A0A060WEB0_ONCMY Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A060WEB0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 445 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	43.5	Very low	44.3	Very low	251 Å²	251	164.3 Å²	164.3	100%	1.236	89%	0.893	S	S	*	*				0	106	0	-78.1	179.4	-165.2	0	0	108.6
2	A	32.1	Very low	45.1	Very low	103 Å²	103	158.1 Å²	158.1	85%	0.851	87%	0.87	S	S	*	*			trans	-146.6	113.9	163.6	0	0	0	0	0	107
3	R	39.8	Very low	45.8	Very low	251 Å²	251	157.1 Å²	157.1	95%	0.947	86%	0.861	S	S	*	*			trans	-78.2	125.2	170.6	-82.9	175.5	168.8	169.6	-3.3	107.5
4	C	33.4	Very low	46.3	Very low	133 Å²	133	153.9 Å²	153.9	90%	0.899	85%	0.854	S	S	*	*			trans	-112.4	109.3	156.1	-92.7	0	0	0	0	108.2
5	R	43.1	Very low	46.9	Very low	252 Å²	252	150.5 Å²	150.5	95%	0.951	83%	0.833	S	S	*	*			trans	-93.5	120.1	155.1	-115.8	-179.4	175.7	179.6	-2.2	105.4
6	C	42.7	Very low	47.6	Very low	132 Å²	132	148.8 Å²	148.8	89%	0.892	82%	0.819	S	S	*	*			trans	-130.6	133.2	160.2	-119.3	0	0	0	0	109.9
7	N	45.4	Very low	48.4	Very low	162 Å²	162	144.8 Å²	144.8	87%	0.866	80%	0.801	S	S	*	*			trans	-43.5	140	175.2	-86	-26.6	0	0	0	114.6
8	G	52.9	Low	49.2	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	79%	0.79	S	S	*	*	S	Bend	trans	66.8	113.4	143	0	0	0	0	0	116.1
9	T	52.3	Low	50.3	Low	146 Å²	146	137.8 Å²	137.8	90%	0.896	77%	0.77	S	S	*	*			trans	81.9	62	165.8	1.2	0	0	0	0	117
10	I	50.9	Low	51.5	Low	147 Å²	147	136.8 Å²	136.8	75%	0.754	76%	0.761	S	S	*	*			trans	-140.4	101.6	150.9	-57.3	-180	0	0	0	109.3
11	L	51.6	Low	52.8	Low	165 Å²	165	135.8 Å²	135.8	86%	0.864	75%	0.752	S	S	*	*			trans	-154.9	56.7	152.7	-140.2	109.5	0	0	0	110.4
12	C	53.3	Low	54.5	Low	90 Å²	90	125.5 Å²	125.5	61%	0.608	71%	0.709	S	S	*	*	S	Bend	trans	-149.8	26.3	175	-138.4	0	0	0	0	114.9
13	L	53.9	Low	56.9	Low	145 Å²	145	126 Å²	126	76%	0.759	69%	0.694	S	S	*	*	S	Bend	trans	-115	-10.2	177.3	-85.3	157.4	0	0	0	114.4
14	C	53.6	Low	58.9	Low	112 Å²	112	118.6 Å²	118.6	76%	0.757	67%	0.673	S	S	*	*	S	Bend	trans	-96	-11	175.1	-62	0	0	0	0	114.1
15	L	54.4	Low	61.5	Low	103 Å²	103	117.4 Å²	117.4	54%	0.539	66%	0.657	S	S	.	*	H	α-helix	trans	-86	-29.3	-178.3	-82.4	158.6	0	0	0	113.2	C18 V19	L15-C18 PolarHBondContact O-N 2.98Å; L15-V19 WeakPolarHBondContact O-CB 3.46Å; L15-V19 WeakPolarHBondContact O-CG2 3.38Å; L15-V19 PolarHBondContact O-N 3.14Å
16	M	58.8	Low	63.7	Low	124 Å²	124	109.7 Å²	109.7	61%	0.611	64%	0.638	S	S	*	*	H	α-helix	trans	-63.6	-43.3	-176.7	-76.1	-67.4	166.4	0	0	114.1	C18 M20	M16-C18 VanDerWaalsContact C-N 3.35Å; M16-C18 PolarHBondContact O-N 3.35Å; M16-M20 WeakPolarHBondContact O-CB 3.26Å; M16-M20 VanDerWaalsContact O-CG 3.24Å; M16-M20 WeakPolarHBondContact O-CG 3.36Å; M16-M20 PolarHBondContact O-N 3.07Å
17	P	61	Low	65.7	Low	80 Å²	80	111.3 Å²	111.3	52%	0.519	63%	0.626	S	S	.	*	H	α-helix	trans	-65.5	-37.7	176.9	-19.4	31.9	0	0	0	112.4	M21	P17-M21 WeakPolarHBondContact O-CB 3.34Å; P17-M21 VanDerWaalsContact O-CG 3.3Å; P17-M21 WeakPolarHBondContact O-CG 3.39Å; P17-M21 PolarHBondContact O-N 2.97Å
18	C	62.8	Low	67.7	Low	88 Å²	88	107.1 Å²	107.1	60%	0.595	60%	0.603	S	S	*	*	H	α-helix	trans	-70.7	-39.8	-179.9	-68.4	0	0	0	0	112.4	L15 M16 M21 G22	L15-C18 PolarHBondContact O-N 2.98Å; M16-C18 VanDerWaalsContact C-N 3.35Å; M16-C18 PolarHBondContact O-N 3.35Å; C18-M21 PolarHBondContact O-N 3.09Å; C18-G22 PolarHBondContact O-N 3.5Å
19	V	71.1	Confident	69.4	Low	69 Å²	69	110.3 Å²	110.3	42%	0.418	60%	0.602	S	S	.	*	H	α-helix	trans	-67.3	-40.5	176.8	173.4	0	0	0	0	110.5	L15 G22 H23	L15-V19 WeakPolarHBondContact O-CB 3.46Å; L15-V19 WeakPolarHBondContact O-CG2 3.38Å; L15-V19 PolarHBondContact O-N 3.14Å; V19-G22 PolarHBondContact O-N 3.05Å; V19-H23 PolarHBondContact O-CD2 2.84Å; V19-H23 PolarHBondContact O-N 2.74Å
20	M	73.1	Confident	70.9	Confident	118 Å²	118	107.2 Å²	107.2	58%	0.581	58%	0.583	S	S	*	*	H	α-helix	trans	-65.6	-41	176.1	-69.9	-83.6	78.5	0	0	113	M16 G22 H23 L24	M16-M20 WeakPolarHBondContact O-CB 3.26Å; M16-M20 VanDerWaalsContact O-CG 3.24Å; M16-M20 WeakPolarHBondContact O-CG 3.36Å; M16-M20 PolarHBondContact O-N 3.07Å; M20-G22 VanDerWaalsContact C-N 3.31Å; M20-G22 PolarHBondContact O-N 3.26Å; M20-H23 HydrophobicContact CE-CB 4.45Å; M20-H23 PolarHBondContact O-N 3.23Å; M20-L24 WeakPolarHBondContact O-CB 3.1Å; M20-L24 PolarHBondContact O-N 3.29Å
