5	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-61.2	-42.4	175.2	-75.6	179.2	178	-177.9	0	112.1	V223 R224 K229 V230 I231	V223-K227 HydrophobicContact CG1-CD 4.12Å; V223-K227 HydrophobicContact CG1-CG 4.48Å; V223-K227 WeakPolarHBondContact O-CB 3.43Å; V223-K227 WeakPolarHBondContact O-CG 2.93Å; V223-K227 PolarHBondContact O-N 2.93Å; R224-K227 PolarHBondContact O-N 3.2Å; K227-K229 VanDerWaalsContact C-N 3.32Å; K227-K229 PolarHBondContact O-N 3.34Å; K227-V230 PolarHBondContact O-N 2.9Å; K227-I231 VanDerWaalsContact O-CG1 3.27Å; K227-I231 WeakPolarHBondContact O-CG1 3.26Å; K227-I231 PolarHBondContact O-N 3.48Å
228	A	97.1	Very high	96.3	Very high	57 Å²	57	91.9 Å²	91.9	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-40.9	177.1	0	0	0	0	0	112.1	R224 A225 S226 I231 A232	R224-A228 WeakPolarHBondContact O-CB 3.49Å; R224-A228 PolarHBondContact O-N 2.94Å; A225-A228 PolarHBondContact O-N 3.27Å; S226-A228 PolarHBondContact O-N 3.1Å; A228-I231 PolarHBondContact O-N 3.26Å; A228-A232 WeakPolarHBondContact O-CB 3.27Å; A228-A232 PolarHBondContact O-N 3.45Å
229	K	96.8	Very high	96.3	Very high	160 Å²	160	91.3 Å²	91.3	70%	0.696	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-42.4	175.5	-71.5	178.9	-178	-178.4	0	112.6	A225 S226 K227 A232 A233	A225-K229 WeakPolarHBondContact O-CG 3.27Å; A225-K229 PolarHBondContact O-N 2.98Å; A225-K229 VanDerWaalsContact O-N 3.14Å; S226-K229 PolarHBondContact O-N 2.91Å; K227-K229 VanDerWaalsContact C-N 3.32Å; K227-K229 PolarHBondContact O-N 3.34Å; K229-A232 PolarHBondContact O-N 3.02Å; K229-A233 PolarHBondContact O-N 3.21Å
230	V	97.2	Very high	96.3	Very high	102 Å²	102	88.4 Å²	88.4	62%	0.618	50%	0.504	S	S	*	.	H	α-helix	trans	-65.5	-43.8	177.5	174.2	0	0	0	0	111	S226 K227 A232 A233 Q234	S226-V230 WeakPolarHBondContact O-CG2 3.39Å; S226-V230 PolarHBondContact O-N 3.48Å; S226-V230 VanDerWaalsContact O-N 3.14Å; K227-V230 PolarHBondContact O-N 2.9Å; V230-A232 VanDerWaalsContact C-N 3.32Å; V230-A232 PolarHBondContact O-N 3.39Å; V230-A233 PolarHBondContact O-N 3.31Å; V230-Q234 WeakPolarHBondContact O-CB 3.37Å; V230-Q234 PolarHBondContact O-N 3.02Å
231	I	96.9	Very high	96.5	Very high	122 Å²	122	88.4 Å²	88.4	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-62.9	-40.2	177.3	-67.5	165.4	0	0	0	110.7	K227 A228 Q234 G235	K227-I231 VanDerWaalsContact O-CG1 3.27Å; K227-I231 WeakPolarHBondContact O-CG1 3.26Å; K227-I231 PolarHBondContact O-N 3.48Å; A228-I231 PolarHBondContact O-N 3.26Å; I231-Q234 PolarHBondContact O-N 3.42Å; I231-G235 PolarHBondContact O-N 3.44Å
232	A	97	Very high	96.5	Very high	53 Å²	53	87 Å²	87	44%	0.438	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-49.5	176	0	0	0	0	0	111.9	A228 K229 V230 Q234 G235 E236	A228-A232 WeakPolarHBondContact O-CB 3.27Å; A228-A232 PolarHBondContact O-N 3.45Å; K229-A232 PolarHBondContact O-N 3.02Å; V230-A232 VanDerWaalsContact C-N 3.32Å; V230-A232 PolarHBondContact O-N 3.39Å; A232-Q234 VanDerWaalsContact C-N 3.33Å; A232-Q234 PolarHBondContact O-N 3.08Å; A232-G235 PolarHBondContact O-N 3.43Å; A232-E236 WeakPolarHBondContact O-CG 3.18Å; A232-E236 PolarHBondContact O-N 2.84Å
233	A	96.4	Very high	96.4	Very high	55 Å²	55	90.3 Å²	90.3	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-38.3	177.7	0	0	0	0	0	112.6	K229 V230 E236 L237	K229-A233 PolarHBondContact O-N 3.21Å; V230-A233 PolarHBondContact O-N 3.31Å; A233-E236 PolarHBondContact O-N 2.85Å; A233-L237 PolarHBondContact O-N 2.83Å
234	Q	96.8	Very high	96.4	Very high	93 Å²	93	93.8 Å²	93.8	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-42.1	174.9	-177.5	60.1	27.3	0	0	111.5	V230 I231 A232 E236 L237 E238	V230-Q234 WeakPolarHBondContact O-CB 3.37Å; V230-Q234 PolarHBondContact O-N 3.02Å; I231-Q234 PolarHBondContact O-N 3.42Å; A232-Q234 VanDerWaalsContact C-N 3.33Å; A232-Q234 PolarHBondContact O-N 3.08Å; Q234-E236 VanDerWaalsContact C-N 3.33Å; Q234-E236 PolarHBondContact O-N 2.98Å; Q234-L237 WeakPolarHBondContact O-CB 3.47Å; Q234-L237 PolarHBondContact O-N 2.91Å; Q234-E238 PolarHBondContact NE2-OE1 3.08Å; Q234-E238 WeakPolarHBondContact O-CG 3.23Å; Q234-E238 PolarHBondContact O-N 3.47Å
