A0A060WNQ7_ONCMY Loading...

Peroxisome assembly protein 12

Component of a retrotranslocation channel required for peroxisome organization by mediating export of the PEX5 receptor from peroxisomes to the cytosol, thereby promoting PEX5 recycling. The retrotranslocation channel is composed of PEX2, PEX10 and PEX12; each subunit contributing transmembrane segments that coassemble into an open channel that specifically allows the passage of PEX5 through the peroxisomal membrane. PEX12 also regulates PEX5 recycling by activating the E3 ubiquitin-protein ligase activity of PEX10. When PEX5 recycling is compromised, PEX12 stimulates PEX10-mediated polyubiquitination of PEX5, leading to its subsequent degradation.

AlphaFold DB , UniProt , Accession A0A060WNQ7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 350 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	41.5	Very low	38.9	Very low	239 Å²	239	126.9 Å²	126.9	100%	1.177	73%	0.73	S	S	*	*				0	-11.5	0	-74.1	-173.6	-168	0	0	114.1
2	A	40.2	Very low	39.1	Very low	92 Å²	92	122.3 Å²	122.3	76%	0.76	72%	0.719	S	S	*	*			trans	-81.8	-24.2	179.3	0	0	0	0	0	115	R4 G5	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 2.96Å; A2-G5 PolarHBondContact O-N 2.83Å
3	E	41	Very low	39.8	Very low	173 Å²	173	122 Å²	122	81%	0.808	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-24.3	-175.7	-65.9	176.3	165.8	0	0	113.8	G5	E3-G5 VanDerWaalsContact C-N 3.33Å
4	R	37.1	Very low	41.1	Very low	217 Å²	217	118.8 Å²	118.8	82%	0.819	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-14.1	176.2	-70.3	-176.7	179.4	155.6	0.1	113.4	A2	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 2.96Å
5	G	39.2	Very low	43.2	Very low	42 Å²	42	114.5 Å²	114.5	43%	0.433	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-32.7	176.3	0	0	0	0	0	113.2	A2 E3 H7 L8	A2-G5 PolarHBondContact O-N 2.83Å; E3-G5 VanDerWaalsContact C-N 3.33Å; G5-H7 VanDerWaalsContact C-N 3.28Å; G5-H7 PolarHBondContact O-N 3.14Å; G5-L8 PolarHBondContact O-N 3.27Å
6	A	37.2	Very low	45.6	Very low	67 Å²	67	115.8 Å²	115.8	55%	0.554	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-22.2	179.6	0	0	0	0	0	113.4	T9	A6-T9 PolarHBondContact O-OG1 3.26Å; A6-T9 VanDerWaalsContact O-OG1 3.05Å
7	H	34.1	Very low	47.9	Very low	143 Å²	143	109.1 Å²	109.1	66%	0.662	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-12.3	176.8	-79.5	-79.3	0	0	0	113.8	G5 A11	G5-H7 VanDerWaalsContact C-N 3.28Å; G5-H7 PolarHBondContact O-N 3.14Å; H7-A11 WeakPolarHBondContact O-CB 3.17Å
8	L	38.3	Very low	50.1	Low	136 Å²	136	105.5 Å²	105.5	71%	0.712	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-24.5	176.6	-72.1	168.8	0	0	0	112.8	G5	G5-L8 PolarHBondContact O-N 3.27Å
9	T	42.2	Very low	51.9	Low	125 Å²	125	101.7 Å²	101.7	77%	0.767	60%	0.595	S	S	*	*	S	Bend	trans	-78.1	-23.8	172.9	41.5	0	0	0	0	112.9	A6	A6-T9 PolarHBondContact O-OG1 3.26Å; A6-T9 VanDerWaalsContact O-OG1 3.05Å
10	A	41.7	Very low	53.6	Low	84 Å²	84	104.7 Å²	104.7	69%	0.694	60%	0.601	S	S	*	*	S	Bend	trans	-85.2	-9.7	177.2	0	0	0	0	0	113.9
11	A	35.6	Very low	55.2	Low	78 Å²	78	102.7 Å²	102.7	65%	0.645	59%	0.586	S	S	*	*			trans	-109.2	20.9	-169.6	0	0	0	0	0	114.7	H7	H7-A11 WeakPolarHBondContact O-CB 3.17Å
12	A	41	Very low	57.3	Low	72 Å²	72	91.3 Å²	91.3	60%	0.595	53%	0.53	S	S	*	.			trans	-101.5	102.8	162.6	0	0	0	0	0	108.1	D14	A12-D14 PolarHBondContact O-N 3.03Å
13	A	47.8	Very low	59.4	Low	118 Å²	118	90.6 Å²	90.6	98%	0.975	51%	0.513	S	S	*	.			trans	-67.4	53.6	171	0	0	0	0	0	111.6
14	D	58.2	Low	61.4	Low	77 Å²	77	83.7 Å²	83.7	41%	0.412	49%	0.486	S	S	.	.			trans	-122.5	116.2	-179.8	-147.6	-12.7	0	0	0	107.1	A12 R16	A12-D14 PolarHBondContact O-N 3.03Å; D14-R16 HydrophobicContact CB-CG 4.02Å; D14-R16 PolarHBondContact O-N 3.23Å; D14-R16 WeakPolarHBondContact OD2-CD 3.47Å; D14-R16 IonicContact OD2-CZ 2.88Å; D14-R16 IonicContact OD2-NE 2.76Å; D14-R16 PolarHBondContact OD2-NE 3.14Å; D14-R16 IonicContact OD2-NH1 3.96Å; D14-R16 IonicContact OD2-NH2 3.72Å; D14-R16 PolarHBondContact OD2-NH2 3.28Å
15	D	72.9	Confident	63.7	Low	54 Å²	54	73.6 Å²	73.6	29%	0.289	45%	0.448	S	S	.	.			trans	-68	18.4	-173	-162.8	47.2	0	0	0	112.9	R195 A197	D15-R195 IonicContact OD2-CZ 3.37Å; D15-R195 IonicContact OD2-NH1 3.19Å; D15-R195 PolarHBondContact OD2-NH1 3.45Å; D15-R195 IonicContact OD2-NH2 3.8Å; D15-R195 PolarHBondContact OD2-NH2 3.37Å; D15-A197 WeakPolarHBondContact O-CA 3.44Å
16	R	81.5	Confident	65.9	Low	135 Å²	135	74.9 Å²	74.9	51%	0.509	45%	0.445	S	S	.	.			trans	-106.6	131.9	-174.7	65.8	179.1	-179	-163	-18.3	110.6	D14 H198	D14-R16 HydrophobicContact CB-CG 4.02Å; D14-R16 PolarHBondContact O-N 3.23Å; D14-R16 WeakPolarHBondContact OD2-CD 3.47Å; D14-R16 IonicContact OD2-CZ 2.88Å; D14-R16 IonicContact OD2-NE 2.76Å; D14-R16 PolarHBondContact OD2-NE 3.14Å; D14-R16 IonicContact OD2-NH1 3.96Å; D14-R16 IonicContact OD2-NH2 3.72Å; D14-R16 PolarHBondContact OD2-NH2 3.28Å; R16-H198 PolarHBondContact O-CE1 3.32Å
17	P	85.6	Confident	68	Low	3 Å²	3	74.6 Å²	74.6	2%	0.019	44%	0.439	C	S	.	.			trans	-71.9	151.4	176.7	29.3	-34.5	0	0	0	112.3	V22 L88 Y177 L196	P17-V22 HydrophobicContact CB-CG2 4.17Å; P17-V22 HydrophobicContact CG-CG2 3.88Å; P17-L88 HydrophobicContact CB-CD1 4.46Å; P17-L88 HydrophobicContact CB-CD2 3.72Å; P17-L88 HydrophobicContact CG-CD2 4.38Å; P17-Y177 WeakPolarHBondContact CD-OH 3.25Å; P17-Y177 PolarHBondContact O-OH 3.4Å; P17-L196 WeakPolarHBondContact CD-O 3.49Å; P17-L196 HydrophobicContact CG-CB 3.79Å
18	S	86.1	Confident	70.3	Confident	44 Å²	44	69 Å²	69	31%	0.308	41%	0.414	S	S	.	.			trans	-65.4	150.8	173.8	72.3	0	0	0	0	110.6	F20 E21 V22	S18-F20 PolarHBondContact O-N 2.95Å; S18-E21 WeakPolarHBondContact CB-OE1 3.26Å; S18-E21 PolarHBondContact N-OE2 3.19Å; S18-E21 PolarHBondContact O-N 2.73Å; S18-E21 VanDerWaalsContact OG-CG 3.25Å; S18-E21 WeakPolarHBondContact OG-CG 3.2Å; S18-E21 PolarHBondContact OG-N 3.45Å; S18-E21 PolarHBondContact OG-OE1 2.81Å; S18-V22 WeakPolarHBondContact O-CG2 3.4Å; S18-V22 PolarHBondContact O-N 3.47Å; S18-V22 VanDerWaalsContact O-N 3.17Å
19	I	85.3	Confident	72.3	Confident	33 Å²	33	64.9 Å²	64.9	17%	0.169	39%	0.391	C	S	.	.	H	α-helix	trans	-60.4	-31.4	176.9	-172.7	58.5	0	0	0	111.5	V22 L23 Y177 V178	I19-V22 PolarHBondContact O-N 3.05Å; I19-L23 HydrophobicContact CD1-CG 4.33Å; I19-L23 HydrophobicContact CG1-CD1 4.02Å; I19-L23 HydrophobicContact CG1-CG 4.3Å; I19-L23 WeakPolarHBondContact O-CB 3.37Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.18Å; I19-L23 PolarHBondContact O-N 3.28Å; I19-Y177 HydrophobicContact CD1-CD1 4.1Å; I19-V178 HydrophobicContact CB-CG2 4.08Å; I19-V178 HydrophobicContact CG1-CG2 3.94Å; I19-V178 HydrophobicContact CG2-CG2 4.17Å
20	F	86.1	Confident	74	Confident	161 Å²	161	61.3 Å²	61.3	71%	0.706	38%	0.38	S	S	*	.	H	α-helix	trans	-68.8	-39.5	178	-61.6	-68.2	0	0	0	112.3	S18 V22 L23 A24	S18-F20 PolarHBondContact O-N 2.95Å; F20-V22 VanDerWaalsContact C-N 3.35Å; F20-L23 PolarHBondContact O-N 3.01Å; F20-A24 VanDerWaalsContact O-CB 3.23Å; F20-A24 WeakPolarHBondContact O-CB 3.45Å; F20-A24 PolarHBondContact O-N 3.18Å
21	E	85.7	Confident	75.9	Confident	64 Å²	64	58.4 Å²	58.4	30%	0.299	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-43.9	173.3	-77.3	153.7	-133.9	0	0	111.6	S18 A24 Q25 H198	S18-E21 WeakPolarHBondContact CB-OE1 3.26Å; S18-E21 PolarHBondContact N-OE2 3.19Å; S18-E21 PolarHBondContact O-N 2.73Å; S18-E21 VanDerWaalsContact OG-CG 3.25Å; S18-E21 WeakPolarHBondContact OG-CG 3.2Å; S18-E21 PolarHBondContact OG-N 3.45Å; S18-E21 PolarHBondContact OG-OE1 2.81Å; E21-A24 PolarHBondContact O-N 3.2Å; E21-Q25 WeakPolarHBondContact O-CB 3.27Å; E21-Q25 PolarHBondContact O-N 2.98Å; E21-H198 IonicContact OE2-CD2 3.95Å; E21-H198 IonicContact OE2-CE1 3.71Å; E21-H198 IonicContact OE2-NE2 2.64Å; E21-H198 PolarHBondContact OE2-NE2 3.31Å
22	V	86.3	Confident	78.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-46.7	177	168.7	0	0	0	0	111.2	P17 S18 I19 F20 Q25 D26 H185 L196	P17-V22 HydrophobicContact CB-CG2 4.17Å; P17-V22 HydrophobicContact CG-CG2 3.88Å; S18-V22 WeakPolarHBondContact O-CG2 3.4Å; S18-V22 PolarHBondContact O-N 3.47Å; S18-V22 VanDerWaalsContact O-N 3.17Å; I19-V22 PolarHBondContact O-N 3.05Å; F20-V22 VanDerWaalsContact C-N 3.35Å; V22-Q25 WeakPolarHBondContact O-CB 3.37Å; V22-Q25 PolarHBondContact O-N 3.31Å; V22-D26 PolarHBondContact O-N 3.02Å; V22-D26 VanDerWaalsContact O-N 3.11Å; V22-H185 HydrophobicContact CG1-CB 4.05Å; V22-H185 WeakPolarHBondContact CG1-CD2 3.07Å; V22-H185 VanDerWaalsContact CG1-CE1 3.43Å; V22-H185 WeakPolarHBondContact CG1-CE1 3.49Å; V22-H185 WeakPolarHBondContact CG1-ND1 3.46Å; V22-H185 WeakPolarHBondContact CG1-NE2 3.47Å; V22-L196 HydrophobicContact CG2-CD1 4.23Å
23	L	85.2	Confident	80.1	Confident	77 Å²	77	56.5 Å²	56.5	40%	0.403	32%	0.321	S	S	.	.	H	α-helix	trans	-68.2	-36.9	179.1	-71.8	173.1	0	0	0	112	I19 F20 Q25 D26 S27	I19-L23 HydrophobicContact CD1-CG 4.33Å; I19-L23 HydrophobicContact CG1-CD1 4.02Å; I19-L23 HydrophobicContact CG1-CG 4.3Å; I19-L23 WeakPolarHBondContact O-CB 3.37Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.18Å; I19-L23 PolarHBondContact O-N 3.28Å; F20-L23 PolarHBondContact O-N 3.01Å; L23-Q25 VanDerWaalsContact C-N 3.34Å; L23-D26 PolarHBondContact O-N 3.37Å; L23-S27 WeakPolarHBondContact O-CB 3.37Å; L23-S27 PolarHBondContact O-N 3.4Å
24	A	81.4	Confident	81.8	Confident	28 Å²	28	53.4 Å²	53.4	23%	0.231	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-46	175.3	0	0	0	0	0	110.8	F20 E21 D26 S27 L28 Y86	F20-A24 VanDerWaalsContact O-CB 3.23Å; F20-A24 WeakPolarHBondContact O-CB 3.45Å; F20-A24 PolarHBondContact O-N 3.18Å; E21-A24 PolarHBondContact O-N 3.2Å; A24-D26 PolarHBondContact O-N 3.44Å; A24-S27 PolarHBondContact O-N 3.06Å; A24-S27 PolarHBondContact O-OG 3.45Å; A24-L28 PolarHBondContact O-N 3.44Å; A24-L28 VanDerWaalsContact O-N 3.11Å; A24-Y86 HydrophobicContact CB-CD1 4.43Å; A24-Y86 HydrophobicContact CB-CE1 3.7Å; A24-Y86 HydrophobicContact CB-CE2 4.5Å
25	Q	86.1	Confident	83	Confident	4 Å²	4	52 Å²	52	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-46.9	174.5	177.1	-146.9	-66.3	0	0	112.9	E21 V22 L23 S27 L28 M29 S82 E83 Y86	E21-Q25 WeakPolarHBondContact O-CB 3.27Å; E21-Q25 PolarHBondContact O-N 2.98Å; V22-Q25 WeakPolarHBondContact O-CB 3.37Å; V22-Q25 PolarHBondContact O-N 3.31Å; L23-Q25 VanDerWaalsContact C-N 3.34Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; Q25-L28 PolarHBondContact O-N 3.4Å; Q25-M29 PolarHBondContact O-N 3.41Å; Q25-S82 VanDerWaalsContact CG-OG 3.3Å; Q25-S82 WeakPolarHBondContact CG-OG 3.43Å; Q25-E83 HydrophobicContact CG-CG 4.25Å; Q25-Y86 VanDerWaalsContact CA-CE2 3.46Å; Q25-Y86 HydrophobicContact CB-CD2 3.72Å; Q25-Y86 HydrophobicContact CB-CE2 4.17Å; Q25-Y86 HydrophobicContact CB-CG 4.36Å; Q25-Y86 HydrophobicContact CG-CD2 4.27Å
26	D	84.8	Confident	83.5	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-67.5	-36.5	180	-77.5	-7.8	0	0	0	111.7	V22 L23 A24 L28 M29 G30	V22-D26 PolarHBondContact O-N 3.02Å; V22-D26 VanDerWaalsContact O-N 3.11Å; L23-D26 PolarHBondContact O-N 3.37Å; A24-D26 PolarHBondContact O-N 3.44Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.48Å; D26-M29 PolarHBondContact O-N 2.98Å; D26-G30 PolarHBondContact O-N 3.48Å; D26-G30 VanDerWaalsContact O-N 3.12Å
27	S	83.2	Confident	83.8	Confident	60 Å²	60	50.9 Å²	50.9	42%	0.42	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-38.7	176.4	80.3	0	0	0	0	112.5	L23 A24 Q25 M29 G30 A31	L23-S27 WeakPolarHBondContact O-CB 3.37Å; L23-S27 PolarHBondContact O-N 3.4Å; A24-S27 PolarHBondContact O-N 3.06Å; A24-S27 PolarHBondContact O-OG 3.45Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; S27-M29 VanDerWaalsContact C-N 3.31Å; S27-M29 PolarHBondContact O-N 3.49Å; S27-G30 PolarHBondContact O-N 3.3Å; S27-A31 PolarHBondContact O-N 3.24Å
28	L	81.3	Confident	83.8	Confident	27 Å²	27	56.5 Å²	56.5	14%	0.141	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-43.6	177.8	179.5	63.9	0	0	0	110.5	A24 Q25 D26 G30 A31 V32 F85 Y86	A24-L28 PolarHBondContact O-N 3.44Å; A24-L28 VanDerWaalsContact O-N 3.11Å; Q25-L28 PolarHBondContact O-N 3.4Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.48Å; L28-G30 VanDerWaalsContact C-N 3.33Å; L28-G30 PolarHBondContact O-N 3.29Å; L28-A31 PolarHBondContact O-N 3.24Å; L28-V32 WeakPolarHBondContact O-CG2 3.42Å; L28-V32 PolarHBondContact O-N 3.08Å; L28-F85 HydrophobicContact CD2-CB 4.34Å; L28-F85 HydrophobicContact CD2-CD1 3.88Å; L28-F85 HydrophobicContact CD2-CE1 4.43Å; L28-F85 HydrophobicContact CD2-CG 4.14Å; L28-Y86 HydrophobicContact CB-CE2 4.25Å; L28-Y86 HydrophobicContact CD2-CE2 3.98Å
29	M	80.9	Confident	83.8	Confident	48 Å²	48	56.5 Å²	56.5	24%	0.236	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-33.4	178.2	-71.9	-49.1	-31.1	0	0	113.5	Q25 D26 S27 A31 V32 F81 S82	Q25-M29 PolarHBondContact O-N 3.41Å; D26-M29 PolarHBondContact O-N 2.98Å; S27-M29 VanDerWaalsContact C-N 3.31Å; S27-M29 PolarHBondContact O-N 3.49Å; M29-A31 VanDerWaalsContact C-N 3.33Å; M29-V32 HydrophobicContact CE-CB 4.33Å; M29-V32 HydrophobicContact CE-CG2 4.48Å; M29-F81 HydrophobicContact SD-CD1 3.88Å; M29-S82 WeakPolarHBondContact CG-OG 3.35Å
30	G	78.3	Confident	84	Confident	51 Å²	51	55.8 Å²	55.8	53%	0.526	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-38.2	172.4	0	0	0	0	0	113.2	D26 S27 L28 P34	D26-G30 PolarHBondContact O-N 3.48Å; D26-G30 VanDerWaalsContact O-N 3.12Å; S27-G30 PolarHBondContact O-N 3.3Å; L28-G30 VanDerWaalsContact C-N 3.33Å; L28-G30 PolarHBondContact O-N 3.29Å; G30-P34 WeakPolarHBondContact O-CD 3.46Å
31	A	80.1	Confident	84.1	Confident	22 Å²	22	52.2 Å²	52.2	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-80.4	-28.8	-175.7	0	0	0	0	0	114.5	S27 L28 M29 R33 P34 A35	S27-A31 PolarHBondContact O-N 3.24Å; L28-A31 PolarHBondContact O-N 3.24Å; M29-A31 VanDerWaalsContact C-N 3.33Å; A31-R33 VanDerWaalsContact C-N 3.33Å; A31-R33 PolarHBondContact O-N 3.06Å; A31-P34 VanDerWaalsContact O-CD 3.23Å; A31-P34 WeakPolarHBondContact O-CD 3.03Å; A31-P34 VanDerWaalsContact O-CG 3.3Å; A31-P34 WeakPolarHBondContact O-CG 3.38Å; A31-A35 WeakPolarHBondContact O-CB 3.49Å; A31-A35 PolarHBondContact O-N 3.42Å
32	V	82.1	Confident	84.4	Confident	42 Å²	42	52.6 Å²	52.6	26%	0.255	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-42	-177.7	167.5	0	0	0	0	112.1	L28 M29 L36	L28-V32 WeakPolarHBondContact O-CG2 3.42Å; L28-V32 PolarHBondContact O-N 3.08Å; M29-V32 HydrophobicContact CE-CB 4.33Å; M29-V32 HydrophobicContact CE-CG2 4.48Å; V32-L36 HydrophobicContact CG1-CD1 3.7Å; V32-L36 HydrophobicContact CG1-CG 4.28Å; V32-L36 WeakPolarHBondContact O-CB 3.2Å; V32-L36 WeakPolarHBondContact O-CG 3.44Å; V32-L36 PolarHBondContact O-N 2.86Å
33	R	83	Confident	84.5	Confident	68 Å²	68	56 Å²	56	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-53.3	-177.6	-175.2	178.1	-178.5	-173.7	0.7	113.7	A31 A35 L36 R37 F58 D59	A31-R33 VanDerWaalsContact C-N 3.33Å; A31-R33 PolarHBondContact O-N 3.06Å; R33-A35 VanDerWaalsContact C-N 3.33Å; R33-A35 PolarHBondContact O-N 3.41Å; R33-L36 PolarHBondContact O-N 2.68Å; R33-R37 WeakPolarHBondContact O-CB 3.4Å; R33-R37 PolarHBondContact O-N 3.12Å; R33-F58 HydrophobicContact CG-CE1 4.47Å; R33-D59 IonicContact CZ-OD1 3.78Å; R33-D59 IonicContact NE-OD1 2.71Å; R33-D59 IonicContact NH2-OD1 2.72Å; R33-D59 PolarHBondContact NH2-OD1 2.79Å
34	P	83.4	Confident	84.8	Confident	53 Å²	53	53 Å²	53	34%	0.344	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-37.1	177.6	23	-32.1	0	0	0	112.3	G30 A31 R37 H38	G30-P34 WeakPolarHBondContact O-CD 3.46Å; A31-P34 VanDerWaalsContact O-CD 3.23Å; A31-P34 WeakPolarHBondContact O-CD 3.03Å; A31-P34 VanDerWaalsContact O-CG 3.3Å; A31-P34 WeakPolarHBondContact O-CG 3.38Å; P34-R37 WeakPolarHBondContact O-CB 3.44Å; P34-R37 PolarHBondContact O-N 3.3Å; P34-H38 PolarHBondContact O-N 3.41Å
35	A	83.8	Confident	85.2	Confident	47 Å²	47	57.9 Å²	57.9	39%	0.388	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-49.4	176.1	0	0	0	0	0	112.1	A31 R33 R37 H38 A39	A31-A35 WeakPolarHBondContact O-CB 3.49Å; A31-A35 PolarHBondContact O-N 3.42Å; R33-A35 VanDerWaalsContact C-N 3.33Å; R33-A35 PolarHBondContact O-N 3.41Å; A35-R37 VanDerWaalsContact C-N 3.29Å; A35-R37 PolarHBondContact O-N 3.06Å; A35-H38 PolarHBondContact O-N 2.89Å; A35-A39 PolarHBondContact O-N 3.38Å
36	L	83.7	Confident	85.5	Confident	70 Å²	70	61 Å²	61	37%	0.366	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-39.1	175.2	-75	174.2	0	0	0	111.7	V32 R33 H38 A39 V40 F58	V32-L36 HydrophobicContact CG1-CD1 3.7Å; V32-L36 HydrophobicContact CG1-CG 4.28Å; V32-L36 WeakPolarHBondContact O-CB 3.2Å; V32-L36 WeakPolarHBondContact O-CG 3.44Å; V32-L36 PolarHBondContact O-N 2.86Å; R33-L36 PolarHBondContact O-N 2.68Å; L36-H38 VanDerWaalsContact C-N 3.35Å; L36-H38 PolarHBondContact O-N 2.86Å; L36-A39 PolarHBondContact O-N 2.92Å; L36-V40 VanDerWaalsContact O-CG2 3.3Å; L36-V40 WeakPolarHBondContact O-CG2 3.4Å; L36-V40 PolarHBondContact O-N 2.72Å; L36-F58 HydrophobicContact CB-CE2 4.15Å; L36-F58 HydrophobicContact CB-CZ 4.05Å
37	R	87.2	Confident	85.8	Confident	96 Å²	96	61.4 Å²	61.4	36%	0.362	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-44.7	177.1	-167.9	174	-176.6	122.2	-1.8	110.8	R33 P34 A35 V40 K41 W55 F58 D59	R33-R37 WeakPolarHBondContact O-CB 3.4Å; R33-R37 PolarHBondContact O-N 3.12Å; P34-R37 WeakPolarHBondContact O-CB 3.44Å; P34-R37 PolarHBondContact O-N 3.3Å; A35-R37 VanDerWaalsContact C-N 3.29Å; A35-R37 PolarHBondContact O-N 3.06Å; R37-V40 PolarHBondContact O-N 3.23Å; R37-K41 WeakPolarHBondContact O-CB 3.46Å; R37-K41 PolarHBondContact O-N 3.03Å; R37-W55 HydrophobicContact CG-CH2 4.2Å; R37-W55 HydrophobicContact CG-CZ3 3.79Å; R37-W55 WeakPolarHBondContact O-CZ3 3.32Å; R37-F58 HydrophobicContact CB-CD1 4.32Å; R37-F58 HydrophobicContact CB-CE1 3.62Å; R37-F58 HydrophobicContact CB-CE2 4.19Å; R37-F58 HydrophobicContact CB-CZ 3.54Å; R37-F58 HydrophobicContact CG-CD1 4.05Å; R37-F58 HydrophobicContact CG-CE1 3.83Å; R37-F58 HydrophobicContact CG-CZ 4.16Å; R37-F58 VanDerWaalsContact N-CZ 3.33Å; R37-D59 IonicContact NH1-OD1 3.24Å; R37-D59 PolarHBondContact NH1-OD1 3.03Å; R37-D59 IonicContact NH1-OD2 3.78Å
38	H	86.7	Confident	86.1	Confident	121 Å²	121	63 Å²	63	56%	0.56	36%	0.358	S	S	*	.	H	α-helix	trans	-64.6	-43.9	177.7	-167.2	76.8	0	0	0	111.8	P34 A35 L36 V40 K41 V42	P34-H38 PolarHBondContact O-N 3.41Å; A35-H38 PolarHBondContact O-N 2.89Å; L36-H38 VanDerWaalsContact C-N 3.35Å; L36-H38 PolarHBondContact O-N 2.86Å; H38-V40 PolarHBondContact O-N 3.02Å; H38-K41 VanDerWaalsContact O-CB 3.29Å; H38-K41 WeakPolarHBondContact O-CB 3.34Å; H38-K41 PolarHBondContact O-N 3.2Å; H38-K41 VanDerWaalsContact O-N 3.13Å; H38-V42 WeakPolarHBondContact O-CG2 2.9Å; H38-V42 PolarHBondContact O-N 2.84Å
39	A	85.6	Confident	86.5	Confident	44 Å²	44	67 Å²	67	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-57.4	-48.7	174.6	0	0	0	0	0	111.5	A35 L36 K41 V42 L43	A35-A39 PolarHBondContact O-N 3.38Å; L36-A39 PolarHBondContact O-N 2.92Å; A39-K41 VanDerWaalsContact C-N 3.27Å; A39-K41 PolarHBondContact O-N 3Å; A39-V42 PolarHBondContact O-N 2.69Å; A39-L43 WeakPolarHBondContact O-CD1 3.45Å; A39-L43 PolarHBondContact O-N 2.91Å
40	V	88.9	Confident	86.9	Confident	18 Å²	18	74 Å²	74	11%	0.109	41%	0.412	C	S	.	.	H	α-helix	trans	-63.1	-34.5	177.4	175.2	0	0	0	0	111.7	L36 R37 H38 L43 A44 L54 W55 F58	L36-V40 VanDerWaalsContact O-CG2 3.3Å; L36-V40 WeakPolarHBondContact O-CG2 3.4Å; L36-V40 PolarHBondContact O-N 2.72Å; R37-V40 PolarHBondContact O-N 3.23Å; H38-V40 PolarHBondContact O-N 3.02Å; V40-L43 PolarHBondContact O-N 3.34Å; V40-A44 VanDerWaalsContact O-CB 3.28Å; V40-A44 WeakPolarHBondContact O-CB 3.38Å; V40-A44 PolarHBondContact O-N 2.95Å; V40-L54 HydrophobicContact CG1-CB 4.07Å; V40-L54 HydrophobicContact CG1-CD2 3.94Å; V40-L54 HydrophobicContact CG1-CG 4.08Å; V40-L54 HydrophobicContact CG2-CD2 3.87Å; V40-W55 HydrophobicContact CG1-CB 4.38Å; V40-W55 HydrophobicContact CG1-CE3 4.17Å; V40-F58 HydrophobicContact CB-CD2 4.09Å; V40-F58 HydrophobicContact CB-CE2 4.32Å; V40-F58 HydrophobicContact CG1-CD2 4.22Å; V40-F58 HydrophobicContact CG2-CD2 3.94Å; V40-F58 HydrophobicContact CG2-CE2 3.95Å
41	K	88.4	Confident	87.4	Confident	86 Å²	86	75.7 Å²	75.7	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-60.5	-51.5	173.9	-169.6	-175.8	169.7	-170.7	0	111.3	R37 H38 A39 L43 A44 E45 W55	R37-K41 WeakPolarHBondContact O-CB 3.46Å; R37-K41 PolarHBondContact O-N 3.03Å; H38-K41 VanDerWaalsContact O-CB 3.29Å; H38-K41 WeakPolarHBondContact O-CB 3.34Å; H38-K41 PolarHBondContact O-N 3.2Å; H38-K41 VanDerWaalsContact O-N 3.13Å; A39-K41 VanDerWaalsContact C-N 3.27Å; A39-K41 PolarHBondContact O-N 3Å; K41-L43 VanDerWaalsContact C-N 3.31Å; K41-L43 PolarHBondContact O-N 2.87Å; K41-A44 WeakPolarHBondContact O-CB 3.44Å; K41-A44 PolarHBondContact O-N 3.43Å; K41-A44 VanDerWaalsContact O-N 3.12Å; K41-E45 WeakPolarHBondContact CE-OE1 2.94Å; K41-E45 IonicContact NZ-OE1 2.86Å; K41-E45 WeakPolarHBondContact O-CG 3.45Å; K41-E45 PolarHBondContact O-N 3.37Å; K41-W55 HydrophobicContact CB-CE3 4.05Å; K41-W55 HydrophobicContact CB-CH2 3.82Å; K41-W55 HydrophobicContact CB-CZ3 3.48Å; K41-W55 VanDerWaalsContact CB-CZ3 3.48Å; K41-W55 HydrophobicContact CD-CH2 4.07Å; K41-W55 HydrophobicContact CG-CH2 3.83Å; K41-W55 HydrophobicContact CG-CZ2 4.3Å; K41-W55 HydrophobicContact CG-CZ3 3.99Å
42	V	91.2	Very high	87.8	Confident	72 Å²	72	75.6 Å²	75.6	44%	0.436	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-41.3	178.7	175.1	0	0	0	0	110.9	H38 A39 A44 E45 S46	H38-V42 WeakPolarHBondContact O-CG2 2.9Å; H38-V42 PolarHBondContact O-N 2.84Å; A39-V42 PolarHBondContact O-N 2.69Å; V42-A44 PolarHBondContact O-N 3.36Å; V42-E45 PolarHBondContact O-N 3.36Å; V42-S46 WeakPolarHBondContact O-CB 3.29Å; V42-S46 PolarHBondContact O-N 2.91Å
43	L	88.4	Confident	88.2	Confident	73 Å²	73	79.4 Å²	79.4	38%	0.382	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-43.4	173.8	-91	82.5	0	0	0	111.8	A39 V40 K41 S46 N47 Y51	A39-L43 WeakPolarHBondContact O-CD1 3.45Å; A39-L43 PolarHBondContact O-N 2.91Å; V40-L43 PolarHBondContact O-N 3.34Å; K41-L43 VanDerWaalsContact C-N 3.31Å; K41-L43 PolarHBondContact O-N 2.87Å; L43-S46 PolarHBondContact O-N 3.34Å; L43-S46 PolarHBondContact O-OG 2.95Å; L43-N47 PolarHBondContact O-N 3.38Å; L43-N47 VanDerWaalsContact O-N 3.13Å; L43-Y51 HydrophobicContact CB-CD2 4.25Å; L43-Y51 HydrophobicContact CB-CG 4.33Å; L43-Y51 HydrophobicContact CD2-CD1 4.45Å; L43-Y51 HydrophobicContact CD2-CE1 4.37Å; L43-Y51 HydrophobicContact CD2-CE2 4.5Å; L43-Y51 WeakPolarHBondContact O-CD2 3.16Å
44	A	91.6	Very high	88.5	Confident	14 Å²	14	79 Å²	79	12%	0.116	42%	0.42	C	S	.	.	H	α-helix	trans	-65.7	-36.9	178.7	0	0	0	0	0	112.7	V40 K41 V42 N47 P48 W55	V40-A44 VanDerWaalsContact O-CB 3.28Å; V40-A44 WeakPolarHBondContact O-CB 3.38Å; V40-A44 PolarHBondContact O-N 2.95Å; K41-A44 WeakPolarHBondContact O-CB 3.44Å; K41-A44 PolarHBondContact O-N 3.43Å; K41-A44 VanDerWaalsContact O-N 3.12Å; V42-A44 PolarHBondContact O-N 3.36Å; A44-N47 CarbonylContact O-C 3.47Å; A44-P48 VanDerWaalsContact O-CA 3.31Å; A44-P48 WeakPolarHBondContact O-CA 3.19Å; A44-W55 HydrophobicContact CB-CB 3.97Å; A44-W55 HydrophobicContact CB-CG 4.43Å
45	E	91.6	Very high	88.9	Confident	130 Å²	130	81 Å²	81	61%	0.607	42%	0.421	S	S	*	.	H	α-helix	trans	-68.1	-37.3	174.1	-72.7	171.9	175.3	0	0	111.7	K41 V42	K41-E45 WeakPolarHBondContact CE-OE1 2.94Å; K41-E45 IonicContact NZ-OE1 2.86Å; K41-E45 WeakPolarHBondContact O-CG 3.45Å; K41-E45 PolarHBondContact O-N 3.37Å; V42-E45 PolarHBondContact O-N 3.36Å