21	M	78.2	Confident	72.2	Confident	116 Å²	116	102.1 Å²	102.1	57%	0.571	56%	0.56	S	S	*	*	H	α-helix	trans	-65.6	-35.3	173.9	-71.9	-63.5	-79	0	0	112.2	P17 C18 L24 L25	P17-M21 WeakPolarHBondContact O-CB 3.34Å; P17-M21 VanDerWaalsContact O-CG 3.3Å; P17-M21 WeakPolarHBondContact O-CG 3.39Å; P17-M21 PolarHBondContact O-N 2.97Å; C18-M21 PolarHBondContact O-N 3.09Å; M21-L24 PolarHBondContact O-N 3Å; M21-L24 HydrophobicContact SD-CD2 4.44Å; M21-L25 PolarHBondContact O-N 2.86Å
22	G	81	Confident	73.6	Confident	34 Å²	34	98.2 Å²	98.2	35%	0.351	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-47	172.6	0	0	0	0	0	112.7	C18 V19 M20 L24 L25 V26	C18-G22 PolarHBondContact O-N 3.5Å; V19-G22 PolarHBondContact O-N 3.05Å; M20-G22 VanDerWaalsContact C-N 3.31Å; M20-G22 PolarHBondContact O-N 3.26Å; G22-L24 PolarHBondContact O-N 2.95Å; G22-L25 PolarHBondContact O-N 3.2Å; G22-V26 WeakPolarHBondContact O-CG2 3.5Å; G22-V26 PolarHBondContact O-N 3.15Å
23	H	81	Confident	74.8	Confident	115 Å²	115	101 Å²	101	53%	0.532	54%	0.541	S	S	.	.	H	α-helix	trans	-64.4	-38.2	176.9	-76.8	-66.2	0	0	0	112.8	V19 M20 V26 Y27	V19-H23 PolarHBondContact O-CD2 2.84Å; V19-H23 PolarHBondContact O-N 2.74Å; M20-H23 HydrophobicContact CE-CB 4.45Å; M20-H23 PolarHBondContact O-N 3.23Å; H23-V26 PolarHBondContact O-N 3.48Å; H23-Y27 WeakPolarHBondContact O-CB 3.42Å; H23-Y27 PolarHBondContact O-N 2.65Å
24	L	83.1	Confident	75.8	Confident	94 Å²	94	98 Å²	98	49%	0.492	53%	0.529	S	S	.	.	H	α-helix	trans	-64	-42.9	176.3	-173.3	67.7	0	0	0	111.5	M20 M21 G22 Y27 I28	M20-L24 WeakPolarHBondContact O-CB 3.1Å; M20-L24 PolarHBondContact O-N 3.29Å; M21-L24 PolarHBondContact O-N 3Å; M21-L24 HydrophobicContact SD-CD2 4.44Å; G22-L24 PolarHBondContact O-N 2.95Å; L24-Y27 PolarHBondContact O-N 2.77Å; L24-I28 HydrophobicContact CD1-CD1 4.46Å; L24-I28 HydrophobicContact CG-CD1 4.02Å; L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.37Å; L24-I28 PolarHBondContact O-N 3.38Å
25	L	87.4	Confident	76.6	Confident	108 Å²	108	96.9 Å²	96.9	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-42.2	176.3	-82.4	164.2	0	0	0	112.2	M21 G22 I28 M29	M21-L25 PolarHBondContact O-N 2.86Å; G22-L25 PolarHBondContact O-N 3.2Å; L25-I28 PolarHBondContact O-N 2.94Å; L25-M29 WeakPolarHBondContact O-CB 3.27Å; L25-M29 VanDerWaalsContact O-CG 3.29Å; L25-M29 WeakPolarHBondContact O-CG 3.36Å; L25-M29 PolarHBondContact O-N 3.4Å
26	V	88.3	Confident	77.4	Confident	91 Å²	91	98.1 Å²	98.1	55%	0.552	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-44	175	172.6	0	0	0	0	110.7	G22 H23 I28 M29 V30	G22-V26 WeakPolarHBondContact O-CG2 3.5Å; G22-V26 PolarHBondContact O-N 3.15Å; H23-V26 PolarHBondContact O-N 3.48Å; V26-I28 PolarHBondContact O-N 2.69Å; V26-M29 PolarHBondContact O-N 3.17Å; V26-V30 HydrophobicContact CG1-CG2 4.3Å; V26-V30 WeakPolarHBondContact O-CB 3.44Å; V26-V30 VanDerWaalsContact O-CG2 3.27Å; V26-V30 WeakPolarHBondContact O-CG2 2.82Å; V26-V30 PolarHBondContact O-N 3.26Å
27	Y	86.6	Confident	77.7	Confident	165 Å²	165	95.8 Å²	95.8	65%	0.647	52%	0.524	S	S	*	.	H	α-helix	trans	-62	-43.5	177.6	-179.8	-95.9	0	0	0	112.5	H23 L24 V30 S31	H23-Y27 WeakPolarHBondContact O-CB 3.42Å; H23-Y27 PolarHBondContact O-N 2.65Å; L24-Y27 PolarHBondContact O-N 2.77Å; Y27-V30 PolarHBondContact O-N 3.11Å; Y27-S31 VanDerWaalsContact O-CB 3.28Å; Y27-S31 WeakPolarHBondContact O-CB 3.27Å; Y27-S31 PolarHBondContact O-N 3.39Å; Y27-S31 PolarHBondContact O-OG 3.08Å
28	I	87.5	Confident	77.3	Confident	75 Å²	75	100.2 Å²	100.2	39%	0.385	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-46.3	176.9	-70.1	167.3	0	0	0	110.3	L24 L25 V26 V30 S31 I32	L24-I28 HydrophobicContact CD1-CD1 4.46Å; L24-I28 HydrophobicContact CG-CD1 4.02Å; L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.37Å; L24-I28 PolarHBondContact O-N 3.38Å; L25-I28 PolarHBondContact O-N 2.94Å; V26-I28 PolarHBondContact O-N 2.69Å; I28-V30 PolarHBondContact O-N 2.65Å; I28-S31 PolarHBondContact O-N 3.15Å; I28-I32 HydrophobicContact CG2-CD1 3.67Å; I28-I32 HydrophobicContact CG2-CG1 4.37Å; I28-I32 WeakPolarHBondContact O-CB 3.28Å; I28-I32 VanDerWaalsContact O-CG1 3.27Å; I28-I32 WeakPolarHBondContact O-CG1 3.29Å; I28-I32 PolarHBondContact O-N 2.87Å