235	G	97.2	Very high	96.2	Very high	34 Å²	34	91.3 Å²	91.3	35%	0.351	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-40	173.9	0	0	0	0	0	112.4	I231 A232 E238 A239	I231-G235 PolarHBondContact O-N 3.44Å; A232-G235 PolarHBondContact O-N 3.43Å; G235-E238 PolarHBondContact O-N 3.28Å; G235-A239 VanDerWaalsContact O-CB 3.24Å; G235-A239 WeakPolarHBondContact O-CB 3.45Å; G235-A239 PolarHBondContact O-N 3.06Å
236	E	96.4	Very high	95.9	Very high	134 Å²	134	91.2 Å²	91.2	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-41.2	173.6	-75	175	-175.8	0	0	112.1	A232 A233 Q234 S240	A232-E236 WeakPolarHBondContact O-CG 3.18Å; A232-E236 PolarHBondContact O-N 2.84Å; A233-E236 PolarHBondContact O-N 2.85Å; Q234-E236 VanDerWaalsContact C-N 3.33Å; Q234-E236 PolarHBondContact O-N 2.98Å; E236-S240 VanDerWaalsContact O-CB 3.25Å; E236-S240 WeakPolarHBondContact O-CB 3.44Å; E236-S240 PolarHBondContact O-N 3.18Å; E236-S240 PolarHBondContact O-OG 3Å
237	L	96.3	Very high	95.7	Very high	106 Å²	106	90.5 Å²	90.5	56%	0.555	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-45.8	176.1	178.4	63.5	0	0	0	111.9	A233 Q234 S240 S241	A233-L237 PolarHBondContact O-N 2.83Å; Q234-L237 WeakPolarHBondContact O-CB 3.47Å; Q234-L237 PolarHBondContact O-N 2.91Å; L237-S240 PolarHBondContact O-N 2.77Å; L237-S241 WeakPolarHBondContact O-CB 3.49Å; L237-S241 PolarHBondContact O-N 3.1Å
238	E	96.3	Very high	95.5	Very high	110 Å²	110	88.6 Å²	88.6	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-65.2	-42.5	178.6	-74	175.2	-163.6	0	0	112.1	Q234 G235 S241 T242	Q234-E238 PolarHBondContact NE2-OE1 3.08Å; Q234-E238 WeakPolarHBondContact O-CG 3.23Å; Q234-E238 PolarHBondContact O-N 3.47Å; G235-E238 PolarHBondContact O-N 3.28Å; E238-S241 PolarHBondContact O-N 2.74Å; E238-T242 PolarHBondContact O-N 2.93Å; E238-T242 PolarHBondContact O-OG1 3.13Å
239	A	96.1	Very high	95.1	Very high	51 Å²	51	91.3 Å²	91.3	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-47.8	172.9	0	0	0	0	0	110.8	G235 S241 T242 L243	G235-A239 VanDerWaalsContact O-CB 3.24Å; G235-A239 WeakPolarHBondContact O-CB 3.45Å; G235-A239 PolarHBondContact O-N 3.06Å; A239-S241 VanDerWaalsContact C-N 3.34Å; A239-S241 PolarHBondContact O-N 3.04Å; A239-T242 PolarHBondContact O-N 3.34Å; A239-L243 WeakPolarHBondContact O-CB 3.48Å; A239-L243 VanDerWaalsContact O-CG 3.28Å; A239-L243 WeakPolarHBondContact O-CG 3.27Å; A239-L243 PolarHBondContact O-N 3.33Å
240	S	95.6	Very high	94.7	Very high	71 Å²	71	85.9 Å²	85.9	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-40.6	178.3	-61.1	0	0	0	0	112.4	E236 L237 L243 R244	E236-S240 VanDerWaalsContact O-CB 3.25Å; E236-S240 WeakPolarHBondContact O-CB 3.44Å; E236-S240 PolarHBondContact O-N 3.18Å; E236-S240 PolarHBondContact O-OG 3Å; L237-S240 PolarHBondContact O-N 2.77Å; S240-L243 PolarHBondContact O-N 2.7Å; S240-R244 WeakPolarHBondContact O-CB 3.45Å; S240-R244 PolarHBondContact O-N 2.82Å
241	S	96.6	Very high	94.3	Very high	44 Å²	44	84.6 Å²	84.6	31%	0.308	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-42.7	176.4	-175.7	0	0	0	0	112.1	L237 E238 A239 R244 K245	L237-S241 WeakPolarHBondContact O-CB 3.49Å; L237-S241 PolarHBondContact O-N 3.1Å; E238-S241 PolarHBondContact O-N 2.74Å; A239-S241 VanDerWaalsContact C-N 3.34Å; A239-S241 PolarHBondContact O-N 3.04Å; S241-R244 PolarHBondContact O-N 3.2Å; S241-K245 WeakPolarHBondContact O-CG 3.34Å; S241-K245 PolarHBondContact O-N 3.2Å; S241-K245 VanDerWaalsContact O-N 3.13Å
242	T	95.9	Very high	93.9	Very high	92 Å²	92	87.9 Å²	87.9	56%	0.564	49%	0.487	S	S	*	.	H	α-helix	trans	-66.9	-43.6	177.3	-55.8	0	0	0	0	111.3	E238 A239 R244 K245 A246	E238-T242 PolarHBondContact O-N 2.93Å; E238-T242 PolarHBondContact O-OG1 3.13Å; A239-T242 PolarHBondContact O-N 3.34Å; T242-R244 VanDerWaalsContact C-N 3.35Å; T242-R244 PolarHBondContact O-N 3.23Å; T242-K245 PolarHBondContact O-N 2.98Å; T242-A246 PolarHBondContact O-N 3.34Å