46	S	91.9	Very high	89.1	Confident	70 Å²	70	88.1 Å²	88.1	49%	0.49	44%	0.438	S	S	.	.	H	α-helix	trans	-68.5	-37.4	178.8	77.2	0	0	0	0	113.7	V42 L43	V42-S46 WeakPolarHBondContact O-CB 3.29Å; V42-S46 PolarHBondContact O-N 2.91Å; L43-S46 PolarHBondContact O-N 3.34Å; L43-S46 PolarHBondContact O-OG 2.95Å
47	N	90.7	Very high	89.4	Confident	77 Å²	77	91.4 Å²	91.4	41%	0.412	45%	0.446	S	S	.	.			trans	-148.9	80.6	-174.5	-79.1	-74.8	0	0	0	110.8	L43 A44 S49 R50 Y51	L43-N47 PolarHBondContact O-N 3.38Å; L43-N47 VanDerWaalsContact O-N 3.13Å; A44-N47 CarbonylContact O-C 3.47Å; N47-S49 VanDerWaalsContact C-N 3.28Å; N47-S49 PolarHBondContact O-N 2.9Å; N47-R50 PolarHBondContact O-N 3.15Å; N47-Y51 HydrophobicContact CB-CD2 3.73Å; N47-Y51 HydrophobicContact CB-CE2 3.92Å; N47-Y51 PolarHBondContact O-N 3.49Å; N47-Y51 VanDerWaalsContact O-N 3.12Å
48	P	90.3	Very high	89.5	Confident	94 Å²	94	87.5 Å²	87.5	61%	0.61	43%	0.431	S	S	*	.	H	α-helix	trans	-65	-29.4	-173.4	21.8	-32.1	0	0	0	113.5	A44 G52	A44-P48 VanDerWaalsContact O-CA 3.31Å; A44-P48 WeakPolarHBondContact O-CA 3.19Å; P48-G52 WeakPolarHBondContact O-CA 3.49Å; P48-G52 PolarHBondContact O-N 3.33Å; P48-G52 VanDerWaalsContact O-N 3.11Å
49	S	89.8	Confident	89.6	Confident	111 Å²	111	82.7 Å²	82.7	78%	0.776	41%	0.41	S	S	*	.	H	α-helix	trans	-67.7	-34.9	-178.3	60.2	0	0	0	0	113.7	N47	N47-S49 VanDerWaalsContact C-N 3.28Å; N47-S49 PolarHBondContact O-N 2.9Å
50	R	88.8	Confident	90	Very high	195 Å²	195	83.6 Å²	83.6	74%	0.736	41%	0.407	S	S	*	.	H	α-helix	trans	-94.3	-44.7	180	-65.8	-174.4	-168.1	177.2	4.6	112.6	N47	N47-R50 PolarHBondContact O-N 3.15Å
51	Y	89.1	Confident	90	Very high	86 Å²	86	85.8 Å²	85.8	34%	0.337	42%	0.417	S	S	.	.	H	α-helix	trans	-98.6	-2.9	-170.3	-55.7	-61.1	0	0	0	114.3	L43 N47 F53 L54 W55	L43-Y51 HydrophobicContact CB-CD2 4.25Å; L43-Y51 HydrophobicContact CB-CG 4.33Å; L43-Y51 HydrophobicContact CD2-CD1 4.45Å; L43-Y51 HydrophobicContact CD2-CE1 4.37Å; L43-Y51 HydrophobicContact CD2-CE2 4.5Å; L43-Y51 WeakPolarHBondContact O-CD2 3.16Å; N47-Y51 HydrophobicContact CB-CD2 3.73Å; N47-Y51 HydrophobicContact CB-CE2 3.92Å; N47-Y51 PolarHBondContact O-N 3.49Å; N47-Y51 VanDerWaalsContact O-N 3.12Å; Y51-F53 PolarHBondContact O-N 3.48Å; Y51-L54 WeakPolarHBondContact O-CB 3.14Å; Y51-L54 PolarHBondContact O-N 3.48Å; Y51-W55 PolarHBondContact O-N 3.3Å
52	G	87.4	Confident	90.1	Very high	21 Å²	21	83 Å²	83	22%	0.216	41%	0.405	C	S	.	.	H	α-helix	trans	-62.6	-21.7	176.8	0	0	0	0	0	114.5	P48 R56	P48-G52 WeakPolarHBondContact O-CA 3.49Å; P48-G52 PolarHBondContact O-N 3.33Å; P48-G52 VanDerWaalsContact O-N 3.11Å; G52-R56 WeakPolarHBondContact O-CG 3.45Å; G52-R56 PolarHBondContact O-N 2.9Å; G52-R56 PolarHBondContact O-NE 2.81Å; G52-R56 VanDerWaalsContact O-NE 3.16Å
53	F	91.3	Very high	90	Very high	121 Å²	121	80.1 Å²	80.1	53%	0.531	39%	0.39	S	S	.	.	H	α-helix	trans	-71.2	-41.5	170.2	176.5	-99.6	0	0	0	112	Y51 W55 R56 R57 I61	Y51-F53 PolarHBondContact O-N 3.48Å; F53-W55 VanDerWaalsContact C-N 3.32Å; F53-W55 PolarHBondContact O-N 2.96Å; F53-R56 PolarHBondContact O-N 2.97Å; F53-R57 HydrophobicContact CD2-CG 4.33Å; F53-R57 HydrophobicContact CE1-CB 4.48Å; F53-R57 HydrophobicContact CE2-CG 3.75Å; F53-R57 HydrophobicContact CZ-CB 4.26Å; F53-R57 HydrophobicContact CZ-CG 3.87Å; F53-R57 PolarHBondContact O-N 2.9Å; F53-I61 HydrophobicContact CE1-CD1 4.32Å
54	L	89.8	Confident	90.2	Very high	59 Å²	59	81.7 Å²	81.7	31%	0.309	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-40.5	-177.3	-150.7	76.9	0	0	0	111.3	V40 Y51 F58 I61	V40-L54 HydrophobicContact CG1-CB 4.07Å; V40-L54 HydrophobicContact CG1-CD2 3.94Å; V40-L54 HydrophobicContact CG1-CG 4.08Å; V40-L54 HydrophobicContact CG2-CD2 3.87Å; Y51-L54 WeakPolarHBondContact O-CB 3.14Å; Y51-L54 PolarHBondContact O-N 3.48Å; L54-F58 VanDerWaalsContact O-CA 3.23Å; L54-F58 WeakPolarHBondContact O-CA 3.37Å; L54-F58 WeakPolarHBondContact O-CB 3.45Å; L54-F58 PolarHBondContact O-N 3.25Å; L54-I61 HydrophobicContact CD1-CD1 3.68Å; L54-I61 HydrophobicContact CG-CD1 4.28Å
55	W	90.6	Very high	90	Very high	97 Å²	97	85.7 Å²	85.7	37%	0.367	42%	0.421	S	S	.	.	H	α-helix	trans	-65.6	-45.2	175.1	-178.7	-113	0	0	0	112.8	R37 V40 K41 A44 Y51 F53 R57 F58	R37-W55 HydrophobicContact CG-CH2 4.2Å; R37-W55 HydrophobicContact CG-CZ3 3.79Å; R37-W55 WeakPolarHBondContact O-CZ3 3.32Å; V40-W55 HydrophobicContact CG1-CB 4.38Å; V40-W55 HydrophobicContact CG1-CE3 4.17Å; K41-W55 HydrophobicContact CB-CE3 4.05Å; K41-W55 HydrophobicContact CB-CH2 3.82Å; K41-W55 HydrophobicContact CB-CZ3 3.48Å; K41-W55 VanDerWaalsContact CB-CZ3 3.48Å; K41-W55 HydrophobicContact CD-CH2 4.07Å; K41-W55 HydrophobicContact CG-CH2 3.83Å; K41-W55 HydrophobicContact CG-CZ2 4.3Å; K41-W55 HydrophobicContact CG-CZ3 3.99Å; A44-W55 HydrophobicContact CB-CB 3.97Å; A44-W55 HydrophobicContact CB-CG 4.43Å; Y51-W55 PolarHBondContact O-N 3.3Å; F53-W55 VanDerWaalsContact C-N 3.32Å; F53-W55 PolarHBondContact O-N 2.96Å; W55-R57 PolarHBondContact O-N 3.19Å; W55-F58 WeakPolarHBondContact O-CB 3.26Å; W55-F58 PolarHBondContact O-N 3Å
56	R	88.8	Confident	89.9	Confident	196 Å²	196	80.5 Å²	80.5	74%	0.74	40%	0.398	S	S	*	.	H	α-helix	trans	-66.5	-35.3	-179.1	-75.5	-176	-69	161.2	-3.3	113.5	G52 F53	G52-R56 WeakPolarHBondContact O-CG 3.45Å; G52-R56 PolarHBondContact O-N 2.9Å; G52-R56 PolarHBondContact O-NE 2.81Å; G52-R56 VanDerWaalsContact O-NE 3.16Å; F53-R56 PolarHBondContact O-N 2.97Å
57	R	89.1	Confident	89.9	Confident	139 Å²	139	80 Å²	80	53%	0.525	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	18.1	-179.3	-68.7	-65.2	-160	170.8	4.3	112.9	F53 W55 D59 E60 I61	F53-R57 HydrophobicContact CD2-CG 4.33Å; F53-R57 HydrophobicContact CE1-CB 4.48Å; F53-R57 HydrophobicContact CE2-CG 3.75Å; F53-R57 HydrophobicContact CZ-CB 4.26Å; F53-R57 HydrophobicContact CZ-CG 3.87Å; F53-R57 PolarHBondContact O-N 2.9Å; W55-R57 PolarHBondContact O-N 3.19Å; R57-D59 VanDerWaalsContact C-N 3.33Å; R57-D59 PolarHBondContact O-N 2.81Å; R57-E60 PolarHBondContact O-N 3.41Å; R57-E60 VanDerWaalsContact O-N 3.08Å; R57-I61 HydrophobicContact CB-CD1 3.89Å; R57-I61 HydrophobicContact CB-CG1 4.29Å; R57-I61 WeakPolarHBondContact O-CG1 3.37Å; R57-I61 PolarHBondContact O-N 3.27Å
58	F	89.9	Confident	89.8	Confident	13 Å²	13	83 Å²	83	6%	0.057	40%	0.401	C	S	.	.	H	α-helix	trans	-53	-48.2	-173.9	176.1	-97	0	0	0	112.7	R33 L36 R37 V40 L54 W55 E60 I61 H62	R33-F58 HydrophobicContact CG-CE1 4.47Å; L36-F58 HydrophobicContact CB-CE2 4.15Å; L36-F58 HydrophobicContact CB-CZ 4.05Å; R37-F58 HydrophobicContact CB-CD1 4.32Å; R37-F58 HydrophobicContact CB-CE1 3.62Å; R37-F58 HydrophobicContact CB-CE2 4.19Å; R37-F58 HydrophobicContact CB-CZ 3.54Å; R37-F58 HydrophobicContact CG-CD1 4.05Å; R37-F58 HydrophobicContact CG-CE1 3.83Å; R37-F58 HydrophobicContact CG-CZ 4.16Å; R37-F58 VanDerWaalsContact N-CZ 3.33Å; V40-F58 HydrophobicContact CB-CD2 4.09Å; V40-F58 HydrophobicContact CB-CE2 4.32Å; V40-F58 HydrophobicContact CG1-CD2 4.22Å; V40-F58 HydrophobicContact CG2-CD2 3.94Å; V40-F58 HydrophobicContact CG2-CE2 3.95Å; L54-F58 VanDerWaalsContact O-CA 3.23Å; L54-F58 WeakPolarHBondContact O-CA 3.37Å; L54-F58 WeakPolarHBondContact O-CB 3.45Å; L54-F58 PolarHBondContact O-N 3.25Å; W55-F58 WeakPolarHBondContact O-CB 3.26Å; W55-F58 PolarHBondContact O-N 3Å; F58-E60 VanDerWaalsContact C-N 3.29Å; F58-E60 PolarHBondContact O-N 2.71Å; F58-I61 PolarHBondContact O-N 3.04Å; F58-H62 HydrophobicContact CE1-CB 4.35Å; F58-H62 HydrophobicContact CZ-CB 4.33Å; F58-H62 VanDerWaalsContact O-CB 3.24Å; F58-H62 WeakPolarHBondContact O-CB 3.33Å; F58-H62 PolarHBondContact O-N 2.71Å
59	D	89.1	Confident	89.7	Confident	21 Å²	21	81.1 Å²	81.1	11%	0.112	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-34.6	-177.7	-70.1	-43.7	0	0	0	112.4	R33 R37 R57 G63 Q128	R33-D59 IonicContact CZ-OD1 3.78Å; R33-D59 IonicContact NE-OD1 2.71Å; R33-D59 IonicContact NH2-OD1 2.72Å; R33-D59 PolarHBondContact NH2-OD1 2.79Å; R37-D59 IonicContact NH1-OD1 3.24Å; R37-D59 PolarHBondContact NH1-OD1 3.03Å; R37-D59 IonicContact NH1-OD2 3.78Å; R57-D59 VanDerWaalsContact C-N 3.33Å; R57-D59 PolarHBondContact O-N 2.81Å; D59-G63 PolarHBondContact O-N 2.95Å; D59-Q128 PolarHBondContact OD2-NE2 3.04Å
60	E	92.5	Very high	89.7	Confident	63 Å²	63	76.3 Å²	76.3	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-73.2	-44.1	177.5	-50.4	-50.6	153.7	0	0	111.5	R57 F58 G63 V64 Y121 K125	R57-E60 PolarHBondContact O-N 3.41Å; R57-E60 VanDerWaalsContact O-N 3.08Å; F58-E60 VanDerWaalsContact C-N 3.29Å; F58-E60 PolarHBondContact O-N 2.71Å; E60-G63 PolarHBondContact O-N 2.83Å; E60-V64 WeakPolarHBondContact O-CG2 3.22Å; E60-V64 PolarHBondContact O-N 3.09Å; E60-Y121 VanDerWaalsContact CD-OH 3.24Å; E60-Y121 PolarHBondContact OE1-OH 2.74Å; E60-Y121 PolarHBondContact OE2-OH 3.33Å; E60-K125 VanDerWaalsContact OE1-CE 3.31Å; E60-K125 WeakPolarHBondContact OE1-CE 3.23Å; E60-K125 IonicContact OE1-NZ 2.69Å; E60-K125 PolarHBondContact OE1-NZ 3.22Å
61	I	90.8	Very high	89.7	Confident	63 Å²	63	70.7 Å²	70.7	32%	0.323	33%	0.333	S	S	.	.	H	α-helix	trans	-65.2	-44.9	180	-65.2	162.5	0	0	0	110.1	F53 L54 R57 F58 V64 L65	F53-I61 HydrophobicContact CE1-CD1 4.32Å; L54-I61 HydrophobicContact CD1-CD1 3.68Å; L54-I61 HydrophobicContact CG-CD1 4.28Å; R57-I61 HydrophobicContact CB-CD1 3.89Å; R57-I61 HydrophobicContact CB-CG1 4.29Å; R57-I61 WeakPolarHBondContact O-CG1 3.37Å; R57-I61 PolarHBondContact O-N 3.27Å; F58-I61 PolarHBondContact O-N 3.04Å; I61-V64 PolarHBondContact O-N 3.39Å; I61-L65 VanDerWaalsContact O-CB 3.3Å; I61-L65 WeakPolarHBondContact O-CB 3.26Å; I61-L65 PolarHBondContact O-N 2.72Å
62	H	89.6	Confident	89.6	Confident	27 Å²	27	69.7 Å²	69.7	13%	0.125	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-44.6	175.6	-179	-75.7	0	0	0	111.1	F58 V64 L65 D66	F58-H62 HydrophobicContact CE1-CB 4.35Å; F58-H62 HydrophobicContact CZ-CB 4.33Å; F58-H62 VanDerWaalsContact O-CB 3.24Å; F58-H62 WeakPolarHBondContact O-CB 3.33Å; F58-H62 PolarHBondContact O-N 2.71Å; H62-V64 PolarHBondContact O-N 3.13Å; H62-L65 PolarHBondContact O-N 2.86Å; H62-D66 VanDerWaalsContact O-CB 3.25Å; H62-D66 WeakPolarHBondContact O-CB 3.48Å; H62-D66 PolarHBondContact O-N 2.81Å
63	G	89.9	Confident	89.4	Confident	13 Å²	13	70.7 Å²	70.7	13%	0.134	33%	0.33	C	S	.	.	H	α-helix	trans	-59.9	-45.4	177.5	0	0	0	0	0	112.7	D59 E60 D66 V67	D59-G63 PolarHBondContact O-N 2.95Å; E60-G63 PolarHBondContact O-N 2.83Å; G63-D66 PolarHBondContact O-N 2.99Å; G63-V67 VanDerWaalsContact O-CG2 3.3Å; G63-V67 WeakPolarHBondContact O-CG2 3.36Å; G63-V67 PolarHBondContact O-N 3.27Å
64	V	90.9	Very high	89.1	Confident	105 Å²	105	64.9 Å²	64.9	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-64.6	-43.6	176.8	172.5	0	0	0	0	111.5	E60 I61 H62 V67 F68	E60-V64 WeakPolarHBondContact O-CG2 3.22Å; E60-V64 PolarHBondContact O-N 3.09Å; I61-V64 PolarHBondContact O-N 3.39Å; H62-V64 PolarHBondContact O-N 3.13Å; V64-V67 PolarHBondContact O-N 3.5Å; V64-F68 WeakPolarHBondContact O-CB 3.3Å; V64-F68 PolarHBondContact O-N 2.91Å
65	L	88.7	Confident	88.6	Confident	98 Å²	98	64.5 Å²	64.5	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-43.9	178.5	-176.6	67.4	0	0	0	111.5	I61 H62 F68 L69	I61-L65 VanDerWaalsContact O-CB 3.3Å; I61-L65 WeakPolarHBondContact O-CB 3.26Å; I61-L65 PolarHBondContact O-N 2.72Å; H62-L65 PolarHBondContact O-N 2.86Å; L65-F68 PolarHBondContact O-N 3.19Å; L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.33Å; L65-L69 PolarHBondContact O-N 3.38Å
66	D	89.2	Confident	87.9	Confident	22 Å²	22	67.8 Å²	67.8	12%	0.118	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-44	178.4	-175	46.4	0	0	0	111.4	H62 G63 F68 L69 Q70	H62-D66 VanDerWaalsContact O-CB 3.25Å; H62-D66 WeakPolarHBondContact O-CB 3.48Å; H62-D66 PolarHBondContact O-N 2.81Å; G63-D66 PolarHBondContact O-N 2.99Å; D66-F68 VanDerWaalsContact C-N 3.34Å; D66-F68 PolarHBondContact O-N 2.98Å; D66-L69 PolarHBondContact O-N 3.24Å; D66-Q70 WeakPolarHBondContact O-CB 3.44Å; D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.4Å; D66-Q70 PolarHBondContact O-N 2.94Å; D66-Q70 PolarHBondContact OD1-NE2 2.8Å; D66-Q70 PolarHBondContact OD2-NE2 3.16Å
67	V	90.9	Very high	87.1	Confident	60 Å²	60	59.3 Å²	59.3	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-46	173.1	169.6	0	0	0	0	111.3	G63 V64 H71 L113 A117	G63-V67 VanDerWaalsContact O-CG2 3.3Å; G63-V67 WeakPolarHBondContact O-CG2 3.36Å; G63-V67 PolarHBondContact O-N 3.27Å; V64-V67 PolarHBondContact O-N 3.5Å; V67-H71 WeakPolarHBondContact O-CB 3.48Å; V67-H71 PolarHBondContact O-N 2.89Å; V67-L113 HydrophobicContact CG1-CD2 4.36Å; V67-A117 HydrophobicContact CB-CB 4.5Å; V67-A117 HydrophobicContact CG2-CB 3.58Å
68	F	90.3	Very high	86.6	Confident	138 Å²	138	53.1 Å²	53.1	61%	0.605	27%	0.267	S	S	*	.	H	α-helix	trans	-65.2	-44.1	-179.8	-176.6	-98.3	0	0	0	111.8	V64 L65 D66 H71 H72	V64-F68 WeakPolarHBondContact O-CB 3.3Å; V64-F68 PolarHBondContact O-N 2.91Å; L65-F68 PolarHBondContact O-N 3.19Å; D66-F68 VanDerWaalsContact C-N 3.34Å; D66-F68 PolarHBondContact O-N 2.98Å; F68-H71 PolarHBondContact O-N 3.16Å; F68-H72 WeakPolarHBondContact O-CB 3.33Å; F68-H72 PolarHBondContact O-N 3Å
69	L	87.8	Confident	86.4	Confident	55 Å²	55	52.5 Å²	52.5	29%	0.288	27%	0.265	S	S	.	.	H	α-helix	trans	-59.3	-54.6	177	-174.9	71.5	0	0	0	110.3	L65 D66 H71 H72 F73 F81	L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.33Å; L65-L69 PolarHBondContact O-N 3.38Å; D66-L69 PolarHBondContact O-N 3.24Å; L69-H71 VanDerWaalsContact C-N 3.33Å; L69-H71 PolarHBondContact O-N 3.31Å; L69-H72 WeakPolarHBondContact O-CB 3.45Å; L69-H72 PolarHBondContact O-N 3.3Å; L69-F73 HydrophobicContact CD1-CD2 3.98Å; L69-F73 HydrophobicContact CD1-CE2 3.63Å; L69-F73 HydrophobicContact CG-CD2 4.19Å; L69-F73 HydrophobicContact CG-CE2 4.28Å; L69-F73 WeakPolarHBondContact O-CD2 3.39Å; L69-F73 PolarHBondContact O-N 2.98Å; L69-F73 VanDerWaalsContact O-N 3.08Å; L69-F81 HydrophobicContact CD1-CD2 4.39Å; L69-F81 HydrophobicContact CD2-CB 3.95Å; L69-F81 HydrophobicContact CD2-CD1 4.15Å; L69-F81 HydrophobicContact CD2-CD2 4.27Å; L69-F81 HydrophobicContact CD2-CG 3.85Å; L69-F81 HydrophobicContact CG-CB 4.13Å; L69-F81 HydrophobicContact CG-CG 4.34Å
70	Q	89.6	Confident	86.2	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-39.6	180	-67.4	178.8	12.9	0	0	112.1	D66 H72 F73 L74 L116 A117	D66-Q70 WeakPolarHBondContact O-CB 3.44Å; D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.4Å; D66-Q70 PolarHBondContact O-N 2.94Å; D66-Q70 PolarHBondContact OD1-NE2 2.8Å; D66-Q70 PolarHBondContact OD2-NE2 3.16Å; Q70-H72 VanDerWaalsContact C-N 3.33Å; Q70-H72 PolarHBondContact O-N 3.42Å; Q70-F73 PolarHBondContact O-N 2.96Å; Q70-L74 VanDerWaalsContact O-CB 3.25Å; Q70-L74 WeakPolarHBondContact O-CB 3.43Å; Q70-L74 WeakPolarHBondContact O-CD1 3.5Å; Q70-L74 VanDerWaalsContact O-CG 3.23Å; Q70-L74 WeakPolarHBondContact O-CG 3.18Å; Q70-L74 PolarHBondContact O-N 3.15Å; Q70-L116 PolarHBondContact NE2-O 2.9Å; Q70-A117 VanDerWaalsContact OE1-CB 3.23Å
71	H	88.4	Confident	85.9	Confident	78 Å²	78	51.7 Å²	51.7	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-59.2	-44.6	174.5	-178.1	73.7	0	0	0	112	V67 F68 L69 S75 H109 L113	V67-H71 WeakPolarHBondContact O-CB 3.48Å; V67-H71 PolarHBondContact O-N 2.89Å; F68-H71 PolarHBondContact O-N 3.16Å; L69-H71 VanDerWaalsContact C-N 3.33Å; L69-H71 PolarHBondContact O-N 3.31Å; H71-S75 VanDerWaalsContact O-CB 3.24Å; H71-S75 WeakPolarHBondContact O-CB 3.48Å; H71-S75 PolarHBondContact O-N 3.3Å; H71-S75 PolarHBondContact O-OG 3.3Å; H71-H109 AromaticContact CE1-NE2 3.67Å; H71-H109 AromaticContact ND1-NE2 3.43Å; H71-H109 PolarHBondContact ND1-NE2 2.85Å; H71-L113 HydrophobicContact CB-CD1 3.7Å
72	H	86.3	Confident	85.6	Confident	65 Å²	65	48.9 Å²	48.9	30%	0.301	25%	0.245	S	C	.	.	H	α-helix	trans	-61.1	-50.1	179.3	-175.5	88.5	0	0	0	111.7	F68 L69 Q70 R76	F68-H72 WeakPolarHBondContact O-CB 3.33Å; F68-H72 PolarHBondContact O-N 3Å; L69-H72 WeakPolarHBondContact O-CB 3.45Å; L69-H72 PolarHBondContact O-N 3.3Å; Q70-H72 VanDerWaalsContact C-N 3.33Å; Q70-H72 PolarHBondContact O-N 3.42Å; H72-R76 PolarHBondContact CE1-NE 3.05Å; H72-R76 PolarHBondContact CE1-NH1 3.45Å; H72-R76 VanDerWaalsContact CE1-NH1 3.25Å; H72-R76 PolarHBondContact NE2-NH1 3.14Å; H72-R76 WeakPolarHBondContact O-CB 3.35Å; H72-R76 PolarHBondContact O-N 3.08Å; H72-R76 VanDerWaalsContact O-N 3.12Å
73	F	83.9	Confident	85.5	Confident	41 Å²	41	47.6 Å²	47.6	18%	0.18	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-44.2	-178.9	-81.6	-83	0	0	0	112.1	L69 Q70 S75 R76 T77 A79 F81 N84	L69-F73 HydrophobicContact CD1-CD2 3.98Å; L69-F73 HydrophobicContact CD1-CE2 3.63Å; L69-F73 HydrophobicContact CG-CD2 4.19Å; L69-F73 HydrophobicContact CG-CE2 4.28Å; L69-F73 WeakPolarHBondContact O-CD2 3.39Å; L69-F73 PolarHBondContact O-N 2.98Å; L69-F73 VanDerWaalsContact O-N 3.08Å; Q70-F73 PolarHBondContact O-N 2.96Å; F73-S75 VanDerWaalsContact C-N 3.27Å; F73-S75 PolarHBondContact O-N 3.5Å; F73-R76 PolarHBondContact O-N 3.17Å; F73-T77 PolarHBondContact O-N 3.29Å; F73-T77 PolarHBondContact O-OG1 3.04Å; F73-A79 CarbonylContact C-O 3.56Å; F73-A79 WeakPolarHBondContact CB-O 3.41Å; F73-F81 HydrophobicContact CD2-CB 4.05Å; F73-F81 HydrophobicContact CD2-CD2 4.23Å; F73-F81 HydrophobicContact CE2-CB 4.36Å; F73-F81 AromaticContact CE2-CD2 3.67Å; F73-F81 HydrophobicContact CE2-CD2 3.67Å; F73-F81 HydrophobicContact CE2-CG 4.48Å; F73-F81 HydrophobicContact CG-CB 4.44Å; F73-F81 AromaticContact CZ-CD2 3.83Å; F73-F81 HydrophobicContact CZ-CD2 3.83Å; F73-F81 HydrophobicContact CZ-CE2 4.48Å; F73-N84 HydrophobicContact CD1-CB 4.1Å; F73-N84 HydrophobicContact CE1-CB 4.36Å
74	L	84.1	Confident	85.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-34.2	178.3	-72.8	168.6	0	0	0	112.6	Q70 A79 H109 L113 L116	Q70-L74 VanDerWaalsContact O-CB 3.25Å; Q70-L74 WeakPolarHBondContact O-CB 3.43Å; Q70-L74 WeakPolarHBondContact O-CD1 3.5Å; Q70-L74 VanDerWaalsContact O-CG 3.23Å; Q70-L74 WeakPolarHBondContact O-CG 3.18Å; Q70-L74 PolarHBondContact O-N 3.15Å; L74-A79 WeakPolarHBondContact CA-O 3.47Å; L74-A79 PolarHBondContact N-O 3.48Å; L74-A79 VanDerWaalsContact N-O 3.15Å; L74-H109 VanDerWaalsContact CB-CE1 3.46Å; L74-H109 WeakPolarHBondContact CB-CE1 3.29Å; L74-L113 HydrophobicContact CD1-CB 4.1Å; L74-L116 HydrophobicContact CD1-CD1 4.21Å
75	S	79.6	Confident	84.9	Confident	51 Å²	51	50.4 Å²	50.4	36%	0.357	24%	0.242	S	C	.	.	H	α-helix	trans	-76.6	-30.6	179.3	-54.9	0	0	0	0	112.9	H71 F73 H109	H71-S75 VanDerWaalsContact O-CB 3.24Å; H71-S75 WeakPolarHBondContact O-CB 3.48Å; H71-S75 PolarHBondContact O-N 3.3Å; H71-S75 PolarHBondContact O-OG 3.3Å; F73-S75 VanDerWaalsContact C-N 3.27Å; F73-S75 PolarHBondContact O-N 3.5Å; S75-H109 PolarHBondContact OG-CE1 3.46Å; S75-H109 VanDerWaalsContact OG-CE1 3.26Å
76	R	76.4	Confident	84.6	Confident	166 Å²	166	49.2 Å²	49.2	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-97.9	-39.9	-175.8	-73.9	-168.4	174.1	-175.8	-3.7	114.4	H72 F73	H72-R76 PolarHBondContact CE1-NE 3.05Å; H72-R76 PolarHBondContact CE1-NH1 3.45Å; H72-R76 VanDerWaalsContact CE1-NH1 3.25Å; H72-R76 PolarHBondContact NE2-NH1 3.14Å; H72-R76 WeakPolarHBondContact O-CB 3.35Å; H72-R76 PolarHBondContact O-N 3.08Å; H72-R76 VanDerWaalsContact O-N 3.12Å; F73-R76 PolarHBondContact O-N 3.17Å
77	T	71.5	Confident	84.3	Confident	17 Å²	17	51.4 Å²	51.4	10%	0.104	25%	0.249	C	C	.	.	H	α-helix	trans	-122.8	7.4	-169.6	59.4	0	0	0	0	113.7	F73 A79 A100 M207	F73-T77 PolarHBondContact O-N 3.29Å; F73-T77 PolarHBondContact O-OG1 3.04Å; T77-A79 PolarHBondContact O-N 3.11Å; T77-A100 CarbonylContact C-O 3.52Å; T77-M207 HydrophobicContact CG2-CE 3.61Å
78	S	79.7	Confident	84.1	Confident	9 Å²	9	48.6 Å²	48.6	6%	0.063	23%	0.232	C	C	.	.	S	Bend	trans	52.3	29.5	-178.1	-55.5	0	0	0	0	112.9	R90 A100 G103 L104	S78-R90 VanDerWaalsContact O-CB 3.28Å; S78-R90 WeakPolarHBondContact O-CB 3.49Å; S78-R90 PolarHBondContact O-N 3.49Å; S78-A100 WeakPolarHBondContact CB-O 3.37Å; S78-A100 PolarHBondContact OG-O 2.87Å; S78-G103 WeakPolarHBondContact OG-CA 3.45Å; S78-G103 PolarHBondContact OG-N 3.5Å; S78-L104 VanDerWaalsContact CA-CD1 3.45Å; S78-L104 WeakPolarHBondContact O-CD1 3.49Å
79	A	84.3	Confident	83.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	21%	0.205	C	C	.	.	S	Bend	trans	-142.9	153.5	-175.1	0	0	0	0	0	109	F73 L74 T77 E83 N84 L88	F73-A79 CarbonylContact C-O 3.56Å; F73-A79 WeakPolarHBondContact CB-O 3.41Å; L74-A79 WeakPolarHBondContact CA-O 3.47Å; L74-A79 PolarHBondContact N-O 3.48Å; L74-A79 VanDerWaalsContact N-O 3.15Å; T77-A79 PolarHBondContact O-N 3.11Å; A79-E83 HydrophobicContact CB-CB 3.95Å; A79-N84 HydrophobicContact CB-CB 4.15Å; A79-L88 VanDerWaalsContact CB-O 3.31Å; A79-L88 WeakPolarHBondContact CB-O 3.31Å
80	S	85.9	Confident	83.9	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.021	20%	0.195	C	C	.	.			trans	-70.5	168.2	164.6	82	0	0	0	0	110.4	S82 E83 N84	S80-S82 VanDerWaalsContact C-N 3.35Å; S80-S82 PolarHBondContact O-N 2.85Å; S80-S82 PolarHBondContact OG-OG 3.25Å; S80-E83 PolarHBondContact N-OE2 3.46Å; S80-E83 PolarHBondContact O-N 2.93Å; S80-E83 WeakPolarHBondContact OG-CB 3.45Å; S80-E83 WeakPolarHBondContact OG-CG 3.42Å; S80-E83 PolarHBondContact OG-N 3.48Å; S80-E83 VanDerWaalsContact OG-N 3.08Å; S80-E83 PolarHBondContact OG-OE2 3.05Å; S80-N84 WeakPolarHBondContact O-CB 3.41Å; S80-N84 PolarHBondContact O-N 3.06Å
81	F	85.1	Confident	83.6	Confident	64 Å²	64	41 Å²	41	28%	0.281	20%	0.196	S	C	.	.	H	α-helix	trans	-56.2	-48.4	176.6	167.2	-106.4	0	0	0	112.2	M29 L69 F73 N84 F85	M29-F81 HydrophobicContact SD-CD1 3.88Å; L69-F81 HydrophobicContact CD1-CD2 4.39Å; L69-F81 HydrophobicContact CD2-CB 3.95Å; L69-F81 HydrophobicContact CD2-CD1 4.15Å; L69-F81 HydrophobicContact CD2-CD2 4.27Å; L69-F81 HydrophobicContact CD2-CG 3.85Å; L69-F81 HydrophobicContact CG-CB 4.13Å; L69-F81 HydrophobicContact CG-CG 4.34Å; F73-F81 HydrophobicContact CD2-CB 4.05Å; F73-F81 HydrophobicContact CD2-CD2 4.23Å; F73-F81 HydrophobicContact CE2-CB 4.36Å; F73-F81 AromaticContact CE2-CD2 3.67Å; F73-F81 HydrophobicContact CE2-CD2 3.67Å; F73-F81 HydrophobicContact CE2-CG 4.48Å; F73-F81 HydrophobicContact CG-CB 4.44Å; F73-F81 AromaticContact CZ-CD2 3.83Å; F73-F81 HydrophobicContact CZ-CD2 3.83Å; F73-F81 HydrophobicContact CZ-CE2 4.48Å; F81-N84 PolarHBondContact O-N 3.13Å; F81-F85 PolarHBondContact O-N 2.81Å; F81-F85 VanDerWaalsContact O-N 3.16Å
82	S	84.6	Confident	83.3	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-70.1	-38.5	179	53.2	0	0	0	0	112	Q25 M29 S80 N84 F85 Y86	Q25-S82 VanDerWaalsContact CG-OG 3.3Å; Q25-S82 WeakPolarHBondContact CG-OG 3.43Å; M29-S82 WeakPolarHBondContact CG-OG 3.35Å; S80-S82 VanDerWaalsContact C-N 3.35Å; S80-S82 PolarHBondContact O-N 2.85Å; S80-S82 PolarHBondContact OG-OG 3.25Å; S82-N84 VanDerWaalsContact C-N 3.32Å; S82-N84 PolarHBondContact O-N 2.91Å; S82-F85 WeakPolarHBondContact O-CB 2.84Å; S82-F85 PolarHBondContact O-N 3.34Å; S82-F85 VanDerWaalsContact O-N 3.17Å; S82-Y86 WeakPolarHBondContact O-CD2 3.42Å; S82-Y86 PolarHBondContact O-N 2.86Å; S82-Y86 VanDerWaalsContact O-N 3.12Å