29	M	86.9	Confident	76.9	Confident	132 Å²	132	100.7 Å²	100.7	65%	0.65	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-42.4	179.3	-72.7	-63.1	-130.5	0	0	112.3	L25 V26 I32 F33	L25-M29 WeakPolarHBondContact O-CB 3.27Å; L25-M29 VanDerWaalsContact O-CG 3.29Å; L25-M29 WeakPolarHBondContact O-CG 3.36Å; L25-M29 PolarHBondContact O-N 3.4Å; V26-M29 PolarHBondContact O-N 3.17Å; M29-I32 PolarHBondContact O-N 3.36Å; M29-F33 VanDerWaalsContact O-CB 3.28Å; M29-F33 WeakPolarHBondContact O-CB 3.47Å; M29-F33 PolarHBondContact O-N 2.85Å
30	V	84.6	Confident	76	Confident	80 Å²	80	101.8 Å²	101.8	49%	0.485	55%	0.545	S	S	.	.	H	α-helix	trans	-65	-41.4	175.2	172.5	0	0	0	0	110.8	V26 Y27 I28 F33 V34	V26-V30 HydrophobicContact CG1-CG2 4.3Å; V26-V30 WeakPolarHBondContact O-CB 3.44Å; V26-V30 VanDerWaalsContact O-CG2 3.27Å; V26-V30 WeakPolarHBondContact O-CG2 2.82Å; V26-V30 PolarHBondContact O-N 3.26Å; Y27-V30 PolarHBondContact O-N 3.11Å; I28-V30 PolarHBondContact O-N 2.65Å; V30-F33 PolarHBondContact O-N 3.14Å; V30-V34 HydrophobicContact CG1-CG2 4.24Å; V30-V34 WeakPolarHBondContact O-CB 3.47Å; V30-V34 VanDerWaalsContact O-CG2 3.22Å; V30-V34 WeakPolarHBondContact O-CG2 3.38Å; V30-V34 PolarHBondContact O-N 2.83Å
31	S	78	Confident	74.9	Confident	41 Å²	41	101 Å²	101	29%	0.287	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-39.4	179.2	-59.8	0	0	0	0	112.4	Y27 I28 S35	Y27-S31 VanDerWaalsContact O-CB 3.28Å; Y27-S31 WeakPolarHBondContact O-CB 3.27Å; Y27-S31 PolarHBondContact O-N 3.39Å; Y27-S31 PolarHBondContact O-OG 3.08Å; I28-S31 PolarHBondContact O-N 3.15Å; S31-S35 VanDerWaalsContact O-CB 3.29Å; S31-S35 WeakPolarHBondContact O-CB 3.46Å; S31-S35 PolarHBondContact O-N 3.15Å; S31-S35 PolarHBondContact O-OG 2.87Å
32	I	81.5	Confident	73.6	Confident	82 Å²	82	104.8 Å²	104.8	42%	0.421	56%	0.564	S	S	.	*	H	α-helix	trans	-66.4	-45.4	173.6	-69.6	170.6	0	0	0	110	I28 M29 V34 S35 I36	I28-I32 HydrophobicContact CG2-CD1 3.67Å; I28-I32 HydrophobicContact CG2-CG1 4.37Å; I28-I32 WeakPolarHBondContact O-CB 3.28Å; I28-I32 VanDerWaalsContact O-CG1 3.27Å; I28-I32 WeakPolarHBondContact O-CG1 3.29Å; I28-I32 PolarHBondContact O-N 2.87Å; M29-I32 PolarHBondContact O-N 3.36Å; I32-V34 PolarHBondContact O-N 2.64Å; I32-S35 PolarHBondContact O-N 2.92Å; I32-I36 HydrophobicContact CG2-CD1 3.48Å; I32-I36 VanDerWaalsContact CG2-CD1 3.48Å; I32-I36 HydrophobicContact CG2-CG1 4.2Å; I32-I36 WeakPolarHBondContact O-CB 3.19Å; I32-I36 VanDerWaalsContact O-CG1 3.29Å; I32-I36 WeakPolarHBondContact O-CG1 3.33Å; I32-I36 PolarHBondContact O-N 3.33Å
33	F	78.9	Confident	71.9	Confident	149 Å²	149	110.3 Å²	110.3	65%	0.654	59%	0.585	S	S	*	*	H	α-helix	trans	-63.5	-41.9	178.9	-165.5	-95.2	0	0	0	111.9	M29 V30 S37	M29-F33 VanDerWaalsContact O-CB 3.28Å; M29-F33 WeakPolarHBondContact O-CB 3.47Å; M29-F33 PolarHBondContact O-N 2.85Å; V30-F33 PolarHBondContact O-N 3.14Å; F33-S37 WeakPolarHBondContact O-CB 3.45Å; F33-S37 PolarHBondContact O-N 3.14Å; F33-S37 PolarHBondContact O-OG 3.23Å
34	V	74.4	Confident	70.3	Confident	83 Å²	83	109.4 Å²	109.4	50%	0.503	59%	0.589	S	S	.	*	H	α-helix	trans	-62.4	-44.5	173	170.3	0	0	0	0	110.3	V30 I32 I36 S37 Y38	V30-V34 HydrophobicContact CG1-CG2 4.24Å; V30-V34 WeakPolarHBondContact O-CB 3.47Å; V30-V34 VanDerWaalsContact O-CG2 3.22Å; V30-V34 WeakPolarHBondContact O-CG2 3.38Å; V30-V34 PolarHBondContact O-N 2.83Å; I32-V34 PolarHBondContact O-N 2.64Å; V34-I36 PolarHBondContact O-N 3Å; V34-S37 PolarHBondContact O-N 3.34Å; V34-Y38 VanDerWaalsContact O-CB 3.26Å; V34-Y38 WeakPolarHBondContact O-CB 3.35Å; V34-Y38 PolarHBondContact O-N 3.35Å
35	S	69.9	Low	69	Low	87 Å²	87	111.3 Å²	111.3	61%	0.608	60%	0.604	S	S	*	*	H	α-helix	trans	-68.2	-35.5	-179.2	-58.9	0	0	0	0	113.4	S31 I32	S31-S35 VanDerWaalsContact O-CB 3.29Å; S31-S35 WeakPolarHBondContact O-CB 3.46Å; S31-S35 PolarHBondContact O-N 3.15Å; S31-S35 PolarHBondContact O-OG 2.87Å; I32-S35 PolarHBondContact O-N 2.92Å
36	I	72.3	Confident	67	Low	130 Å²	130	112.9 Å²	112.9	67%	0.667	61%	0.609	S	S	*	*	H	α-helix	trans	-79.3	-33.2	177.9	-64.8	173.5	0	0	0	111.2	I32 V34 Y38	I32-I36 HydrophobicContact CG2-CD1 3.48Å; I32-I36 VanDerWaalsContact CG2-CD1 3.48Å; I32-I36 HydrophobicContact CG2-CG1 4.2Å; I32-I36 WeakPolarHBondContact O-CB 3.19Å; I32-I36 VanDerWaalsContact O-CG1 3.29Å; I32-I36 WeakPolarHBondContact O-CG1 3.33Å; I32-I36 PolarHBondContact O-N 3.33Å; V34-I36 PolarHBondContact O-N 3Å; I36-Y38 VanDerWaalsContact C-N 3.31Å