243	L	93.8	Very high	93.4	Very high	123 Å²	123	87.8 Å²	87.8	64%	0.644	48%	0.483	S	S	*	.	H	α-helix	trans	-62.3	-40.4	175.9	-71.6	173.2	0	0	0	112.1	A239 S240 A246 A247	A239-L243 WeakPolarHBondContact O-CB 3.48Å; A239-L243 VanDerWaalsContact O-CG 3.28Å; A239-L243 WeakPolarHBondContact O-CG 3.27Å; A239-L243 PolarHBondContact O-N 3.33Å; S240-L243 PolarHBondContact O-N 2.7Å; L243-A246 PolarHBondContact O-N 3.12Å; L243-A247 WeakPolarHBondContact O-CB 3.39Å; L243-A247 PolarHBondContact O-N 3.36Å
244	R	95	Very high	92.8	Very high	136 Å²	136	89.7 Å²	89.7	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-60.1	-47.9	174.7	-177.3	-178.7	66.3	96.5	-5.6	111.8	S240 S241 T242 A246 A247 E248	S240-R244 WeakPolarHBondContact O-CB 3.45Å; S240-R244 PolarHBondContact O-N 2.82Å; S241-R244 PolarHBondContact O-N 3.2Å; T242-R244 VanDerWaalsContact C-N 3.35Å; T242-R244 PolarHBondContact O-N 3.23Å; R244-A246 VanDerWaalsContact C-N 3.33Å; R244-A246 PolarHBondContact O-N 2.9Å; R244-A247 PolarHBondContact O-N 2.89Å; R244-E248 WeakPolarHBondContact CG-OE1 3.47Å; R244-E248 IonicContact CZ-OE1 3.26Å; R244-E248 IonicContact NE-OE1 2.68Å; R244-E248 IonicContact NH1-OE1 3.25Å; R244-E248 PolarHBondContact NH1-OE1 2.85Å; R244-E248 IonicContact NH1-OE2 2.62Å; R244-E248 WeakPolarHBondContact O-CG 3.17Å; R244-E248 PolarHBondContact O-N 3.46Å
245	K	94.1	Very high	92.5	Very high	125 Å²	125	89.3 Å²	89.3	54%	0.543	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-41.9	177.4	-69.7	174.6	-175.5	177.7	0	111.9	S241 T242 A247 E248 E249	S241-K245 WeakPolarHBondContact O-CG 3.34Å; S241-K245 PolarHBondContact O-N 3.2Å; S241-K245 VanDerWaalsContact O-N 3.13Å; T242-K245 PolarHBondContact O-N 2.98Å; K245-A247 VanDerWaalsContact C-N 3.34Å; K245-E248 PolarHBondContact O-N 3.37Å; K245-E249 PolarHBondContact O-N 2.93Å
246	A	90.8	Very high	92	Very high	45 Å²	45	89.3 Å²	89.3	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-42.5	175.1	0	0	0	0	0	111.6	T242 L243 R244 E249 M250	T242-A246 PolarHBondContact O-N 3.34Å; L243-A246 PolarHBondContact O-N 3.12Å; R244-A246 VanDerWaalsContact C-N 3.33Å; R244-A246 PolarHBondContact O-N 2.9Å; A246-E249 PolarHBondContact O-N 2.88Å; A246-M250 WeakPolarHBondContact O-CB 3.4Å; A246-M250 WeakPolarHBondContact O-CG 3.36Å; A246-M250 PolarHBondContact O-N 3.32Å
247	A	90.7	Very high	91.6	Very high	57 Å²	57	87.7 Å²	87.7	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-41.5	176.8	0	0	0	0	0	112.4	L243 R244 K245 M250 A251	L243-A247 WeakPolarHBondContact O-CB 3.39Å; L243-A247 PolarHBondContact O-N 3.36Å; R244-A247 PolarHBondContact O-N 2.89Å; K245-A247 VanDerWaalsContact C-N 3.34Å; A247-M250 PolarHBondContact O-N 3.37Å; A247-A251 VanDerWaalsContact O-CB 3.31Å; A247-A251 WeakPolarHBondContact O-CB 3.37Å; A247-A251 PolarHBondContact O-N 2.75Å
248	E	93.2	Very high	91.2	Very high	91 Å²	91	88.5 Å²	88.5	43%	0.425	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-43.4	176	-74.8	170.2	-170.5	0	0	111.9	R244 K245 A251 R252	R244-E248 WeakPolarHBondContact CG-OE1 3.47Å; R244-E248 IonicContact CZ-OE1 3.26Å; R244-E248 IonicContact NE-OE1 2.68Å; R244-E248 IonicContact NH1-OE1 3.25Å; R244-E248 PolarHBondContact NH1-OE1 2.85Å; R244-E248 IonicContact NH1-OE2 2.62Å; R244-E248 WeakPolarHBondContact O-CG 3.17Å; R244-E248 PolarHBondContact O-N 3.46Å; K245-E248 PolarHBondContact O-N 3.37Å; E248-A251 PolarHBondContact O-N 3.2Å; E248-R252 PolarHBondContact O-N 3.34Å
249	E	88.6	Confident	90.9	Very high	113 Å²	113	88.1 Å²	88.1	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-68.9	-39.7	177.4	-170.8	60.6	-158.4	0	0	111.9	K245 A246 A251 R252	K245-E249 PolarHBondContact O-N 2.93Å; A246-E249 PolarHBondContact O-N 2.88Å; E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.89Å; E249-R252 WeakPolarHBondContact O-CB 3.5Å; E249-R252 PolarHBondContact O-N 2.9Å; E249-R252 IonicContact OE2-CZ 2.8Å; E249-R252 IonicContact OE2-NE 3.88Å; E249-R252 IonicContact OE2-NH1 2.81Å; E249-R252 PolarHBondContact OE2-NH1 3.32Å