83	E	87.4	Confident	82.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-45.7	175.4	-74.7	160.7	-166.9	0	0	111	Q25 A79 S80 F85 Y86 S87 L88 R90 L196	Q25-E83 HydrophobicContact CG-CG 4.25Å; A79-E83 HydrophobicContact CB-CB 3.95Å; S80-E83 PolarHBondContact N-OE2 3.46Å; S80-E83 PolarHBondContact O-N 2.93Å; S80-E83 WeakPolarHBondContact OG-CB 3.45Å; S80-E83 WeakPolarHBondContact OG-CG 3.42Å; S80-E83 PolarHBondContact OG-N 3.48Å; S80-E83 VanDerWaalsContact OG-N 3.08Å; S80-E83 PolarHBondContact OG-OE2 3.05Å; E83-F85 VanDerWaalsContact C-N 3.29Å; E83-F85 PolarHBondContact O-N 3.35Å; E83-Y86 CarbonylContact O-C 3.43Å; E83-Y86 PolarHBondContact O-N 3.49Å; E83-S87 PolarHBondContact O-N 3.34Å; E83-S87 VanDerWaalsContact O-N 3.1Å; E83-L88 CarbonylContact C-O 3.44Å; E83-L88 HydrophobicContact CB-CB 4.12Å; E83-L88 HydrophobicContact CG-CB 4.48Å; E83-L88 PolarHBondContact O-N 2.92Å; E83-R90 IonicContact OE1-CZ 3.39Å; E83-R90 IonicContact OE1-NE 3.83Å; E83-R90 PolarHBondContact OE1-NE 3.09Å; E83-R90 IonicContact OE1-NH2 3.07Å; E83-R90 PolarHBondContact OE1-NH2 2.9Å; E83-R90 WeakPolarHBondContact OE2-CD 3.3Å; E83-R90 VanDerWaalsContact OE2-CG 3.3Å; E83-R90 WeakPolarHBondContact OE2-CG 2.9Å; E83-R90 IonicContact OE2-CZ 3.3Å; E83-R90 IonicContact OE2-NE 2.74Å; E83-R90 PolarHBondContact OE2-NE 3.47Å; E83-R90 IonicContact OE2-NH2 3.97Å; E83-L196 HydrophobicContact CG-CD2 3.78Å
84	N	86	Confident	81.5	Confident	58 Å²	58	42.9 Å²	42.9	31%	0.31	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-35.9	177.7	-172.5	81.2	0	0	0	112.1	F73 A79 S80 F81 S82 Y86 S87	F73-N84 HydrophobicContact CD1-CB 4.1Å; F73-N84 HydrophobicContact CE1-CB 4.36Å; A79-N84 HydrophobicContact CB-CB 4.15Å; S80-N84 WeakPolarHBondContact O-CB 3.41Å; S80-N84 PolarHBondContact O-N 3.06Å; F81-N84 PolarHBondContact O-N 3.13Å; S82-N84 VanDerWaalsContact C-N 3.32Å; S82-N84 PolarHBondContact O-N 2.91Å; N84-Y86 VanDerWaalsContact C-N 3.33Å; N84-S87 PolarHBondContact O-N 3.23Å
85	F	83.4	Confident	80.2	Confident	119 Å²	119	44.9 Å²	44.9	52%	0.522	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-38.3	175.7	-174.5	-95.8	0	0	0	112.2	L28 F81 S82 E83 S87	L28-F85 HydrophobicContact CD2-CB 4.34Å; L28-F85 HydrophobicContact CD2-CD1 3.88Å; L28-F85 HydrophobicContact CD2-CE1 4.43Å; L28-F85 HydrophobicContact CD2-CG 4.14Å; F81-F85 PolarHBondContact O-N 2.81Å; F81-F85 VanDerWaalsContact O-N 3.16Å; S82-F85 WeakPolarHBondContact O-CB 2.84Å; S82-F85 PolarHBondContact O-N 3.34Å; S82-F85 VanDerWaalsContact O-N 3.17Å; E83-F85 VanDerWaalsContact C-N 3.29Å; E83-F85 PolarHBondContact O-N 3.35Å; F85-S87 VanDerWaalsContact C-N 3.3Å; F85-S87 PolarHBondContact O-N 3.45Å
86	Y	82.2	Confident	79	Confident	73 Å²	73	54 Å²	54	29%	0.286	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	14.6	175.7	-71.1	-82.1	0	0	0	113.7	A24 Q25 L28 S82 E83 N84 L88	A24-Y86 HydrophobicContact CB-CD1 4.43Å; A24-Y86 HydrophobicContact CB-CE1 3.7Å; A24-Y86 HydrophobicContact CB-CE2 4.5Å; Q25-Y86 VanDerWaalsContact CA-CE2 3.46Å; Q25-Y86 HydrophobicContact CB-CD2 3.72Å; Q25-Y86 HydrophobicContact CB-CE2 4.17Å; Q25-Y86 HydrophobicContact CB-CG 4.36Å; Q25-Y86 HydrophobicContact CG-CD2 4.27Å; L28-Y86 HydrophobicContact CB-CE2 4.25Å; L28-Y86 HydrophobicContact CD2-CE2 3.98Å; S82-Y86 WeakPolarHBondContact O-CD2 3.42Å; S82-Y86 PolarHBondContact O-N 2.86Å; S82-Y86 VanDerWaalsContact O-N 3.12Å; E83-Y86 CarbonylContact O-C 3.43Å; E83-Y86 PolarHBondContact O-N 3.49Å; N84-Y86 VanDerWaalsContact C-N 3.33Å; Y86-L88 VanDerWaalsContact C-N 3.27Å; Y86-L88 PolarHBondContact O-N 2.86Å
87	S	84	Confident	78.3	Confident	68 Å²	68	52.3 Å²	52.3	48%	0.476	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	36.1	179.9	-54.3	0	0	0	0	114.1	E83 N84 F85 L199	E83-S87 PolarHBondContact O-N 3.34Å; E83-S87 VanDerWaalsContact O-N 3.1Å; N84-S87 PolarHBondContact O-N 3.23Å; F85-S87 VanDerWaalsContact C-N 3.3Å; F85-S87 PolarHBondContact O-N 3.45Å; S87-L199 VanDerWaalsContact O-CB 3.32Å; S87-L199 WeakPolarHBondContact O-CB 3.13Å; S87-L199 PolarHBondContact O-N 3.3Å
88	L	85.4	Confident	77.7	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	148.5	176.8	-57.1	178.5	0	0	0	110.9	P17 A79 E83 Y86 L196 A197	P17-L88 HydrophobicContact CB-CD1 4.46Å; P17-L88 HydrophobicContact CB-CD2 3.72Å; P17-L88 HydrophobicContact CG-CD2 4.38Å; A79-L88 VanDerWaalsContact CB-O 3.31Å; A79-L88 WeakPolarHBondContact CB-O 3.31Å; E83-L88 CarbonylContact C-O 3.44Å; E83-L88 HydrophobicContact CB-CB 4.12Å; E83-L88 HydrophobicContact CG-CB 4.48Å; E83-L88 PolarHBondContact O-N 2.92Å; Y86-L88 VanDerWaalsContact C-N 3.27Å; Y86-L88 PolarHBondContact O-N 2.86Å; L88-L196 HydrophobicContact CB-CD2 4.28Å; L88-A197 WeakPolarHBondContact CA-O 3.29Å
89	K	87.1	Confident	76.8	Confident	12 Å²	12	60.7 Å²	60.7	5%	0.052	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.5	175.2	66.4	176.4	178.3	-173.8	0	111.7	V91 A100 L196 A197 H198 L199 D203	K89-V91 HydrophobicContact CD-CG2 4.21Å; K89-V91 HydrophobicContact CG-CG2 4.12Å; K89-A100 HydrophobicContact CD-CB 4.16Å; K89-L196 CarbonylContact O-C 3.52Å; K89-L196 WeakPolarHBondContact O-CA 3.49Å; K89-A197 HydrophobicContact CG-CB 4.13Å; K89-A197 WeakPolarHBondContact CG-O 3.45Å; K89-A197 PolarHBondContact N-O 3.39Å; K89-A197 PolarHBondContact O-N 3.27Å; K89-H198 VanDerWaalsContact CE-O 3.23Å; K89-H198 WeakPolarHBondContact CE-O 3.24Å; K89-L199 HydrophobicContact CB-CD1 4.44Å; K89-L199 HydrophobicContact CD-CD1 4.4Å; K89-D203 IonicContact NZ-OD2 3.92Å; K89-D203 PolarHBondContact NZ-OD2 3.27Å
90	R	86.8	Confident	75.6	Confident	17 Å²	17	60.8 Å²	60.8	6%	0.064	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.8	172.9	-77.4	176.7	-175.2	-137	-8.5	110.9	S78 E83 L104 S112 L116 V194 L196	S78-R90 VanDerWaalsContact O-CB 3.28Å; S78-R90 WeakPolarHBondContact O-CB 3.49Å; S78-R90 PolarHBondContact O-N 3.49Å; E83-R90 IonicContact OE1-CZ 3.39Å; E83-R90 IonicContact OE1-NE 3.83Å; E83-R90 PolarHBondContact OE1-NE 3.09Å; E83-R90 IonicContact OE1-NH2 3.07Å; E83-R90 PolarHBondContact OE1-NH2 2.9Å; E83-R90 WeakPolarHBondContact OE2-CD 3.3Å; E83-R90 VanDerWaalsContact OE2-CG 3.3Å; E83-R90 WeakPolarHBondContact OE2-CG 2.9Å; E83-R90 IonicContact OE2-CZ 3.3Å; E83-R90 IonicContact OE2-NE 2.74Å; E83-R90 PolarHBondContact OE2-NE 3.47Å; E83-R90 IonicContact OE2-NH2 3.97Å; R90-L104 HydrophobicContact CB-CD1 3.8Å; R90-L104 HydrophobicContact CB-CD2 4.05Å; R90-L104 HydrophobicContact CB-CG 4.47Å; R90-S112 PolarHBondContact NH1-OG 3.07Å; R90-L116 VanDerWaalsContact CZ-CD1 3.49Å; R90-L116 VanDerWaalsContact NH2-CD1 3.29Å; R90-V194 HydrophobicContact CB-CG1 3.38Å; R90-V194 HydrophobicContact CG-CG1 3.59Å; R90-L196 HydrophobicContact CG-CD2 4.12Å
91	V	83.1	Confident	74.3	Confident	13 Å²	13	64.1 Å²	64.1	8%	0.079	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.7	177.1	-173.7	0	0	0	0	109.4	K89 A93 V194 R195 A197	K89-V91 HydrophobicContact CD-CG2 4.21Å; K89-V91 HydrophobicContact CG-CG2 4.12Å; V91-A93 PolarHBondContact O-N 3.23Å; V91-V194 CarbonylContact O-C 3.08Å; V91-V194 WeakPolarHBondContact O-CA 3.47Å; V91-R195 HydrophobicContact CB-CG 4.09Å; V91-R195 PolarHBondContact N-O 3.48Å; V91-R195 PolarHBondContact O-N 2.87Å; V91-A197 HydrophobicContact CG2-CB 3.89Å
92	A	81.5	Confident	73.1	Confident	39 Å²	39	66.3 Å²	66.3	32%	0.322	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	132	176.2	0	0	0	0	0	110.7	S94 G95	A92-S94 PolarHBondContact O-N 3.41Å; A92-S94 VanDerWaalsContact O-N 3.13Å; A92-G95 PolarHBondContact O-N 3.05Å
93	A	70.7	Confident	71.9	Confident	59 Å²	59	66.9 Å²	66.9	49%	0.488	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.6	-173.5	0	0	0	0	0	114.4	V91 G193	V91-A93 PolarHBondContact O-N 3.23Å; A93-G193 WeakPolarHBondContact CB-O 3.44Å; A93-G193 PolarHBondContact N-O 3.3Å
94	S	62.6	Low	71	Confident	126 Å²	126	68.1 Å²	68.1	88%	0.881	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	9.8	-173.1	-171.1	0	0	0	0	114	A92	A92-S94 PolarHBondContact O-N 3.41Å; A92-S94 VanDerWaalsContact O-N 3.13Å
95	G	56	Low	70.1	Confident	42 Å²	42	74.5 Å²	74.5	43%	0.433	38%	0.38	S	S	.	.	S	Bend	trans	-120.3	152.8	-172	0	0	0	0	0	114.2	A92 E97	A92-G95 PolarHBondContact O-N 3.05Å; G95-E97 PolarHBondContact O-N 3Å
96	R	56.1	Low	69.7	Low	243 Å²	243	70.8 Å²	70.8	92%	0.917	38%	0.375	S	S	*	.			trans	-51	130.5	168	-141.2	174.3	-169.8	170.6	1.7	108.9	R98	R96-R98 PolarHBondContact O-N 3.39Å
97	E	61.5	Low	69.5	Low	130 Å²	130	76 Å²	76	61%	0.607	40%	0.4	S	S	*	.			trans	-52	114.1	179.7	-68.5	175.9	178.3	0	0	109.5	G95 R195	G95-E97 PolarHBondContact O-N 3Å; E97-R195 IonicContact OE1-NH2 3.79Å; E97-R195 PolarHBondContact OE1-NH2 3.12Å
98	R	58.3	Low	69.4	Low	156 Å²	156	76.4 Å²	76.4	59%	0.589	39%	0.394	S	S	*	.			trans	-96	137.5	173.3	-76.9	-177.4	178.5	-171.5	-4.6	107.8	R96	R96-R98 PolarHBondContact O-N 3.39Å
99	P	60	Low	69.3	Low	47 Å²	47	77 Å²	77	31%	0.305	40%	0.396	S	S	.	.			trans	-65	143.9	180	22.7	-27	0	0	0	110.2	H101 L102 D203	P99-H101 VanDerWaalsContact CB-CE1 3.46Å; P99-H101 WeakPolarHBondContact CB-CE1 3.4Å; P99-H101 WeakPolarHBondContact CG-CE1 3.38Å; P99-H101 PolarHBondContact O-N 2.76Å; P99-L102 HydrophobicContact CG-CD1 3.84Å; P99-L102 PolarHBondContact O-N 3.1Å; P99-D203 WeakPolarHBondContact CA-OD1 3.26Å
100	A	59	Low	69.2	Low	2 Å²	2	83.7 Å²	83.7	2%	0.017	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-58.8	-20.8	-164	0	0	0	0	0	114.5	T77 S78 K89 L102 L199 D203	T77-A100 CarbonylContact C-O 3.52Å; S78-A100 WeakPolarHBondContact CB-O 3.37Å; S78-A100 PolarHBondContact OG-O 2.87Å; K89-A100 HydrophobicContact CD-CB 4.16Å; A100-L102 VanDerWaalsContact C-N 3.33Å; A100-L102 PolarHBondContact O-N 3.15Å; A100-L199 HydrophobicContact CB-CD1 3.98Å; A100-D203 HydrophobicContact CB-CB 4.17Å; A100-D203 PolarHBondContact N-OD1 3.18Å
101	H	58.8	Low	69.2	Low	73 Å²	73	85 Å²	85	34%	0.338	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-75	-10	-177	67.6	-99.4	0	0	0	115.6	P99 M207	P99-H101 VanDerWaalsContact CB-CE1 3.46Å; P99-H101 WeakPolarHBondContact CB-CE1 3.4Å; P99-H101 WeakPolarHBondContact CG-CE1 3.38Å; P99-H101 PolarHBondContact O-N 2.76Å; H101-M207 HydrophobicContact CB-CG 4.28Å
102	L	60.3	Low	69.4	Low	111 Å²	111	84.4 Å²	84.4	58%	0.581	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-90.9	-5.8	-177.9	-86.5	134.3	0	0	0	114.4	P99 A100	P99-L102 HydrophobicContact CG-CD1 3.84Å; P99-L102 PolarHBondContact O-N 3.1Å; A100-L102 VanDerWaalsContact C-N 3.33Å; A100-L102 PolarHBondContact O-N 3.15Å
103	G	60.6	Low	69.8	Low	15 Å²	15	83.1 Å²	83.1	16%	0.155	42%	0.417	C	S	.	.			trans	71.6	163.6	-178	0	0	0	0	0	113.7	S78	S78-G103 WeakPolarHBondContact OG-CA 3.45Å; S78-G103 PolarHBondContact OG-N 3.5Å
104	L	66.8	Low	70.7	Confident	25 Å²	25	83.8 Å²	83.8	13%	0.131	41%	0.411	C	S	.	.			trans	-72.3	138.7	173.3	-87.9	78.4	0	0	0	110.4	S78 R90 G106 H108 H109 V194	S78-L104 VanDerWaalsContact CA-CD1 3.45Å; S78-L104 WeakPolarHBondContact O-CD1 3.49Å; R90-L104 HydrophobicContact CB-CD1 3.8Å; R90-L104 HydrophobicContact CB-CD2 4.05Å; R90-L104 HydrophobicContact CB-CG 4.47Å; L104-G106 PolarHBondContact O-N 3.3Å; L104-H108 HydrophobicContact CD2-CB 4.3Å; L104-H109 HydrophobicContact CB-CB 4.04Å; L104-H109 WeakPolarHBondContact O-CB 3.4Å; L104-V194 HydrophobicContact CD2-CG2 3.95Å
105	R	68.1	Low	71.9	Confident	192 Å²	192	79.1 Å²	79.1	73%	0.725	38%	0.376	S	S	*	.			trans	-74.6	126.5	-179.9	-168.4	-178.7	178.9	-159.6	-0.1	111.1	K107 H108 H109	R105-K107 PolarHBondContact O-N 3.06Å; R105-H108 PolarHBondContact O-N 3.09Å; R105-H109 PolarHBondContact O-N 2.9Å
106	G	74.2	Confident	73.3	Confident	41 Å²	41	79.1 Å²	79.1	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	31.9	-95.8	159.8	0	0	0	0	0	116.4	L104 H108 H109 W110	L104-G106 PolarHBondContact O-N 3.3Å; G106-H108 PolarHBondContact O-N 2.93Å; G106-H109 WeakPolarHBondContact O-CB 3.43Å; G106-H109 PolarHBondContact O-N 3.39Å; G106-W110 PolarHBondContact O-N 2.71Å
107	K	78.9	Confident	74.8	Confident	184 Å²	184	67.8 Å²	67.8	80%	0.8	32%	0.324	S	S	*	.	H	α-helix	trans	-60.1	-40.6	-175.7	-62.8	-174.1	179.7	-175.5	0	113	R105 C111	R105-K107 PolarHBondContact O-N 3.06Å; K107-C111 WeakPolarHBondContact O-CB 3.43Å; K107-C111 PolarHBondContact O-N 2.98Å
108	H	81.6	Confident	76	Confident	75 Å²	75	65.4 Å²	65.4	35%	0.347	32%	0.315	S	S	.	.	H	α-helix	trans	-73.5	-31.6	178.4	-61	-70.5	0	0	0	112.2	L104 R105 G106 S112 A192 V194	L104-H108 HydrophobicContact CD2-CB 4.3Å; R105-H108 PolarHBondContact O-N 3.09Å; G106-H108 PolarHBondContact O-N 2.93Å; H108-S112 WeakPolarHBondContact O-CB 3.5Å; H108-S112 PolarHBondContact O-N 3.4Å; H108-S112 PolarHBondContact O-OG 3.45Å; H108-A192 PolarHBondContact ND1-O 3.41Å; H108-V194 HydrophobicContact CB-CG2 4.39Å
109	H	83.4	Confident	77.4	Confident	15 Å²	15	60 Å²	60	7%	0.069	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-53.6	173.9	-180	75.5	0	0	0	111.4	H71 L74 S75 L104 R105 G106 S112 L113	H71-H109 AromaticContact CE1-NE2 3.67Å; H71-H109 AromaticContact ND1-NE2 3.43Å; H71-H109 PolarHBondContact ND1-NE2 2.85Å; L74-H109 VanDerWaalsContact CB-CE1 3.46Å; L74-H109 WeakPolarHBondContact CB-CE1 3.29Å; S75-H109 PolarHBondContact OG-CE1 3.46Å; S75-H109 VanDerWaalsContact OG-CE1 3.26Å; L104-H109 HydrophobicContact CB-CB 4.04Å; L104-H109 WeakPolarHBondContact O-CB 3.4Å; R105-H109 PolarHBondContact O-N 2.9Å; G106-H109 WeakPolarHBondContact O-CB 3.43Å; G106-H109 PolarHBondContact O-N 3.39Å; H109-S112 PolarHBondContact O-N 3.39Å; H109-L113 VanDerWaalsContact O-CB 3.3Å; H109-L113 WeakPolarHBondContact O-CB 3.37Å; H109-L113 PolarHBondContact O-N 3.24Å
110	W	85.4	Confident	78.6	Confident	152 Å²	152	60.5 Å²	60.5	58%	0.576	30%	0.303	S	S	*	.	H	α-helix	trans	-65.4	-40.9	178.8	-80.4	103.8	0	0	0	112.4	G106 L113 I114	G106-W110 PolarHBondContact O-N 2.71Å; W110-L113 HydrophobicContact CE3-CD2 4.43Å; W110-L113 HydrophobicContact CZ3-CD2 4.44Å; W110-L113 PolarHBondContact O-N 3.31Å; W110-I114 WeakPolarHBondContact O-CB 3.49Å; W110-I114 WeakPolarHBondContact O-CD1 3.37Å; W110-I114 VanDerWaalsContact O-CG1 3.23Å; W110-I114 WeakPolarHBondContact O-CG1 3.4Å; W110-I114 PolarHBondContact O-N 3.24Å
111	C	87.2	Confident	80	Confident	45 Å²	45	63 Å²	63	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-63.5	-44.6	175.4	-169.5	0	0	0	0	111.2	K107 L113 I114 L115	K107-C111 WeakPolarHBondContact O-CB 3.43Å; K107-C111 PolarHBondContact O-N 2.98Å; C111-L113 PolarHBondContact O-N 2.87Å; C111-I114 PolarHBondContact O-N 3.3Å; C111-L115 WeakPolarHBondContact O-CB 3.27Å; C111-L115 VanDerWaalsContact O-CG 3.23Å; C111-L115 WeakPolarHBondContact O-CG 3.47Å; C111-L115 PolarHBondContact O-N 3.1Å
112	S	87.4	Confident	81.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-45.1	174.9	-72.8	0	0	0	0	112.6	R90 H108 H109 L115 L116	R90-S112 PolarHBondContact NH1-OG 3.07Å; H108-S112 WeakPolarHBondContact O-CB 3.5Å; H108-S112 PolarHBondContact O-N 3.4Å; H108-S112 PolarHBondContact O-OG 3.45Å; H109-S112 PolarHBondContact O-N 3.39Å; S112-L115 PolarHBondContact O-N 2.95Å; S112-L116 VanDerWaalsContact O-CB 3.25Å; S112-L116 WeakPolarHBondContact O-CB 3.48Å; S112-L116 WeakPolarHBondContact O-CG 3.41Å; S112-L116 PolarHBondContact O-N 3.33Å
113	L	88.4	Confident	82.8	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	31%	0.305	C	S	.	.	H	α-helix	trans	-65.6	-43	-179.4	-177.7	148.9	0	0	0	111.7	V67 H71 L74 H109 W110 C111 L116 A117	V67-L113 HydrophobicContact CG1-CD2 4.36Å; H71-L113 HydrophobicContact CB-CD1 3.7Å; L74-L113 HydrophobicContact CD1-CB 4.1Å; H109-L113 VanDerWaalsContact O-CB 3.3Å; H109-L113 WeakPolarHBondContact O-CB 3.37Å; H109-L113 PolarHBondContact O-N 3.24Å; W110-L113 HydrophobicContact CE3-CD2 4.43Å; W110-L113 HydrophobicContact CZ3-CD2 4.44Å; W110-L113 PolarHBondContact O-N 3.31Å; C111-L113 PolarHBondContact O-N 2.87Å; L113-L116 PolarHBondContact O-N 2.98Å; L113-A117 PolarHBondContact O-N 3.23Å
114	I	89.6	Confident	84	Confident	74 Å²	74	62.1 Å²	62.1	38%	0.379	30%	0.302	S	S	.	.	I	π-helix	trans	-62.4	-46	176.1	-72	167.1	0	0	0	110.4	W110 C111 L118 V119	W110-I114 WeakPolarHBondContact O-CB 3.49Å; W110-I114 WeakPolarHBondContact O-CD1 3.37Å; W110-I114 VanDerWaalsContact O-CG1 3.23Å; W110-I114 WeakPolarHBondContact O-CG1 3.4Å; W110-I114 PolarHBondContact O-N 3.24Å; C111-I114 PolarHBondContact O-N 3.3Å; I114-L118 HydrophobicContact CG2-CB 4.27Å; I114-L118 HydrophobicContact CG2-CD2 4.1Å; I114-L118 WeakPolarHBondContact O-CA 3.32Å; I114-L118 VanDerWaalsContact O-CB 3.27Å; I114-L118 WeakPolarHBondContact O-CB 3.3Å; I114-L118 PolarHBondContact O-N 3.39Å; I114-V119 PolarHBondContact O-N 3.3Å; I114-V119 VanDerWaalsContact O-N 3.1Å
115	L	88.4	Confident	85	Confident	28 Å²	28	63.8 Å²	63.8	15%	0.147	31%	0.308	C	S	.	.	I	π-helix	trans	-70.2	-32.4	-177.9	-66.7	177	0	0	0	113	C111 S112 V119 F188 L191 A192	C111-L115 WeakPolarHBondContact O-CB 3.27Å; C111-L115 VanDerWaalsContact O-CG 3.23Å; C111-L115 WeakPolarHBondContact O-CG 3.47Å; C111-L115 PolarHBondContact O-N 3.1Å; S112-L115 PolarHBondContact O-N 2.95Å; L115-V119 HydrophobicContact CD2-CG2 3.83Å; L115-F188 HydrophobicContact CB-CB 4.33Å; L115-F188 HydrophobicContact CB-CD1 4.35Å; L115-F188 HydrophobicContact CD1-CB 4.46Å; L115-F188 WeakPolarHBondContact CD1-O 3.23Å; L115-F188 HydrophobicContact CD2-CD1 4.05Å; L115-L191 HydrophobicContact CD1-CB 4.02Å; L115-A192 HydrophobicContact CD1-CB 4.18Å
116	L	85.7	Confident	86	Confident	42 Å²	42	58 Å²	58	22%	0.22	29%	0.291	C	S	.	.	I	π-helix	trans	-81	-37.1	179.7	-81.8	174.2	0	0	0	114.5	Q70 L74 R90 S112 L113 P120	Q70-L116 PolarHBondContact NE2-O 2.9Å; L74-L116 HydrophobicContact CD1-CD1 4.21Å; R90-L116 VanDerWaalsContact CZ-CD1 3.49Å; R90-L116 VanDerWaalsContact NH2-CD1 3.29Å; S112-L116 VanDerWaalsContact O-CB 3.25Å; S112-L116 WeakPolarHBondContact O-CB 3.48Å; S112-L116 WeakPolarHBondContact O-CG 3.41Å; S112-L116 PolarHBondContact O-N 3.33Å; L113-L116 PolarHBondContact O-N 2.98Å; L116-P120 WeakPolarHBondContact O-CG 3.27Å
117	A	86.4	Confident	86.6	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.033	29%	0.289	C	S	.	.	I	π-helix	trans	-108.1	-48.3	-175.8	0	0	0	0	0	112.9	V67 Q70 L113 P120 Y121	V67-A117 HydrophobicContact CB-CB 4.5Å; V67-A117 HydrophobicContact CG2-CB 3.58Å; Q70-A117 VanDerWaalsContact OE1-CB 3.23Å; L113-A117 PolarHBondContact O-N 3.23Å; A117-P120 WeakPolarHBondContact O-CD 3.43Å; A117-P120 WeakPolarHBondContact O-CG 3.41Å; A117-Y121 WeakPolarHBondContact O-CB 3.41Å; A117-Y121 PolarHBondContact O-N 2.56Å
118	L	87.1	Confident	87	Confident	80 Å²	80	54.5 Å²	54.5	42%	0.419	27%	0.267	S	S	.	.	I	π-helix	trans	-74.1	-44.2	-171.3	-174.8	65	0	0	0	111.7	I114 Y121 L122	I114-L118 HydrophobicContact CG2-CB 4.27Å; I114-L118 HydrophobicContact CG2-CD2 4.1Å; I114-L118 WeakPolarHBondContact O-CA 3.32Å; I114-L118 VanDerWaalsContact O-CB 3.27Å; I114-L118 WeakPolarHBondContact O-CB 3.3Å; I114-L118 PolarHBondContact O-N 3.39Å; L118-Y121 PolarHBondContact O-N 3.21Å; L118-L122 HydrophobicContact CD1-CD1 4.36Å; L118-L122 HydrophobicContact CD1-CG 4.28Å; L118-L122 HydrophobicContact CD2-CD1 4.44Å; L118-L122 HydrophobicContact CG-CD1 3.93Å; L118-L122 HydrophobicContact CG-CG 4.28Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.28Å; L118-L122 PolarHBondContact O-N 3.08Å
119	V	88.1	Confident	87.2	Confident	43 Å²	43	53.7 Å²	53.7	26%	0.261	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-51.1	179.4	176.2	0	0	0	0	113	I114 L115 Y121 L122 R123 F188	I114-V119 PolarHBondContact O-N 3.3Å; I114-V119 VanDerWaalsContact O-N 3.1Å; L115-V119 HydrophobicContact CD2-CG2 3.83Å; V119-Y121 VanDerWaalsContact C-N 3.29Å; V119-Y121 PolarHBondContact O-N 3.34Å; V119-L122 PolarHBondContact O-N 2.82Å; V119-R123 PolarHBondContact O-N 2.99Å; V119-F188 HydrophobicContact CB-CE1 4.43Å; V119-F188 HydrophobicContact CG1-CE1 3.71Å; V119-F188 HydrophobicContact CG1-CZ 3.85Å
120	P	85.8	Confident	87.3	Confident	58 Å²	58	53.8 Å²	53.8	38%	0.377	27%	0.268	S	S	.	.	H	α-helix	trans	-65.7	-32.3	178.3	22.1	-30.8	0	0	0	112.8	L116 A117 A124	L116-P120 WeakPolarHBondContact O-CG 3.27Å; A117-P120 WeakPolarHBondContact O-CD 3.43Å; A117-P120 WeakPolarHBondContact O-CG 3.41Å; P120-A124 WeakPolarHBondContact O-CB 3.11Å; P120-A124 PolarHBondContact O-N 2.97Å
121	Y	88.5	Confident	87.3	Confident	55 Å²	55	48.8 Å²	48.8	22%	0.216	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-47.5	172	172.4	-89.7	0	0	0	111.6	E60 A117 L118 V119 A124 K125	E60-Y121 VanDerWaalsContact CD-OH 3.24Å; E60-Y121 PolarHBondContact OE1-OH 2.74Å; E60-Y121 PolarHBondContact OE2-OH 3.33Å; A117-Y121 WeakPolarHBondContact O-CB 3.41Å; A117-Y121 PolarHBondContact O-N 2.56Å; L118-Y121 PolarHBondContact O-N 3.21Å; V119-Y121 VanDerWaalsContact C-N 3.29Å; V119-Y121 PolarHBondContact O-N 3.34Å; Y121-A124 PolarHBondContact O-N 3.43Å; Y121-K125 HydrophobicContact CD1-CG 4.41Å; Y121-K125 HydrophobicContact CE1-CG 3.9Å; Y121-K125 HydrophobicContact CE2-CG 4.39Å; Y121-K125 PolarHBondContact O-N 3.31Å; Y121-K125 WeakPolarHBondContact OH-CE 3.23Å
122	L	88.6	Confident	87.1	Confident	87 Å²	87	53.1 Å²	53.1	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-44.6	177.9	-70.8	174	0	0	0	111.8	L118 V119 A124 K125 L126	L118-L122 HydrophobicContact CD1-CD1 4.36Å; L118-L122 HydrophobicContact CD1-CG 4.28Å; L118-L122 HydrophobicContact CD2-CD1 4.44Å; L118-L122 HydrophobicContact CG-CD1 3.93Å; L118-L122 HydrophobicContact CG-CG 4.28Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.28Å; L118-L122 PolarHBondContact O-N 3.08Å; V119-L122 PolarHBondContact O-N 2.82Å; L122-A124 VanDerWaalsContact C-N 3.31Å; L122-A124 PolarHBondContact O-N 3.45Å; L122-K125 PolarHBondContact O-N 3.03Å; L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 3Å
123	R	88.1	Confident	86.6	Confident	81 Å²	81	54.9 Å²	54.9	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-56	-47.5	175	-177.1	175.7	176.6	158.1	3	110.7	V119 K125 L126 E127 D167	V119-R123 PolarHBondContact O-N 2.99Å; R123-K125 PolarHBondContact O-N 3.16Å; R123-L126 WeakPolarHBondContact O-CB 3.27Å; R123-L126 PolarHBondContact O-N 2.98Å; R123-E127 WeakPolarHBondContact CG-OE1 3.05Å; R123-E127 IonicContact CZ-OE1 2.84Å; R123-E127 IonicContact NE-OE1 2.82Å; R123-E127 PolarHBondContact NE-OE1 2.95Å; R123-E127 WeakPolarHBondContact O-CG 3.49Å; R123-E127 PolarHBondContact O-N 3.23Å; R123-D167 IonicContact CZ-OD1 3.31Å; R123-D167 IonicContact NH1-OD1 2.98Å; R123-D167 PolarHBondContact NH1-OD1 3.47Å; R123-D167 IonicContact NH2-OD1 2.88Å; R123-D167 PolarHBondContact NH2-OD1 2.95Å; R123-D167 IonicContact NH2-OD2 2.86Å; R123-D167 PolarHBondContact NH2-OD2 3.14Å
124	A	86.3	Confident	86.2	Confident	11 Å²	11	61.3 Å²	61.3	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-65.4	-38.1	179	0	0	0	0	0	113.4	P120 Y121 L122 E127 Q128	P120-A124 WeakPolarHBondContact O-CB 3.11Å; P120-A124 PolarHBondContact O-N 2.97Å; Y121-A124 PolarHBondContact O-N 3.43Å; L122-A124 VanDerWaalsContact C-N 3.31Å; L122-A124 PolarHBondContact O-N 3.45Å; A124-E127 PolarHBondContact O-N 3.47Å; A124-Q128 VanDerWaalsContact O-CG 3.28Å; A124-Q128 WeakPolarHBondContact O-CG 3.36Å; A124-Q128 PolarHBondContact O-N 3.39Å
125	K	88.6	Confident	85.6	Confident	61 Å²	61	62.3 Å²	62.3	27%	0.265	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-41.2	173.7	-78.5	-66.8	-165.6	-178	0	111.8	E60 Y121 L122 R123 Q128 V129	E60-K125 VanDerWaalsContact OE1-CE 3.31Å; E60-K125 WeakPolarHBondContact OE1-CE 3.23Å; E60-K125 IonicContact OE1-NZ 2.69Å; E60-K125 PolarHBondContact OE1-NZ 3.22Å; Y121-K125 HydrophobicContact CD1-CG 4.41Å; Y121-K125 HydrophobicContact CE1-CG 3.9Å; Y121-K125 HydrophobicContact CE2-CG 4.39Å; Y121-K125 PolarHBondContact O-N 3.31Å; Y121-K125 WeakPolarHBondContact OH-CE 3.23Å; L122-K125 PolarHBondContact O-N 3.03Å; R123-K125 PolarHBondContact O-N 3.16Å; K125-Q128 PolarHBondContact O-N 3.09Å; K125-V129 VanDerWaalsContact O-CG2 3.3Å; K125-V129 WeakPolarHBondContact O-CG2 3.31Å; K125-V129 PolarHBondContact O-N 3.12Å