37	S	65.1	Low	65.1	Low	74 Å²	74	116.3 Å²	116.3	52%	0.517	62%	0.616	S	S	.	*	H	α-helix	trans	-77.8	-18.1	176.7	-54.8	0	0	0	0	112.7	F33 V34 S39	F33-S37 WeakPolarHBondContact O-CB 3.45Å; F33-S37 PolarHBondContact O-N 3.14Å; F33-S37 PolarHBondContact O-OG 3.23Å; V34-S37 PolarHBondContact O-N 3.34Å; S37-S39 VanDerWaalsContact C-N 3.31Å; S37-S39 PolarHBondContact O-N 3.49Å; S37-S39 VanDerWaalsContact O-N 3.09Å
38	Y	51.1	Low	63.3	Low	173 Å²	173	113.1 Å²	113.1	68%	0.678	61%	0.614	S	S	*	*			trans	-84.8	74.8	175.4	-144.7	-91.8	0	0	0	110.6	V34 I36 P40	V34-Y38 VanDerWaalsContact O-CB 3.26Å; V34-Y38 WeakPolarHBondContact O-CB 3.35Å; V34-Y38 PolarHBondContact O-N 3.35Å; I36-Y38 VanDerWaalsContact C-N 3.31Å; Y38-P40 WeakPolarHBondContact O-CD 3.39Å
39	S	56.1	Low	61.4	Low	98 Å²	98	110.8 Å²	110.8	69%	0.685	61%	0.606	S	S	*	*			trans	-75.2	113.1	155.3	-66.3	0	0	0	0	106.9	S37	S37-S39 VanDerWaalsContact C-N 3.31Å; S37-S39 PolarHBondContact O-N 3.49Å; S37-S39 VanDerWaalsContact O-N 3.09Å
40	P	52.2	Low	59.5	Low	93 Å²	93	109.1 Å²	109.1	60%	0.604	61%	0.605	S	S	*	*			trans	-56.7	132.9	174.5	23.3	-30.4	0	0	0	107.4	Y38 H42	Y38-P40 WeakPolarHBondContact O-CD 3.39Å; P40-H42 PolarHBondContact O-N 3.21Å; P40-H42 VanDerWaalsContact O-N 3.12Å
41	P	49.6	Very low	58	Low	102 Å²	102	106.3 Å²	106.3	66%	0.662	59%	0.592	S	S	*	*			trans	-55.3	127.8	177.9	22	-30.7	0	0	0	107.5	L43	P41-L43 PolarHBondContact O-N 3.4Å
42	H	50.9	Low	56.8	Low	194 Å²	194	109.5 Å²	109.5	90%	0.898	61%	0.609	S	S	*	*			trans	-57.9	96.9	169.8	-83.3	-74.1	0	0	0	107.1	P40 P44	P40-H42 PolarHBondContact O-N 3.21Å; P40-H42 VanDerWaalsContact O-N 3.12Å; H42-P44 WeakPolarHBondContact O-CD 2.99Å
43	L	44.8	Very low	55.5	Low	151 Å²	151	108.7 Å²	108.7	79%	0.791	61%	0.611	S	S	*	*			trans	-68.3	113.6	172	-82	159.8	0	0	0	105.8	P41 V45	P41-L43 PolarHBondContact O-N 3.4Å; L43-V45 PolarHBondContact O-N 3.23Å
44	P	46.8	Very low	54.2	Low	95 Å²	95	106.2 Å²	106.2	62%	0.617	62%	0.618	S	S	*	*			trans	-57.8	134.7	172.3	24.9	-31.3	0	0	0	107.5	H42 H46	H42-P44 WeakPolarHBondContact O-CD 2.99Å; P44-H46 PolarHBondContact O-N 3.32Å
45	V	55.4	Low	53.1	Low	135 Å²	135	109.6 Å²	109.6	82%	0.818	63%	0.633	S	S	*	*	S	Bend	trans	-55.8	-15.2	-179.8	-174	0	0	0	0	111.7	L43	L43-V45 PolarHBondContact O-N 3.23Å
46	H	47	Very low	52.4	Low	141 Å²	141	108.9 Å²	108.9	65%	0.653	63%	0.629	S	S	*	*	S	Bend	trans	-128.5	117.5	174.8	-54	-55.8	0	0	0	110.5	P44 V48	P44-H46 PolarHBondContact O-N 3.32Å; H46-V48 PolarHBondContact O-N 2.96Å
47	F	46.7	Very low	51.6	Low	163 Å²	163	107.3 Å²	107.3	72%	0.715	64%	0.644	S	S	*	*			trans	-77.9	112.8	162.4	179.1	-96.6	0	0	0	108.2	A49	F47-A49 HydrophobicContact CE1-CB 3.99Å
48	V	50.1	Low	51.2	Low	97 Å²	97	108 Å²	108	59%	0.588	65%	0.654	S	S	*	*			trans	-99	111.3	172.2	-176.7	0	0	0	0	107.3	H46	H46-V48 PolarHBondContact O-N 2.96Å
49	A	46.7	Very low	51.2	Low	27 Å²	27	106.5 Å²	106.5	22%	0.223	66%	0.658	C	S	.	*			trans	-64.2	133.8	179.1	0	0	0	0	0	110.5	F47 G51 S61	F47-A49 HydrophobicContact CE1-CB 3.99Å; A49-G51 PolarHBondContact O-N 3.34Å; A49-S61 PolarHBondContact O-OG 3.19Å
50	P	47.1	Very low	50.9	Low	97 Å²	97	106.1 Å²	106.1	63%	0.63	66%	0.66	S	S	*	*			trans	-62	133.8	178.9	23.9	-32.1	0	0	0	111	L64	P50-L64 PolarHBondContact O-N 3.4Å
51	G	53.7	Low	51	Low	21 Å²	21	102.8 Å²	102.8	22%	0.216	64%	0.639	C	S	.	*	B	Isolated β-bridge	trans	-142.8	173	-172.6	0	0	0	0	0	115.4	A49 S53 H62	A49-G51 PolarHBondContact O-N 3.34Å; G51-S53 PolarHBondContact O-N 3.29Å; G51-H62 CarbonylContact C-O 3.58Å; G51-H62 WeakPolarHBondContact CA-O 3.45Å
52	V	51.5	Low	51.1	Low	107 Å²	107	104.6 Å²	104.6	65%	0.648	64%	0.638	S	S	*	*	S	Bend	trans	-75.3	-13.4	-162.3	-146.4	0	0	0	0	115	H62 L64	V52-H62 HydrophobicContact CG2-CB 4.49Å; V52-H62 WeakPolarHBondContact CG2-O 3.39Å; V52-H62 PolarHBondContact N-O 2.97Å; V52-L64 HydrophobicContact CB-CD2 4.13Å; V52-L64 HydrophobicContact CG1-CD2 3.95Å; V52-L64 HydrophobicContact CG2-CD2 3.84Å; V52-L64 HydrophobicContact CG2-CG 4.33Å
53	S	54.6	Low	51.1	Low	66 Å²	66	98.6 Å²	98.6	46%	0.462	62%	0.616	S	S	.	*	S	Bend	trans	-117.2	133.6	-176.3	120	0	0	0	0	111.2	G51	G51-S53 PolarHBondContact O-N 3.29Å