250	M	88.5	Confident	90.6	Very high	47 Å²	47	92.1 Å²	92.1	23%	0.232	49%	0.493	C	S	.	.	H	α-helix	trans	-64.4	-35.8	173.1	-72.3	175.8	64.9	0	0	112.4	A246 A247 R252 S253 R260	A246-M250 WeakPolarHBondContact O-CB 3.4Å; A246-M250 WeakPolarHBondContact O-CG 3.36Å; A246-M250 PolarHBondContact O-N 3.32Å; A247-M250 PolarHBondContact O-N 3.37Å; M250-R252 VanDerWaalsContact C-N 3.27Å; M250-R252 PolarHBondContact O-N 3.19Å; M250-S253 CarbonylContact O-C 3.55Å; M250-S253 VanDerWaalsContact O-C 3.3Å; M250-S253 PolarHBondContact O-N 3.47Å; M250-S253 VanDerWaalsContact O-N 3.15Å; M250-R260 HydrophobicContact CE-CB 3.43Å; M250-R260 VanDerWaalsContact CE-CB 3.43Å; M250-R260 HydrophobicContact CE-CG 3.7Å
251	A	87.1	Confident	90.1	Very high	74 Å²	74	92.3 Å²	92.3	61%	0.612	48%	0.483	S	S	*	.	H	α-helix	trans	-67.5	-27.1	178.5	0	0	0	0	0	112.7	A247 E248 E249 S253	A247-A251 VanDerWaalsContact O-CB 3.31Å; A247-A251 WeakPolarHBondContact O-CB 3.37Å; A247-A251 PolarHBondContact O-N 2.75Å; E248-A251 PolarHBondContact O-N 3.2Å; E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.89Å; A251-S253 PolarHBondContact O-N 3.31Å
252	R	90	Very high	89.7	Confident	191 Å²	191	95.4 Å²	95.4	72%	0.721	50%	0.496	S	S	*	.	H	α-helix	trans	-65.9	-24.6	173.1	-67.6	175.1	-179.5	172.9	-6.9	112.8	E248 E249 M250	E248-R252 PolarHBondContact O-N 3.34Å; E249-R252 WeakPolarHBondContact O-CB 3.5Å; E249-R252 PolarHBondContact O-N 2.9Å; E249-R252 IonicContact OE2-CZ 2.8Å; E249-R252 IonicContact OE2-NE 3.88Å; E249-R252 IonicContact OE2-NH1 2.81Å; E249-R252 PolarHBondContact OE2-NH1 3.32Å; M250-R252 VanDerWaalsContact C-N 3.27Å; M250-R252 PolarHBondContact O-N 3.19Å
253	S	86.9	Confident	89.4	Confident	52 Å²	52	96.6 Å²	96.6	36%	0.364	50%	0.495	S	S	.	.			trans	-126.1	98.3	179.9	-177.8	0	0	0	0	111.1	M250 A251 T255 A256	M250-S253 CarbonylContact O-C 3.55Å; M250-S253 VanDerWaalsContact O-C 3.3Å; M250-S253 PolarHBondContact O-N 3.47Å; M250-S253 VanDerWaalsContact O-N 3.15Å; A251-S253 PolarHBondContact O-N 3.31Å; S253-T255 PolarHBondContact O-N 2.93Å; S253-A256 WeakPolarHBondContact O-CB 3.44Å; S253-A256 PolarHBondContact O-N 3.34Å
254	P	83	Confident	89.1	Confident	94 Å²	94	94 Å²	94	61%	0.61	48%	0.484	S	S	*	.	H	α-helix	trans	-52.3	-33.4	177.6	-27.3	34.4	0	0	0	113.5	A256 L257 Q258	P254-A256 PolarHBondContact O-N 2.9Å; P254-L257 PolarHBondContact O-N 2.97Å; P254-Q258 PolarHBondContact O-N 3.39Å
255	T	89.7	Confident	88.5	Confident	85 Å²	85	89.1 Å²	89.1	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-64.9	-35.2	176.5	-45.6	0	0	0	0	112.5	S253 L257 Q258 L259	S253-T255 PolarHBondContact O-N 2.93Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.49Å; T255-Q258 PolarHBondContact O-N 3.25Å; T255-L259 WeakPolarHBondContact O-CG 3.22Å; T255-L259 PolarHBondContact O-N 2.96Å
256	A	88.1	Confident	87.9	Confident	34 Å²	34	85.8 Å²	85.8	28%	0.281	46%	0.464	S	S	.	.	H	α-helix	trans	-65	-38.4	177.1	0	0	0	0	0	111.8	S253 P254 L259 R260	S253-A256 WeakPolarHBondContact O-CB 3.44Å; S253-A256 PolarHBondContact O-N 3.34Å; P254-A256 PolarHBondContact O-N 2.9Å; A256-L259 PolarHBondContact O-N 3.45Å; A256-R260 WeakPolarHBondContact O-CB 3.49Å; A256-R260 PolarHBondContact O-N 2.72Å
257	L	88	Confident	87.6	Confident	100 Å²	100	87.7 Å²	87.7	52%	0.524	47%	0.471	S	S	.	.	H	α-helix	trans	-66.2	-40.9	175.6	-166	150.3	0	0	0	111.4	P254 T255 R260 Y261	P254-L257 PolarHBondContact O-N 2.97Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.49Å; L257-R260 PolarHBondContact O-N 3.29Å; L257-Y261 WeakPolarHBondContact O-CB 3.49Å; L257-Y261 PolarHBondContact O-N 2.92Å
258	Q	86.8	Confident	87.1	Confident	123 Å²	123	87.9 Å²	87.9	58%	0.575	46%	0.463	S	S	*	.	H	α-helix	trans	-63.2	-44	174.1	-68.4	176.5	0.8	0	0	112.3	P254 T255 Y261 L262	P254-Q258 PolarHBondContact O-N 3.39Å; T255-Q258 PolarHBondContact O-N 3.25Å; Q258-Y261 WeakPolarHBondContact O-CB 3.31Å; Q258-Y261 PolarHBondContact O-N 2.96Å; Q258-L262 WeakPolarHBondContact O-CG 3.47Å; Q258-L262 PolarHBondContact O-N 3.42Å