126	L	88.1	Confident	84.9	Confident	69 Å²	69	65.1 Å²	65.1	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-63.1	-43.7	176	-72.7	168.2	0	0	0	111.5	L122 R123 Q128 V129 L130 Y159	L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 3Å; R123-L126 WeakPolarHBondContact O-CB 3.27Å; R123-L126 PolarHBondContact O-N 2.98Å; L126-Q128 PolarHBondContact O-N 3.39Å; L126-V129 PolarHBondContact O-N 2.9Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 3.32Å; L126-Y159 HydrophobicContact CB-CE2 4.17Å; L126-Y159 HydrophobicContact CD1-CE2 4.18Å
127	E	87.7	Confident	84.3	Confident	81 Å²	81	66.1 Å²	66.1	38%	0.379	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.7	-73.6	170.5	-174.5	0	0	112.2	R123 A124 V129 L130 A131 Y159	R123-E127 WeakPolarHBondContact CG-OE1 3.05Å; R123-E127 IonicContact CZ-OE1 2.84Å; R123-E127 IonicContact NE-OE1 2.82Å; R123-E127 PolarHBondContact NE-OE1 2.95Å; R123-E127 WeakPolarHBondContact O-CG 3.49Å; R123-E127 PolarHBondContact O-N 3.23Å; A124-E127 PolarHBondContact O-N 3.47Å; E127-V129 PolarHBondContact O-N 2.94Å; E127-L130 PolarHBondContact O-N 3.23Å; E127-A131 WeakPolarHBondContact O-CB 3.4Å; E127-A131 PolarHBondContact O-N 2.92Å; E127-Y159 HydrophobicContact CG-CE1 4.19Å; E127-Y159 WeakPolarHBondContact CG-OH 3.44Å; E127-Y159 PolarHBondContact OE1-OH 3.3Å
128	Q	86.6	Confident	83.5	Confident	72 Å²	72	68.8 Å²	68.8	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-43.2	173.7	-75.2	176.3	0.1	0	0	112.3	D59 A124 K125 L126 A131 K132	D59-Q128 PolarHBondContact OD2-NE2 3.04Å; A124-Q128 VanDerWaalsContact O-CG 3.28Å; A124-Q128 WeakPolarHBondContact O-CG 3.36Å; A124-Q128 PolarHBondContact O-N 3.39Å; K125-Q128 PolarHBondContact O-N 3.09Å; L126-Q128 PolarHBondContact O-N 3.39Å; Q128-A131 PolarHBondContact O-N 2.86Å; Q128-K132 PolarHBondContact O-N 3.06Å; Q128-K132 VanDerWaalsContact O-N 3.09Å
129	V	85.3	Confident	82.5	Confident	57 Å²	57	68.6 Å²	68.6	35%	0.345	34%	0.338	S	S	.	.	H	α-helix	trans	-66.3	-42.2	177.7	168.5	0	0	0	0	110.9	K125 L126 E127 K132 Q133 Y152 L156	K125-V129 VanDerWaalsContact O-CG2 3.3Å; K125-V129 WeakPolarHBondContact O-CG2 3.31Å; K125-V129 PolarHBondContact O-N 3.12Å; L126-V129 PolarHBondContact O-N 2.9Å; E127-V129 PolarHBondContact O-N 2.94Å; V129-K132 PolarHBondContact O-N 3.19Å; V129-Q133 PolarHBondContact O-N 3.48Å; V129-Y152 WeakPolarHBondContact CG1-OH 3.49Å; V129-L156 HydrophobicContact CG1-CD2 4.47Å
130	L	86.2	Confident	81.1	Confident	17 Å²	17	67.8 Å²	67.8	9%	0.089	33%	0.334	C	S	.	.	H	α-helix	trans	-64.7	-40.7	176.8	-176.9	65.6	0	0	0	112	L126 E127 Q133 R134 L156 Y159	L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 3.32Å; E127-L130 PolarHBondContact O-N 3.23Å; L130-Q133 PolarHBondContact O-N 3.03Å; L130-R134 WeakPolarHBondContact O-CG 3.29Å; L130-R134 PolarHBondContact O-N 3.3Å; L130-L156 HydrophobicContact CD1-CB 4.16Å; L130-L156 HydrophobicContact CD1-CD2 4.29Å; L130-Y159 HydrophobicContact CD2-CD1 3.56Å; L130-Y159 HydrophobicContact CD2-CE1 4.06Å; L130-Y159 HydrophobicContact CD2-CG 4.48Å
131	A	84.9	Confident	79.9	Confident	47 Å²	47	68.5 Å²	68.5	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-60	-49.3	175.6	0	0	0	0	0	110.9	E127 Q128 Q133 R134 D135	E127-A131 WeakPolarHBondContact O-CB 3.4Å; E127-A131 PolarHBondContact O-N 2.92Å; Q128-A131 PolarHBondContact O-N 2.86Å; A131-Q133 VanDerWaalsContact C-N 3.28Å; A131-Q133 PolarHBondContact O-N 3.05Å; A131-R134 PolarHBondContact O-N 3.48Å; A131-R134 VanDerWaalsContact O-N 3.16Å; A131-D135 VanDerWaalsContact O-CG 3.3Å; A131-D135 PolarHBondContact O-N 2.97Å
132	K	82.9	Confident	78.5	Confident	137 Å²	137	74.8 Å²	74.8	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-58.5	-40.4	176.4	-170.3	-177.1	177.2	-172.5	0	112.3	Q128 V129 D135 E136	Q128-K132 PolarHBondContact O-N 3.06Å; Q128-K132 VanDerWaalsContact O-N 3.09Å; V129-K132 PolarHBondContact O-N 3.19Å; K132-D135 PolarHBondContact O-N 2.93Å; K132-E136 WeakPolarHBondContact CE-OE1 3.38Å; K132-E136 WeakPolarHBondContact O-CG 3.44Å; K132-E136 PolarHBondContact O-N 2.89Å
133	Q	77.4	Confident	77	Confident	36 Å²	36	76.3 Å²	76.3	17%	0.168	37%	0.365	C	S	.	.	H	α-helix	trans	-68.5	-40.1	178	-171.6	64.5	37.5	0	0	112.4	V129 L130 A131 D135 E136 D137 L156	V129-Q133 PolarHBondContact O-N 3.48Å; L130-Q133 PolarHBondContact O-N 3.03Å; A131-Q133 VanDerWaalsContact C-N 3.28Å; A131-Q133 PolarHBondContact O-N 3.05Å; Q133-D135 VanDerWaalsContact C-N 3.3Å; Q133-E136 PolarHBondContact O-N 3.32Å; Q133-D137 WeakPolarHBondContact O-CB 3.38Å; Q133-D137 PolarHBondContact O-N 3.48Å; Q133-L156 HydrophobicContact CB-CD1 4.24Å; Q133-L156 HydrophobicContact CG-CD1 4.05Å
134	R	79.5	Confident	75.4	Confident	148 Å²	148	78.3 Å²	78.3	56%	0.558	39%	0.389	S	S	*	.	H	α-helix	trans	-60.4	-43	174.7	-78.6	-180	-179.1	168.6	0.4	110.6	L130 A131 D137 D138	L130-R134 WeakPolarHBondContact O-CG 3.29Å; L130-R134 PolarHBondContact O-N 3.3Å; A131-R134 PolarHBondContact O-N 3.48Å; A131-R134 VanDerWaalsContact O-N 3.16Å; R134-D137 PolarHBondContact O-N 2.92Å; R134-D138 VanDerWaalsContact O-CB 3.29Å; R134-D138 WeakPolarHBondContact O-CB 3.16Å; R134-D138 PolarHBondContact O-N 2.86Å
135	D	77	Confident	74.3	Confident	94 Å²	94	82.3 Å²	82.3	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-59.6	-49.9	175.2	-64	-21.1	0	0	0	110.6	A131 K132 Q133 D137 D138 F139	A131-D135 VanDerWaalsContact O-CG 3.3Å; A131-D135 PolarHBondContact O-N 2.97Å; K132-D135 PolarHBondContact O-N 2.93Å; Q133-D135 VanDerWaalsContact C-N 3.3Å; D135-D137 VanDerWaalsContact C-N 3.34Å; D135-D137 PolarHBondContact O-N 3.4Å; D135-D138 PolarHBondContact O-N 3.37Å; D135-F139 HydrophobicContact CB-CD2 4.43Å; D135-F139 HydrophobicContact CB-CE2 4.08Å; D135-F139 WeakPolarHBondContact O-CD2 3.49Å; D135-F139 WeakPolarHBondContact O-CG 3.43Å; D135-F139 PolarHBondContact O-N 3.21Å
136	E	75.4	Confident	73.9	Confident	88 Å²	88	82.8 Å²	82.8	41%	0.411	41%	0.414	S	S	.	.	H	α-helix	trans	-60.3	-39.1	178.3	-73.1	178.8	-170.3	0	0	113.5	K132 Q133 F139 S140	K132-E136 WeakPolarHBondContact CE-OE1 3.38Å; K132-E136 WeakPolarHBondContact O-CG 3.44Å; K132-E136 PolarHBondContact O-N 2.89Å; Q133-E136 PolarHBondContact O-N 3.32Å; E136-F139 CarbonylContact O-C 3.55Å; E136-F139 PolarHBondContact O-N 2.91Å; E136-S140 PolarHBondContact O-N 3.39Å
137	D	72.1	Confident	73.6	Confident	62 Å²	62	84.8 Å²	84.8	33%	0.332	43%	0.431	S	S	.	.	H	α-helix	trans	-68	-39.4	176	-85.4	-25.3	0	0	0	111.9	Q133 R134 D135 F139 S140 R153	Q133-D137 WeakPolarHBondContact O-CB 3.38Å; Q133-D137 PolarHBondContact O-N 3.48Å; R134-D137 PolarHBondContact O-N 2.92Å; D135-D137 VanDerWaalsContact C-N 3.34Å; D135-D137 PolarHBondContact O-N 3.4Å; D137-F139 PolarHBondContact O-N 2.98Å; D137-S140 PolarHBondContact O-N 3.35Å; D137-R153 IonicContact OD1-CZ 3.62Å; D137-R153 IonicContact OD1-NH1 3.31Å; D137-R153 PolarHBondContact OD1-NH1 3.49Å; D137-R153 IonicContact OD1-NH2 2.92Å; D137-R153 PolarHBondContact OD1-NH2 3.41Å; D137-R153 IonicContact OD2-CZ 3.65Å; D137-R153 IonicContact OD2-NE 3.46Å; D137-R153 IonicContact OD2-NH2 3.42Å; D137-R153 PolarHBondContact OD2-NH2 2.99Å
138	D	69.5	Low	73.4	Confident	61 Å²	61	87.6 Å²	87.6	33%	0.326	45%	0.448	S	S	.	.	H	α-helix	trans	-68.2	-26.1	177	-156.9	38.7	0	0	0	111.8	R134 D135 S140 N304 K344 Y346	R134-D138 VanDerWaalsContact O-CB 3.29Å; R134-D138 WeakPolarHBondContact O-CB 3.16Å; R134-D138 PolarHBondContact O-N 2.86Å; D135-D138 PolarHBondContact O-N 3.37Å; D138-S140 VanDerWaalsContact C-N 3.33Å; D138-N304 PolarHBondContact O-ND2 3.21Å; D138-K344 PolarHBondContact O-NZ 3.23Å; D138-K344 IonicContact OD1-NZ 3.44Å; D138-K344 PolarHBondContact OD1-NZ 3.41Å; D138-K344 IonicContact OD2-NZ 3.18Å; D138-K344 PolarHBondContact OD2-NZ 2.8Å; D138-Y346 PolarHBondContact OD2-OH 3.41Å
139	F	65.6	Low	73.1	Confident	76 Å²	76	88.2 Å²	88.2	33%	0.333	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	3.1	168.8	-64.1	-51.7	0	0	0	114	D135 E136 D137 I141 Y317	D135-F139 HydrophobicContact CB-CD2 4.43Å; D135-F139 HydrophobicContact CB-CE2 4.08Å; D135-F139 WeakPolarHBondContact O-CD2 3.49Å; D135-F139 WeakPolarHBondContact O-CG 3.43Å; D135-F139 PolarHBondContact O-N 3.21Å; E136-F139 CarbonylContact O-C 3.55Å; E136-F139 PolarHBondContact O-N 2.91Å; D137-F139 PolarHBondContact O-N 2.98Å; F139-I141 HydrophobicContact CB-CD1 4.49Å; F139-I141 HydrophobicContact CB-CG1 4.44Å; F139-I141 WeakPolarHBondContact O-CG1 3.42Å; F139-I141 PolarHBondContact O-N 2.95Å; F139-Y317 HydrophobicContact CB-CD1 4.27Å; F139-Y317 HydrophobicContact CB-CE1 3.51Å; F139-Y317 HydrophobicContact CD1-CD2 4.24Å; F139-Y317 AromaticContact CD1-CE1 3.88Å; F139-Y317 HydrophobicContact CD1-CE1 3.88Å; F139-Y317 AromaticContact CD1-CE2 3.47Å; F139-Y317 HydrophobicContact CD1-CE2 3.47Å; F139-Y317 VanDerWaalsContact CD1-CE2 3.47Å; F139-Y317 AromaticContact CD1-CZ 3.24Å; F139-Y317 WeakPolarHBondContact CD1-OH 3.09Å; F139-Y317 HydrophobicContact CE1-CE2 4.04Å; F139-Y317 HydrophobicContact CG-CE1 4.08Å; F139-Y317 HydrophobicContact CG-CE2 4.42Å; F139-Y317 AromaticContact CG-CZ 3.76Å; F139-Y317 WeakPolarHBondContact CG-OH 3.48Å; F139-Y317 WeakPolarHBondContact O-CD1 3.47Å; F139-Y317 WeakPolarHBondContact O-CE1 3.04Å
140	S	60.1	Low	72.9	Confident	25 Å²	25	94.5 Å²	94.5	18%	0.175	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	20.9	170.1	69.3	0	0	0	0	116.5	E136 D137 D138 R142 R318	E136-S140 PolarHBondContact O-N 3.39Å; D137-S140 PolarHBondContact O-N 3.35Å; D138-S140 VanDerWaalsContact C-N 3.33Å; S140-R142 PolarHBondContact O-N 2.94Å; S140-R318 WeakPolarHBondContact O-CD 3.15Å
141	I	60.8	Low	72.8	Confident	74 Å²	74	100.6 Å²	100.6	38%	0.379	50%	0.498	S	S	.	.			trans	-81.5	84.4	178.7	-54.6	174.9	0	0	0	108.5	F139 L143 Y317 Y321	F139-I141 HydrophobicContact CB-CD1 4.49Å; F139-I141 HydrophobicContact CB-CG1 4.44Å; F139-I141 WeakPolarHBondContact O-CG1 3.42Å; F139-I141 PolarHBondContact O-N 2.95Å; I141-L143 HydrophobicContact CG2-CD1 3.58Å; I141-L143 PolarHBondContact O-N 3Å; I141-Y317 HydrophobicContact CG1-CE1 4.46Å; I141-Y321 HydrophobicContact CD1-CD1 4.28Å; I141-Y321 HydrophobicContact CD1-CE1 3.84Å
142	R	57.7	Low	72.7	Confident	187 Å²	187	103.4 Å²	103.4	71%	0.706	50%	0.499	S	S	*	.			trans	-75.4	88.9	173.3	-62.1	-98.2	-173.6	176.4	0.2	109.5	S140	S140-R142 PolarHBondContact O-N 2.94Å
143	L	56.8	Low	72.6	Confident	119 Å²	119	100 Å²	100	62%	0.623	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-67.6	148.6	164.9	-105.8	75.6	0	0	0	110.1	I141 Q145	I141-L143 HydrophobicContact CG2-CD1 3.58Å; I141-L143 PolarHBondContact O-N 3Å; L143-Q145 VanDerWaalsContact O-CG 3.26Å; L143-Q145 WeakPolarHBondContact O-CG 3.3Å; L143-Q145 PolarHBondContact O-N 3.46Å
144	P	54.4	Low	72.9	Confident	123 Å²	123	101.2 Å²	101.2	80%	0.799	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-61.7	123.6	176.9	20.5	-25	0	0	0	110
145	Q	63.7	Low	73.3	Confident	94 Å²	94	100.4 Å²	100.4	44%	0.439	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-97.1	128.2	-165	-62	-149.7	-30.3	0	0	112.6	L143	L143-Q145 VanDerWaalsContact O-CG 3.26Å; L143-Q145 WeakPolarHBondContact O-CG 3.3Å; L143-Q145 PolarHBondContact O-N 3.46Å
146	T	80.5	Confident	73.6	Confident	72 Å²	72	96.3 Å²	96.3	44%	0.442	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-73.5	154.3	165.2	57.9	0	0	0	0	110	L148 Q149 R150	T146-L148 PolarHBondContact O-N 3.39Å; T146-L148 VanDerWaalsContact O-N 3.14Å; T146-Q149 WeakPolarHBondContact O-CB 3.24Å; T146-Q149 PolarHBondContact O-N 2.88Å; T146-Q149 WeakPolarHBondContact OG1-CG 3.46Å; T146-R150 PolarHBondContact O-N 3.34Å
147	P	82.4	Confident	73.9	Confident	111 Å²	111	95 Å²	95	72%	0.721	48%	0.482	S	S	*	.	H	α-helix	trans	-57.2	-31.6	-179.9	21.7	-33.5	0	0	0	112.9	R150 M151	P147-R150 WeakPolarHBondContact O-CB 3.42Å; P147-R150 PolarHBondContact O-N 3.42Å; P147-M151 PolarHBondContact O-N 2.93Å; P147-M151 VanDerWaalsContact O-N 3.14Å
148	L	81.8	Confident	74.7	Confident	140 Å²	140	94 Å²	94	73%	0.733	48%	0.482	S	S	*	.	H	α-helix	trans	-65.9	-38.3	176.2	-168.8	127.9	0	0	0	112.7	T146 R150 M151 Y152	T146-L148 PolarHBondContact O-N 3.39Å; T146-L148 VanDerWaalsContact O-N 3.14Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 3.06Å; L148-M151 PolarHBondContact O-N 2.95Å; L148-Y152 WeakPolarHBondContact O-CB 3.41Å; L148-Y152 PolarHBondContact O-N 2.99Å
149	Q	80.7	Confident	75.7	Confident	85 Å²	85	92.6 Å²	92.6	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-68.2	-31.6	175.1	-72.2	173.3	-12.1	0	0	112.2	T146 R153	T146-Q149 WeakPolarHBondContact O-CB 3.24Å; T146-Q149 PolarHBondContact O-N 2.88Å; T146-Q149 WeakPolarHBondContact OG1-CG 3.46Å; Q149-R153 WeakPolarHBondContact O-CB 3.41Å; Q149-R153 PolarHBondContact O-N 3Å
150	R	81.9	Confident	76.8	Confident	188 Å²	188	90.9 Å²	90.9	71%	0.709	47%	0.469	S	S	*	.	H	α-helix	trans	-68.1	-42.3	175.3	-166.8	174.3	-175.3	167.1	0.3	111.7	T146 P147 L148 R153 A154	T146-R150 PolarHBondContact O-N 3.34Å; P147-R150 WeakPolarHBondContact O-CB 3.42Å; P147-R150 PolarHBondContact O-N 3.42Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 3.06Å; R150-R153 PolarHBondContact O-N 3.27Å; R150-A154 PolarHBondContact O-N 3.47Å
151	M	82.8	Confident	78.3	Confident	146 Å²	146	98.4 Å²	98.4	72%	0.719	50%	0.495	S	S	*	.	H	α-helix	trans	-64	-44.3	173.1	-76.8	-151	62.4	0	0	112.4	P147 L148 R153 A154 F155	P147-M151 PolarHBondContact O-N 2.93Å; P147-M151 VanDerWaalsContact O-N 3.14Å; L148-M151 PolarHBondContact O-N 2.95Å; M151-R153 VanDerWaalsContact C-N 3.31Å; M151-R153 PolarHBondContact O-N 3.45Å; M151-A154 PolarHBondContact O-N 3Å; M151-F155 PolarHBondContact O-N 3.34Å
152	Y	83.5	Confident	79.8	Confident	106 Å²	106	99.4 Å²	99.4	42%	0.416	50%	0.504	S	S	.	.	H	α-helix	trans	-57.7	-43.3	175.6	174.5	-105.4	0	0	0	112.2	V129 L148 F155 L156	V129-Y152 WeakPolarHBondContact CG1-OH 3.49Å; L148-Y152 WeakPolarHBondContact O-CB 3.41Å; L148-Y152 PolarHBondContact O-N 2.99Å; Y152-F155 PolarHBondContact O-N 2.91Å; Y152-L156 HydrophobicContact CD1-CD1 3.93Å; Y152-L156 HydrophobicContact CE1-CD1 3.35Å; Y152-L156 HydrophobicContact CE1-CG 4.35Å; Y152-L156 HydrophobicContact CE2-CD1 4.11Å; Y152-L156 HydrophobicContact CE2-CG 4.36Å; Y152-L156 VanDerWaalsContact CZ-CD1 3.48Å; Y152-L156 WeakPolarHBondContact O-CG 3.3Å; Y152-L156 PolarHBondContact O-N 2.83Å
153	R	80.8	Confident	81.3	Confident	64 Å²	64	91.7 Å²	91.7	24%	0.242	48%	0.479	C	S	.	.	H	α-helix	trans	-66.1	-40.2	175.7	-171.2	178	-177.5	148.5	9.7	112.7	D137 Q149 R150 M151 F155 L156 A157	D137-R153 IonicContact OD1-CZ 3.62Å; D137-R153 IonicContact OD1-NH1 3.31Å; D137-R153 PolarHBondContact OD1-NH1 3.49Å; D137-R153 IonicContact OD1-NH2 2.92Å; D137-R153 PolarHBondContact OD1-NH2 3.41Å; D137-R153 IonicContact OD2-CZ 3.65Å; D137-R153 IonicContact OD2-NE 3.46Å; D137-R153 IonicContact OD2-NH2 3.42Å; D137-R153 PolarHBondContact OD2-NH2 2.99Å; Q149-R153 WeakPolarHBondContact O-CB 3.41Å; Q149-R153 PolarHBondContact O-N 3Å; R150-R153 PolarHBondContact O-N 3.27Å; M151-R153 VanDerWaalsContact C-N 3.31Å; M151-R153 PolarHBondContact O-N 3.45Å; R153-F155 VanDerWaalsContact C-N 3.34Å; R153-L156 PolarHBondContact O-N 3.46Å; R153-A157 WeakPolarHBondContact O-CB 3.3Å; R153-A157 PolarHBondContact O-N 3.31Å
154	A	84.5	Confident	83.1	Confident	63 Å²	63	90.3 Å²	90.3	52%	0.521	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-41.6	176	0	0	0	0	0	111.4	R150 M151 A157 A158	R150-A154 PolarHBondContact O-N 3.47Å; M151-A154 PolarHBondContact O-N 3Å; A154-A157 PolarHBondContact O-N 3.34Å; A154-A158 PolarHBondContact O-N 2.85Å
155	F	86.4	Confident	85	Confident	131 Å²	131	86.5 Å²	86.5	58%	0.575	46%	0.458	S	S	*	.	H	α-helix	trans	-61.6	-46.7	173.8	178.3	-98.7	0	0	0	112	M151 Y152 R153 A157 A158 Y159	M151-F155 PolarHBondContact O-N 3.34Å; Y152-F155 PolarHBondContact O-N 2.91Å; R153-F155 VanDerWaalsContact C-N 3.34Å; F155-A157 VanDerWaalsContact C-N 3.32Å; F155-A157 PolarHBondContact O-N 3Å; F155-A158 WeakPolarHBondContact O-CB 3.36Å; F155-A158 PolarHBondContact O-N 3.44Å; F155-A158 VanDerWaalsContact O-N 3.13Å; F155-Y159 PolarHBondContact O-N 3.46Å; F155-Y159 VanDerWaalsContact O-N 3.09Å
156	L	83.3	Confident	86.3	Confident	8 Å²	8	85.6 Å²	85.6	4%	0.042	45%	0.451	C	S	.	.	H	α-helix	trans	-64.2	-34.8	176.1	-74.5	177.1	0	0	0	113.1	V129 L130 Q133 Y152 R153 A158 Y159 P160	V129-L156 HydrophobicContact CG1-CD2 4.47Å; L130-L156 HydrophobicContact CD1-CB 4.16Å; L130-L156 HydrophobicContact CD1-CD2 4.29Å; Q133-L156 HydrophobicContact CB-CD1 4.24Å; Q133-L156 HydrophobicContact CG-CD1 4.05Å; Y152-L156 HydrophobicContact CD1-CD1 3.93Å; Y152-L156 HydrophobicContact CE1-CD1 3.35Å; Y152-L156 HydrophobicContact CE1-CG 4.35Å; Y152-L156 HydrophobicContact CE2-CD1 4.11Å; Y152-L156 HydrophobicContact CE2-CG 4.36Å; Y152-L156 VanDerWaalsContact CZ-CD1 3.48Å; Y152-L156 WeakPolarHBondContact O-CG 3.3Å; Y152-L156 PolarHBondContact O-N 2.83Å; R153-L156 PolarHBondContact O-N 3.46Å; L156-A158 VanDerWaalsContact C-N 3.28Å; L156-A158 PolarHBondContact O-N 3Å; L156-Y159 WeakPolarHBondContact O-CB 3.23Å; L156-Y159 PolarHBondContact O-N 3.26Å; L156-P160 WeakPolarHBondContact O-CD 3.45Å
157	A	83.6	Confident	86.8	Confident	59 Å²	59	85.6 Å²	85.6	49%	0.488	45%	0.448	S	S	.	.	H	α-helix	trans	-69.2	-27.6	174.4	0	0	0	0	0	112.5	R153 A154 F155 P160	R153-A157 WeakPolarHBondContact O-CB 3.3Å; R153-A157 PolarHBondContact O-N 3.31Å; A154-A157 PolarHBondContact O-N 3.34Å; F155-A157 VanDerWaalsContact C-N 3.32Å; F155-A157 PolarHBondContact O-N 3Å; A157-P160 WeakPolarHBondContact O-CD 3.37Å; A157-P160 WeakPolarHBondContact O-CG 3.42Å
158	A	88.9	Confident	87.3	Confident	42 Å²	42	83.1 Å²	83.1	35%	0.347	43%	0.434	S	S	.	.	H	α-helix	trans	-77.6	-29.3	174.5	0	0	0	0	0	112.9	A154 F155 L156 Y161 V162	A154-A158 PolarHBondContact O-N 2.85Å; F155-A158 WeakPolarHBondContact O-CB 3.36Å; F155-A158 PolarHBondContact O-N 3.44Å; F155-A158 VanDerWaalsContact O-N 3.13Å; L156-A158 VanDerWaalsContact C-N 3.28Å; L156-A158 PolarHBondContact O-N 3Å; A158-Y161 WeakPolarHBondContact O-CB 3.43Å; A158-Y161 PolarHBondContact O-N 3Å; A158-V162 PolarHBondContact O-N 3.11Å; A158-V162 VanDerWaalsContact O-N 3.13Å
159	Y	89.3	Confident	87.9	Confident	32 Å²	32	83.6 Å²	83.6	13%	0.125	43%	0.426	C	S	.	.	H	α-helix	trans	-46.9	-48.7	-180	-179	-93.6	0	0	0	115.4	L126 E127 L130 F155 L156 Y161 V162 S163	L126-Y159 HydrophobicContact CB-CE2 4.17Å; L126-Y159 HydrophobicContact CD1-CE2 4.18Å; E127-Y159 HydrophobicContact CG-CE1 4.19Å; E127-Y159 WeakPolarHBondContact CG-OH 3.44Å; E127-Y159 PolarHBondContact OE1-OH 3.3Å; L130-Y159 HydrophobicContact CD2-CD1 3.56Å; L130-Y159 HydrophobicContact CD2-CE1 4.06Å; L130-Y159 HydrophobicContact CD2-CG 4.48Å; F155-Y159 PolarHBondContact O-N 3.46Å; F155-Y159 VanDerWaalsContact O-N 3.09Å; L156-Y159 WeakPolarHBondContact O-CB 3.23Å; L156-Y159 PolarHBondContact O-N 3.26Å; Y159-Y161 VanDerWaalsContact C-N 3.26Å; Y159-Y161 PolarHBondContact O-N 3.18Å; Y159-V162 CarbonylContact O-C 3.58Å; Y159-V162 WeakPolarHBondContact O-CA 3.38Å; Y159-V162 WeakPolarHBondContact O-CB 3.38Å; Y159-V162 PolarHBondContact O-N 3.12Å; Y159-S163 PolarHBondContact O-N 3.24Å
160	P	89	Confident	88.4	Confident	39 Å²	39	80.9 Å²	80.9	25%	0.253	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-32.7	179.9	23.2	-35.2	0	0	0	113.4	L156 A157 S163 V164	L156-P160 WeakPolarHBondContact O-CD 3.45Å; A157-P160 WeakPolarHBondContact O-CD 3.37Å; A157-P160 WeakPolarHBondContact O-CG 3.42Å; P160-S163 WeakPolarHBondContact CA-OG 3.1Å; P160-S163 PolarHBondContact O-OG 3.42Å; P160-V164 VanDerWaalsContact O-CG2 3.26Å; P160-V164 WeakPolarHBondContact O-CG2 3.41Å; P160-V164 PolarHBondContact O-N 2.95Å
161	Y	92.2	Very high	88.9	Confident	183 Å²	183	78 Å²	78	72%	0.718	41%	0.408	S	S	*	.	H	α-helix	trans	-71.7	-38.7	174.8	-59.1	-76.1	0	0	0	111.2	A158 Y159 V164 G165	A158-Y161 WeakPolarHBondContact O-CB 3.43Å; A158-Y161 PolarHBondContact O-N 3Å; Y159-Y161 VanDerWaalsContact C-N 3.26Å; Y159-Y161 PolarHBondContact O-N 3.18Å; Y161-V164 PolarHBondContact O-N 3.29Å; Y161-G165 PolarHBondContact O-N 2.99Å
162	V	91.3	Very high	89.3	Confident	95 Å²	95	74.3 Å²	74.3	58%	0.576	40%	0.396	S	S	*	.	H	α-helix	trans	-64.1	-42.1	174.5	178	0	0	0	0	110.9	A158 Y159 G165 W166	A158-V162 PolarHBondContact O-N 3.11Å; A158-V162 VanDerWaalsContact O-N 3.13Å; Y159-V162 CarbonylContact O-C 3.58Å; Y159-V162 WeakPolarHBondContact O-CA 3.38Å; Y159-V162 WeakPolarHBondContact O-CB 3.38Å; Y159-V162 PolarHBondContact O-N 3.12Å; V162-G165 PolarHBondContact O-N 3.29Å; V162-W166 WeakPolarHBondContact O-CB 3.46Å; V162-W166 PolarHBondContact O-N 2.72Å
163	S	90.5	Very high	89.7	Confident	25 Å²	25	70 Å²	70	18%	0.175	38%	0.379	C	S	.	.	H	α-helix	trans	-65.6	-42.4	177.7	65.7	0	0	0	0	111.6	Y159 P160 G165 W166 D167	Y159-S163 PolarHBondContact O-N 3.24Å; P160-S163 WeakPolarHBondContact CA-OG 3.1Å; P160-S163 PolarHBondContact O-OG 3.42Å; S163-G165 VanDerWaalsContact C-N 3.35Å; S163-G165 PolarHBondContact O-N 3.4Å; S163-W166 WeakPolarHBondContact O-CB 3.47Å; S163-W166 PolarHBondContact O-N 2.93Å; S163-D167 WeakPolarHBondContact O-CB 3.2Å; S163-D167 VanDerWaalsContact O-CG 3.26Å; S163-D167 PolarHBondContact O-N 3.19Å
164	V	92.8	Very high	90.1	Very high	91 Å²	91	69.3 Å²	69.3	55%	0.552	38%	0.379	S	S	*	.	H	α-helix	trans	-61.8	-43.5	174.2	169.9	0	0	0	0	111.2	P160 Y161 W166 D167 S168	P160-V164 VanDerWaalsContact O-CG2 3.26Å; P160-V164 WeakPolarHBondContact O-CG2 3.41Å; P160-V164 PolarHBondContact O-N 2.95Å; Y161-V164 PolarHBondContact O-N 3.29Å; V164-W166 VanDerWaalsContact C-N 3.33Å; V164-W166 PolarHBondContact O-N 3.09Å; V164-D167 PolarHBondContact O-N 2.89Å; V164-S168 VanDerWaalsContact O-CB 3.27Å; V164-S168 WeakPolarHBondContact O-CB 3.41Å; V164-S168 PolarHBondContact O-N 3.22Å; V164-S168 PolarHBondContact O-OG 3.44Å
165	G	94.3	Very high	90.4	Very high	42 Å²	42	69.9 Å²	69.9	43%	0.433	37%	0.373	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.4	0	0	0	0	0	112.4	Y161 V162 S163 W169	Y161-G165 PolarHBondContact O-N 2.99Å; V162-G165 PolarHBondContact O-N 3.29Å; S163-G165 VanDerWaalsContact C-N 3.35Å; S163-G165 PolarHBondContact O-N 3.4Å; G165-W169 PolarHBondContact O-N 3.45Å
166	W	91.2	Very high	90.5	Very high	76 Å²	76	67.6 Å²	67.6	29%	0.288	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-51.1	175.7	178.2	-91.1	0	0	0	112.2	V162 S163 V164 S168 W169 V170 P187 F188	V162-W166 WeakPolarHBondContact O-CB 3.46Å; V162-W166 PolarHBondContact O-N 2.72Å; S163-W166 WeakPolarHBondContact O-CB 3.47Å; S163-W166 PolarHBondContact O-N 2.93Å; V164-W166 VanDerWaalsContact C-N 3.33Å; V164-W166 PolarHBondContact O-N 3.09Å; W166-S168 VanDerWaalsContact C-N 3.28Å; W166-S168 PolarHBondContact O-N 3.08Å; W166-W169 WeakPolarHBondContact O-CB 3.31Å; W166-W169 PolarHBondContact O-N 3.13Å; W166-W169 VanDerWaalsContact O-N 3.09Å; W166-V170 HydrophobicContact CZ2-CG2 4.36Å; W166-V170 WeakPolarHBondContact O-CG2 3.1Å; W166-V170 PolarHBondContact O-N 2.79Å; W166-P187 HydrophobicContact CH2-CB 4.04Å; W166-P187 HydrophobicContact CH2-CG 3.76Å; W166-P187 HydrophobicContact CZ2-CB 4.36Å; W166-P187 HydrophobicContact CZ2-CG 3.57Å; W166-F188 AromaticContact CE2-CZ 3.83Å; W166-F188 HydrophobicContact CH2-CD1 4.04Å; W166-F188 AromaticContact CH2-CE1 3.55Å; W166-F188 HydrophobicContact CH2-CE1 3.55Å; W166-F188 AromaticContact CH2-CZ 3.96Å; W166-F188 HydrophobicContact CH2-CZ 3.96Å; W166-F188 AromaticContact CZ2-CD1 3.94Å; W166-F188 HydrophobicContact CZ2-CD1 3.94Å; W166-F188 HydrophobicContact CZ2-CD2 4.31Å; W166-F188 AromaticContact CZ2-CE1 3.26Å; W166-F188 HydrophobicContact CZ2-CE1 3.26Å; W166-F188 AromaticContact CZ2-CE2 3.7Å; W166-F188 HydrophobicContact CZ2-CE2 3.7Å; W166-F188 HydrophobicContact CZ2-CG 4.43Å; W166-F188 AromaticContact CZ2-CZ 3.15Å; W166-F188 HydrophobicContact CZ2-CZ 3.15Å