54	A	52.7	Low	51.3	Low	96 Å²	96	97.3 Å²	97.3	79%	0.793	61%	0.61	S	S	*	*			trans	-61.1	134.8	170.3	0	0	0	0	0	110.4	S56	A54-S56 PolarHBondContact O-N 3.38Å
55	N	51.2	Low	51.3	Low	154 Å²	154	94.7 Å²	94.7	82%	0.824	60%	0.6	S	S	*	*			trans	-34.9	103.8	-178.1	-93.4	-14.3	0	0	0	113.5
56	S	54	Low	51	Low	73 Å²	73	92.9 Å²	92.9	51%	0.51	59%	0.591	S	S	.	*			trans	-102.1	117.1	151.3	64	0	0	0	0	105.4	A54 A58 L59	A54-S56 PolarHBondContact O-N 3.38Å; S56-A58 PolarHBondContact O-N 2.9Å; S56-L59 PolarHBondContact O-N 3.45Å
57	G	55.8	Low	51	Low	97 Å²	97	93 Å²	93	100%	1	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	21.6	-167.2	0	0	0	0	0	117.1
58	A	56.7	Low	51.1	Low	88 Å²	88	94.1 Å²	94.1	73%	0.727	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-20	-179.5	0	0	0	0	0	114	S56	S56-A58 PolarHBondContact O-N 2.9Å
59	L	51.2	Low	50.9	Low	142 Å²	142	95.9 Å²	95.9	74%	0.743	60%	0.596	S	S	*	*	S	Bend	trans	-142.6	142.5	-177.7	-69.3	170.7	0	0	0	111.7	S56	S56-L59 PolarHBondContact O-N 3.45Å
60	A	50.8	Low	51.2	Low	90 Å²	90	98.6 Å²	98.6	74%	0.744	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.8	172.8	0	0	0	0	0	110.6	H62	A60-H62 PolarHBondContact O-N 3.47Å
61	S	52.8	Low	51.5	Low	22 Å²	22	102.9 Å²	102.9	15%	0.154	61%	0.61	C	S	.	*	P	Polyproline II helix	trans	-62	129.4	-179.4	48	0	0	0	0	111.7	A49	A49-S61 PolarHBondContact O-OG 3.19Å
62	H	52.4	Low	51.7	Low	141 Å²	141	103.9 Å²	103.9	65%	0.653	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.1	173.1	-72	-63.7	0	0	0	110.1	G51 V52 A60	G51-H62 CarbonylContact C-O 3.58Å; G51-H62 WeakPolarHBondContact CA-O 3.45Å; V52-H62 HydrophobicContact CG2-CB 4.49Å; V52-H62 WeakPolarHBondContact CG2-O 3.39Å; V52-H62 PolarHBondContact N-O 2.97Å; A60-H62 PolarHBondContact O-N 3.47Å
63	P	51.8	Low	51.8	Low	67 Å²	67	106.6 Å²	106.6	44%	0.435	62%	0.615	S	S	.	*	B	Isolated β-bridge	trans	-62.5	140.1	-174.7	25.5	-33.8	0	0	0	111.6	G65	P63-G65 WeakPolarHBondContact CB-O 3.27Å; P63-G65 PolarHBondContact O-N 2.88Å
64	L	48.4	Very low	52.2	Low	125 Å²	125	109.5 Å²	109.5	65%	0.654	63%	0.626	S	S	*	*	S	Bend	trans	-66.2	-13.4	-178.3	-77.2	159.4	0	0	0	114.1	P50 V52	P50-L64 PolarHBondContact O-N 3.4Å; V52-L64 HydrophobicContact CB-CD2 4.13Å; V52-L64 HydrophobicContact CG1-CD2 3.95Å; V52-L64 HydrophobicContact CG2-CD2 3.84Å; V52-L64 HydrophobicContact CG2-CG 4.33Å
65	G	47.4	Very low	53.4	Low	40 Å²	40	106.6 Å²	106.6	41%	0.412	60%	0.6	S	S	.	*	S	Bend	trans	-147.9	168.3	172.3	0	0	0	0	0	109.8	P63 F67	P63-G65 WeakPolarHBondContact CB-O 3.27Å; P63-G65 PolarHBondContact O-N 2.88Å; G65-F67 PolarHBondContact O-N 3.43Å
66	P	48.5	Very low	55.3	Low	97 Å²	97	99.5 Å²	99.5	63%	0.63	56%	0.563	S	S	*	*			trans	-63.1	127.5	176.3	29.3	-34	0	0	0	108.8	W68	P66-W68 VanDerWaalsContact CB-O 3.3Å; P66-W68 WeakPolarHBondContact CB-O 3.2Å; P66-W68 PolarHBondContact O-N 3.01Å
67	F	47.6	Very low	57.1	Low	144 Å²	144	96.1 Å²	96.1	63%	0.632	54%	0.539	S	S	*	.	S	Bend	trans	-54.5	-24.7	174.8	178.3	-94.9	0	0	0	111.9	G65	G65-F67 PolarHBondContact O-N 3.43Å
68	W	48.5	Very low	58.9	Low	186 Å²	186	92.3 Å²	92.3	71%	0.705	49%	0.494	S	S	*	.	S	Bend	trans	-106.1	119.5	172.3	-55.8	99.3	0	0	0	109.7	P66 L70	P66-W68 VanDerWaalsContact CB-O 3.3Å; P66-W68 WeakPolarHBondContact CB-O 3.2Å; P66-W68 PolarHBondContact O-N 3.01Å; W68-L70 HydrophobicContact CB-CG 4.39Å; W68-L70 PolarHBondContact O-N 2.84Å
69	N	46.3	Very low	60.6	Low	134 Å²	134	90 Å²	90	72%	0.717	47%	0.469	S	S	*	.			trans	-69.5	100.2	167.6	-172.4	-0.8	0	0	0	108.8	R71	N69-R71 VanDerWaalsContact C-N 3.29Å; N69-R71 PolarHBondContact O-N 3.43Å; N69-R71 WeakPolarHBondContact OD1-CB 3.41Å; N69-R71 WeakPolarHBondContact OD1-CG 3.47Å; N69-R71 PolarHBondContact OD1-N 2.97Å
70	L	52	Low	62.5	Low	83 Å²	83	84.7 Å²	84.7	44%	0.435	44%	0.441	S	S	.	.			trans	-87.3	12.8	-178	-79.1	158.2	0	0	0	113.2	W68 L72	W68-L70 HydrophobicContact CB-CG 4.39Å; W68-L70 PolarHBondContact O-N 2.84Å; L70-L72 VanDerWaalsContact C-N 3.28Å; L70-L72 PolarHBondContact O-N 2.91Å
71	R	54.8	Low	64.3	Low	187 Å²	187	81 Å²	81	71%	0.706	41%	0.408	S	S	*	.			trans	-69.8	87.2	178.2	-71	-172.4	-173.3	-167.4	2.3	110.6	N69 E73	N69-R71 VanDerWaalsContact C-N 3.29Å; N69-R71 PolarHBondContact O-N 3.43Å; N69-R71 WeakPolarHBondContact OD1-CB 3.41Å; N69-R71 WeakPolarHBondContact OD1-CG 3.47Å; N69-R71 PolarHBondContact OD1-N 2.97Å; R71-E73 VanDerWaalsContact C-N 3.33Å