259	L	90.9	Very high	86.3	Confident	103 Å²	103	86.4 Å²	86.4	54%	0.539	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-43.5	175	-71.3	174.4	0	0	0	111.6	T255 A256 Y261 L262 Q263	T255-L259 WeakPolarHBondContact O-CG 3.22Å; T255-L259 PolarHBondContact O-N 2.96Å; A256-L259 PolarHBondContact O-N 3.45Å; L259-Y261 VanDerWaalsContact C-N 3.33Å; L259-Y261 PolarHBondContact O-N 3.48Å; L259-L262 PolarHBondContact O-N 2.86Å; L259-Q263 WeakPolarHBondContact O-CG 3.21Å; L259-Q263 PolarHBondContact O-N 3.41Å
260	R	88.9	Confident	85.8	Confident	134 Å²	134	86.3 Å²	86.3	51%	0.506	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-44	174.1	178.1	66.1	117.5	-166.5	2.4	111.3	M250 A256 L257 Q263 T264	M250-R260 HydrophobicContact CE-CB 3.43Å; M250-R260 VanDerWaalsContact CE-CB 3.43Å; M250-R260 HydrophobicContact CE-CG 3.7Å; A256-R260 WeakPolarHBondContact O-CB 3.49Å; A256-R260 PolarHBondContact O-N 2.72Å; L257-R260 PolarHBondContact O-N 3.29Å; R260-Q263 WeakPolarHBondContact O-CB 3.49Å; R260-Q263 PolarHBondContact O-N 2.94Å; R260-T264 PolarHBondContact O-N 2.68Å; R260-T264 PolarHBondContact O-OG1 2.97Å; R260-T264 VanDerWaalsContact O-OG1 3.1Å
261	Y	85.8	Confident	85.3	Confident	76 Å²	76	90.7 Å²	90.7	30%	0.298	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-45.6	178.2	-177	-101.2	0	0	0	111.8	L257 Q258 L259 Q263 T264 L265 F278	L257-Y261 WeakPolarHBondContact O-CB 3.49Å; L257-Y261 PolarHBondContact O-N 2.92Å; Q258-Y261 WeakPolarHBondContact O-CB 3.31Å; Q258-Y261 PolarHBondContact O-N 2.96Å; L259-Y261 VanDerWaalsContact C-N 3.33Å; L259-Y261 PolarHBondContact O-N 3.48Å; Y261-Q263 PolarHBondContact O-N 3.39Å; Y261-T264 PolarHBondContact O-N 2.81Å; Y261-L265 HydrophobicContact CD1-CD1 3.78Å; Y261-L265 HydrophobicContact CD1-CG 4.42Å; Y261-L265 HydrophobicContact CE1-CD1 3.38Å; Y261-L265 HydrophobicContact CE1-CG 4.13Å; Y261-L265 WeakPolarHBondContact O-CG 3.47Å; Y261-L265 PolarHBondContact O-N 2.69Å; Y261-F278 AromaticContact CE1-CE2 3.61Å; Y261-F278 HydrophobicContact CE1-CE2 3.61Å; Y261-F278 AromaticContact CE1-CZ 3.63Å; Y261-F278 HydrophobicContact CE1-CZ 3.63Å; Y261-F278 AromaticContact CZ-CE2 3.81Å; Y261-F278 AromaticContact CZ-CZ 3.88Å; Y261-F278 WeakPolarHBondContact OH-CD2 3.33Å; Y261-F278 WeakPolarHBondContact OH-CE2 3.32Å; Y261-F278 WeakPolarHBondContact OH-CZ 3.31Å
262	L	89	Confident	84.5	Confident	109 Å²	109	96 Å²	96	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-39.4	174.7	-68.3	176.7	0	0	0	112.5	Q258 L259 L265 A266	Q258-L262 WeakPolarHBondContact O-CG 3.47Å; Q258-L262 PolarHBondContact O-N 3.42Å; L259-L262 PolarHBondContact O-N 2.86Å; L262-L265 HydrophobicContact CD2-CD1 4.49Å; L262-L265 PolarHBondContact O-N 2.74Å; L262-A266 PolarHBondContact O-N 3.06Å
263	Q	88.4	Confident	83.3	Confident	117 Å²	117	91.4 Å²	91.4	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-46.6	173.5	-75.8	179.5	-24	0	0	111.7	L259 R260 Y261 L265 A266 T267	L259-Q263 WeakPolarHBondContact O-CG 3.21Å; L259-Q263 PolarHBondContact O-N 3.41Å; R260-Q263 WeakPolarHBondContact O-CB 3.49Å; R260-Q263 PolarHBondContact O-N 2.94Å; Y261-Q263 PolarHBondContact O-N 3.39Å; Q263-L265 VanDerWaalsContact C-N 3.3Å; Q263-L265 PolarHBondContact O-N 2.83Å; Q263-A266 PolarHBondContact O-N 2.97Å; Q263-T267 PolarHBondContact O-N 3.46Å; Q263-T267 PolarHBondContact O-OG1 3.36Å; Q263-T267 VanDerWaalsContact O-OG1 3.12Å
264	T	86.7	Confident	82.2	Confident	67 Å²	67	94.7 Å²	94.7	41%	0.411	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-40.9	176.9	-61.9	0	0	0	0	111.2	R260 Y261 T267 I268	R260-T264 PolarHBondContact O-N 2.68Å; R260-T264 PolarHBondContact O-OG1 2.97Å; R260-T264 VanDerWaalsContact O-OG1 3.1Å; Y261-T264 PolarHBondContact O-N 2.81Å; T264-T267 PolarHBondContact O-N 3.49Å; T264-I268 HydrophobicContact CG2-CD1 3.81Å; T264-I268 HydrophobicContact CG2-CG1 4.43Å; T264-I268 VanDerWaalsContact O-CG1 3.24Å; T264-I268 WeakPolarHBondContact O-CG1 3.37Å; T264-I268 PolarHBondContact O-N 2.68Å