167	D	91.9	Very high	90.7	Very high	72 Å²	72	68.3 Å²	68.3	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-65.9	-34.2	-178.6	-63.4	-28.4	0	0	0	110.7	R123 S163 V164 V170 F171	R123-D167 IonicContact CZ-OD1 3.31Å; R123-D167 IonicContact NH1-OD1 2.98Å; R123-D167 PolarHBondContact NH1-OD1 3.47Å; R123-D167 IonicContact NH2-OD1 2.88Å; R123-D167 PolarHBondContact NH2-OD1 2.95Å; R123-D167 IonicContact NH2-OD2 2.86Å; R123-D167 PolarHBondContact NH2-OD2 3.14Å; S163-D167 WeakPolarHBondContact O-CB 3.2Å; S163-D167 VanDerWaalsContact O-CG 3.26Å; S163-D167 PolarHBondContact O-N 3.19Å; V164-D167 PolarHBondContact O-N 2.89Å; D167-V170 PolarHBondContact O-N 3.19Å; D167-F171 WeakPolarHBondContact O-CB 3.28Å; D167-F171 PolarHBondContact O-N 3.12Å
168	S	93.8	Very high	90.9	Very high	59 Å²	59	69.6 Å²	69.6	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-41.4	170.9	-58.7	0	0	0	0	112.2	V164 W166 F171 C172	V164-S168 VanDerWaalsContact O-CB 3.27Å; V164-S168 WeakPolarHBondContact O-CB 3.41Å; V164-S168 PolarHBondContact O-N 3.22Å; V164-S168 PolarHBondContact O-OG 3.44Å; W166-S168 VanDerWaalsContact C-N 3.28Å; W166-S168 PolarHBondContact O-N 3.08Å; S168-F171 PolarHBondContact O-N 3.12Å; S168-C172 WeakPolarHBondContact O-CB 3.11Å; S168-C172 PolarHBondContact O-N 3.17Å; S168-C172 PolarHBondContact O-SG 2.85Å
169	W	93.4	Very high	90.8	Very high	150 Å²	150	74.1 Å²	74.1	57%	0.568	38%	0.382	S	S	*	.	H	α-helix	trans	-63.5	-45.3	175.8	-176.1	-77	0	0	0	111.7	G165 W166 F171 C172 Q173	G165-W169 PolarHBondContact O-N 3.45Å; W166-W169 WeakPolarHBondContact O-CB 3.31Å; W166-W169 PolarHBondContact O-N 3.13Å; W166-W169 VanDerWaalsContact O-N 3.09Å; W169-F171 VanDerWaalsContact C-N 3.34Å; W169-F171 PolarHBondContact O-N 3.48Å; W169-C172 PolarHBondContact O-N 2.78Å; W169-Q173 WeakPolarHBondContact O-CB 3.34Å; W169-Q173 PolarHBondContact O-N 3.49Å
170	V	91.1	Very high	90.4	Very high	28 Å²	28	74.6 Å²	74.6	17%	0.17	40%	0.396	C	S	.	.	H	α-helix	trans	-57.2	-48.6	175.2	173.9	0	0	0	0	110.3	W166 D167 Q173 Q174 P187	W166-V170 HydrophobicContact CZ2-CG2 4.36Å; W166-V170 WeakPolarHBondContact O-CG2 3.1Å; W166-V170 PolarHBondContact O-N 2.79Å; D167-V170 PolarHBondContact O-N 3.19Å; V170-Q173 PolarHBondContact O-N 3.47Å; V170-Q174 HydrophobicContact CG1-CG 4.45Å; V170-Q174 WeakPolarHBondContact O-CG 3.43Å; V170-Q174 PolarHBondContact O-N 3.47Å; V170-P187 HydrophobicContact CG2-CG 3.66Å
171	F	91.7	Very high	90.2	Very high	127 Å²	127	82.8 Å²	82.8	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-60.7	-47.6	179	177.7	-100.8	0	0	0	112.4	D167 S168 W169 Q173 Q174 L175	D167-F171 WeakPolarHBondContact O-CB 3.28Å; D167-F171 PolarHBondContact O-N 3.12Å; S168-F171 PolarHBondContact O-N 3.12Å; W169-F171 VanDerWaalsContact C-N 3.34Å; W169-F171 PolarHBondContact O-N 3.48Å; F171-Q173 VanDerWaalsContact C-N 3.25Å; F171-Q173 PolarHBondContact O-N 2.96Å; F171-Q174 PolarHBondContact O-N 3.41Å; F171-L175 WeakPolarHBondContact O-CB 3.05Å; F171-L175 PolarHBondContact O-N 3.2Å
172	C	92.5	Very high	89.8	Confident	69 Å²	69	75.2 Å²	75.2	47%	0.466	40%	0.397	S	S	.	.	H	α-helix	trans	-57.3	-40.7	176.1	-75.5	0	0	0	0	111.7	S168 W169 L175 L176	S168-C172 WeakPolarHBondContact O-CB 3.11Å; S168-C172 PolarHBondContact O-N 3.17Å; S168-C172 PolarHBondContact O-SG 2.85Å; W169-C172 PolarHBondContact O-N 2.78Å; C172-L175 PolarHBondContact O-N 2.67Å; C172-L176 VanDerWaalsContact O-CG 3.29Å; C172-L176 WeakPolarHBondContact O-CG 3.42Å; C172-L176 PolarHBondContact O-N 2.82Å
173	Q	90.6	Very high	89.4	Confident	16 Å²	16	78.9 Å²	78.9	8%	0.075	41%	0.405	C	S	.	.	H	α-helix	trans	-70.1	-40.4	178.3	-171.3	171.7	-4.2	0	0	112.9	W169 V170 F171 L175 L176 Y177 T184 S186 P187	W169-Q173 WeakPolarHBondContact O-CB 3.34Å; W169-Q173 PolarHBondContact O-N 3.49Å; V170-Q173 PolarHBondContact O-N 3.47Å; F171-Q173 VanDerWaalsContact C-N 3.25Å; F171-Q173 PolarHBondContact O-N 2.96Å; Q173-L175 VanDerWaalsContact C-N 3.3Å; Q173-L175 PolarHBondContact O-N 3.26Å; Q173-L176 PolarHBondContact O-N 3.25Å; Q173-Y177 WeakPolarHBondContact O-CB 3.37Å; Q173-Y177 PolarHBondContact O-N 3.4Å; Q173-T184 PolarHBondContact NE2-O 3.36Å; Q173-T184 PolarHBondContact NE2-OG1 3.43Å; Q173-T184 VanDerWaalsContact NE2-OG1 3.09Å; Q173-S186 VanDerWaalsContact CD-C 3.46Å; Q173-S186 VanDerWaalsContact NE2-C 3.31Å; Q173-S186 PolarHBondContact NE2-O 3.26Å; Q173-S186 VanDerWaalsContact OE1-C 3.25Å; Q173-P187 VanDerWaalsContact OE1-CD 3.24Å
174	Q	90.5	Very high	89.1	Confident	48 Å²	48	78.3 Å²	78.3	22%	0.224	40%	0.401	C	S	.	.	H	α-helix	trans	-60	-42.6	172.7	-72.5	173.1	-19.4	0	0	111.1	V170 F171 Y177 V178 H185	V170-Q174 HydrophobicContact CG1-CG 4.45Å; V170-Q174 WeakPolarHBondContact O-CG 3.43Å; V170-Q174 PolarHBondContact O-N 3.47Å; F171-Q174 PolarHBondContact O-N 3.41Å; Q174-Y177 WeakPolarHBondContact O-CB 3.33Å; Q174-Y177 PolarHBondContact O-N 2.91Å; Q174-V178 WeakPolarHBondContact O-CG2 3.23Å; Q174-V178 PolarHBondContact O-N 2.87Å; Q174-H185 WeakPolarHBondContact CG-O 3.33Å
175	L	89.9	Confident	88.8	Confident	76 Å²	76	74.2 Å²	74.2	40%	0.398	38%	0.376	S	S	.	.	H	α-helix	trans	-62.6	-44.5	176.6	-172.4	66	0	0	0	111.5	F171 C172 Q173 Y177 V178 F179	F171-L175 WeakPolarHBondContact O-CB 3.05Å; F171-L175 PolarHBondContact O-N 3.2Å; C172-L175 PolarHBondContact O-N 2.67Å; Q173-L175 VanDerWaalsContact C-N 3.3Å; Q173-L175 PolarHBondContact O-N 3.26Å; L175-Y177 VanDerWaalsContact C-N 3.28Å; L175-Y177 PolarHBondContact O-N 2.97Å; L175-V178 PolarHBondContact O-N 2.92Å; L175-F179 HydrophobicContact CD1-CD2 4.08Å; L175-F179 HydrophobicContact CD1-CE2 3.44Å; L175-F179 VanDerWaalsContact CD1-CE2 3.44Å; L175-F179 HydrophobicContact CD1-CZ 4.08Å; L175-F179 HydrophobicContact CD2-CE2 4.02Å; L175-F179 HydrophobicContact CG-CD2 3.82Å; L175-F179 HydrophobicContact CG-CE2 3.45Å; L175-F179 VanDerWaalsContact CG-CE2 3.45Å; L175-F179 WeakPolarHBondContact O-CD2 3.3Å; L175-F179 PolarHBondContact O-N 3.5Å
176	L	88.7	Confident	88.4	Confident	82 Å²	82	72.9 Å²	72.9	43%	0.429	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-33.1	174.4	-72.2	171.1	0	0	0	113	C172 Q173 G180 R181 A182	C172-L176 VanDerWaalsContact O-CG 3.29Å; C172-L176 WeakPolarHBondContact O-CG 3.42Å; C172-L176 PolarHBondContact O-N 2.82Å; Q173-L176 PolarHBondContact O-N 3.25Å; L176-G180 PolarHBondContact O-N 3.39Å; L176-R181 HydrophobicContact CD2-CB 4.3Å; L176-R181 PolarHBondContact O-N 2.9Å; L176-A182 HydrophobicContact CB-CB 3.87Å; L176-A182 PolarHBondContact O-N 3.13Å; L176-A182 VanDerWaalsContact O-N 3.09Å
177	Y	87.8	Confident	88.2	Confident	23 Å²	23	69.4 Å²	69.4	9%	0.09	35%	0.347	C	S	.	.	H	α-helix	trans	-67.4	-45	174.7	-178.1	-97.1	0	0	0	111.3	P17 I19 Q173 Q174 L175 F179 G180 A182 H185	P17-Y177 WeakPolarHBondContact CD-OH 3.25Å; P17-Y177 PolarHBondContact O-OH 3.4Å; I19-Y177 HydrophobicContact CD1-CD1 4.1Å; Q173-Y177 WeakPolarHBondContact O-CB 3.37Å; Q173-Y177 PolarHBondContact O-N 3.4Å; Q174-Y177 WeakPolarHBondContact O-CB 3.33Å; Q174-Y177 PolarHBondContact O-N 2.91Å; L175-Y177 VanDerWaalsContact C-N 3.28Å; L175-Y177 PolarHBondContact O-N 2.97Å; Y177-F179 VanDerWaalsContact C-N 3.33Å; Y177-F179 PolarHBondContact O-N 2.92Å; Y177-G180 WeakPolarHBondContact O-CA 3.39Å; Y177-G180 PolarHBondContact O-N 3.42Å; Y177-A182 WeakPolarHBondContact CD2-O 3.49Å; Y177-H185 HydrophobicContact CD1-CB 4.08Å; Y177-H185 HydrophobicContact CD2-CB 4.14Å; Y177-H185 HydrophobicContact CE1-CB 4.41Å; Y177-H185 HydrophobicContact CE2-CB 4.46Å; Y177-H185 HydrophobicContact CG-CB 3.94Å
178	V	86.9	Confident	88	Confident	86 Å²	86	68.9 Å²	68.9	52%	0.521	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-40	176	172.6	0	0	0	0	111.6	I19 Q174 L175 G180	I19-V178 HydrophobicContact CB-CG2 4.08Å; I19-V178 HydrophobicContact CG1-CG2 3.94Å; I19-V178 HydrophobicContact CG2-CG2 4.17Å; Q174-V178 WeakPolarHBondContact O-CG2 3.23Å; Q174-V178 PolarHBondContact O-N 2.87Å; L175-V178 PolarHBondContact O-N 2.92Å; V178-G180 PolarHBondContact O-N 3.12Å
179	F	86.7	Confident	87.7	Confident	138 Å²	138	66.3 Å²	66.3	61%	0.605	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	1	173.4	-70.5	-55.6	0	0	0	114.1	L175 Y177 R181	L175-F179 HydrophobicContact CD1-CD2 4.08Å; L175-F179 HydrophobicContact CD1-CE2 3.44Å; L175-F179 VanDerWaalsContact CD1-CE2 3.44Å; L175-F179 HydrophobicContact CD1-CZ 4.08Å; L175-F179 HydrophobicContact CD2-CE2 4.02Å; L175-F179 HydrophobicContact CG-CD2 3.82Å; L175-F179 HydrophobicContact CG-CE2 3.45Å; L175-F179 VanDerWaalsContact CG-CE2 3.45Å; L175-F179 WeakPolarHBondContact O-CD2 3.3Å; L175-F179 PolarHBondContact O-N 3.5Å; Y177-F179 VanDerWaalsContact C-N 3.33Å; Y177-F179 PolarHBondContact O-N 2.92Å; F179-R181 PolarHBondContact O-N 3.35Å
180	G	81.4	Confident	87.4	Confident	41 Å²	41	66.6 Å²	66.6	42%	0.423	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	10.7	178	0	0	0	0	0	114.9	L176 Y177 V178	L176-G180 PolarHBondContact O-N 3.39Å; Y177-G180 WeakPolarHBondContact O-CA 3.39Å; Y177-G180 PolarHBondContact O-N 3.42Å; V178-G180 PolarHBondContact O-N 3.12Å
181	R	84.4	Confident	87.2	Confident	212 Å²	212	69.9 Å²	69.9	80%	0.8	34%	0.34	S	S	*	.	S	Bend	trans	-84	-31.2	177.7	-73.3	-160	167.2	111.9	-0	112.8	L176 F179	L176-R181 HydrophobicContact CD2-CB 4.3Å; L176-R181 PolarHBondContact O-N 2.9Å; F179-R181 PolarHBondContact O-N 3.35Å
182	A	84.6	Confident	86.8	Confident	24 Å²	24	64 Å²	64	20%	0.198	32%	0.315	C	S	.	.			trans	-103.4	140.1	175.8	0	0	0	0	0	111.1	L176 Y177	L176-A182 HydrophobicContact CB-CB 3.87Å; L176-A182 PolarHBondContact O-N 3.13Å; L176-A182 VanDerWaalsContact O-N 3.09Å; Y177-A182 WeakPolarHBondContact CD2-O 3.49Å
183	K	82.6	Confident	86.3	Confident	171 Å²	171	62 Å²	62	74%	0.743	31%	0.306	S	S	*	.	S	Bend	trans	-84.6	-12.2	174	-61.9	-177.5	-178.1	-178.5	0	113.1
184	T	85.3	Confident	86.1	Confident	14 Å²	14	61.2 Å²	61.2	9%	0.086	30%	0.302	C	S	.	.			trans	-125.2	135.1	-175.7	51	0	0	0	0	110	Q173 L189 V194	Q173-T184 PolarHBondContact NE2-O 3.36Å; Q173-T184 PolarHBondContact NE2-OG1 3.43Å; Q173-T184 VanDerWaalsContact NE2-OG1 3.09Å; T184-L189 HydrophobicContact CG2-CB 4.46Å; T184-V194 VanDerWaalsContact CG2-O 3.28Å; T184-V194 WeakPolarHBondContact CG2-O 3.3Å
185	H	84.6	Confident	85.9	Confident	5 Å²	5	61.2 Å²	61.2	2%	0.023	30%	0.3	C	S	.	.	S	Bend	trans	-85.4	-27.9	-176.8	71.2	-99.5	0	0	0	113.3	V22 Q174 Y177 L189 L196	V22-H185 HydrophobicContact CG1-CB 4.05Å; V22-H185 WeakPolarHBondContact CG1-CD2 3.07Å; V22-H185 VanDerWaalsContact CG1-CE1 3.43Å; V22-H185 WeakPolarHBondContact CG1-CE1 3.49Å; V22-H185 WeakPolarHBondContact CG1-ND1 3.46Å; V22-H185 WeakPolarHBondContact CG1-NE2 3.47Å; Q174-H185 WeakPolarHBondContact CG-O 3.33Å; Y177-H185 HydrophobicContact CD1-CB 4.08Å; Y177-H185 HydrophobicContact CD2-CB 4.14Å; Y177-H185 HydrophobicContact CE1-CB 4.41Å; Y177-H185 HydrophobicContact CE2-CB 4.46Å; Y177-H185 HydrophobicContact CG-CB 3.94Å; H185-L189 WeakPolarHBondContact CE1-CD1 3.35Å; H185-L196 WeakPolarHBondContact CE1-CD1 3.5Å
186	S	86.8	Confident	85.8	Confident	13 Å²	13	58 Å²	58	9%	0.091	28%	0.283	C	S	.	.	S	Bend	trans	-123	148.1	-176.7	56.5	0	0	0	0	112.1	Q173 F188 L189 W190	Q173-S186 VanDerWaalsContact CD-C 3.46Å; Q173-S186 VanDerWaalsContact NE2-C 3.31Å; Q173-S186 PolarHBondContact NE2-O 3.26Å; Q173-S186 VanDerWaalsContact OE1-C 3.25Å; S186-F188 PolarHBondContact O-N 2.67Å; S186-L189 PolarHBondContact O-N 3.45Å; S186-L189 WeakPolarHBondContact OG-CG 3.25Å; S186-W190 PolarHBondContact O-N 3.17Å; S186-W190 VanDerWaalsContact O-N 3.12Å
187	P	86.8	Confident	85.6	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-29.3	179	23.4	-33	0	0	0	111.4	W166 V170 Q173 L189 W190 L191	W166-P187 HydrophobicContact CH2-CB 4.04Å; W166-P187 HydrophobicContact CH2-CG 3.76Å; W166-P187 HydrophobicContact CZ2-CB 4.36Å; W166-P187 HydrophobicContact CZ2-CG 3.57Å; V170-P187 HydrophobicContact CG2-CG 3.66Å; Q173-P187 VanDerWaalsContact OE1-CD 3.24Å; P187-L189 PolarHBondContact O-N 3.06Å; P187-W190 PolarHBondContact O-N 3.45Å; P187-L191 WeakPolarHBondContact O-CB 3.23Å; P187-L191 VanDerWaalsContact O-CG 3.27Å; P187-L191 WeakPolarHBondContact O-CG 3.25Å; P187-L191 PolarHBondContact O-N 3.35Å
188	F	88.6	Confident	85.5	Confident	61 Å²	61	56.1 Å²	56.1	27%	0.268	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-44.3	174	-61.9	-52.8	0	0	0	112.3	L115 V119 W166 S186 A192	L115-F188 HydrophobicContact CB-CB 4.33Å; L115-F188 HydrophobicContact CB-CD1 4.35Å; L115-F188 HydrophobicContact CD1-CB 4.46Å; L115-F188 WeakPolarHBondContact CD1-O 3.23Å; L115-F188 HydrophobicContact CD2-CD1 4.05Å; V119-F188 HydrophobicContact CB-CE1 4.43Å; V119-F188 HydrophobicContact CG1-CE1 3.71Å; V119-F188 HydrophobicContact CG1-CZ 3.85Å; W166-F188 AromaticContact CE2-CZ 3.83Å; W166-F188 HydrophobicContact CH2-CD1 4.04Å; W166-F188 AromaticContact CH2-CE1 3.55Å; W166-F188 HydrophobicContact CH2-CE1 3.55Å; W166-F188 AromaticContact CH2-CZ 3.96Å; W166-F188 HydrophobicContact CH2-CZ 3.96Å; W166-F188 AromaticContact CZ2-CD1 3.94Å; W166-F188 HydrophobicContact CZ2-CD1 3.94Å; W166-F188 HydrophobicContact CZ2-CD2 4.31Å; W166-F188 AromaticContact CZ2-CE1 3.26Å; W166-F188 HydrophobicContact CZ2-CE1 3.26Å; W166-F188 AromaticContact CZ2-CE2 3.7Å; W166-F188 HydrophobicContact CZ2-CE2 3.7Å; W166-F188 HydrophobicContact CZ2-CG 4.43Å; W166-F188 AromaticContact CZ2-CZ 3.15Å; W166-F188 HydrophobicContact CZ2-CZ 3.15Å; S186-F188 PolarHBondContact O-N 2.67Å; F188-A192 WeakPolarHBondContact O-CB 3.46Å; F188-A192 PolarHBondContact O-N 2.95Å
189	L	86.1	Confident	85	Confident	5 Å²	5	54 Å²	54	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-71.2	-36.1	176.8	-72.1	-179.2	0	0	0	112.6	T184 H185 S186 P187 A192 G193 V194 L196	T184-L189 HydrophobicContact CG2-CB 4.46Å; H185-L189 WeakPolarHBondContact CE1-CD1 3.35Å; S186-L189 PolarHBondContact O-N 3.45Å; S186-L189 WeakPolarHBondContact OG-CG 3.25Å; P187-L189 PolarHBondContact O-N 3.06Å; L189-A192 PolarHBondContact O-N 2.86Å; L189-G193 PolarHBondContact O-N 3.4Å; L189-V194 HydrophobicContact CD2-CB 4.5Å; L189-V194 HydrophobicContact CD2-CG1 4.44Å; L189-V194 PolarHBondContact O-N 3.44Å; L189-L196 HydrophobicContact CD1-CD1 3.91Å; L189-L196 HydrophobicContact CD1-CG 3.97Å
190	W	88.3	Confident	84.4	Confident	156 Å²	156	50.2 Å²	50.2	59%	0.591	25%	0.247	S	C	*	.	H	α-helix	trans	-61.2	-46.7	174.1	-177.8	80.5	0	0	0	111.7	S186 P187 A192 G193	S186-W190 PolarHBondContact O-N 3.17Å; S186-W190 VanDerWaalsContact O-N 3.12Å; P187-W190 PolarHBondContact O-N 3.45Å; W190-A192 VanDerWaalsContact C-N 3.35Å; W190-A192 PolarHBondContact O-N 2.88Å; W190-G193 PolarHBondContact O-N 2.86Å
191	L	86.6	Confident	83.5	Confident	98 Å²	98	50.4 Å²	50.4	51%	0.513	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-37.7	175.1	-72.2	169.3	0	0	0	112.5	L115 P187 G193	L115-L191 HydrophobicContact CD1-CB 4.02Å; P187-L191 WeakPolarHBondContact O-CB 3.23Å; P187-L191 VanDerWaalsContact O-CG 3.27Å; P187-L191 WeakPolarHBondContact O-CG 3.25Å; P187-L191 PolarHBondContact O-N 3.35Å; L191-G193 PolarHBondContact O-N 2.85Å
192	A	83.5	Confident	82.4	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-68.3	-17.1	174.4	0	0	0	0	0	113	H108 L115 F188 L189 W190 V194	H108-A192 PolarHBondContact ND1-O 3.41Å; L115-A192 HydrophobicContact CD1-CB 4.18Å; F188-A192 WeakPolarHBondContact O-CB 3.46Å; F188-A192 PolarHBondContact O-N 2.95Å; L189-A192 PolarHBondContact O-N 2.86Å; W190-A192 VanDerWaalsContact C-N 3.35Å; W190-A192 PolarHBondContact O-N 2.88Å; A192-V194 VanDerWaalsContact C-N 3.35Å; A192-V194 HydrophobicContact CB-CB 4.29Å; A192-V194 HydrophobicContact CB-CG2 4.06Å
193	G	82.1	Confident	81.5	Confident	26 Å²	26	46.5 Å²	46.5	27%	0.268	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	32.2	-174.2	0	0	0	0	0	112.8	A93 L189 W190 L191	A93-G193 WeakPolarHBondContact CB-O 3.44Å; A93-G193 PolarHBondContact N-O 3.3Å; L189-G193 PolarHBondContact O-N 3.4Å; W190-G193 PolarHBondContact O-N 2.86Å; L191-G193 PolarHBondContact O-N 2.85Å
194	V	85.6	Confident	80.7	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.4	-171.7	175.4	0	0	0	0	110	R90 V91 L104 H108 T184 L189 A192	R90-V194 HydrophobicContact CB-CG1 3.38Å; R90-V194 HydrophobicContact CG-CG1 3.59Å; V91-V194 CarbonylContact O-C 3.08Å; V91-V194 WeakPolarHBondContact O-CA 3.47Å; L104-V194 HydrophobicContact CD2-CG2 3.95Å; H108-V194 HydrophobicContact CB-CG2 4.39Å; T184-V194 VanDerWaalsContact CG2-O 3.28Å; T184-V194 WeakPolarHBondContact CG2-O 3.3Å; L189-V194 HydrophobicContact CD2-CB 4.5Å; L189-V194 HydrophobicContact CD2-CG1 4.44Å; L189-V194 PolarHBondContact O-N 3.44Å; A192-V194 VanDerWaalsContact C-N 3.35Å; A192-V194 HydrophobicContact CB-CB 4.29Å; A192-V194 HydrophobicContact CB-CG2 4.06Å
195	R	87.4	Confident	79.6	Confident	47 Å²	47	44.6 Å²	44.6	18%	0.177	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	152.3	169.7	69.3	175.7	-175.7	94.7	-5.3	110.2	D15 V91 E97	D15-R195 IonicContact OD2-CZ 3.37Å; D15-R195 IonicContact OD2-NH1 3.19Å; D15-R195 PolarHBondContact OD2-NH1 3.45Å; D15-R195 IonicContact OD2-NH2 3.8Å; D15-R195 PolarHBondContact OD2-NH2 3.37Å; V91-R195 HydrophobicContact CB-CG 4.09Å; V91-R195 PolarHBondContact N-O 3.48Å; V91-R195 PolarHBondContact O-N 2.87Å; E97-R195 IonicContact OE1-NH2 3.79Å; E97-R195 PolarHBondContact OE1-NH2 3.12Å
196	L	86.6	Confident	78.4	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	145.5	167.9	-72.4	166.4	0	0	0	109.9	P17 V22 E83 L88 K89 R90 H185 L189	P17-L196 WeakPolarHBondContact CD-O 3.49Å; P17-L196 HydrophobicContact CG-CB 3.79Å; V22-L196 HydrophobicContact CG2-CD1 4.23Å; E83-L196 HydrophobicContact CG-CD2 3.78Å; L88-L196 HydrophobicContact CB-CD2 4.28Å; K89-L196 CarbonylContact O-C 3.52Å; K89-L196 WeakPolarHBondContact O-CA 3.49Å; R90-L196 HydrophobicContact CG-CD2 4.12Å; H185-L196 WeakPolarHBondContact CE1-CD1 3.5Å; L189-L196 HydrophobicContact CD1-CD1 3.91Å; L189-L196 HydrophobicContact CD1-CG 3.97Å
197	A	84.4	Confident	77.1	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.1	173.3	0	0	0	0	0	109.5	D15 L88 K89 V91	D15-A197 WeakPolarHBondContact O-CA 3.44Å; L88-A197 WeakPolarHBondContact CA-O 3.29Å; K89-A197 HydrophobicContact CG-CB 4.13Å; K89-A197 WeakPolarHBondContact CG-O 3.45Å; K89-A197 PolarHBondContact N-O 3.39Å; K89-A197 PolarHBondContact O-N 3.27Å; V91-A197 HydrophobicContact CG2-CB 3.89Å
198	H	85.2	Confident	75.8	Confident	65 Å²	65	55.7 Å²	55.7	30%	0.301	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	149.9	172.9	-67.6	113.6	0	0	0	111.5	R16 E21 K89 T200	R16-H198 PolarHBondContact O-CE1 3.32Å; E21-H198 IonicContact OE2-CD2 3.95Å; E21-H198 IonicContact OE2-CE1 3.71Å; E21-H198 IonicContact OE2-NE2 2.64Å; E21-H198 PolarHBondContact OE2-NE2 3.31Å; K89-H198 VanDerWaalsContact CE-O 3.23Å; K89-H198 WeakPolarHBondContact CE-O 3.24Å; H198-T200 PolarHBondContact O-N 2.96Å
199	L	76.8	Confident	74.3	Confident	42 Å²	42	59.2 Å²	59.2	22%	0.22	31%	0.313	C	S	.	.			trans	-70.8	110.2	171.2	-163	70.8	0	0	0	109.2	S87 K89 A100 D203 I204	S87-L199 VanDerWaalsContact O-CB 3.32Å; S87-L199 WeakPolarHBondContact O-CB 3.13Å; S87-L199 PolarHBondContact O-N 3.3Å; K89-L199 HydrophobicContact CB-CD1 4.44Å; K89-L199 HydrophobicContact CD-CD1 4.4Å; A100-L199 HydrophobicContact CB-CD1 3.98Å; L199-D203 HydrophobicContact CD1-CB 4.04Å; L199-D203 HydrophobicContact CG-CB 4.42Å; L199-I204 HydrophobicContact CD2-CD1 4.26Å; L199-I204 HydrophobicContact CD2-CG1 3.7Å; L199-I204 HydrophobicContact CG-CG1 3.99Å
200	T	74.2	Confident	72.4	Confident	58 Å²	58	66.3 Å²	66.3	36%	0.356	34%	0.344	S	S	.	.			trans	-72.4	145.3	-179.6	-43.2	0	0	0	0	110.2	H198 H202 D203 I204	H198-T200 PolarHBondContact O-N 2.96Å; T200-H202 HydrophobicContact CG2-CB 4.45Å; T200-H202 PolarHBondContact O-N 3.2Å; T200-H202 VanDerWaalsContact O-N 3.09Å; T200-D203 WeakPolarHBondContact O-CA 3.39Å; T200-D203 WeakPolarHBondContact O-CB 3.26Å; T200-D203 PolarHBondContact O-N 3.45Å; T200-I204 PolarHBondContact O-N 2.88Å
201	G	63.6	Low	70.2	Confident	46 Å²	46	63.7 Å²	63.7	47%	0.474	35%	0.347	S	S	.	.	H	α-helix	trans	-54.5	-31.6	177.9	0	0	0	0	0	114.3	D203 I204 T205	G201-D203 VanDerWaalsContact C-N 3.32Å; G201-D203 PolarHBondContact O-N 3.31Å; G201-I204 PolarHBondContact O-N 2.99Å; G201-T205 PolarHBondContact O-N 3.4Å; G201-T205 VanDerWaalsContact O-N 3.13Å; G201-T205 PolarHBondContact O-OG1 3.08Å
202	H	61.3	Low	68.1	Low	142 Å²	142	63.3 Å²	63.3	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-64.7	-30.6	172.3	-69.4	-62.6	0	0	0	113.8	T200 T205 N206	T200-H202 HydrophobicContact CG2-CB 4.45Å; T200-H202 PolarHBondContact O-N 3.2Å; T200-H202 VanDerWaalsContact O-N 3.09Å; H202-T205 WeakPolarHBondContact CA-OG1 3.47Å; H202-T205 PolarHBondContact O-OG1 2.87Å; H202-N206 WeakPolarHBondContact O-CB 3.28Å; H202-N206 PolarHBondContact O-N 2.9Å; H202-N206 PolarHBondContact O-ND2 3.03Å
203	D	65.1	Low	65.9	Low	11 Å²	11	68.5 Å²	68.5	6%	0.059	39%	0.394	C	S	.	.	H	α-helix	trans	-72.8	-38.3	174.7	-74.6	-44.8	0	0	0	111.3	K89 P99 A100 L199 T200 G201 N206 M207	K89-D203 IonicContact NZ-OD2 3.92Å; K89-D203 PolarHBondContact NZ-OD2 3.27Å; P99-D203 WeakPolarHBondContact CA-OD1 3.26Å; A100-D203 HydrophobicContact CB-CB 4.17Å; A100-D203 PolarHBondContact N-OD1 3.18Å; L199-D203 HydrophobicContact CD1-CB 4.04Å; L199-D203 HydrophobicContact CG-CB 4.42Å; T200-D203 WeakPolarHBondContact O-CA 3.39Å; T200-D203 WeakPolarHBondContact O-CB 3.26Å; T200-D203 PolarHBondContact O-N 3.45Å; G201-D203 VanDerWaalsContact C-N 3.32Å; G201-D203 PolarHBondContact O-N 3.31Å; D203-N206 PolarHBondContact O-N 2.83Å; D203-M207 WeakPolarHBondContact O-CG 3.31Å; D203-M207 PolarHBondContact O-N 3.29Å
204	I	65.2	Low	64	Low	76 Å²	76	72.1 Å²	72.1	39%	0.39	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-48.8	178.2	-55.6	173.2	0	0	0	109.8	L199 T200 G201 N206 M207 D208	L199-I204 HydrophobicContact CD2-CD1 4.26Å; L199-I204 HydrophobicContact CD2-CG1 3.7Å; L199-I204 HydrophobicContact CG-CG1 3.99Å; T200-I204 PolarHBondContact O-N 2.88Å; G201-I204 PolarHBondContact O-N 2.99Å; I204-N206 VanDerWaalsContact C-N 3.27Å; I204-N206 PolarHBondContact O-N 2.82Å; I204-M207 PolarHBondContact O-N 2.68Å; I204-M207 VanDerWaalsContact O-N 3.09Å; I204-D208 PolarHBondContact O-N 2.92Å
205	T	61.9	Low	61.7	Low	70 Å²	70	77 Å²	77	43%	0.429	45%	0.447	S	S	.	.	H	α-helix	trans	-61	-36.6	177	52.3	0	0	0	0	112.4	G201 H202 L209	G201-T205 PolarHBondContact O-N 3.4Å; G201-T205 VanDerWaalsContact O-N 3.13Å; G201-T205 PolarHBondContact O-OG1 3.08Å; H202-T205 WeakPolarHBondContact CA-OG1 3.47Å; H202-T205 PolarHBondContact O-OG1 2.87Å; T205-L209 WeakPolarHBondContact O-CB 3.35Å; T205-L209 WeakPolarHBondContact O-CD1 3.24Å; T205-L209 WeakPolarHBondContact O-CG 3.39Å; T205-L209 PolarHBondContact O-N 3.25Å; T205-L209 VanDerWaalsContact O-N 3.16Å
206	N	60.8	Low	59.1	Low	70 Å²	70	86.1 Å²	86.1	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-73.9	-25.8	177.9	-73.7	-30.3	0	0	0	113.1	H202 D203 I204	H202-N206 WeakPolarHBondContact O-CB 3.28Å; H202-N206 PolarHBondContact O-N 2.9Å; H202-N206 PolarHBondContact O-ND2 3.03Å; D203-N206 PolarHBondContact O-N 2.83Å; I204-N206 VanDerWaalsContact C-N 3.27Å; I204-N206 PolarHBondContact O-N 2.82Å