72	L	57.8	Low	66.1	Low	43 Å²	43	80.5 Å²	80.5	23%	0.225	40%	0.404	C	S	.	.			trans	-72.6	-27.8	174.6	-74.4	156.3	0	0	0	112.4	L70 D74 S75 Q80 H83	L70-L72 VanDerWaalsContact C-N 3.28Å; L70-L72 PolarHBondContact O-N 2.91Å; L72-D74 PolarHBondContact O-N 2.86Å; L72-D74 VanDerWaalsContact O-N 3.16Å; L72-S75 PolarHBondContact O-N 3.3Å; L72-S75 PolarHBondContact O-OG 3.21Å; L72-Q80 WeakPolarHBondContact O-CG 3.48Å; L72-Q80 PolarHBondContact O-NE2 3.09Å; L72-H83 WeakPolarHBondContact CD1-CD2 3.31Å; L72-H83 HydrophobicContact CD2-CB 3.52Å; L72-H83 WeakPolarHBondContact CD2-CD2 3.43Å
73	E	52.6	Low	67.8	Low	163 Å²	163	76.4 Å²	76.4	76%	0.762	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.3	-171.5	-66.9	177.4	170.4	0	0	113.1	R71	R71-E73 VanDerWaalsContact C-N 3.33Å
74	D	63.3	Low	69.4	Low	127 Å²	127	77.4 Å²	77.4	68%	0.679	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	5.1	178.8	-59.4	-41.4	0	0	0	113.9	L72	L72-D74 PolarHBondContact O-N 2.86Å; L72-D74 VanDerWaalsContact O-N 3.16Å
75	S	76.8	Confident	71.3	Confident	35 Å²	35	74 Å²	74	25%	0.245	36%	0.364	C	S	.	.	S	Bend	trans	-90.3	153.5	-177.2	67.3	0	0	0	0	112.4	L72 Q80	L72-S75 PolarHBondContact O-N 3.3Å; L72-S75 PolarHBondContact O-OG 3.21Å; S75-Q80 VanDerWaalsContact O-CD 3.31Å; S75-Q80 PolarHBondContact O-NE2 3.22Å; S75-Q80 WeakPolarHBondContact OG-CG 3.46Å
76	A	91.3	Very high	73.2	Confident	6 Å²	6	73.9 Å²	73.9	5%	0.05	36%	0.355	C	S	.	.			trans	-67.1	156.8	-179.6	0	0	0	0	0	111.7	W78 N79 Q80 E341 S342 F343 K345	A76-W78 PolarHBondContact O-N 2.87Å; A76-N79 WeakPolarHBondContact CB-OD1 3.28Å; A76-N79 WeakPolarHBondContact O-CA 3.36Å; A76-N79 WeakPolarHBondContact O-CB 3.4Å; A76-N79 PolarHBondContact O-N 3.16Å; A76-Q80 PolarHBondContact O-N 3.19Å; A76-E341 WeakPolarHBondContact CB-O 3.5Å; A76-S342 CarbonylContact C-O 3.57Å; A76-S342 WeakPolarHBondContact CA-O 3.03Å; A76-S342 WeakPolarHBondContact CB-O 3.27Å; A76-F343 WeakPolarHBondContact CB-O 3.45Å; A76-K345 HydrophobicContact CB-CB 3.96Å
77	L	92.8	Very high	74.8	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-48.1	-55	-171.8	176	64.9	0	0	0	113	N79 Q80 L81 W124 H127 L128 V142 M145 S342 F343	L77-N79 VanDerWaalsContact C-N 3.3Å; L77-N79 PolarHBondContact O-N 3.13Å; L77-Q80 WeakPolarHBondContact O-CB 3.42Å; L77-Q80 PolarHBondContact O-N 3.43Å; L77-L81 HydrophobicContact CD1-CD1 4.04Å; L77-L81 HydrophobicContact CD1-CG 4.14Å; L77-L81 HydrophobicContact CG-CD1 4.08Å; L77-L81 HydrophobicContact CG-CG 4.48Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 3.2Å; L77-W124 HydrophobicContact CD1-CB 4.12Å; L77-W124 HydrophobicContact CD2-CB 4.27Å; L77-H127 HydrophobicContact CD1-CB 3.72Å; L77-L128 HydrophobicContact CB-CD1 4.28Å; L77-L128 HydrophobicContact CD2-CB 4.28Å; L77-L128 HydrophobicContact CD2-CD2 4.08Å; L77-V142 HydrophobicContact CD2-CG1 4.1Å; L77-M145 HydrophobicContact CD2-CE 4.24Å; L77-S342 PolarHBondContact N-O 3.3Å; L77-F343 HydrophobicContact CD2-CD2 4.33Å; L77-F343 PolarHBondContact N-O 2.98Å
78	W	94	Very high	76.6	Confident	17 Å²	17	71.2 Å²	71.2	6%	0.064	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-39.5	-177.8	-173.9	97	0	0	0	111.7	A76 Q80 L81 Q82 F343 Y344 V374 H375 L376 F377 M386	A76-W78 PolarHBondContact O-N 2.87Å; W78-Q80 PolarHBondContact O-N 3.34Å; W78-L81 PolarHBondContact O-N 3.47Å; W78-Q82 HydrophobicContact CD2-CB 4.38Å; W78-Q82 HydrophobicContact CE3-CB 4.03Å; W78-Q82 HydrophobicContact CH2-CB 3.93Å; W78-Q82 HydrophobicContact CH2-CG 3.7Å; W78-Q82 HydrophobicContact CZ2-CB 4.27Å; W78-Q82 HydrophobicContact CZ2-CG 4.19Å; W78-Q82 HydrophobicContact CZ3-CB 3.79Å; W78-Q82 HydrophobicContact CZ3-CG 3.95Å; W78-Q82 VanDerWaalsContact O-CB 3.3Å; W78-Q82 WeakPolarHBondContact O-CB 3.34Å; W78-Q82 PolarHBondContact O-N 3.29Å; W78-F343 HydrophobicContact CB-CD1 4.4Å; W78-F343 HydrophobicContact CB-CE1 4.04Å; W78-F343 HydrophobicContact CB-CE2 4.32Å; W78-F343 HydrophobicContact CB-CZ 3.99Å; W78-F343 WeakPolarHBondContact CB-O 3Å; W78-F343 AromaticContact CD1-CZ 3.94Å; W78-F343 HydrophobicContact CG-CE1 4.4Å; W78-F343 HydrophobicContact CG-CZ 4.3Å; W78-F343 PolarHBondContact N-O 2.85Å; W78-Y344 HydrophobicContact CB-CD2 4.44Å; W78-Y344 AromaticContact CD2-CD2 