265	L	82.9	Confident	81.8	Confident	35 Å²	35	95.5 Å²	95.5	18%	0.183	52%	0.522	C	S	.	.	H	α-helix	trans	-61.7	-43	173.5	-76	174.2	0	0	0	112.6	Y261 L262 Q263 I268 A269 I276 F278	Y261-L265 HydrophobicContact CD1-CD1 3.78Å; Y261-L265 HydrophobicContact CD1-CG 4.42Å; Y261-L265 HydrophobicContact CE1-CD1 3.38Å; Y261-L265 HydrophobicContact CE1-CG 4.13Å; Y261-L265 WeakPolarHBondContact O-CG 3.47Å; Y261-L265 PolarHBondContact O-N 2.69Å; L262-L265 HydrophobicContact CD2-CD1 4.49Å; L262-L265 PolarHBondContact O-N 2.74Å; Q263-L265 VanDerWaalsContact C-N 3.3Å; Q263-L265 PolarHBondContact O-N 2.83Å; L265-I268 PolarHBondContact O-N 3.22Å; L265-A269 WeakPolarHBondContact O-CB 3.29Å; L265-A269 PolarHBondContact O-N 3Å; L265-I276 HydrophobicContact CD2-CG2 4.07Å; L265-F278 HydrophobicContact CD1-CD2 4.29Å; L265-F278 HydrophobicContact CD1-CE2 3.75Å; L265-F278 HydrophobicContact CD2-CD2 4.3Å
266	A	83	Confident	80.8	Confident	55 Å²	55	95.5 Å²	95.5	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-41.2	176.8	0	0	0	0	0	111.9	L262 Q263 A269 T270	L262-A266 PolarHBondContact O-N 3.06Å; Q263-A266 PolarHBondContact O-N 2.97Å; A266-A269 PolarHBondContact O-N 3.43Å; A266-T270 PolarHBondContact O-N 3.02Å; A266-T270 PolarHBondContact O-OG1 2.9Å
267	T	82.5	Confident	80.1	Confident	85 Å²	85	100 Å²	100	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-46.4	175.1	-54.6	0	0	0	0	111.5	Q263 T264 A269 T270 E271	Q263-T267 PolarHBondContact O-N 3.46Å; Q263-T267 PolarHBondContact O-OG1 3.36Å; Q263-T267 VanDerWaalsContact O-OG1 3.12Å; T264-T267 PolarHBondContact O-N 3.49Å; T267-A269 VanDerWaalsContact C-N 3.32Å; T267-A269 PolarHBondContact O-N 3.32Å; T267-T270 WeakPolarHBondContact O-CB 3.4Å; T267-T270 PolarHBondContact O-N 2.91Å; T267-E271 PolarHBondContact O-N 2.77Å; T267-E271 VanDerWaalsContact O-N 3.1Å
268	I	81	Confident	79.3	Confident	60 Å²	60	100 Å²	100	31%	0.308	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-41.4	177.4	-68.2	166.3	0	0	0	111	T264 L265 T270 E271 I276	T264-I268 HydrophobicContact CG2-CD1 3.81Å; T264-I268 HydrophobicContact CG2-CG1 4.43Å; T264-I268 VanDerWaalsContact O-CG1 3.24Å; T264-I268 WeakPolarHBondContact O-CG1 3.37Å; T264-I268 PolarHBondContact O-N 2.68Å; L265-I268 PolarHBondContact O-N 3.22Å; I268-T270 PolarHBondContact O-N 3.31Å; I268-E271 PolarHBondContact O-N 3.06Å; I268-I276 HydrophobicContact CG2-CG1 4.25Å
269	A	76.5	Confident	78.5	Confident	60 Å²	60	98.5 Å²	98.5	50%	0.496	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-28.8	176.1	0	0	0	0	0	112.6	L265 A266 T267 I276	L265-A269 WeakPolarHBondContact O-CB 3.29Å; L265-A269 PolarHBondContact O-N 3Å; A266-A269 PolarHBondContact O-N 3.43Å; T267-A269 VanDerWaalsContact C-N 3.32Å; T267-A269 PolarHBondContact O-N 3.32Å; A269-I276 HydrophobicContact CB-CD1 4.24Å
270	T	79	Confident	77.6	Confident	111 Å²	111	98.4 Å²	98.4	68%	0.681	54%	0.538	S	S	*	.	H	α-helix	trans	-75.6	-32.9	177.4	-52.7	0	0	0	0	112.3	A266 T267 I268 Q272	A266-T270 PolarHBondContact O-N 3.02Å; A266-T270 PolarHBondContact O-OG1 2.9Å; T267-T270 WeakPolarHBondContact O-CB 3.4Å; T267-T270 PolarHBondContact O-N 2.91Å; I268-T270 PolarHBondContact O-N 3.31Å; T270-Q272 PolarHBondContact O-N 2.8Å
271	E	77	Confident	76.7	Confident	139 Å²	139	95.2 Å²	95.2	65%	0.65	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	14.2	-179.5	-83.5	-166	165.4	0	0	115.4	T267 I268 N273	T267-E271 PolarHBondContact O-N 2.77Å; T267-E271 VanDerWaalsContact O-N 3.1Å; I268-E271 PolarHBondContact O-N 3.06Å; E271-N273 PolarHBondContact O-N 3.16Å
272	Q	70.4	Confident	76.2	Confident	185 Å²	185	97.4 Å²	97.4	86%	0.864	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.2	21.9	179.2	-55.6	-179.6	18.3	0	0	114.4	T270 S274	T270-Q272 PolarHBondContact O-N 2.8Å; Q272-S274 PolarHBondContact O-N 3.48Å
273	N	64.3	Low	75.3	Confident	96 Å²	96	99.5 Å²	99.5	51%	0.513	56%	0.557	S	S	.	*			trans	-69.8	121.1	174.2	-89	-29.4	0	0	0	110.3	E271 T275	E271-N273 PolarHBondContact O-N 3.16Å; N273-T275 PolarHBondContact O-N 2.84Å
274	S	63.4	Low	74.3	Confident	121 Å²	121	98.7 Å²	98.7	85%	0.846	56%	0.556	S	S	*	*	S	Bend	trans	-71.2	-9.1	-173.8	-176.7	0	0	0	0	115	Q272	Q272-S274 PolarHBondContact O-N 3.48Å