207	M	59.2	Low	56.9	Low	61 Å²	61	90 Å²	90	30%	0.3	51%	0.514	S	S	.	.	H	α-helix	trans	-74.6	-42.8	172.3	-74.8	-180	63.5	0	0	111.7	T77 H101 D203 I204 L209 K210	T77-M207 HydrophobicContact CG2-CE 3.61Å; H101-M207 HydrophobicContact CB-CG 4.28Å; D203-M207 WeakPolarHBondContact O-CG 3.31Å; D203-M207 PolarHBondContact O-N 3.29Å; I204-M207 PolarHBondContact O-N 2.68Å; I204-M207 VanDerWaalsContact O-N 3.09Å; M207-L209 VanDerWaalsContact C-N 3.3Å; M207-L209 PolarHBondContact O-N 2.85Å; M207-K210 PolarHBondContact O-N 3.3Å
208	D	59.5	Low	54.9	Low	122 Å²	122	97.9 Å²	97.9	65%	0.652	56%	0.555	S	S	*	*	H	α-helix	trans	-66.9	-30.7	179.1	-73.1	-28.5	0	0	0	112.9	I204 K210	I204-D208 PolarHBondContact O-N 2.92Å; D208-K210 PolarHBondContact O-N 2.86Å
209	L	57.4	Low	52.5	Low	136 Å²	136	99.9 Å²	99.9	71%	0.712	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-9.9	176.6	-73	168.8	0	0	0	113.9	T205 M207 P211	T205-L209 WeakPolarHBondContact O-CB 3.35Å; T205-L209 WeakPolarHBondContact O-CD1 3.24Å; T205-L209 WeakPolarHBondContact O-CG 3.39Å; T205-L209 PolarHBondContact O-N 3.25Å; T205-L209 VanDerWaalsContact O-N 3.16Å; M207-L209 VanDerWaalsContact C-N 3.3Å; M207-L209 PolarHBondContact O-N 2.85Å; L209-P211 VanDerWaalsContact O-CD 3.31Å; L209-P211 WeakPolarHBondContact O-CD 3.29Å
210	K	44.9	Very low	51.6	Low	154 Å²	154	103 Å²	103	67%	0.67	60%	0.601	S	S	*	*			trans	-117.5	69.1	175.3	-164.4	174.2	-177.9	178.3	0	110.9	M207 D208	M207-K210 PolarHBondContact O-N 3.3Å; D208-K210 PolarHBondContact O-N 2.86Å
211	P	43.3	Very low	50.6	Low	101 Å²	101	104.4 Å²	104.4	66%	0.656	61%	0.614	S	S	*	*			trans	-61.8	144.4	157.8	30.8	-30.1	0	0	0	107.2	L209 S213	L209-P211 VanDerWaalsContact O-CD 3.31Å; L209-P211 WeakPolarHBondContact O-CD 3.29Å; P211-S213 PolarHBondContact O-N 2.62Å
212	A	42.8	Very low	50.3	Low	90 Å²	90	108 Å²	108	74%	0.744	63%	0.626	S	S	*	*			trans	-35.3	128.4	178.5	0	0	0	0	0	112.3	P214	A212-P214 VanDerWaalsContact C-CD 3.41Å; A212-P214 WeakPolarHBondContact O-CD 3.24Å
213	S	37.7	Very low	49.9	Very low	113 Å²	113	103.3 Å²	103.3	79%	0.79	62%	0.616	S	S	*	*			trans	-77	106.5	161.3	52.3	0	0	0	0	108.8	P211	P211-S213 PolarHBondContact O-N 2.62Å
214	P	40.4	Very low	49.5	Very low	102 Å²	102	107.6 Å²	107.6	66%	0.662	64%	0.636	S	S	*	*			trans	-110.2	125.7	138.8	34.3	-26.4	0	0	0	108.2	A212	A212-P214 VanDerWaalsContact C-CD 3.41Å; A212-P214 WeakPolarHBondContact O-CD 3.24Å
215	S	37.2	Very low	48.9	Very low	101 Å²	101	113.3 Å²	113.3	71%	0.706	65%	0.653	S	S	*	*			trans	-4.6	137.3	152.1	53.1	0	0	0	0	118.9
216	R	32.7	Very low	48.6	Very low	240 Å²	240	115.4 Å²	115.4	91%	0.906	66%	0.66	S	S	*	*			trans	84.5	110.2	152.8	-69	173.7	170.5	141.2	-2.8	117.9
217	A	42.3	Very low	48.3	Very low	89 Å²	89	119.8 Å²	119.8	74%	0.736	67%	0.672	S	S	*	*			trans	-58	143.5	147.6	0	0	0	0	0	110.5
218	I	40.7	Very low	48.2	Very low	167 Å²	167	124.3 Å²	124.3	86%	0.856	69%	0.685	S	S	*	*			trans	171.8	136.5	130.9	-83.9	152.7	0	0	0	108.6
219	S	36.4	Very low	48.1	Very low	107 Å²	107	124 Å²	124	75%	0.748	68%	0.683	S	S	*	*			trans	89.1	121.2	157.5	-167.8	0	0	0	0	119.4
220	S	56.6	Low	48	Very low	106 Å²	106	120.8 Å²	120.8	74%	0.741	67%	0.669	S	S	*	*			trans	-51.6	157.8	168.7	51.1	0	0	0	0	114.3
221	S	54.5	Low	48.6	Very low	89 Å²	89	116.8 Å²	116.8	62%	0.622	66%	0.66	S	S	*	*			trans	162.9	163.4	137.7	-176.5	0	0	0	0	111.3	G223 E224	S221-G223 PolarHBondContact O-N 2.68Å; S221-E224 PolarHBondContact O-N 3.11Å
222	V	56.3	Low	49.3	Very low	120 Å²	120	116.8 Å²	116.8	73%	0.727	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-30.5	-21.1	177.6	-177.1	0	0	0	0	116.5	E224 R225	V222-E224 PolarHBondContact O-N 3.4Å; V222-R225 PolarHBondContact O-N 3.42Å
223	G	53.2	Low	50.1	Low	44 Å²	44	117 Å²	117	45%	0.454	65%	0.651	S	S	.	*	H	α-helix	trans	-57.8	-21.8	171.2	0	0	0	0	0	115.9	S221 L226 R227	S221-G223 PolarHBondContact O-N 2.68Å; G223-L226 PolarHBondContact O-N 2.91Å; G223-R227 VanDerWaalsContact O-CB 3.29Å; G223-R227 WeakPolarHBondContact O-CB 3.41Å; G223-R227 PolarHBondContact O-N 3.43Å
224	E	55.5	Low	51.2	Low	101 Å²	101	116.1 Å²	116.1	47%	0.472	64%	0.641	S	S	.	*	H	α-helix	trans	-76.4	-21.1	175.9	-74	-173	151.2	0	0	114.7	S221 V222 R227 R228	S221-E224 PolarHBondContact O-N 3.11Å; V222-E224 PolarHBondContact O-N 3.4Å; E224-R227 IonicContact OE1-NH2 2.67Å; E224-R228 WeakPolarHBondContact O-CG 3.45Å; E224-R228 PolarHBondContact O-N 2.86Å; E224-R228 PolarHBondContact O-NE 3.39Å; E224-R228 VanDerWaalsContact O-NE 3.14Å
225	R	53.1	Low	52.1	Low	197 Å²	197	113.1 Å²	113.1	74%	0.743	63%	0.628	S	S	*	*	H	α-helix	trans	-77.2	-39.1	168.4	-87.6	-179.8	175	169.7	-1.3	110.7	V222 R228 L229	V222-R225 PolarHBondContact O-N 3.42Å; R225-R228 PolarHBondContact O-N 3.38Å; R225-L229 PolarHBondContact O-N 2.87Å
226	L	55.8	Low	53.2	Low	113 Å²	113	110.4 Å²	110.4	59%	0.592	62%	0.616	S	S	*	*	H	α-helix	trans	-66.9	-39.6	174	-169.4	62.3	0	0	0	111.4	G223 R228 L229 T230	G223-L226 PolarHBondContact O-N 2.91Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 2.93Å; L226-L229 PolarHBondContact O-N 3.49Å; L226-T230 HydrophobicContact CD1-CG2 4.43Å; L226-T230 HydrophobicContact CG-CG2 4.37Å; L226-T230 WeakPolarHBondContact O-CB 3.45Å; L226-T230 VanDerWaalsContact O-CG2 3.29Å; L226-T230 WeakPolarHBondContact O-CG2 3.47Å; L226-T230 PolarHBondContact O-N 2.88Å; L226-T230 PolarHBondContact O-OG1 2.77Å
227	R	54.3	Low	54.7	Low	162 Å²	162	103 Å²	103	61%	0.611	60%	0.597	S	S	*	*	H	α-helix	trans	-62.6	-34.4	174.5	-167	175	82.2	-161.7	0	112.8	G223 E224 T230 S231	G223-R227 VanDerWaalsContact O-CB 3.29Å; G223-R227 WeakPolarHBondContact O-CB 3.41Å; G223-R227 PolarHBondContact O-N 3.43Å; E224-R227 IonicContact OE1-NH2 2.67Å; R227-T230 WeakPolarHBondContact CA-OG1 3.35Å; R227-T230 PolarHBondContact O-OG1 2.98Å; R227-S231 WeakPolarHBondContact O-CB 3.45Å; R227-S231 PolarHBondContact O-N 3.31Å; R227-S231 PolarHBondContact O-OG 2.88Å
228	R	57.2	Low	55.7	Low	156 Å²	156	101.2 Å²	101.2	59%	0.589	58%	0.582	S	S	*	*	H	α-helix	trans	-72.5	-46	175.3	-81.6	-177.4	-88.3	-173.6	-10.4	111.5	E224 R225 L226 S231 T232	E224-R228 WeakPolarHBondContact O-CG 3.45Å; E224-R228 PolarHBondContact O-N 2.86Å; E224-R228 PolarHBondContact O-NE 3.39Å; E224-R228 VanDerWaalsContact O-NE 3.14Å; R225-R228 PolarHBondContact O-N 3.38Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 2.93Å; R228-S231 WeakPolarHBondContact CA-OG 3.48Å; R228-S231 PolarHBondContact O-N 3.34Å; R228-S231 PolarHBondContact O-OG 2.9Å; R228-T232 PolarHBondContact O-N 2.82Å; R228-T232 PolarHBondContact O-OG1 3.27Å
229	L	57.3	Low	56.8	Low	116 Å²	116	99 Å²	99	61%	0.607	57%	0.571	S	S	*	*	H	α-helix	trans	-64.1	-41.8	175.2	-74.7	167.7	0	0	0	112.4	R225 L226 S231 T232 V233	R225-L229 PolarHBondContact O-N 2.87Å; L226-L229 PolarHBondContact O-N 3.49Å; L229-S231 VanDerWaalsContact C-N 3.35Å; L229-T232 PolarHBondContact O-N 3.28Å; L229-V233 WeakPolarHBondContact O-CB 3.02Å; L229-V233 VanDerWaalsContact O-CG2 3.29Å; L229-V233 WeakPolarHBondContact O-CG2 3.37Å; L229-V233 PolarHBondContact O-N 3.43Å
230	T	55.8	Low	58.1	Low	68 Å²	68	97.5 Å²	97.5	42%	0.417	56%	0.561	S	S	.	*	H	α-helix	trans	-67.9	-34.2	174	58.1	0	0	0	0	111.5	L226 R227 V233 V234	L226-T230 HydrophobicContact CD1-CG2 4.43Å; L226-T230 HydrophobicContact CG-CG2 4.37Å; L226-T230 WeakPolarHBondContact O-CB 3.45Å; L226-T230 VanDerWaalsContact O-CG2 3.29Å; L226-T230 WeakPolarHBondContact O-CG2 3.47Å; L226-T230 PolarHBondContact O-N 2.88Å; L226-T230 PolarHBondContact O-OG1 2.77Å; R227-T230 WeakPolarHBondContact CA-OG1 3.35Å; R227-T230 PolarHBondContact O-OG1 2.98Å; T230-V233 PolarHBondContact O-N 3.15Å; T230-V234 WeakPolarHBondContact O-CB 3.48Å; T230-V234 WeakPolarHBondContact O-CG2 3.27Å; T230-V234 PolarHBondContact O-N 3.45Å
231	S	56.5	Low	58.9	Low	70 Å²	70	97.4 Å²	97.4	49%	0.49	55%	0.551	S	S	.	*	H	α-helix	trans	-67.3	-34.1	173.7	69.6	0	0	0	0	113.3	R227 R228 L229 G235	R227-S231 WeakPolarHBondContact O-CB 3.45Å; R227-S231 PolarHBondContact O-N 3.31Å; R227-S231 PolarHBondContact O-OG 2.88Å; R228-S231 WeakPolarHBondContact CA-OG 3.48Å; R228-S231 PolarHBondContact O-N 3.34Å; R228-S231 PolarHBondContact O-OG 2.9Å; L229-S231 VanDerWaalsContact C-N 3.35Å; S231-G235 PolarHBondContact O-N 3.47Å
232	T	58.7	Low	59.9	Low	101 Å²	101	95.7 Å²	95.7	62%	0.62	54%	0.539	S	S	*	.	H	α-helix	trans	-74	-38.6	175.6	-46.7	0	0	0	0	111.6	R228 L229 G235 G236	R228-T232 PolarHBondContact O-N 2.82Å; R228-T232 PolarHBondContact O-OG1 3.27Å; L229-T232 PolarHBondContact O-N 3.28Å; T232-G235 PolarHBondContact O-N 3.45Å; T232-G236 PolarHBondContact O-N 3Å
233	V	59.2	Low	60.8	Low	95 Å²	95	93.2 Å²	93.2	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-70.3	-41.9	174.5	173.5	0	0	0	0	110.9	L229 T230 G235 G236 V237	L229-V233 WeakPolarHBondContact O-CB 3.02Å; L229-V233 VanDerWaalsContact O-CG2 3.29Å; L229-V233 WeakPolarHBondContact O-CG2 3.37Å; L229-V233 PolarHBondContact O-N 3.43Å; T230-V233 PolarHBondContact O-N 3.15Å; V233-G235 VanDerWaalsContact C-N 3.33Å; V233-G236 PolarHBondContact O-N 3.11Å; V233-V237 HydrophobicContact CG1-CG2 4.19Å; V233-V237 VanDerWaalsContact O-CB 3.26Å; V233-V237 WeakPolarHBondContact O-CB 3.43Å; V233-V237 WeakPolarHBondContact O-CG2 3.45Å; V233-V237 PolarHBondContact O-N 2.7Å
234	V	62	Low	62.1	Low	95 Å²	95	94.6 Å²	94.6	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-65.7	-37	173.8	170	0	0	0	0	110.7	T230 A238	T230-V234 WeakPolarHBondContact O-CB 3.48Å; T230-V234 WeakPolarHBondContact O-CG2 3.27Å; T230-V234 PolarHBondContact O-N 3.45Å; V234-A238 WeakPolarHBondContact O-CA 3.25Å; V234-A238 WeakPolarHBondContact O-CB 3.42Å; V234-A238 PolarHBondContact O-N 3.03Å
235	G	58	Low	63.2	Low	39 Å²	39	94.7 Å²	94.7	40%	0.402	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-43	173.1	0	0	0	0	0	112.9	S231 T232 V233 A238 L239	S231-G235 PolarHBondContact O-N 3.47Å; T232-G235 PolarHBondContact O-N 3.45Å; V233-G235 VanDerWaalsContact C-N 3.33Å; G235-A238 PolarHBondContact O-N 3.4Å; G235-L239 VanDerWaalsContact O-CB 3.32Å; G235-L239 WeakPolarHBondContact O-CB 3.43Å; G235-L239 PolarHBondContact O-N 3.27Å
236	G	62.2	Low	64.3	Low	43 Å²	43	88.5 Å²	88.5	44%	0.443	52%	0.518	S	S	.	.	H	α-helix	trans	-68.8	-39	175	0	0	0	0	0	113.3	T232 V233 S240	T232-G236 PolarHBondContact O-N 3Å; V233-G236 PolarHBondContact O-N 3.11Å; G236-S240 VanDerWaalsContact O-CB 3.25Å; G236-S240 WeakPolarHBondContact O-CB 3.4Å; G236-S240 PolarHBondContact O-N 3.41Å
237	V	63.2	Low	65.6	Low	86 Å²	86	88.8 Å²	88.8	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-69.9	-38.5	173.7	171.8	0	0	0	0	110.5	V233 S240 L241	V233-V237 HydrophobicContact CG1-CG2 4.19Å; V233-V237 VanDerWaalsContact O-CB 3.26Å; V233-V237 WeakPolarHBondContact O-CB 3.43Å; V233-V237 WeakPolarHBondContact O-CG2 3.45Å; V233-V237 PolarHBondContact O-N 2.7Å; V237-S240 PolarHBondContact O-N 3.4Å; V237-L241 WeakPolarHBondContact O-CA 3.21Å; V237-L241 WeakPolarHBondContact O-CB 3.38Å; V237-L241 PolarHBondContact O-N 3.03Å
238	A	63.9	Low	67.1	Low	51 Å²	51	82.4 Å²	82.4	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-69.3	-35.6	175.8	0	0	0	0	0	112	V234 G235 S242	V234-A238 WeakPolarHBondContact O-CA 3.25Å; V234-A238 WeakPolarHBondContact O-CB 3.42Å; V234-A238 PolarHBondContact O-N 3.03Å; G235-A238 PolarHBondContact O-N 3.4Å; A238-S242 WeakPolarHBondContact O-CB 3.38Å; A238-S242 PolarHBondContact O-N 2.87Å; A238-S242 PolarHBondContact O-OG 3.08Å
239	L	63.6	Low	68.2	Low	120 Å²	120	77.9 Å²	77.9	63%	0.628	49%	0.493	S	S	*	.	H	α-helix	trans	-70.1	-42.1	173.8	-162.9	71.8	0	0	0	111.1	G235 S242 T243	G235-L239 VanDerWaalsContact O-CB 3.32Å; G235-L239 WeakPolarHBondContact O-CB 3.43Å; G235-L239 PolarHBondContact O-N 3.27Å; L239-S242 WeakPolarHBondContact CA-OG 3.3Å; L239-S242 PolarHBondContact O-N 2.76Å; L239-S242 PolarHBondContact O-OG 3.34Å; L239-T243 VanDerWaalsContact O-CG2 3.3Å; L239-T243 WeakPolarHBondContact O-CG2 3.47Å; L239-T243 PolarHBondContact O-N 3.22Å; L239-T243 PolarHBondContact O-OG1 3.44Å
240	S	64.3	Low	69.2	Low	75 Å²	75	79 Å²	79	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-69.3	-34.4	175.1	-163.7	0	0	0	0	112.6	G236 V237 T243 S244	G236-S240 VanDerWaalsContact O-CB 3.25Å; G236-S240 WeakPolarHBondContact O-CB 3.4Å; G236-S240 PolarHBondContact O-N 3.41Å; V237-S240 PolarHBondContact O-N 3.4Å; S240-T243 WeakPolarHBondContact CA-OG1 3.23Å; S240-T243 PolarHBondContact O-OG1 3.2Å; S240-T243 VanDerWaalsContact O-OG1 3.05Å; S240-S244 WeakPolarHBondContact O-CB 3.33Å; S240-S244 PolarHBondContact O-N 3.25Å
241	L	72.8	Confident	70.4	Confident	104 Å²	104	81.3 Å²	81.3	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-74.5	-37	176.5	-172.4	70	0	0	0	111.1	V237 L245	V237-L241 WeakPolarHBondContact O-CA 3.21Å; V237-L241 WeakPolarHBondContact O-CB 3.38Å; V237-L241 PolarHBondContact O-N 3.03Å; L241-L245 HydrophobicContact CG-CD1 4.27Å; L241-L245 WeakPolarHBondContact O-CB 3.28Å; L241-L245 WeakPolarHBondContact O-CG 3.3Å; L241-L245 PolarHBondContact O-N 2.97Å
242	S	75.3	Confident	71.4	Confident	53 Å²	53	82.8 Å²	82.8	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-41.4	174.2	56.5	0	0	0	0	111.4	A238 L239 L245 S246	A238-S242 WeakPolarHBondContact O-CB 3.38Å; A238-S242 PolarHBondContact O-N 2.87Å; A238-S242 PolarHBondContact O-OG 3.08Å; L239-S242 WeakPolarHBondContact CA-OG 3.3Å; L239-S242 PolarHBondContact O-N 2.76Å; L239-S242 PolarHBondContact O-OG 3.34Å; S242-L245 PolarHBondContact O-N 3.5Å; S242-S246 WeakPolarHBondContact O-CB 3.12Å; S242-S246 PolarHBondContact O-N 2.71Å; S242-S246 PolarHBondContact O-OG 3.07Å
243	T	75.4	Confident	72.3	Confident	69 Å²	69	82.3 Å²	82.3	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-67	-38.6	173.4	55.5	0	0	0	0	112.2	L239 S240 S246 L247	L239-T243 VanDerWaalsContact O-CG2 3.3Å; L239-T243 WeakPolarHBondContact O-CG2 3.47Å; L239-T243 PolarHBondContact O-N 3.22Å; L239-T243 PolarHBondContact O-OG1 3.44Å; S240-T243 WeakPolarHBondContact CA-OG1 3.23Å; S240-T243 PolarHBondContact O-OG1 3.2Å; S240-T243 VanDerWaalsContact O-OG1 3.05Å; T243-S246 PolarHBondContact O-N 3.18Å; T243-L247 WeakPolarHBondContact O-CB 3.34Å; T243-L247 WeakPolarHBondContact O-CG 3.32Å; T243-L247 PolarHBondContact O-N 3.43Å
244	S	79.5	Confident	73.1	Confident	72 Å²	72	81.9 Å²	81.9	50%	0.503	48%	0.481	S	S	.	.	H	α-helix	trans	-68.3	-35	173.6	-167.5	0	0	0	0	112.4	S240 G248	S240-S244 WeakPolarHBondContact O-CB 3.33Å; S240-S244 PolarHBondContact O-N 3.25Å; S244-G248 WeakPolarHBondContact O-CA 3.4Å; S244-G248 PolarHBondContact O-N 3.24Å
245	L	79.7	Confident	73.8	Confident	104 Å²	104	79.8 Å²	79.8	55%	0.545	47%	0.466	S	S	.	.	H	α-helix	trans	-65.3	-44.5	169.8	-94.7	159.7	0	0	0	111.1	L241 S242 G248 V249	L241-L245 HydrophobicContact CG-CD1 4.27Å; L241-L245 WeakPolarHBondContact O-CB 3.28Å; L241-L245 WeakPolarHBondContact O-CG 3.3Å; L241-L245 PolarHBondContact O-N 2.97Å; S242-L245 PolarHBondContact O-N 3.5Å; L245-G248 CarbonylContact O-C 3.59Å; L245-G248 PolarHBondContact O-N 2.99Å; L245-V249 WeakPolarHBondContact O-CB 3.36Å; L245-V249 WeakPolarHBondContact O-CG2 3.43Å; L245-V249 PolarHBondContact O-N 2.94Å
246	S	75.8	Confident	74.7	Confident	67 Å²	67	82.6 Å²	82.6	47%	0.469	47%	0.469	S	S	.	.	H	α-helix	trans	-61.7	-46.1	176.8	-54.8	0	0	0	0	111.6	S242 T243 V249 F250	S242-S246 WeakPolarHBondContact O-CB 3.12Å; S242-S246 PolarHBondContact O-N 2.71Å; S242-S246 PolarHBondContact O-OG 3.07Å; T243-S246 PolarHBondContact O-N 3.18Å; S246-V249 PolarHBondContact O-N 3.15Å; S246-F250 WeakPolarHBondContact O-CB 3.08Å; S246-F250 PolarHBondContact O-N 3.27Å
247	L	83.3	Confident	75.4	Confident	119 Å²	119	87.2 Å²	87.2	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-65.1	-39.2	174.8	-77.3	164.1	0	0	0	111.6	T243 F250 F251	T243-L247 WeakPolarHBondContact O-CB 3.34Å; T243-L247 WeakPolarHBondContact O-CG 3.32Å; T243-L247 PolarHBondContact O-N 3.43Å; L247-F250 PolarHBondContact O-N 2.81Å; L247-F251 VanDerWaalsContact O-CB 3.29Å; L247-F251 WeakPolarHBondContact O-CB 3.34Å; L247-F251 PolarHBondContact O-N 2.93Å
248	G	85.8	Confident	75.6	Confident	27 Å²	27	88.4 Å²	88.4	28%	0.278	47%	0.468	S	S	.	.	H	α-helix	trans	-66.5	-40.7	176.3	0	0	0	0	0	112.6	S244 L245 F251 L252	S244-G248 WeakPolarHBondContact O-CA 3.4Å; S244-G248 PolarHBondContact O-N 3.24Å; L245-G248 CarbonylContact O-C 3.59Å; L245-G248 PolarHBondContact O-N 2.99Å; G248-F251 PolarHBondContact O-N 3.08Å; G248-L252 VanDerWaalsContact O-CB 3.28Å; G248-L252 WeakPolarHBondContact O-CB 3.42Å; G248-L252 VanDerWaalsContact O-CG 3.23Å; G248-L252 WeakPolarHBondContact O-CG 3.48Å; G248-L252 PolarHBondContact O-N 2.74Å
249	V	80.6	Confident	75.9	Confident	61 Å²	61	93 Å²	93	37%	0.37	48%	0.476	S	S	.	.	H	α-helix	trans	-66.4	-42.5	174.8	169.2	0	0	0	0	110.4	L245 S246 L252 Q253	L245-V249 WeakPolarHBondContact O-CB 3.36Å; L245-V249 WeakPolarHBondContact O-CG2 3.43Å; L245-V249 PolarHBondContact O-N 2.94Å; S246-V249 PolarHBondContact O-N 3.15Å; V249-L252 PolarHBondContact O-N 3.22Å; V249-Q253 WeakPolarHBondContact O-CB 3.33Å; V249-Q253 PolarHBondContact O-N 3.12Å
250	F	78.7	Confident	76.4	Confident	140 Å²	140	89 Å²	89	61%	0.614	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-44.5	173.6	-179.8	-94.3	0	0	0	111.9	S246 L247 Q253 F254	S246-F250 WeakPolarHBondContact O-CB 3.08Å; S246-F250 PolarHBondContact O-N 3.27Å; L247-F250 PolarHBondContact O-N 2.81Å; F250-Q253 PolarHBondContact O-N 3.3Å; F250-F254 WeakPolarHBondContact O-CB 3.35Å; F250-F254 PolarHBondContact O-N 3.13Å
251	F	79.8	Confident	76.2	Confident	117 Å²	117	90 Å²	90	51%	0.513	46%	0.464	S	S	.	.	H	α-helix	trans	-67.4	-36.2	178	-170.9	-105.7	0	0	0	112	L247 G248 F254 L255	L247-F251 VanDerWaalsContact O-CB 3.29Å; L247-F251 WeakPolarHBondContact O-CB 3.34Å; L247-F251 PolarHBondContact O-N 2.93Å; G248-F251 PolarHBondContact O-N 3.08Å; F251-F254 HydrophobicContact CD2-CD1 4.41Å; F251-F254 HydrophobicContact CE2-CD1 4.35Å; F251-F254 WeakPolarHBondContact O-CB 3.46Å; F251-F254 PolarHBondContact O-N 3.25Å; F251-L255 HydrophobicContact CD1-CD1 3.89Å; F251-L255 HydrophobicContact CD1-CG 4.14Å; F251-L255 HydrophobicContact CE1-CD1 3.51Å; F251-L255 HydrophobicContact CE1-CD2 4.32Å; F251-L255 HydrophobicContact CE1-CG 3.87Å; F251-L255 HydrophobicContact CZ-CD1 4.23Å; F251-L255 HydrophobicContact CZ-CD2 4.22Å; F251-L255 HydrophobicContact CZ-CG 4.2Å; F251-L255 WeakPolarHBondContact O-CB 3.33Å; F251-L255 WeakPolarHBondContact O-CG 3.44Å; F251-L255 PolarHBondContact O-N 2.82Å
252	L	77.3	Confident	75.7	Confident	100 Å²	100	92.1 Å²	92.1	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-40.6	172.7	-77.5	171.5	0	0	0	111.9	G248 V249 F254 L255 E256	G248-L252 VanDerWaalsContact O-CB 3.28Å; G248-L252 WeakPolarHBondContact O-CB 3.42Å; G248-L252 VanDerWaalsContact O-CG 3.23Å; G248-L252 WeakPolarHBondContact O-CG 3.48Å; G248-L252 PolarHBondContact O-N 2.74Å; V249-L252 PolarHBondContact O-N 3.22Å; L252-F254 VanDerWaalsContact C-N 3.33Å; L252-L255 PolarHBondContact O-N 2.88Å; L252-E256 VanDerWaalsContact O-CB 3.23Å; L252-E256 WeakPolarHBondContact O-CB 3.42Å; L252-E256 PolarHBondContact O-N 3.24Å
253	Q	78.8	Confident	75.3	Confident	91 Å²	91	91.1 Å²	91.1	43%	0.425	46%	0.462	S	S	.	.	H	α-helix	trans	-61.8	-41.8	171	-88.2	-172.3	-14.7	0	0	111.5	V249 F250 E256 W257	V249-Q253 WeakPolarHBondContact O-CB 3.33Å; V249-Q253 PolarHBondContact O-N 3.12Å; F250-Q253 PolarHBondContact O-N 3.3Å; Q253-E256 PolarHBondContact O-N 2.97Å; Q253-W257 WeakPolarHBondContact O-CB 3.44Å; Q253-W257 PolarHBondContact O-N 2.79Å
254	F	75.9	Confident	74.9	Confident	86 Å²	86	90.1 Å²	90.1	38%	0.377	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174.3	171.5	-96.8	0	0	0	111.7	F250 F251 L252 W257 W258	F250-F254 WeakPolarHBondContact O-CB 3.35Å; F250-F254 PolarHBondContact O-N 3.13Å; F251-F254 HydrophobicContact CD2-CD1 4.41Å; F251-F254 HydrophobicContact CE2-CD1 4.35Å; F251-F254 WeakPolarHBondContact O-CB 3.46Å; F251-F254 PolarHBondContact O-N 3.25Å; L252-F254 VanDerWaalsContact C-N 3.33Å; F254-W257 HydrophobicContact CD2-CE3 4.19Å; F254-W257 HydrophobicContact CD2-CZ3 4.5Å; F254-W257 HydrophobicContact CE2-CE3 4.12Å; F254-W257 HydrophobicContact CE2-CZ3 4.01Å; F254-W257 PolarHBondContact O-N 3.43Å; F254-W258 HydrophobicContact CE2-CE3 4.32Å; F254-W258 HydrophobicContact CZ-CD2 4.42Å; F254-W258 AromaticContact CZ-CE3 3.85Å; F254-W258 HydrophobicContact CZ-CE3 3.85Å; F254-W258 HydrophobicContact CZ-CZ3 4.41Å; F254-W258 VanDerWaalsContact O-CB 3.26Å; F254-W258 WeakPolarHBondContact O-CB 3.05Å; F254-W258 PolarHBondContact O-N 3.39Å
255	L	75.5	Confident	74.1	Confident	51 Å²	51	91.3 Å²	91.3	27%	0.267	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-38.6	176	-74.3	-174.6	0	0	0	112	F251 L252 W257 W258 Y259	F251-L255 HydrophobicContact CD1-CD1 3.89Å; F251-L255 HydrophobicContact CD1-CG 4.14Å; F251-L255 HydrophobicContact CE1-CD1 3.51Å; F251-L255 HydrophobicContact CE1-CD2 4.32Å; F251-L255 HydrophobicContact CE1-CG 3.87Å; F251-L255 HydrophobicContact CZ-CD1 4.23Å; F251-L255 HydrophobicContact CZ-CD2 4.22Å; F251-L255 HydrophobicContact CZ-CG 4.2Å; F251-L255 WeakPolarHBondContact O-CB 3.33Å; F251-L255 WeakPolarHBondContact O-CG 3.44Å; F251-L255 PolarHBondContact O-N 2.82Å; L252-L255 PolarHBondContact O-N 2.88Å; L255-W257 VanDerWaalsContact C-N 3.3Å; L255-W257 PolarHBondContact O-N 2.76Å; L255-W258 PolarHBondContact O-N 3.17Å; L255-Y259 HydrophobicContact CB-CD2 4.35Å; L255-Y259 HydrophobicContact CD2-CD2 4.41Å; L255-Y259 HydrophobicContact CD2-CE2 4.03Å; L255-Y259 WeakPolarHBondContact O-CB 3.49Å; L255-Y259 VanDerWaalsContact O-CD2 3.25Å; L255-Y259 WeakPolarHBondContact O-CD2 3.23Å; L255-Y259 PolarHBondContact O-N 3.21Å
256	E	77.9	Confident	73.6	Confident	99 Å²	99	89.4 Å²	89.4	46%	0.463	45%	0.446	S	S	.	.	H	α-helix	trans	-63.3	-39.6	175.1	-174.7	172.3	-165.3	0	0	110.8	L252 Q253 S260	L252-E256 VanDerWaalsContact O-CB 3.23Å; L252-E256 WeakPolarHBondContact O-CB 3.42Å; L252-E256 PolarHBondContact O-N 3.24Å; Q253-E256 PolarHBondContact O-N 2.97Å; E256-S260 WeakPolarHBondContact O-CA 3.49Å; E256-S260 WeakPolarHBondContact O-CB 3.5Å; E256-S260 PolarHBondContact O-N 3.48Å
257	W	75.7	Confident	73.3	Confident	140 Å²	140	88.5 Å²	88.5	53%	0.53	44%	0.436	S	S	.	.	H	α-helix	trans	-66	-45.6	170.1	175.5	78.6	0	0	0	112.3	Q253 F254 L255 Y259 S260 N263	Q253-W257 WeakPolarHBondContact O-CB 3.44Å; Q253-W257 PolarHBondContact O-N 2.79Å; F254-W257 HydrophobicContact CD2-CE3 4.19Å; F254-W257 HydrophobicContact CD2-CZ3 4.5Å; F254-W257 HydrophobicContact CE2-CE3 4.12Å; F254-W257 HydrophobicContact CE2-CZ3 4.01Å; F254-W257 PolarHBondContact O-N 3.43Å; L255-W257 VanDerWaalsContact C-N 3.3Å; L255-W257 PolarHBondContact O-N 2.76Å; W257-Y259 PolarHBondContact O-N 3.21Å; W257-S260 WeakPolarHBondContact O-CB 3.25Å; W257-S260 PolarHBondContact O-N 2.75Å; W257-S260 VanDerWaalsContact O-N 3.15Å; W257-S260 PolarHBondContact O-OG 2.78Å; W257-N263 WeakPolarHBondContact CZ2-ND2 3.47Å
258	W	67.4	Low	72.4	Confident	110 Å²	110	88.6 Å²	88.6	42%	0.417	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-37.4	-179.2	-170.3	-94.8	0	0	0	112.8	F254 L255 I267	F254-W258 HydrophobicContact CE2-CE3 4.32Å; F254-W258 HydrophobicContact CZ-CD2 4.42Å; F254-W258 AromaticContact CZ-CE3 3.85Å; F254-W258 HydrophobicContact CZ-CE3 3.85Å; F254-W258 HydrophobicContact CZ-CZ3 4.41Å; F254-W258 VanDerWaalsContact O-CB 3.26Å; F254-W258 WeakPolarHBondContact O-CB 3.05Å; F254-W258 PolarHBondContact O-N 3.39Å; L255-W258 PolarHBondContact O-N 3.17Å; W258-I267 HydrophobicContact CZ2-CD1 4.1Å