4Å; W78-Y344 HydrophobicContact CD2-CD2 4Å; W78-Y344 HydrophobicContact CD2-CE2 4.38Å; W78-Y344 AromaticContact CE3-CD2 3.47Å; W78-Y344 HydrophobicContact CE3-CD2 3.47Å; W78-Y344 VanDerWaalsContact CE3-CD2 3.47Å; W78-Y344 AromaticContact CE3-CE2 3.56Å; W78-Y344 HydrophobicContact CE3-CE2 3.56Å; W78-Y344 HydrophobicContact CG-CD2 4.41Å; W78-Y344 HydrophobicContact CZ3-CD2 4.06Å; W78-Y344 AromaticContact CZ3-CE2 3.64Å; W78-Y344 HydrophobicContact CZ3-CE2 3.64Å; W78-V374 HydrophobicContact CZ2-CG1 4.16Å; W78-H375 PolarHBondContact NE1-O 2.78Å; W78-L376 PolarHBondContact NE1-O 2.02Å; W78-L376 VanDerWaalsContact NE1-O 3.16Å; W78-F377 AromaticContact CD1-CD2 3.9Å; W78-F377 HydrophobicContact CD2-CD2 4.15Å; W78-F377 HydrophobicContact CD2-CE2 4.5Å; W78-F377 AromaticContact CE2-CD2 3.93Å; W78-F377 HydrophobicContact CG-CD2 4.15Å; W78-F377 HydrophobicContact CG-CE2 4.45Å; W78-F377 AromaticContact NE1-CD2 3.73Å; W78-M386 HydrophobicContact CH2-CE 3.8Å; W78-M386 HydrophobicContact CH2-SD 3.46Å; W78-M386 WeakPolarHBondContact CH2-SD 3.33Å; W78-M386 HydrophobicContact CZ2-CE 3.96Å; W78-M386 HydrophobicContact CZ2-SD 3.34Å; W78-M386 WeakPolarHBondContact CZ2-SD 3.39Å; W78-M386 HydrophobicContact CZ3-CE 4.17Å; W78-M386 HydrophobicContact CZ3-SD 4.4Å
79	N	92.5	Very high	78.2	Confident	39 Å²	39	65.2 Å²	65.2	21%	0.209	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-42.6	177.9	-60.1	91.1	0	0	0	111.4	A76 L77 H83 Y344 K345	A76-N79 WeakPolarHBondContact CB-OD1 3.28Å; A76-N79 WeakPolarHBondContact O-CA 3.36Å; A76-N79 WeakPolarHBondContact O-CB 3.4Å; A76-N79 PolarHBondContact O-N 3.16Å; L77-N79 VanDerWaalsContact C-N 3.3Å; L77-N79 PolarHBondContact O-N 3.13Å; N79-H83 VanDerWaalsContact O-CB 3.25Å; N79-H83 WeakPolarHBondContact O-CB 3.49Å; N79-H83 PolarHBondContact O-N 3.31Å; N79-Y344 WeakPolarHBondContact OD1-CA 3.39Å; N79-K345 PolarHBondContact ND2-O 2.83Å; N79-K345 PolarHBondContact OD1-N 2.77Å; N79-K345 PolarHBondContact OD1-O 3.43Å
80	Q	89.4	Confident	79.8	Confident	31 Å²	31	61.5 Å²	61.5	15%	0.145	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-51.1	175.9	-68.5	179.9	-13.9	0	0	111.1	L72 S75 A76 L77 W78 Q82 H83 L84	L72-Q80 WeakPolarHBondContact O-CG 3.48Å; L72-Q80 PolarHBondContact O-NE2 3.09Å; S75-Q80 VanDerWaalsContact O-CD 3.31Å; S75-Q80 PolarHBondContact O-NE2 3.22Å; S75-Q80 WeakPolarHBondContact OG-CG 3.46Å; A76-Q80 PolarHBondContact O-N 3.19Å; L77-Q80 WeakPolarHBondContact O-CB 3.42Å; L77-Q80 PolarHBondContact O-N 3.43Å; W78-Q80 PolarHBondContact O-N 3.34Å; Q80-Q82 PolarHBondContact O-N 3.15Å; Q80-H83 PolarHBondContact O-N 3.34Å; Q80-L84 WeakPolarHBondContact O-CG 3.46Å; Q80-L84 PolarHBondContact O-N 3.21Å
81	L	90.1	Very high	80.8	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-48.2	-179.7	-64.2	-179.3	0	0	0	111.5	L77 W78 H83 L84 W85 W124 M145 H375	L77-L81 HydrophobicContact CD1-CD1 4.04Å; L77-L81 HydrophobicContact CD1-CG 4.14Å; L77-L81 HydrophobicContact CG-CD1 4.08Å; L77-L81 HydrophobicContact CG-CG 4.48Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 3.2Å; W78-L81 PolarHBondContact O-N 3.47Å; L81-H83 VanDerWaalsContact C-N 3.31Å; L81-H83 PolarHBondContact O-N 3.36Å; L81-L84 PolarHBondContact O-N 2.91Å; L81-W85 WeakPolarHBondContact O-CB 3.32Å; L81-W85 PolarHBondContact O-N 3.01Å; L81-W124 HydrophobicContact CD1-CD2 4.18Å; L81-W124 HydrophobicContact CD1-CE3 4.16Å; L81-W124 HydrophobicContact CD1-CG 4.41Å; L81-W124 HydrophobicContact CD2-CD2 4.08Å; L81-W124 HydrophobicContact CD2-CE3 3.24Å; L81-W124 HydrophobicContact CD2-CH2 4.25Å; L81-W124 HydrophobicContact CD2-CZ3 3.34Å; L81-W124 HydrophobicContact CG-CE3 4.33Å; L81-M145 HydrophobicContact CD1-CE 3.41Å; L81-M145 VanDerWaalsContact CD1-CE 3.41Å; L81-H375 VanDerWaalsContact C-CE1 3.46Å; L81-H375 PolarHBondContact O-CE1 3.3Å; L81-H375 VanDerWaalsContact O-CE1 3.23Å