275	T	75.6	Confident	73.3	Confident	110 Å²	110	99.4 Å²	99.4	68%	0.675	56%	0.557	S	S	*	*			trans	-140.1	106.9	-175.9	-54.1	0	0	0	0	110.2	N273 V277	N273-T275 PolarHBondContact O-N 2.84Å; T275-V277 HydrophobicContact CG2-CG2 4.17Å
276	I	69.2	Low	72.5	Confident	86 Å²	86	103.3 Å²	103.3	44%	0.441	57%	0.574	S	S	.	*			trans	-93	106.3	172.2	-56.6	176.3	0	0	0	107.8	L265 I268 A269 F278	L265-I276 HydrophobicContact CD2-CG2 4.07Å; I268-I276 HydrophobicContact CG2-CG1 4.25Å; A269-I276 HydrophobicContact CB-CD1 4.24Å; I276-F278 PolarHBondContact O-N 2.74Å
277	V	73.3	Confident	71.8	Confident	127 Å²	127	104.5 Å²	104.5	77%	0.77	58%	0.579	S	S	*	*			trans	-82.3	104.7	172.8	-177.9	0	0	0	0	108	T275 P279	T275-V277 HydrophobicContact CG2-CG2 4.17Å; V277-P279 VanDerWaalsContact O-CD 3.25Å; V277-P279 WeakPolarHBondContact O-CD 3.48Å
278	F	70.2	Confident	71	Confident	102 Å²	102	108.3 Å²	108.3	45%	0.447	59%	0.589	S	S	.	*			trans	-88.5	112.4	179.2	-165.3	-79.9	0	0	0	110.2	Y261 L265 I276 L280	Y261-F278 AromaticContact CE1-CE2 3.61Å; Y261-F278 HydrophobicContact CE1-CE2 3.61Å; Y261-F278 AromaticContact CE1-CZ 3.63Å; Y261-F278 HydrophobicContact CE1-CZ 3.63Å; Y261-F278 AromaticContact CZ-CE2 3.81Å; Y261-F278 AromaticContact CZ-CZ 3.88Å; Y261-F278 WeakPolarHBondContact OH-CD2 3.33Å; Y261-F278 WeakPolarHBondContact OH-CE2 3.32Å; Y261-F278 WeakPolarHBondContact OH-CZ 3.31Å; L265-F278 HydrophobicContact CD1-CD2 4.29Å; L265-F278 HydrophobicContact CD1-CE2 3.75Å; L265-F278 HydrophobicContact CD2-CD2 4.3Å; I276-F278 PolarHBondContact O-N 2.74Å; F278-L280 HydrophobicContact CD1-CD2 3.71Å; F278-L280 HydrophobicContact CD1-CG 3.78Å; F278-L280 HydrophobicContact CE1-CD2 3.45Å; F278-L280 VanDerWaalsContact CE1-CD2 3.45Å; F278-L280 HydrophobicContact CE1-CG 4.05Å; F278-L280 PolarHBondContact O-N 3.18Å; F278-L280 VanDerWaalsContact O-N 3.14Å
279	P	71.5	Confident	70.3	Confident	90 Å²	90	111 Å²	111	58%	0.584	60%	0.603	S	S	*	*			trans	-74.4	104.4	172.6	29.5	-32.8	0	0	0	109.3	V277	V277-P279 VanDerWaalsContact O-CD 3.25Å; V277-P279 WeakPolarHBondContact O-CD 3.48Å
280	L	71.7	Confident	69.6	Low	101 Å²	101	111.9 Å²	111.9	53%	0.529	61%	0.606	S	S	.	*			trans	-79.9	129.2	167.4	-73.7	170.1	0	0	0	109.2	F278 I282 L285	F278-L280 HydrophobicContact CD1-CD2 3.71Å; F278-L280 HydrophobicContact CD1-CG 3.78Å; F278-L280 HydrophobicContact CE1-CD2 3.45Å; F278-L280 VanDerWaalsContact CE1-CD2 3.45Å; F278-L280 HydrophobicContact CE1-CG 4.05Å; F278-L280 PolarHBondContact O-N 3.18Å; F278-L280 VanDerWaalsContact O-N 3.14Å; L280-I282 PolarHBondContact O-N 3.45Å; L280-L285 HydrophobicContact CB-CD1 4.18Å
281	P	70	Confident	68.8	Low	68 Å²	68	114.6 Å²	114.6	44%	0.442	61%	0.608	S	S	.	*			trans	-53.5	131	170.1	-23	30.7	0	0	0	110.5	E283 L284 L285	P281-E283 PolarHBondContact O-N 2.82Å; P281-E283 VanDerWaalsContact O-N 3.11Å; P281-L284 HydrophobicContact CG-CD1 4.37Å; P281-L284 PolarHBondContact O-N 3.46Å; P281-L285 PolarHBondContact O-N 3.43Å
282	I	74.2	Confident	67.9	Low	121 Å²	121	117 Å²	117	62%	0.621	62%	0.617	S	S	*	*	H	α-helix	trans	-60.2	-24.8	178.6	-57.5	164.3	0	0	0	110.6	L280 L284 L285 Q286	L280-I282 PolarHBondContact O-N 3.45Å; I282-L284 VanDerWaalsContact C-N 3.33Å; I282-L284 PolarHBondContact O-N 3.16Å; I282-L285 CarbonylContact O-C 3.56Å; I282-L285 WeakPolarHBondContact O-CB 3.36Å; I282-L285 PolarHBondContact O-N 2.84Å; I282-L285 VanDerWaalsContact O-N 3.14Å; I282-Q286 HydrophobicContact CG2-CG 4.3Å; I282-Q286 WeakPolarHBondContact O-CG 3.24Å; I282-Q286 PolarHBondContact O-N 2.9Å
283	E	70.6	Confident	67.1	Low	154 Å²	154	116.7 Å²	116.7	72%	0.72	62%	0.615	S	S	*	*	H	α-helix	trans	-58.2	-40.7	173.4	-62	170.9	-175.1	0	0	112.8	P281 Q286 S287	P281-E283 PolarHBondContact O-N 2.82Å; P281-E283 VanDerWaalsContact O-N 3.11Å; E283-Q286 PolarHBondContact O-N 2.9Å; E283-S287 PolarHBondContact O-N 3.46Å
284	L	67.4	Low	66.4	Low	100 Å²	100	119 Å²	119	52%	0.524	65%	0.647	S	S	.	*	H	α-helix	trans	-68.8	-38.8	175.2	-68.3	179.2	0	0	0	111	P281 I282 Q286 S287 F288	P281-L284 HydrophobicContact CG-CD1 4.37Å; P281-L284 PolarHBondContact O-N 3.46Å; I282-L284 VanDerWaalsContact C-N 3.33Å; I282-L284 PolarHBondContact O-N 3.16Å; L284-Q286 VanDerWaalsContact C-N 3.33Å; L284-S287 PolarHBondContact O-N 2.91Å; L284-F288 PolarHBondContact O-N 3Å