259	Y	70.8	Confident	71.6	Confident	148 Å²	148	91.9 Å²	91.9	58%	0.58	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	5.8	175.4	-70.2	-71.7	0	0	0	113.2	L255 W257 S261 Q264	L255-Y259 HydrophobicContact CB-CD2 4.35Å; L255-Y259 HydrophobicContact CD2-CD2 4.41Å; L255-Y259 HydrophobicContact CD2-CE2 4.03Å; L255-Y259 WeakPolarHBondContact O-CB 3.49Å; L255-Y259 VanDerWaalsContact O-CD2 3.25Å; L255-Y259 WeakPolarHBondContact O-CD2 3.23Å; L255-Y259 PolarHBondContact O-N 3.21Å; W257-Y259 PolarHBondContact O-N 3.21Å; Y259-S261 PolarHBondContact O-N 3.34Å; Y259-Q264 VanDerWaalsContact CD1-NE2 3.33Å
260	S	74.3	Confident	71.2	Confident	35 Å²	35	96.1 Å²	96.1	25%	0.245	47%	0.466	C	S	.	.	S	Bend	trans	-56.6	140.7	173.1	69.9	0	0	0	0	109	E256 W257 E262 N263 Q264	E256-S260 WeakPolarHBondContact O-CA 3.49Å; E256-S260 WeakPolarHBondContact O-CB 3.5Å; E256-S260 PolarHBondContact O-N 3.48Å; W257-S260 WeakPolarHBondContact O-CB 3.25Å; W257-S260 PolarHBondContact O-N 2.75Å; W257-S260 VanDerWaalsContact O-N 3.15Å; W257-S260 PolarHBondContact O-OG 2.78Å; S260-E262 PolarHBondContact O-N 3.24Å; S260-E262 VanDerWaalsContact O-N 3.08Å; S260-N263 PolarHBondContact O-N 3.4Å; S260-Q264 PolarHBondContact O-N 2.75Å
261	S	59.9	Low	70.9	Confident	96 Å²	96	94.3 Å²	94.3	67%	0.671	47%	0.466	S	S	*	.	H	α-helix	trans	-56.2	-30.4	-175	47.3	0	0	0	0	112.6	Y259 N265	Y259-S261 PolarHBondContact O-N 3.34Å; S261-N265 PolarHBondContact O-N 2.85Å; S261-N265 PolarHBondContact O-ND2 3.38Å; S261-N265 VanDerWaalsContact O-ND2 3.12Å
262	E	63.3	Low	70	Confident	149 Å²	149	92.2 Å²	92.2	70%	0.696	47%	0.466	S	S	*	.	H	α-helix	trans	-66.7	-49.2	175.7	-159.4	168.3	164.6	0	0	111.6	S260 N265 T266	S260-E262 PolarHBondContact O-N 3.24Å; S260-E262 VanDerWaalsContact O-N 3.08Å; E262-N265 PolarHBondContact O-N 2.82Å; E262-T266 PolarHBondContact O-N 2.86Å; E262-T266 VanDerWaalsContact O-N 3.14Å
263	N	66.8	Low	69.4	Low	33 Å²	33	94.7 Å²	94.7	18%	0.176	48%	0.479	C	S	.	.	H	α-helix	trans	-71.7	-29.5	176.6	-82.9	23.4	0	0	0	113.5	W257 S260 N265 T266 I267	W257-N263 WeakPolarHBondContact CZ2-ND2 3.47Å; S260-N263 PolarHBondContact O-N 3.4Å; N263-N265 VanDerWaalsContact C-N 3.27Å; N263-N265 PolarHBondContact O-N 2.8Å; N263-T266 VanDerWaalsContact CA-OG1 3.29Å; N263-T266 WeakPolarHBondContact CA-OG1 3.33Å; N263-T266 PolarHBondContact O-N 2.64Å; N263-T266 PolarHBondContact O-OG1 3.17Å; N263-I267 WeakPolarHBondContact O-CB 3.33Å; N263-I267 VanDerWaalsContact O-CG1 3.27Å; N263-I267 WeakPolarHBondContact O-CG1 3.23Å; N263-I267 PolarHBondContact O-N 3.12Å
264	Q	67.3	Low	69	Low	48 Å²	48	95.9 Å²	95.9	22%	0.224	50%	0.495	C	S	.	.	H	α-helix	trans	-63.4	-36.2	171.6	-75.5	-67.8	-54.6	0	0	111.4	Y259 S260 K268	Y259-Q264 VanDerWaalsContact CD1-NE2 3.33Å; S260-Q264 PolarHBondContact O-N 2.75Å; Q264-K268 WeakPolarHBondContact O-CB 3.35Å; Q264-K268 WeakPolarHBondContact O-CD 3.23Å; Q264-K268 WeakPolarHBondContact O-CG 3.45Å; Q264-K268 PolarHBondContact O-N 3.3Å
265	N	62.9	Low	68.5	Low	97 Å²	97	98 Å²	98	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-71.2	-36.8	175	-67.1	-25	0	0	0	111.8	S261 E262 N263 T269	S261-N265 PolarHBondContact O-N 2.85Å; S261-N265 PolarHBondContact O-ND2 3.38Å; S261-N265 VanDerWaalsContact O-ND2 3.12Å; E262-N265 PolarHBondContact O-N 2.82Å; N263-N265 VanDerWaalsContact C-N 3.27Å; N263-N265 PolarHBondContact O-N 2.8Å; N265-T269 WeakPolarHBondContact O-CB 3.35Å; N265-T269 WeakPolarHBondContact O-CG2 3.26Å; N265-T269 PolarHBondContact O-N 3.32Å; N265-T269 PolarHBondContact O-OG1 2.8Å
266	T	69	Low	68.2	Low	64 Å²	64	100.8 Å²	100.8	39%	0.393	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-42.1	174.9	62.8	0	0	0	0	112.2	E262 N263 T269 L270	E262-T266 PolarHBondContact O-N 2.86Å; E262-T266 VanDerWaalsContact O-N 3.14Å; N263-T266 VanDerWaalsContact CA-OG1 3.29Å; N263-T266 WeakPolarHBondContact CA-OG1 3.33Å; N263-T266 PolarHBondContact O-N 2.64Å; N263-T266 PolarHBondContact O-OG1 3.17Å; T266-T269 VanDerWaalsContact CA-OG1 3.24Å; T266-T269 WeakPolarHBondContact CA-OG1 3.43Å; T266-T269 PolarHBondContact O-N 3.2Å; T266-T269 PolarHBondContact O-OG1 3.16Å; T266-L270 WeakPolarHBondContact O-CB 3.46Å; T266-L270 VanDerWaalsContact O-CG 3.24Å; T266-L270 WeakPolarHBondContact O-CG 3.48Å; T266-L270 PolarHBondContact O-N 2.81Å
267	I	67.8	Low	67.8	Low	48 Å²	48	101.1 Å²	101.1	25%	0.246	55%	0.547	C	S	.	.	H	α-helix	trans	-65.6	-42.8	174.5	-66.1	167.3	0	0	0	110.3	W258 N263 T269 L270 T271	W258-I267 HydrophobicContact CZ2-CD1 4.1Å; N263-I267 WeakPolarHBondContact O-CB 3.33Å; N263-I267 VanDerWaalsContact O-CG1 3.27Å; N263-I267 WeakPolarHBondContact O-CG1 3.23Å; N263-I267 PolarHBondContact O-N 3.12Å; I267-T269 VanDerWaalsContact C-N 3.29Å; I267-T269 PolarHBondContact O-N 3.37Å; I267-L270 PolarHBondContact O-N 3.22Å; I267-T271 HydrophobicContact CG2-CG2 4.24Å; I267-T271 WeakPolarHBondContact O-CB 3.49Å; I267-T271 WeakPolarHBondContact O-CG2 3.25Å; I267-T271 PolarHBondContact O-N 3.43Å; I267-T271 PolarHBondContact O-OG1 3.49Å
268	K	66.1	Low	67.6	Low	121 Å²	121	98.9 Å²	98.9	53%	0.526	55%	0.55	S	S	.	*	H	α-helix	trans	-62.8	-34	175.8	-77.3	171.1	-173.9	176.8	0	112.7	Q264 S272	Q264-K268 WeakPolarHBondContact O-CB 3.35Å; Q264-K268 WeakPolarHBondContact O-CD 3.23Å; Q264-K268 WeakPolarHBondContact O-CG 3.45Å; Q264-K268 PolarHBondContact O-N 3.3Å; K268-S272 WeakPolarHBondContact O-CA 3.18Å; K268-S272 WeakPolarHBondContact O-CB 3.35Å; K268-S272 PolarHBondContact O-N 2.92Å; K268-S272 PolarHBondContact O-OG 3.1Å; K268-S272 VanDerWaalsContact O-OG 3.08Å
269	T	68.8	Low	67.7	Low	96 Å²	96	97.8 Å²	97.8	59%	0.589	56%	0.557	S	S	*	*	H	α-helix	trans	-76.7	-34.3	175.4	40.2	0	0	0	0	112.5	N265 T266 I267 S272	N265-T269 WeakPolarHBondContact O-CB 3.35Å; N265-T269 WeakPolarHBondContact O-CG2 3.26Å; N265-T269 PolarHBondContact O-N 3.32Å; N265-T269 PolarHBondContact O-OG1 2.8Å; T266-T269 VanDerWaalsContact CA-OG1 3.24Å; T266-T269 WeakPolarHBondContact CA-OG1 3.43Å; T266-T269 PolarHBondContact O-N 3.2Å; T266-T269 PolarHBondContact O-OG1 3.16Å; I267-T269 VanDerWaalsContact C-N 3.29Å; I267-T269 PolarHBondContact O-N 3.37Å; T269-S272 WeakPolarHBondContact CA-OG 3.31Å; T269-S272 PolarHBondContact O-OG 3.17Å
270	L	72.2	Confident	67.2	Low	149 Å²	149	97 Å²	97	78%	0.78	56%	0.562	S	S	*	*	H	α-helix	trans	-73.6	-29.7	174.3	-69.9	173.6	0	0	0	113.2	T266 I267	T266-L270 WeakPolarHBondContact O-CB 3.46Å; T266-L270 VanDerWaalsContact O-CG 3.24Å; T266-L270 WeakPolarHBondContact O-CG 3.48Å; T266-L270 PolarHBondContact O-N 2.81Å; I267-L270 PolarHBondContact O-N 3.22Å
271	T	72.4	Confident	66.3	Low	103 Å²	103	104 Å²	104	63%	0.632	59%	0.59	S	S	*	*	H	α-helix	trans	-100.6	-10	179.4	56.6	0	0	0	0	113.7	I267 L273	I267-T271 HydrophobicContact CG2-CG2 4.24Å; I267-T271 WeakPolarHBondContact O-CB 3.49Å; I267-T271 WeakPolarHBondContact O-CG2 3.25Å; I267-T271 PolarHBondContact O-N 3.43Å; I267-T271 PolarHBondContact O-OG1 3.49Å; T271-L273 PolarHBondContact O-N 3.19Å
272	S	59.6	Low	66	Low	73 Å²	73	104.9 Å²	104.9	51%	0.51	59%	0.587	S	S	.	*	S	Bend	trans	-67.3	122	172.7	53.9	0	0	0	0	109.1	K268 T269	K268-S272 WeakPolarHBondContact O-CA 3.18Å; K268-S272 WeakPolarHBondContact O-CB 3.35Å; K268-S272 PolarHBondContact O-N 2.92Å; K268-S272 PolarHBondContact O-OG 3.1Å; K268-S272 VanDerWaalsContact O-OG 3.08Å; T269-S272 WeakPolarHBondContact CA-OG 3.31Å; T269-S272 PolarHBondContact O-OG 3.17Å
273	L	65.3	Low	65.5	Low	151 Å²	151	104.6 Å²	104.6	79%	0.791	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-51.8	146.1	164.1	-67.6	167.7	0	0	0	109.2	T271 T275	T271-L273 PolarHBondContact O-N 3.19Å; L273-T275 PolarHBondContact O-N 3.24Å; L273-T275 VanDerWaalsContact O-N 3.12Å
274	P	70.6	Confident	64.6	Low	116 Å²	116	110.2 Å²	110.2	75%	0.753	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-52.2	126.1	172.2	22.8	-32.3	0	0	0	107.9
275	T	65.1	Low	63.6	Low	131 Å²	131	113.8 Å²	113.8	80%	0.804	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-51.1	121.3	177.4	38	0	0	0	0	107.7	L273	L273-T275 PolarHBondContact O-N 3.24Å; L273-T275 VanDerWaalsContact O-N 3.12Å
276	P	68.8	Low	62.9	Low	110 Å²	110	117.3 Å²	117.3	71%	0.714	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-55.6	141	-177.6	23.2	-32.8	0	0	0	108.1
277	P	70.6	Confident	61.9	Low	106 Å²	106	119.4 Å²	119.4	69%	0.688	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-52.1	138.3	177.1	22.8	-32.6	0	0	0	108.5
278	P	71.3	Confident	60.9	Low	92 Å²	92	124.2 Å²	124.2	60%	0.597	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-51.6	135.4	-177.4	20.5	-31.8	0	0	0	109.3	I280	P278-I280 PolarHBondContact O-N 2.95Å
279	P	69.6	Low	60.1	Low	87 Å²	87	124.1 Å²	124.1	57%	0.565	70%	0.696	S	S	*	*			trans	-56.4	114.2	-176.4	17.6	-28.9	0	0	0	110.4	H281 L282	P279-H281 PolarHBondContact O-N 3.02Å; P279-L282 HydrophobicContact CG-CD1 4.27Å; P279-L282 PolarHBondContact O-N 3.38Å; P279-L282 VanDerWaalsContact O-N 3.15Å
280	I	59.9	Low	59.1	Low	132 Å²	132	130.4 Å²	130.4	68%	0.677	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-61.5	-22	-171.9	-56.1	168.6	0	0	0	111.6	P278 L282 Q283	P278-I280 PolarHBondContact O-N 2.95Å; I280-L282 PolarHBondContact O-N 3.31Å; I280-Q283 WeakPolarHBondContact O-CB 3.23Å; I280-Q283 PolarHBondContact O-N 2.76Å; I280-Q283 VanDerWaalsContact O-N 3.1Å
281	H	56.2	Low	58.3	Low	181 Å²	181	131.7 Å²	131.7	84%	0.838	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-66.7	-13.6	178.3	-65.2	-67.8	0	0	0	114.7	P279	P279-H281 PolarHBondContact O-N 3.02Å
282	L	53.6	Low	58	Low	116 Å²	116	129.9 Å²	129.9	61%	0.607	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-94.7	-9.3	173.5	-74.2	164.8	0	0	0	113.4	P279 I280 N284	P279-L282 HydrophobicContact CG-CD1 4.27Å; P279-L282 PolarHBondContact O-N 3.38Å; P279-L282 VanDerWaalsContact O-N 3.15Å; I280-L282 PolarHBondContact O-N 3.31Å; L282-N284 VanDerWaalsContact C-N 3.32Å; L282-N284 PolarHBondContact O-N 3.32Å
283	Q	52.4	Low	58.9	Low	142 Å²	142	134 Å²	134	66%	0.664	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-21.7	-178.3	-146.9	87.9	24.2	0	0	112.8	I280	I280-Q283 WeakPolarHBondContact O-CB 3.23Å; I280-Q283 PolarHBondContact O-N 2.76Å; I280-Q283 VanDerWaalsContact O-N 3.1Å
284	N	47.6	Very low	59.9	Low	151 Å²	151	128 Å²	128	81%	0.807	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-0.6	-178.3	-82.5	-1.8	0	0	0	114.1	L282 E286	L282-N284 VanDerWaalsContact C-N 3.32Å; L282-N284 PolarHBondContact O-N 3.32Å; N284-E286 PolarHBondContact O-N 3.45Å
285	Q	46.9	Very low	60.8	Low	124 Å²	124	122.6 Å²	122.6	58%	0.579	65%	0.648	S	S	*	*	S	Bend	trans	-77.8	116.7	160.1	-70.3	-173.3	-16.9	0	0	105.7
286	E	47.3	Very low	62	Low	171 Å²	171	119.1 Å²	119.1	80%	0.799	63%	0.628	S	S	*	*			trans	-38.7	133.9	165.3	-70.2	-164.7	141.2	0	0	108.3	N284 L288	N284-E286 PolarHBondContact O-N 3.45Å; E286-L288 VanDerWaalsContact C-N 3.33Å; E286-L288 PolarHBondContact O-N 2.84Å
287	P	48.8	Very low	63	Low	108 Å²	108	117 Å²	117	70%	0.701	61%	0.61	S	S	*	*			trans	-55.4	106.2	179.1	23.1	-31.7	0	0	0	106	T289	P287-T289 VanDerWaalsContact C-N 3.26Å; P287-T289 WeakPolarHBondContact O-CA 3.28Å; P287-T289 PolarHBondContact O-N 2.96Å
288	L	46.9	Very low	63.8	Low	148 Å²	148	114.1 Å²	114.1	78%	0.775	59%	0.592	S	S	*	*			trans	-50.6	104	-179.8	-96.5	158.1	0	0	0	105.2	E286 R290	E286-L288 VanDerWaalsContact C-N 3.33Å; E286-L288 PolarHBondContact O-N 2.84Å; L288-R290 PolarHBondContact O-N 3.45Å
289	T	47.4	Very low	64.7	Low	120 Å²	120	114.7 Å²	114.7	74%	0.736	60%	0.597	S	S	*	*	S	Bend	trans	-58.9	134.7	-168.9	22	0	0	0	0	106	P287	P287-T289 VanDerWaalsContact C-N 3.26Å; P287-T289 WeakPolarHBondContact O-CA 3.28Å; P287-T289 PolarHBondContact O-N 2.96Å
290	R	48	Very low	65.5	Low	228 Å²	228	118 Å²	118	86%	0.86	60%	0.602	S	S	*	*			trans	98.2	63.4	-179.1	-49.1	155.9	-164.6	-171.7	6.1	114.5	L288 S292	L288-R290 PolarHBondContact O-N 3.45Å; R290-S292 PolarHBondContact O-N 3.4Å
291	H	55.9	Low	66.9	Low	175 Å²	175	117.9 Å²	117.9	81%	0.81	60%	0.602	S	S	*	*			trans	-67	64	136.2	-68.2	-62.9	0	0	0	108.9	K293	H291-K293 PolarHBondContact O-N 3.09Å; H291-K293 VanDerWaalsContact O-N 3.12Å
292	S	65.9	Low	68.3	Low	65 Å²	65	111.7 Å²	111.7	46%	0.455	57%	0.571	S	S	.	*			trans	-59.2	121.6	166.1	-177.5	0	0	0	0	105.3	R290 A294 R302	R290-S292 PolarHBondContact O-N 3.4Å; S292-A294 PolarHBondContact O-N 2.81Å; S292-A294 WeakPolarHBondContact OG-CB 3.29Å; S292-A294 PolarHBondContact OG-N 3.33Å; S292-R302 PolarHBondContact O-NH1 3.26Å
293	K	78.6	Confident	69.8	Low	159 Å²	159	110.2 Å²	110.2	69%	0.691	57%	0.567	S	S	*	*	S	Bend	trans	-62.5	2	168.6	-67.7	-171.9	179.2	-173.9	0	111.2	H291 I301 R302	H291-K293 PolarHBondContact O-N 3.09Å; H291-K293 VanDerWaalsContact O-N 3.12Å; K293-I301 CarbonylContact O-C 3.09Å; K293-I301 WeakPolarHBondContact O-CA 3.34Å; K293-R302 WeakPolarHBondContact O-CB 3.46Å; K293-R302 WeakPolarHBondContact O-CG 3.38Å; K293-R302 PolarHBondContact O-N 3.45Å
294	A	87.3	Confident	71.4	Confident	27 Å²	27	106.2 Å²	106.2	22%	0.223	55%	0.55	C	S	.	*	B	Isolated β-bridge	trans	-79.1	148	175	0	0	0	0	0	112.9	S292 K300 R302	S292-A294 PolarHBondContact O-N 2.81Å; S292-A294 WeakPolarHBondContact OG-CB 3.29Å; S292-A294 PolarHBondContact OG-N 3.33Å; A294-K300 CarbonylContact C-O 3.55Å; A294-K300 WeakPolarHBondContact CA-O 3.29Å; A294-R302 PolarHBondContact O-NH1 2.9Å
295	C	89.5	Confident	73.4	Confident	2 Å²	2	101 Å²	101	1%	0.014	52%	0.522	C	S	.	.			trans	-80.2	133.7	171.4	-179.2	0	0	0	0	110.4	L297 C298 C299 K300 R302 C316	C295-L297 PolarHBondContact O-N 2.83Å; C295-L297 PolarHBondContact SG-N 3.34Å; C295-C298 WeakPolarHBondContact CB-SG 3.45Å; C295-C299 WeakPolarHBondContact O-CA 3.44Å; C295-C299 PolarHBondContact O-N 2.75Å; C295-K300 PolarHBondContact N-O 2.75Å; C295-R302 HydrophobicContact CB-CG 3.86Å; C295-C316 VanDerWaalsContact CB-SG 3.51Å; C295-C316 PolarHBondContact SG-N 3.49Å
296	P	89	Confident	75.4	Confident	58 Å²	58	95.2 Å²	95.2	38%	0.377	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.1	176.2	-21.7	31.1	0	0	0	115	V314 F315 M332	P296-V314 WeakPolarHBondContact CD-O 3.49Å; P296-F315 HydrophobicContact CB-CD1 4.19Å; P296-F315 HydrophobicContact CB-CE1 3.88Å; P296-F315 HydrophobicContact CG-CD1 3.96Å; P296-F315 HydrophobicContact CG-CE1 3.81Å; P296-M332 HydrophobicContact CB-SD 4.01Å
297	L	89.7	Confident	77.6	Confident	65 Å²	65	88.4 Å²	88.4	34%	0.34	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-43.5	-178.3	-72.5	172.1	0	0	0	113.1	C295 F315 C319 I320 P331	C295-L297 PolarHBondContact O-N 2.83Å; C295-L297 PolarHBondContact SG-N 3.34Å; L297-F315 HydrophobicContact CD1-CD1 3.86Å; L297-F315 HydrophobicContact CD1-CE1 4.39Å; L297-F315 HydrophobicContact CD1-CG 4.44Å; L297-F315 HydrophobicContact CG-CD1 3.84Å; L297-F315 HydrophobicContact CG-CE1 4.15Å; L297-C319 HydrophobicContact CB-CB 3.8Å; L297-C319 HydrophobicContact CD1-CB 3.67Å; L297-C319 HydrophobicContact CG-CB 4.4Å; L297-I320 HydrophobicContact CD1-CB 4.3Å; L297-I320 HydrophobicContact CD1-CD1 4.19Å; L297-P331 HydrophobicContact CD1-CG 4.34Å; L297-P331 HydrophobicContact CD2-CB 3.81Å; L297-P331 HydrophobicContact CD2-CG 4Å; L297-P331 HydrophobicContact CG-CG 4.38Å
298	C	88.8	Confident	79.7	Confident	46 Å²	46	83.2 Å²	83.2	31%	0.311	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-5.2	-176.8	71.1	0	0	0	0	113.9	C295 K300	C295-C298 WeakPolarHBondContact CB-SG 3.45Å; C298-K300 PolarHBondContact O-N 3.28Å
299	C	88.6	Confident	81.8	Confident	104 Å²	104	79.2 Å²	79.2	70%	0.703	42%	0.416	S	S	*	.			trans	55.8	13.1	-178.8	-57.5	0	0	0	0	115.1	C295	C295-C299 WeakPolarHBondContact O-CA 3.44Å; C295-C299 PolarHBondContact O-N 2.75Å
300	K	88.2	Confident	83.8	Confident	155 Å²	155	75.7 Å²	75.7	67%	0.674	40%	0.395	S	S	*	.	S	Bend	trans	-98.9	163.7	174.8	-64.5	177.5	-175.2	-174.2	0	110.2	A294 C295 C298 R302	A294-K300 CarbonylContact C-O 3.55Å; A294-K300 WeakPolarHBondContact CA-O 3.29Å; C295-K300 PolarHBondContact N-O 2.75Å; C298-K300 PolarHBondContact O-N 3.28Å; K300-R302 PolarHBondContact O-N 2.96Å
301	I	87.6	Confident	85.7	Confident	131 Å²	131	66 Å²	66	67%	0.672	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-50.2	131.5	169.9	-60.2	171.7	0	0	0	108.8	K293 T303	K293-I301 CarbonylContact O-C 3.09Å; K293-I301 WeakPolarHBondContact O-CA 3.34Å; I301-T303 PolarHBondContact O-N 2.92Å
302	R	87.1	Confident	87.3	Confident	50 Å²	50	60.2 Å²	60.2	19%	0.189	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-63.9	134.9	-177.4	-71.6	-170.8	-63.2	-94.9	0.5	109.9	S292 K293 A294 C295 K300 D305 C316	S292-R302 PolarHBondContact O-NH1 3.26Å; K293-R302 WeakPolarHBondContact O-CB 3.46Å; K293-R302 WeakPolarHBondContact O-CG 3.38Å; K293-R302 PolarHBondContact O-N 3.45Å; A294-R302 PolarHBondContact O-NH1 2.9Å; C295-R302 HydrophobicContact CB-CG 3.86Å; K300-R302 PolarHBondContact O-N 2.96Å; R302-D305 WeakPolarHBondContact CB-OD1 3.46Å; R302-D305 IonicContact CZ-OD2 2.85Å; R302-D305 IonicContact NE-OD1 2.82Å; R302-D305 IonicContact NE-OD2 3.6Å; R302-D305 PolarHBondContact NE-OD2 3.26Å; R302-D305 IonicContact NH2-OD2 3.93Å; R302-D305 PolarHBondContact NH2-OD2 3.28Å; R302-C316 VanDerWaalsContact CA-SG 3.55Å
303	T	84.6	Confident	88.5	Confident	86 Å²	86	61 Å²	61	53%	0.528	35%	0.345	S	S	.	.	S	Bend	trans	-119.5	124.7	173.8	56.3	0	0	0	0	106.6	I301 C316	I301-T303 PolarHBondContact O-N 2.92Å; T303-C316 PolarHBondContact N-SG 3.31Å; T303-C316 VanDerWaalsContact N-SG 3.41Å; T303-C316 WeakPolarHBondContact O-CA 3.36Å
304	N	85.8	Confident	89	Confident	58 Å²	58	55.2 Å²	55.2	31%	0.31	32%	0.322	S	S	.	.	S	Bend	trans	54.8	75	-171.9	-63.7	-13.6	0	0	0	111.3	D138 T306 Y317	D138-N304 PolarHBondContact O-ND2 3.21Å; N304-T306 PolarHBondContact O-N 3.27Å; N304-T306 PolarHBondContact O-OG1 2.95Å; N304-Y317 PolarHBondContact O-N 3.42Å
305	D	89.4	Confident	89.2	Confident	42 Å²	42	53.9 Å²	53.9	23%	0.225	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	122.5	179.9	-78.1	30.9	0	0	0	110.1	R302 V314 I345	R302-D305 WeakPolarHBondContact CB-OD1 3.46Å; R302-D305 IonicContact CZ-OD2 2.85Å; R302-D305 IonicContact NE-OD1 2.82Å; R302-D305 IonicContact NE-OD2 3.6Å; R302-D305 PolarHBondContact NE-OD2 3.26Å; R302-D305 IonicContact NH2-OD2 3.93Å; R302-D305 PolarHBondContact NH2-OD2 3.28Å; D305-V314 HydrophobicContact CB-CG1 3.91Å; D305-I345 HydrophobicContact CB-CB 4.35Å; D305-I345 PolarHBondContact O-N 3.09Å
306	T	90.1	Very high	89.2	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.4	-178.3	-55.6	0	0	0	0	108.7	N304 V314 F315 Y317 I320 L342 I343	N304-T306 PolarHBondContact O-N 3.27Å; N304-T306 PolarHBondContact O-OG1 2.95Å; T306-V314 WeakPolarHBondContact O-CA 3.46Å; T306-F315 PolarHBondContact N-O 3.13Å; T306-F315 PolarHBondContact O-N 3.36Å; T306-Y317 HydrophobicContact CG2-CD2 4.04Å; T306-Y317 VanDerWaalsContact OG1-CA 3.29Å; T306-Y317 WeakPolarHBondContact OG1-CA 3.46Å; T306-Y317 WeakPolarHBondContact OG1-CB 3.37Å; T306-Y317 WeakPolarHBondContact OG1-CD2 3.43Å; T306-Y317 PolarHBondContact OG1-N 2.94Å; T306-I320 HydrophobicContact CG2-CG2 4.31Å; T306-L342 HydrophobicContact CG2-CB 4.05Å; T306-L342 HydrophobicContact CG2-CD2 3.78Å; T306-I343 CarbonylContact C-O 3.54Å; T306-I343 WeakPolarHBondContact CA-O 3.32Å
307	V	92.3	Very high	89.3	Confident	28 Å²	28	52.1 Å²	52.1	17%	0.17	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	142.6	174.5	67.4	0	0	0	0	110.2	F313 V314 I343 I345	V307-F313 WeakPolarHBondContact CA-O 3.42Å; V307-V314 HydrophobicContact CB-CG2 4.21Å; V307-V314 HydrophobicContact CG2-CG2 4.24Å; V307-I343 HydrophobicContact CG1-CB 3.81Å; V307-I343 HydrophobicContact CG1-CG2 4.29Å; V307-I343 PolarHBondContact N-O 3.38Å; V307-I343 PolarHBondContact O-N 3.3Å; V307-I345 HydrophobicContact CB-CD1 3.61Å; V307-I345 HydrophobicContact CB-CG1 4.23Å; V307-I345 HydrophobicContact CG1-CD1 3.71Å; V307-I345 HydrophobicContact CG1-CG1 3.9Å
308	L	92.3	Very high	89.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.2	169.8	-159	68	0	0	0	109.4	T310 S311 G312 F313 F315 I320 I324 C330 T337 L342	L308-T310 WeakPolarHBondContact CD2-OG1 3.37Å; L308-T310 WeakPolarHBondContact CG-OG1 3.43Å; L308-T310 PolarHBondContact O-N 3.05Å; L308-T310 VanDerWaalsContact O-N 3.15Å; L308-S311 WeakPolarHBondContact CD2-OG 3.18Å; L308-S311 PolarHBondContact O-N 2.79Å; L308-S311 VanDerWaalsContact O-N 3.16Å; L308-G312 WeakPolarHBondContact O-CA 3.43Å; L308-G312 PolarHBondContact O-N 3.34Å; L308-F313 PolarHBondContact N-O 2.89Å; L308-F315 HydrophobicContact CB-CE2 4.41Å; L308-I320 HydrophobicContact CD1-CG1 4.37Å; L308-I324 HydrophobicContact CD1-CD1 3.44Å; L308-I324 VanDerWaalsContact CD1-CD1 3.44Å; L308-C330 HydrophobicContact CD2-CB 3.62Å; L308-T337 HydrophobicContact CD1-CG2 3.47Å; L308-T337 VanDerWaalsContact CD1-CG2 3.47Å; L308-T337 HydrophobicContact CD2-CG2 3.87Å; L308-T337 HydrophobicContact CG-CG2 3.76Å; L308-L342 HydrophobicContact CD1-CD2 3.77Å; L308-L342 HydrophobicContact CD1-CG 4.43Å
309	S	91.1	Very high	89.2	Confident	64 Å²	64	54.9 Å²	54.9	45%	0.448	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.1	-176.2	64.1	0	0	0	0	113.6	H341	S309-H341 PolarHBondContact N-O 2.8Å; S309-H341 WeakPolarHBondContact OG-CA 3.29Å; S309-H341 VanDerWaalsContact OG-CB 3.31Å; S309-H341 WeakPolarHBondContact OG-CB 3.49Å; S309-H341 PolarHBondContact OG-O 3.34Å
310	T	90.5	Very high	89.4	Confident	46 Å²	46	50 Å²	50	28%	0.282	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-27.5	178.7	56.9	0	0	0	0	114.1	L308 Y335 T337 H341	L308-T310 WeakPolarHBondContact CD2-OG1 3.37Å; L308-T310 WeakPolarHBondContact CG-OG1 3.43Å; L308-T310 PolarHBondContact O-N 3.05Å; L308-T310 VanDerWaalsContact O-N 3.15Å; T310-Y335 WeakPolarHBondContact O-CD2 3.29Å; T310-T337 HydrophobicContact CG2-CG2 3.78Å; T310-T337 WeakPolarHBondContact OG1-CG2 3.29Å; T310-T337 PolarHBondContact OG1-OG1 2.98Å; T310-H341 HydrophobicContact CG2-CB 4.11Å
311	S	88.4	Confident	89.5	Confident	25 Å²	25	44.8 Å²	44.8	18%	0.175	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130	-12.4	-171.4	65.6	0	0	0	0	114.7	L308 F313 C330	L308-S311 WeakPolarHBondContact CD2-OG 3.18Å; L308-S311 PolarHBondContact O-N 2.79Å; L308-S311 VanDerWaalsContact O-N 3.16Å; S311-F313 WeakPolarHBondContact O-CD2 3.47Å; S311-F313 PolarHBondContact O-N 2.87Å; S311-C330 PolarHBondContact OG-SG 2.88Å
312	G	88.6	Confident	89.6	Confident	52 Å²	52	43 Å²	43	54%	0.536	24%	0.239	S	C	.	.			trans	75.4	-1.2	-179.7	0	0	0	0	0	115.2	L308	L308-G312 WeakPolarHBondContact O-CA 3.43Å; L308-G312 PolarHBondContact O-N 3.34Å
313	F	90.3	Very high	89.9	Confident	83 Å²	83	43.4 Å²	43.4	36%	0.364	24%	0.241	S	C	.	.			trans	-78.8	142.6	178	-73.4	-83.6	0	0	0	112.4	V307 L308 S311 F315 M332 T333	V307-F313 WeakPolarHBondContact CA-O 3.42Å; L308-F313 PolarHBondContact N-O 2.89Å; S311-F313 WeakPolarHBondContact O-CD2 3.47Å; S311-F313 PolarHBondContact O-N 2.87Å; F313-F315 HydrophobicContact CB-CD2 4.41Å; F313-F315 HydrophobicContact CB-CE2 3.47Å; F313-F315 VanDerWaalsContact CB-CE2 3.47Å; F313-F315 HydrophobicContact CB-CZ 3.56Å; F313-F315 HydrophobicContact CG-CZ 4.44Å; F313-F315 WeakPolarHBondContact O-CE2 2.84Å; F313-M332 HydrophobicContact CD1-CG 4.38Å; F313-M332 HydrophobicContact CD2-CB 4.03Å; F313-M332 HydrophobicContact CD2-CG 4.44Å; F313-M332 HydrophobicContact CE1-CE 4.48Å; F313-M332 HydrophobicContact CE2-CB 4.08Å; F313-M332 HydrophobicContact CG-CB 4.34Å; F313-M332 HydrophobicContact CG-CG 4.25Å; F313-M332 HydrophobicContact CZ-CB 4.43Å; F313-T333 HydrophobicContact CD2-CG2 4.16Å; F313-T333 HydrophobicContact CE2-CG2 3.69Å
314	V	90.6	Very high	90.3	Very high	36 Å²	36	39.3 Å²	39.3	22%	0.218	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.1	179.7	-169.1	0	0	0	0	110.8	P296 D305 T306 V307 I345	P296-V314 WeakPolarHBondContact CD-O 3.49Å; D305-V314 HydrophobicContact CB-CG1 3.91Å; T306-V314 WeakPolarHBondContact O-CA 3.46Å; V307-V314 HydrophobicContact CB-CG2 4.21Å; V307-V314 HydrophobicContact CG2-CG2 4.24Å; V314-I345 HydrophobicContact CG2-CD1 4.26Å
315	F	91.3	Very high	90.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	170.3	-179.9	-54	-89.9	0	0	0	110.6	P296 L297 T306 L308 F313 I320 P331 M332	P296-F315 HydrophobicContact CB-CD1 4.19Å; P296-F315 HydrophobicContact CB-CE1 3.88Å; P296-F315 HydrophobicContact CG-CD1 3.96Å; P296-F315 HydrophobicContact CG-CE1 3.81Å; L297-F315 HydrophobicContact CD1-CD1 3.86Å; L297-F315 HydrophobicContact CD1-CE1 4.39Å; L297-F315 HydrophobicContact CD1-CG 4.44Å; L297-F315 HydrophobicContact CG-CD1 3.84Å; L297-F315 HydrophobicContact CG-CE1 4.15Å; T306-F315 PolarHBondContact N-O 3.13Å; T306-F315 PolarHBondContact O-N 3.36Å; L308-F315 HydrophobicContact CB-CE2 4.41Å; F313-F315 HydrophobicContact CB-CD2 4.41Å; F313-F315 HydrophobicContact CB-CE2 3.47Å; F313-F315 VanDerWaalsContact CB-CE2 3.47Å; F313-F315 HydrophobicContact CB-CZ 3.56Å; F313-F315 HydrophobicContact CG-CZ 4.44Å; F313-F315 WeakPolarHBondContact O-CE2 2.84Å; F315-I320 HydrophobicContact CB-CB 3.72Å; F315-I320 HydrophobicContact CB-CG1 4.4Å; F315-I320 HydrophobicContact CB-CG2 4.01Å; F315-I320 HydrophobicContact CD1-CD1 4.45Å; F315-I320 HydrophobicContact CD2-CB 4.11Å; F315-I320 HydrophobicContact CD2-CD1 3.77Å; F315-I320 HydrophobicContact CD2-CG1 3.82Å; F315-I320 HydrophobicContact CE2-CD1 3.87Å; F315-I320 HydrophobicContact CE2-CG1 4.34Å; F315-I320 HydrophobicContact CG-CB 3.99Å; F315-I320 HydrophobicContact CG-CD1 4.08Å; F315-I320 HydrophobicContact CG-CG1 4.17Å; F315-I320 HydrophobicContact CZ-CD1 4.27Å; F315-P331 HydrophobicContact CE1-CG 3.78Å; F315-P331 HydrophobicContact CZ-CG 3.74Å; F315-M332 HydrophobicContact CE1-CG 3.97Å; F315-M332 HydrophobicContact CZ-CG 3.74Å
316	C	90	Very high	90.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.014	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.3	159	-58.2	0	0	0	0	108.5	C295 R302 T303 R318 C319 I320	C295-C316 VanDerWaalsContact CB-SG 3.51Å; C295-C316 PolarHBondContact SG-N 3.49Å; R302-C316 VanDerWaalsContact CA-SG 3.55Å; T303-C316 PolarHBondContact N-SG 3.31Å; T303-C316 VanDerWaalsContact N-SG 3.41Å; T303-C316 WeakPolarHBondContact O-CA 3.36Å; C316-R318 PolarHBondContact O-N 2.96Å; C316-R318 VanDerWaalsContact O-N 3.15Å; C316-C319 HydrophobicContact CB-CB 4.26Å; C316-C319 PolarHBondContact O-N 3.49Å; C316-I320 WeakPolarHBondContact O-CG2 3.36Å; C316-I320 PolarHBondContact O-N 2.99Å
317	Y	89.4	Confident	90.9	Very high	21 Å²	21	48.2 Å²	48.2	8%	0.082	27%	0.268	C	S	.	.	H	α-helix	trans	-44.4	-51.1	175.2	-177.9	-90.2	0	0	0	112.4	F139 I141 N304 T306 C319 I320 Y321	F139-Y317 HydrophobicContact CB-CD1 4.27Å; F139-Y317 HydrophobicContact CB-CE1 3.51Å; F139-Y317 HydrophobicContact CD1-CD2 4.24Å; F139-Y317 AromaticContact CD1-CE1 3.88Å; F139-Y317 HydrophobicContact CD1-CE1 3.88Å; F139-Y317 AromaticContact CD1-CE2 3.47Å; F139-Y317 HydrophobicContact CD1-CE2 3.47Å; F139-Y317 VanDerWaalsContact CD1-CE2 3.47Å; F139-Y317 AromaticContact CD1-CZ 3.24Å; F139-Y317 WeakPolarHBondContact CD1-OH 3.09Å; F139-Y317 HydrophobicContact CE1-CE2 4.04Å; F139-Y317 HydrophobicContact CG-CE1 4.08Å; F139-Y317 HydrophobicContact CG-CE2 4.42Å; F139-Y317 AromaticContact CG-CZ 3.76Å; F139-Y317 WeakPolarHBondContact CG-OH 3.48Å; F139-Y317 WeakPolarHBondContact O-CD1 3.47Å; F139-Y317 WeakPolarHBondContact O-CE1 3.04Å; I141-Y317 HydrophobicContact CG1-CE1 4.46Å; N304-Y317 PolarHBondContact O-N 3.42Å; T306-Y317 HydrophobicContact CG2-CD2 4.04Å; T306-Y317 VanDerWaalsContact OG1-CA 3.29Å; T306-Y317 WeakPolarHBondContact OG1-CA 3.46Å; T306-Y317 WeakPolarHBondContact OG1-CB 3.37Å; T306-Y317 WeakPolarHBondContact OG1-CD2 3.43Å; T306-Y317 PolarHBondContact OG1-N 2.94Å; Y317-C319 VanDerWaalsContact C-N 3.31Å; Y317-C319 PolarHBondContact O-N 2.72Å; Y317-I320 WeakPolarHBondContact O-CG2 3.21Å; Y317-I320 PolarHBondContact O-N 3.29Å; Y317-Y321 HydrophobicContact CE1-CD2 4.05Å; Y317-Y321 HydrophobicContact CE1-CG 4.11Å; Y317-Y321 AromaticContact CZ-CD2 3.75Å; Y317-Y321 WeakPolarHBondContact O-CB 3.06Å; Y317-Y321 PolarHBondContact O-N 2.79Å; Y317-Y321 WeakPolarHBondContact OH-CD2 3.04Å
318	R	87.8	Confident	90.9	Very high	140 Å²	140	53.1 Å²	53.1	53%	0.528	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-40.3	-177.2	-158.9	178.9	82.1	124	1.9	113.4	S140 C316 V322	S140-R318 WeakPolarHBondContact O-CD 3.15Å; C316-R318 PolarHBondContact O-N 2.96Å; C316-R318 VanDerWaalsContact O-N 3.15Å; R318-V322 VanDerWaalsContact O-CG2 3.27Å; R318-V322 WeakPolarHBondContact O-CG2 3.36Å; R318-V322 PolarHBondContact O-N 2.82Å
319	C	89.4	Confident	91	Very high	29 Å²	29	58.9 Å²	58.9	20%	0.196	31%	0.311	C	S	.	.	H	α-helix	trans	-72.7	-46.3	-175.2	-61.4	0	0	0	0	110.4	L297 C316 Y317 Y323	L297-C319 HydrophobicContact CB-CB 3.8Å; L297-C319 HydrophobicContact CD1-CB 3.67Å; L297-C319 HydrophobicContact CG-CB 4.4Å; C316-C319 HydrophobicContact CB-CB 4.26Å; C316-C319 PolarHBondContact O-N 3.49Å; Y317-C319 VanDerWaalsContact C-N 3.31Å; Y317-C319 PolarHBondContact O-N 2.72Å; C319-Y323 PolarHBondContact O-N 2.77Å
320	I	91.9	Very high	91	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-73.7	-36	-177.3	-167.6	62.7	0	0	0	112.1	L297 T306 L308 F315 C316 Y317 V322 Y323 I324 P331 L342	L297-I320 HydrophobicContact CD1-CB 4.3Å; L297-I320 HydrophobicContact CD1-CD1 4.19Å; T306-I320 HydrophobicContact CG2-CG2 4.31Å; L308-I320 HydrophobicContact CD1-CG1 4.37Å; F315-I320 HydrophobicContact CB-CB 3.72Å; F315-I320 HydrophobicContact CB-CG1 4.4Å; F315-I320 HydrophobicContact CB-CG2 4.01Å; F315-I320 HydrophobicContact CD1-CD1 4.45Å; F315-I320 HydrophobicContact CD2-CB 4.11Å; F315-I320 HydrophobicContact CD2-CD1 3.77Å; F315-I320 HydrophobicContact CD2-CG1 3.82Å; F315-I320 HydrophobicContact CE2-CD1 3.87Å; F315-I320 HydrophobicContact CE2-CG1 4.34Å; F315-I320 HydrophobicContact CG-CB 3.99Å; F315-I320 HydrophobicContact CG-CD1 4.08Å; F315-I320 HydrophobicContact CG-CG1 4.17Å; F315-I320 HydrophobicContact CZ-CD1 4.27Å; C316-I320 WeakPolarHBondContact O-CG2 3.36Å; C316-I320 PolarHBondContact O-N 2.99Å; Y317-I320 WeakPolarHBondContact O-CG2 3.21Å; Y317-I320 PolarHBondContact O-N 3.29Å; I320-V322 PolarHBondContact O-N 3.21Å; I320-Y323 PolarHBondContact O-N 3.34Å; I320-I324 HydrophobicContact CD1-CD1 4.05Å; I320-I324 HydrophobicContact CD1-CG1 4.18Å; I320-I324 HydrophobicContact CG1-CD1 3.69Å; I320-I324 HydrophobicContact CG1-CG1 4.23Å; I320-I324 WeakPolarHBondContact O-CB 3.3Å; I320-I324 WeakPolarHBondContact O-CG1 3.25Å; I320-I324 PolarHBondContact O-N 3.45Å; I320-P331 HydrophobicContact CD1-CG 3.75Å; I320-L342 HydrophobicContact CB-CD2 4.31Å; I320-L342 HydrophobicContact CG1-CD2 3.85Å; I320-L342 HydrophobicContact CG2-CD2 3.52Å
321	Y	91.2	Very high	91.1	Very high	47 Å²	47	55.3 Å²	55.3	18%	0.184	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-48	176.1	-178.7	-87.4	0	0	0	111.8	I141 Y317 Y323 K325 L339 L342	I141-Y321 HydrophobicContact CD1-CD1 4.28Å; I141-Y321 HydrophobicContact CD1-CE1 3.84Å; Y317-Y321 HydrophobicContact CE1-CD2 4.05Å; Y317-Y321 HydrophobicContact CE1-CG 4.11Å; Y317-Y321 AromaticContact CZ-CD2 3.75Å; Y317-Y321 WeakPolarHBondContact O-CB 3.06Å; Y317-Y321 PolarHBondContact O-N 2.79Å; Y317-Y321 WeakPolarHBondContact OH-CD2 3.04Å; Y321-Y323 VanDerWaalsContact C-N 3.34Å; Y321-Y323 PolarHBondContact O-N 3.02Å; Y321-K325 HydrophobicContact CE1-CD 4.09Å; Y321-K325 VanDerWaalsContact O-CB 3.26Å; Y321-K325 WeakPolarHBondContact O-CB 3.48Å; Y321-K325 PolarHBondContact O-N 3.16Å; Y321-L339 HydrophobicContact CD2-CD2 3.74Å; Y321-L339 HydrophobicContact CE2-CD1 4.06Å; Y321-L339 HydrophobicContact CE2-CD2 3.73Å; Y321-L339 HydrophobicContact CE2-CG 4.46Å; Y321-L339 HydrophobicContact CG-CD2 4.41Å; Y321-L342 HydrophobicContact CD2-CD1 4.05Å
322	V	90.4	Very high	91.2	Very high	92 Å²	92	59.1 Å²	59.1	56%	0.558	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-42.5	178.1	173.7	0	0	0	0	110.9	R318 I320 A326	R318-V322 VanDerWaalsContact O-CG2 3.27Å; R318-V322 WeakPolarHBondContact O-CG2 3.36Å; R318-V322 PolarHBondContact O-N 2.82Å; I320-V322 PolarHBondContact O-N 3.21Å; V322-A326 PolarHBondContact O-N 3.47Å
323	Y	91.6	Very high	91.3	Very high	59 Å²	59	59.1 Å²	59.1	23%	0.231	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-47	179.9	-174.4	-91.6	0	0	0	112.5	C319 I320 Y321 A326 N327 R329 P331	C319-Y323 PolarHBondContact O-N 2.77Å; I320-Y323 PolarHBondContact O-N 3.34Å; Y321-Y323 VanDerWaalsContact C-N 3.34Å; Y321-Y323 PolarHBondContact O-N 3.02Å; Y323-A326 PolarHBondContact O-N 3.48Å; Y323-N327 HydrophobicContact CD1-CB 4.43Å; Y323-N327 HydrophobicContact CE1-CB 4.04Å; Y323-N327 WeakPolarHBondContact CE2-ND2 3.41Å; Y323-N327 WeakPolarHBondContact O-CB 2.98Å; Y323-N327 PolarHBondContact O-N 3.05Å; Y323-N327 PolarHBondContact O-ND2 2.9Å; Y323-N327 VanDerWaalsContact O-ND2 3.08Å; Y323-R329 WeakPolarHBondContact CD1-O 3.48Å; Y323-R329 HydrophobicContact CE1-CG 4.13Å; Y323-R329 WeakPolarHBondContact CE1-O 3.31Å; Y323-P331 HydrophobicContact CD1-CB 3.92Å; Y323-P331 HydrophobicContact CD1-CG 4.12Å; Y323-P331 HydrophobicContact CD2-CB 4.45Å; Y323-P331 HydrophobicContact CE1-CB 3.59Å; Y323-P331 HydrophobicContact CE1-CG 4.18Å; Y323-P331 HydrophobicContact CE2-CB 4.17Å; Y323-P331 HydrophobicContact CG-CB 4.33Å
324	I	93.2	Very high	91.2	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-67.2	-40.5	-180	-71.3	172.4	0	0	0	111.1	L308 I320 A326 N327 Q328 T337 L339 L342	L308-I324 HydrophobicContact CD1-CD1 3.44Å; L308-I324 VanDerWaalsContact CD1-CD1 3.44Å; I320-I324 HydrophobicContact CD1-CD1 4.05Å; I320-I324 HydrophobicContact CD1-CG1 4.18Å; I320-I324 HydrophobicContact CG1-CD1 3.69Å; I320-I324 HydrophobicContact CG1-CG1 4.23Å; I320-I324 WeakPolarHBondContact O-CB 3.3Å; I320-I324 WeakPolarHBondContact O-CG1 3.25Å; I320-I324 PolarHBondContact O-N 3.45Å; I324-A326 PolarHBondContact O-N 2.83Å; I324-N327 PolarHBondContact O-N 2.75Å; I324-Q328 VanDerWaalsContact O-CA 3.3Å; I324-Q328 WeakPolarHBondContact O-CA 3.32Å; I324-Q328 PolarHBondContact O-N 2.88Å; I324-T337 HydrophobicContact CD1-CG2 4.21Å; I324-T337 WeakPolarHBondContact CG2-O 3.17Å; I324-L339 HydrophobicContact CB-CD2 4.27Å; I324-L339 HydrophobicContact CG2-CD2 3.81Å; I324-L339 HydrophobicContact CG2-CG 4.34Å; I324-L342 HydrophobicContact CD1-CD1 4.31Å; I324-L342 HydrophobicContact CD1-CD2 3.77Å; I324-L342 HydrophobicContact CD1-CG 4.07Å
325	K	91.8	Very high	91.3	Very high	142 Å²	142	61.9 Å²	61.9	62%	0.617	31%	0.312	S	S	*	.	H	α-helix	trans	-59.1	-34	177	-170.7	176.2	-176.9	178.6	0	112	Y321	Y321-K325 HydrophobicContact CE1-CD 4.09Å; Y321-K325 VanDerWaalsContact O-CB 3.26Å; Y321-K325 WeakPolarHBondContact O-CB 3.48Å; Y321-K325 PolarHBondContact O-N 3.16Å
326	A	92.6	Very high	91.4	Very high	80 Å²	80	67 Å²	67	66%	0.661	35%	0.346	S	S	*	.	H	α-helix	trans	-86.3	-38.4	178.9	0	0	0	0	0	113.8	V322 Y323 I324	V322-A326 PolarHBondContact O-N 3.47Å; Y323-A326 PolarHBondContact O-N 3.48Å; I324-A326 PolarHBondContact O-N 2.83Å
327	N	93.1	Very high	91.4	Very high	66 Å²	66	67 Å²	67	35%	0.353	35%	0.345	S	S	.	.	H	α-helix	trans	-115.7	-12.6	-167.4	-61.9	-84.2	0	0	0	115	Y323 I324 R329	Y323-N327 HydrophobicContact CD1-CB 4.43Å; Y323-N327 HydrophobicContact CE1-CB 4.04Å; Y323-N327 WeakPolarHBondContact CE2-ND2 3.41Å; Y323-N327 WeakPolarHBondContact O-CB 2.98Å; Y323-N327 PolarHBondContact O-N 3.05Å; Y323-N327 PolarHBondContact O-ND2 2.9Å; Y323-N327 VanDerWaalsContact O-ND2 3.08Å; I324-N327 PolarHBondContact O-N 2.75Å; N327-R329 HydrophobicContact CB-CG 3.88Å; N327-R329 WeakPolarHBondContact O-CG 3.26Å; N327-R329 PolarHBondContact O-N 2.77Å
328	Q	93.6	Very high	91.6	Very high	130 Å²	130	70.5 Å²	70.5	61%	0.607	36%	0.362	S	S	*	.	S	Bend	trans	46.7	34.7	-176.6	-62.8	-165.2	-18.7	0	0	115.2	I324 T337	I324-Q328 VanDerWaalsContact O-CA 3.3Å; I324-Q328 WeakPolarHBondContact O-CA 3.32Å; I324-Q328 PolarHBondContact O-N 2.88Å; Q328-T337 CarbonylContact C-O 3.57Å; Q328-T337 WeakPolarHBondContact CA-O 3.14Å; Q328-T337 PolarHBondContact O-N 3.35Å
329	R	93.4	Very high	91.6	Very high	122 Å²	122	67.3 Å²	67.3	46%	0.46	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-146.6	161.7	-179	66.3	-168.6	173.4	173.3	-6.1	111.5	Y323 N327 Y335	Y323-R329 WeakPolarHBondContact CD1-O 3.48Å; Y323-R329 HydrophobicContact CE1-CG 4.13Å; Y323-R329 WeakPolarHBondContact CE1-O 3.31Å; N327-R329 HydrophobicContact CB-CG 3.88Å; N327-R329 WeakPolarHBondContact O-CG 3.26Å; N327-R329 PolarHBondContact O-N 2.77Å; R329-Y335 CarbonylContact C-O 3.57Å; R329-Y335 WeakPolarHBondContact CA-O 3.43Å
330	C	92.2	Very high	91.7	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.007	38%	0.379	C	S	.	.			trans	-72.4	133.4	171.8	179.9	0	0	0	0	110.5	L308 S311 M332 T333 G334 Y335	L308-C330 HydrophobicContact CD2-CB 3.62Å; S311-C330 PolarHBondContact OG-SG 2.88Å; C330-M332 VanDerWaalsContact C-N 3.3Å; C330-M332 PolarHBondContact O-N 3.47Å; C330-M332 PolarHBondContact SG-N 2.75Å; C330-T333 WeakPolarHBondContact CB-OG1 3.21Å; C330-T333 PolarHBondContact SG-N 2.93Å; C330-T333 PolarHBondContact SG-OG1 3.19Å; C330-T333 VanDerWaalsContact SG-OG1 3.33Å; C330-G334 VanDerWaalsContact O-CA 3.26Å; C330-G334 WeakPolarHBondContact O-CA 3.34Å; C330-G334 PolarHBondContact O-N 3.18Å; C330-Y335 PolarHBondContact N-O 2.94Å
331	P	92.2	Very high	91.6	Very high	34 Å²	34	75.3 Å²	75.3	22%	0.221	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.8	178	26.8	-34.1	0	0	0	113.7	L297 F315 I320 Y323	L297-P331 HydrophobicContact CD1-CG 4.34Å; L297-P331 HydrophobicContact CD2-CB 3.81Å; L297-P331 HydrophobicContact CD2-CG 4Å; L297-P331 HydrophobicContact CG-CG 4.38Å; F315-P331 HydrophobicContact CE1-CG 3.78Å; F315-P331 HydrophobicContact CZ-CG 3.74Å; I320-P331 HydrophobicContact CD1-CG 3.75Å; Y323-P331 HydrophobicContact CD1-CB 3.92Å; Y323-P331 HydrophobicContact CD1-CG 4.12Å; Y323-P331 HydrophobicContact CD2-CB 4.45Å; Y323-P331 HydrophobicContact CE1-CB 3.59Å; Y323-P331 HydrophobicContact CE1-CG 4.18Å; Y323-P331 HydrophobicContact CE2-CB 4.17Å; Y323-P331 HydrophobicContact CG-CB 4.33Å
332	M	89.5	Confident	91.6	Very high	104 Å²	104	74.4 Å²	74.4	51%	0.512	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-43.3	-176.3	-62.1	-61.2	-68.5	0	0	112.4	P296 F313 F315 C330	P296-M332 HydrophobicContact CB-SD 4.01Å; F313-M332 HydrophobicContact CD1-CG 4.38Å; F313-M332 HydrophobicContact CD2-CB 4.03Å; F313-M332 HydrophobicContact CD2-CG 4.44Å; F313-M332 HydrophobicContact CE1-CE 4.48Å; F313-M332 HydrophobicContact CE2-CB 4.08Å; F313-M332 HydrophobicContact CG-CB 4.34Å; F313-M332 HydrophobicContact CG-CG 4.25Å; F313-M332 HydrophobicContact CZ-CB 4.43Å; F315-M332 HydrophobicContact CE1-CG 3.97Å; F315-M332 HydrophobicContact CZ-CG 3.74Å; C330-M332 VanDerWaalsContact C-N 3.3Å; C330-M332 PolarHBondContact O-N 3.47Å; C330-M332 PolarHBondContact SG-N 2.75Å
333	T	91.1	Very high	91.6	Very high	52 Å²	52	74.3 Å²	74.3	32%	0.319	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-13.1	-173.8	64	0	0	0	0	113.8	F313 C330 Y335	F313-T333 HydrophobicContact CD2-CG2 4.16Å; F313-T333 HydrophobicContact CE2-CG2 3.69Å; C330-T333 WeakPolarHBondContact CB-OG1 3.21Å; C330-T333 PolarHBondContact SG-N 2.93Å; C330-T333 PolarHBondContact SG-OG1 3.19Å; C330-T333 VanDerWaalsContact SG-OG1 3.33Å; T333-Y335 HydrophobicContact CG2-CD2 4.43Å; T333-Y335 HydrophobicContact CG2-CE2 4.32Å; T333-Y335 PolarHBondContact O-N 2.73Å; T333-Y335 WeakPolarHBondContact OG1-CD2 3.09Å; T333-Y335 PolarHBondContact OG1-N 2.97Å
334	G	89.7	Confident	91.4	Very high	47 Å²	47	73 Å²	73	49%	0.485	38%	0.379	S	S	.	.			trans	73.2	0.8	-175.1	0	0	0	0	0	115.1	C330	C330-G334 VanDerWaalsContact O-CA 3.26Å; C330-G334 WeakPolarHBondContact O-CA 3.34Å; C330-G334 PolarHBondContact O-N 3.18Å
335	Y	92.6	Very high	91.1	Very high	131 Å²	131	76.4 Å²	76.4	51%	0.514	40%	0.396	S	S	.	.			trans	-61.2	139.9	-179.3	-66.8	-30	0	0	0	112.7	T310 R329 C330 T333 T337	T310-Y335 WeakPolarHBondContact O-CD2 3.29Å; R329-Y335 CarbonylContact C-O 3.57Å; R329-Y335 WeakPolarHBondContact CA-O 3.43Å; C330-Y335 PolarHBondContact N-O 2.94Å; T333-Y335 HydrophobicContact CG2-CD2 4.43Å; T333-Y335 HydrophobicContact CG2-CE2 4.32Å; T333-Y335 PolarHBondContact O-N 2.73Å; T333-Y335 WeakPolarHBondContact OG1-CD2 3.09Å; T333-Y335 PolarHBondContact OG1-N 2.97Å; Y335-T337 PolarHBondContact O-N 2.95Å; Y335-T337 PolarHBondContact O-OG1 3.33Å
336	P	92	Very high	90.6	Very high	108 Å²	108	77.4 Å²	77.4	70%	0.701	40%	0.397	S	S	*	.	B	Isolated β-bridge	trans	-59.4	124	177	26.6	-33.8	0	0	0	108.5
337	T	91.6	Very high	89.7	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.012	39%	0.392	C	S	.	.			trans	-145.3	127.4	-174.5	-47.2	0	0	0	0	111.5	L308 T310 I324 Q328 Y335 H341	L308-T337 HydrophobicContact CD1-CG2 3.47Å; L308-T337 VanDerWaalsContact CD1-CG2 3.47Å; L308-T337 HydrophobicContact CD2-CG2 3.87Å; L308-T337 HydrophobicContact CG-CG2 3.76Å; T310-T337 HydrophobicContact CG2-CG2 3.78Å; T310-T337 WeakPolarHBondContact OG1-CG2 3.29Å; T310-T337 PolarHBondContact OG1-OG1 2.98Å; I324-T337 HydrophobicContact CD1-CG2 4.21Å; I324-T337 WeakPolarHBondContact CG2-O 3.17Å; Q328-T337 CarbonylContact C-O 3.57Å; Q328-T337 WeakPolarHBondContact CA-O 3.14Å; Q328-T337 PolarHBondContact O-N 3.35Å; Y335-T337 PolarHBondContact O-N 2.95Å; Y335-T337 PolarHBondContact O-OG1 3.33Å; T337-H341 HydrophobicContact CG2-CB 3.54Å
338	E	91.8	Very high	88.1	Confident	94 Å²	94	80.4 Å²	80.4	44%	0.439	42%	0.416	S	S	.	.			trans	-102.6	169.5	175.5	-59.9	177.1	167.4	0	0	112.6	Q340 H341	E338-Q340 HydrophobicContact CB-CG 4.05Å; E338-Q340 PolarHBondContact O-N 3.23Å; E338-Q340 VanDerWaalsContact O-N 3.17Å; E338-Q340 PolarHBondContact OE2-NE2 3.36Å; E338-H341 PolarHBondContact N-ND1 3.05Å; E338-H341 WeakPolarHBondContact O-CB 3.41Å; E338-H341 PolarHBondContact O-N 3.14Å; E338-H341 VanDerWaalsContact O-N 3.08Å; E338-H341 PolarHBondContact O-ND1 3.31Å; E338-H341 VanDerWaalsContact O-ND1 3.14Å
339	L	89.3	Confident	86.1	Confident	72 Å²	72	82.5 Å²	82.5	38%	0.377	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-60.4	-26.5	-178	-63.4	176.4	0	0	0	114.1	Y321 I324 H341 L342	Y321-L339 HydrophobicContact CD2-CD2 3.74Å; Y321-L339 HydrophobicContact CE2-CD1 4.06Å; Y321-L339 HydrophobicContact CE2-CD2 3.73Å; Y321-L339 HydrophobicContact CE2-CG 4.46Å; Y321-L339 HydrophobicContact CG-CD2 4.41Å; I324-L339 HydrophobicContact CB-CD2 4.27Å; I324-L339 HydrophobicContact CG2-CD2 3.81Å; I324-L339 HydrophobicContact CG2-CG 4.34Å; L339-H341 PolarHBondContact O-N 3.4Å; L339-L342 HydrophobicContact CD2-CD1 3.99Å; L339-L342 WeakPolarHBondContact O-CB 3.43Å; L339-L342 PolarHBondContact O-N 3.23Å
340	Q	90.4	Very high	83.7	Confident	147 Å²	147	85.5 Å²	85.5	69%	0.687	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-66.7	-18.8	177	57.7	178.9	0.2	0	0	114	E338 L342	E338-Q340 HydrophobicContact CB-CG 4.05Å; E338-Q340 PolarHBondContact O-N 3.23Å; E338-Q340 VanDerWaalsContact O-N 3.17Å; E338-Q340 PolarHBondContact OE2-NE2 3.36Å; Q340-L342 VanDerWaalsContact C-N 3.28Å; Q340-L342 PolarHBondContact O-N 3.2Å
341	H	90.3	Very high	83.3	Confident	51 Å²	51	89.7 Å²	89.7	24%	0.236	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-86.5	1.1	179.5	-55.8	103.4	0	0	0	113.2	S309 T310 T337 E338 L339	S309-H341 PolarHBondContact N-O 2.8Å; S309-H341 WeakPolarHBondContact OG-CA 3.29Å; S309-H341 VanDerWaalsContact OG-CB 3.31Å; S309-H341 WeakPolarHBondContact OG-CB 3.49Å; S309-H341 PolarHBondContact OG-O 3.34Å; T310-H341 HydrophobicContact CG2-CB 4.11Å; T337-H341 HydrophobicContact CG2-CB 3.54Å; E338-H341 PolarHBondContact N-ND1 3.05Å; E338-H341 WeakPolarHBondContact O-CB 3.41Å; E338-H341 PolarHBondContact O-N 3.14Å; E338-H341 VanDerWaalsContact O-N 3.08Å; E338-H341 PolarHBondContact O-ND1 3.31Å; E338-H341 VanDerWaalsContact O-ND1 3.14Å; L339-H341 PolarHBondContact O-N 3.4Å
342	L	90.6	Very high	82.8	Confident	28 Å²	28	92.6 Å²	92.6	15%	0.147	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	114.7	175.6	-69.8	169	0	0	0	109.6	T306 L308 I320 Y321 I324 L339 Q340	T306-L342 HydrophobicContact CG2-CB 4.05Å; T306-L342 HydrophobicContact CG2-CD2 3.78Å; L308-L342 HydrophobicContact CD1-CD2 3.77Å; L308-L342 HydrophobicContact CD1-CG 4.43Å; I320-L342 HydrophobicContact CB-CD2 4.31Å; I320-L342 HydrophobicContact CG1-CD2 3.85Å; I320-L342 HydrophobicContact CG2-CD2 3.52Å; Y321-L342 HydrophobicContact CD2-CD1 4.05Å; I324-L342 HydrophobicContact CD1-CD1 4.31Å; I324-L342 HydrophobicContact CD1-CD2 3.77Å; I324-L342 HydrophobicContact CD1-CG 4.07Å; L339-L342 HydrophobicContact CD2-CD1 3.99Å; L339-L342 WeakPolarHBondContact O-CB 3.43Å; L339-L342 PolarHBondContact O-N 3.23Å; Q340-L342 VanDerWaalsContact C-N 3.28Å; Q340-L342 PolarHBondContact O-N 3.2Å
343	I	90.4	Very high	82.5	Confident	90 Å²	90	92 Å²	92	46%	0.462	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	116.8	176.7	-57.1	175.3	0	0	0	107.9	T306 V307	T306-I343 CarbonylContact C-O 3.54Å; T306-I343 WeakPolarHBondContact CA-O 3.32Å; V307-I343 HydrophobicContact CG1-CB 3.81Å; V307-I343 HydrophobicContact CG1-CG2 4.29Å; V307-I343 PolarHBondContact N-O 3.38Å; V307-I343 PolarHBondContact O-N 3.3Å
344	K	88.2	Confident	82	Confident	32 Å²	32	94.4 Å²	94.4	14%	0.139	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	130.6	175.7	-169.4	170	170.8	-176.8	0	109.3	D138 Y346	D138-K344 PolarHBondContact O-NZ 3.23Å; D138-K344 IonicContact OD1-NZ 3.44Å; D138-K344 PolarHBondContact OD1-NZ 3.41Å; D138-K344 IonicContact OD2-NZ 3.18Å; D138-K344 PolarHBondContact OD2-NZ 2.8Å; K344-Y346 HydrophobicContact CD-CE1 4.13Å; K344-Y346 HydrophobicContact CG-CE1 4.46Å; K344-Y346 HydrophobicContact CG-CE2 4.44Å
345	I	87.7	Confident	81.5	Confident	71 Å²	71	97.3 Å²	97.3	36%	0.364	51%	0.514	S	S	.	.			trans	-100.5	122.6	176.7	-59.3	175.8	0	0	0	107.4	D305 V307 V314	D305-I345 HydrophobicContact CB-CB 4.35Å; D305-I345 PolarHBondContact O-N 3.09Å; V307-I345 HydrophobicContact CB-CD1 3.61Å; V307-I345 HydrophobicContact CB-CG1 4.23Å; V307-I345 HydrophobicContact CG1-CD1 3.71Å; V307-I345 HydrophobicContact CG1-CG1 3.9Å; V314-I345 HydrophobicContact CG2-CD1 4.26Å
346	Y	81.3	Confident	80.7	Confident	164 Å²	164	95.1 Å²	95.1	64%	0.643	51%	0.514	S	S	*	.			trans	-94.2	108.6	168.5	-59.7	-81.9	0	0	0	107.3	D138 K344	D138-Y346 PolarHBondContact OD2-OH 3.41Å; K344-Y346 HydrophobicContact CD-CE1 4.13Å; K344-Y346 HydrophobicContact CG-CE1 4.46Å; K344-Y346 HydrophobicContact CG-CE2 4.44Å
347	S	71.8	Confident	79.9	Confident	77 Å²	77	94.1 Å²	94.1	54%	0.538	50%	0.5	S	S	.	.			trans	-79.6	134	171.9	-152.8	0	0	0	0	108.1	E349	S347-E349 PolarHBondContact O-N 2.71Å; S347-E349 VanDerWaalsContact O-N 3.11Å
348	P	59.9	Low	79	Confident	132 Å²	132	101.2 Å²	101.2	86%	0.857	54%	0.538	S	S	*	.	S	Bend	trans	-67.2	-6.7	179.5	27.2	-34.2	0	0	0	113.5
349	E	51.9	Low	78	Confident	174 Å²	174	101.8 Å²	101.8	81%	0.813	55%	0.546	S	S	*	.			trans	-120.5	93	178.8	-63.8	-176.2	-178.5	0	0	110.9	S347	S347-E349 PolarHBondContact O-N 2.71Å; S347-E349 VanDerWaalsContact O-N 3.11Å
350	S	43.8	Very low	76.9	Confident	184 Å²	184	104.5 Å²	104.5	100%	1.287	56%	0.561	S	S	*	*			trans	-150.5	0	160	60.4	0	0	0	0	110.2

Retrieved 350 of 350 residues in 124.7 ms (Link to these results)

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