285	L	66.2	Low	66.6	Low	82 Å²	82	118.9 Å²	118.9	43%	0.429	64%	0.637	S	S	.	*	H	α-helix	trans	-62.8	-40.5	174	-79	131	0	0	0	111.3	L280 P281 I282 F288 L289	L280-L285 HydrophobicContact CB-CD1 4.18Å; P281-L285 PolarHBondContact O-N 3.43Å; I282-L285 CarbonylContact O-C 3.56Å; I282-L285 WeakPolarHBondContact O-CB 3.36Å; I282-L285 PolarHBondContact O-N 2.84Å; I282-L285 VanDerWaalsContact O-N 3.14Å; L285-F288 PolarHBondContact O-N 3.41Å; L285-L289 WeakPolarHBondContact O-CB 3.23Å; L285-L289 WeakPolarHBondContact O-CD1 3.48Å; L285-L289 PolarHBondContact O-N 2.95Å
286	Q	66.5	Low	66.1	Low	117 Å²	117	119.3 Å²	119.3	55%	0.547	64%	0.635	S	S	.	*	H	α-helix	trans	-65.7	-42.6	177.7	-74.4	178.4	15	0	0	112.1	I282 E283 L284 F288 L289 S290	I282-Q286 HydrophobicContact CG2-CG 4.3Å; I282-Q286 WeakPolarHBondContact O-CG 3.24Å; I282-Q286 PolarHBondContact O-N 2.9Å; E283-Q286 PolarHBondContact O-N 2.9Å; L284-Q286 VanDerWaalsContact C-N 3.33Å; Q286-F288 PolarHBondContact O-N 3.34Å; Q286-L289 PolarHBondContact O-N 3.41Å; Q286-S290 VanDerWaalsContact O-CB 3.3Å; Q286-S290 WeakPolarHBondContact O-CB 3.35Å; Q286-S290 PolarHBondContact O-N 3.43Å; Q286-S290 PolarHBondContact O-OG 3.28Å; Q286-S290 VanDerWaalsContact O-OG 3.04Å
287	S	66.9	Low	66	Low	80 Å²	80	121.2 Å²	121.2	56%	0.559	65%	0.646	S	S	*	*	H	α-helix	trans	-55.4	-42.1	174.3	173.7	0	0	0	0	111.9	E283 L284 K291	E283-S287 PolarHBondContact O-N 3.46Å; L284-S287 PolarHBondContact O-N 2.91Å; S287-K291 PolarHBondContact O-N 3.13Å
288	F	66.9	Low	65.5	Low	165 Å²	165	120.8 Å²	120.8	72%	0.724	64%	0.639	S	S	*	*	H	α-helix	trans	-74.7	-39	177.4	-91.1	-87.3	0	0	0	113.6	L284 L285 Q286 K291	L284-F288 PolarHBondContact O-N 3Å; L285-F288 PolarHBondContact O-N 3.41Å; Q286-F288 PolarHBondContact O-N 3.34Å; F288-K291 PolarHBondContact O-N 3.19Å
289	L	65.3	Low	65.2	Low	116 Å²	116	122 Å²	122	61%	0.607	65%	0.651	S	S	*	*	H	α-helix	trans	-66.6	-43.5	177.4	-101.4	130.1	0	0	0	111.8	L285 Q286 K291 K292	L285-L289 WeakPolarHBondContact O-CB 3.23Å; L285-L289 WeakPolarHBondContact O-CD1 3.48Å; L285-L289 PolarHBondContact O-N 2.95Å; Q286-L289 PolarHBondContact O-N 3.41Å; L289-K291 VanDerWaalsContact C-N 3.25Å; L289-K291 PolarHBondContact O-N 3.47Å; L289-K292 PolarHBondContact O-N 2.88Å; L289-K292 VanDerWaalsContact O-N 3.16Å
290	S	62.2	Low	64.8	Low	79 Å²	79	124.1 Å²	124.1	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-63.6	-31.4	178.1	-64.6	0	0	0	0	112.2	Q286 K292 Q293	Q286-S290 VanDerWaalsContact O-CB 3.3Å; Q286-S290 WeakPolarHBondContact O-CB 3.35Å; Q286-S290 PolarHBondContact O-N 3.43Å; Q286-S290 PolarHBondContact O-OG 3.28Å; Q286-S290 VanDerWaalsContact O-OG 3.04Å; S290-K292 VanDerWaalsContact C-N 3.29Å; S290-K292 PolarHBondContact O-N 3.48Å; S290-Q293 PolarHBondContact O-N 3.04Å
291	K	62.2	Low	64.3	Low	167 Å²	167	125.8 Å²	125.8	73%	0.726	66%	0.664	S	S	*	*	H	α-helix	trans	-72.6	-18.3	177.9	-159.5	175.8	-176.3	-177.2	0	113.7	S287 F288 L289	S287-K291 PolarHBondContact O-N 3.13Å; F288-K291 PolarHBondContact O-N 3.19Å; L289-K291 VanDerWaalsContact C-N 3.25Å; L289-K291 PolarHBondContact O-N 3.47Å
292	K	57.2	Low	63.9	Low	191 Å²	191	130.2 Å²	130.2	83%	0.83	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-9.5	177.5	-158.6	176.1	179.6	-177.4	0	113.1	L289 S290	L289-K292 PolarHBondContact O-N 2.88Å; L289-K292 VanDerWaalsContact O-N 3.16Å; S290-K292 VanDerWaalsContact C-N 3.29Å; S290-K292 PolarHBondContact O-N 3.48Å
293	Q	55	Low	63	Low	177 Å²	177	131 Å²	131	83%	0.827	69%	0.686	S	S	*	*			trans	-98.4	1.3	178	-69.8	-171.2	-26.1	0	0	113.9	S290	S290-Q293 PolarHBondContact O-N 3.04Å
294	A	49.8	Very low	62.3	Low	144 Å²	144	128.9 Å²	128.9	100%	1.19	68%	0.683	S	S	*	*			trans	-113.4	0	169.4	0	0	0	0	0	109.6

Retrieved 294 of 294 residues in 101.2 ms (Link to these results)

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