82	Q	90.8	Very high	81.5	Confident	13 Å²	13	61.1 Å²	61.1	6%	0.061	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-40.6	178.6	-171.8	59.3	43.6	0	0	111.7	W78 Q80 W85 D86 R373 H375	W78-Q82 HydrophobicContact CD2-CB 4.38Å; W78-Q82 HydrophobicContact CE3-CB 4.03Å; W78-Q82 HydrophobicContact CH2-CB 3.93Å; W78-Q82 HydrophobicContact CH2-CG 3.7Å; W78-Q82 HydrophobicContact CZ2-CB 4.27Å; W78-Q82 HydrophobicContact CZ2-CG 4.19Å; W78-Q82 HydrophobicContact CZ3-CB 3.79Å; W78-Q82 HydrophobicContact CZ3-CG 3.95Å; W78-Q82 VanDerWaalsContact O-CB 3.3Å; W78-Q82 WeakPolarHBondContact O-CB 3.34Å; W78-Q82 PolarHBondContact O-N 3.29Å; Q80-Q82 PolarHBondContact O-N 3.15Å; Q82-W85 PolarHBondContact O-N 3.43Å; Q82-D86 PolarHBondContact NE2-OD1 3.16Å; Q82-D86 WeakPolarHBondContact O-CB 3.5Å; Q82-D86 PolarHBondContact O-N 3.2Å; Q82-R373 PolarHBondContact NE2-O 3.22Å; Q82-H375 PolarHBondContact OE1-ND1 3.15Å
83	H	87	Confident	82	Confident	54 Å²	54	63.2 Å²	63.2	25%	0.25	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-43.7	178.3	-177.6	91.5	0	0	0	112.6	L72 N79 Q80 L81 W85 D86 R87	L72-H83 WeakPolarHBondContact CD1-CD2 3.31Å; L72-H83 HydrophobicContact CD2-CB 3.52Å; L72-H83 WeakPolarHBondContact CD2-CD2 3.43Å; N79-H83 VanDerWaalsContact O-CB 3.25Å; N79-H83 WeakPolarHBondContact O-CB 3.49Å; N79-H83 PolarHBondContact O-N 3.31Å; Q80-H83 PolarHBondContact O-N 3.34Å; L81-H83 VanDerWaalsContact C-N 3.31Å; L81-H83 PolarHBondContact O-N 3.36Å; H83-W85 VanDerWaalsContact C-N 3.29Å; H83-W85 PolarHBondContact O-N 2.87Å; H83-D86 PolarHBondContact O-N 2.91Å; H83-R87 WeakPolarHBondContact NE2-CD 3.5Å; H83-R87 WeakPolarHBondContact O-CG 3.23Å; H83-R87 PolarHBondContact O-N 2.97Å
84	L	85.9	Confident	82.4	Confident	88 Å²	88	62.3 Å²	62.3	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-43.1	175	-70.7	173.3	0	0	0	111	Q80 L81 D86 R87 H88	Q80-L84 WeakPolarHBondContact O-CG 3.46Å; Q80-L84 PolarHBondContact O-N 3.21Å; L81-L84 PolarHBondContact O-N 2.91Å; L84-D86 VanDerWaalsContact C-N 3.33Å; L84-D86 PolarHBondContact O-N 3.35Å; L84-R87 PolarHBondContact O-N 3.13Å; L84-H88 WeakPolarHBondContact O-CB 3.33Å; L84-H88 PolarHBondContact O-N 3.06Å
85	W	88.1	Confident	81.8	Confident	53 Å²	53	58.6 Å²	58.6	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-37.2	177	-159.2	-118.1	0	0	0	112.9	L81 Q82 H83 H88 H89 M112 E372 H375	L81-W85 WeakPolarHBondContact O-CB 3.32Å; L81-W85 PolarHBondContact O-N 3.01Å; Q82-W85 PolarHBondContact O-N 3.43Å; H83-W85 VanDerWaalsContact C-N 3.29Å; H83-W85 PolarHBondContact O-N 2.87Å; W85-H88 PolarHBondContact O-N 2.6Å; W85-H89 AromaticContact CD1-ND1 3.83Å; W85-H89 AromaticContact CD2-CE1 3.38Å; W85-H89 AromaticContact CD2-ND1 3.57Å; W85-H89 AromaticContact CE2-CE1 3.19Å; W85-H89 AromaticContact CE2-ND1 3.6Å; W85-H89 AromaticContact CE3-CE1 3.62Å; W85-H89 AromaticContact CG-ND1 3.75Å; W85-H89 AromaticContact CH2-CE1 3.56Å; W85-H89 AromaticContact CZ2-CE1 3.31Å; W85-H89 WeakPolarHBondContact CZ2-CE1 3.35Å; W85-H89 AromaticContact CZ3-CE1 3.68Å; W85-H89 AromaticContact NE1-CE1 3.74Å; W85-H89 AromaticContact NE1-ND1 3.73Å; W85-H89 PolarHBondContact O-N 2.98Å; W85-H89 PolarHBondContact O-ND1 3.33Å; W85-M112 HydrophobicContact CE3-CE 3.58Å; W85-M112 HydrophobicContact CE3-SD 4.3Å; W85-M112 HydrophobicContact CH2-CE 4.38Å; W85-M112 HydrophobicContact CH2-SD 4.03Å; W85-M112 HydrophobicContact CZ3-CE 3.32Å; W85-M112 HydrophobicContact CZ3-SD 3.45Å; W85-M112 WeakPolarHBondContact CZ3-SD 3.33Å; W85-E372 PolarHBondContact NE1-O 3.42Å; W85-H375 AromaticContact CG-CE1 3.81Å
86	D	86.6	Confident	80.2	Confident	39 Å²	39	64.3 Å²	64.3	21%	0.209	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-45.6	175.8	-75.4	1	0	0	0	111.7	Q82 H83 L84 H88 H89 N90 R390	Q82-D86 PolarHBondContact NE2-OD1 3.16Å; Q82-D86 WeakPolarHBondContact O-CB 3.5Å; Q82-D86 PolarHBondContact O-N 3.2Å; H83-D86 PolarHBondContact O-N 2.91Å; L84-D86 VanDerWaalsContact C-N 3.33Å; L84-D86 PolarHBondContact O-N 3.35Å; D86-H88 VanDerWaalsContact C-N 3.3Å; D86-H88 PolarHBondContact O-N 3Å; D86-H89 PolarHBondContact O-N 2.81Å; D86-N90 WeakPolarHBondContact O-CB 3.27Å; D86-N90 PolarHBondContact O-N 2.74Å; D86-R390 IonicContact OD1-CZ 3.59Å; D86-R390 IonicContact OD1-NH1 3.06Å; D86-R390 PolarHBondContact OD1-NH1 3.33Å; D86-R390 IonicContact OD1-NH2 3.75Å; D86-R390 PolarHBondContact OD1-NH2 3.41Å; D86-R390 IonicContact OD2-CZ 3.88Å; D86-R390 IonicContact OD2-NH1 2.6Å; D86-R390 PolarHBondContact OD2-NH1 2.96Å; D86-R390 IonicContact OD2-NH2 2.65Å
87	R	83.8	Confident	78	Confident	104 Å²	104	69.9 Å²	69.9	39%	0.392	37%	0.366	S	S	.	.	H	α-helix	trans	-63.1	-40.2	174.7	-67.6	-174.7	83.6	157.7	3.2	111.5	H83 L84 H89 L93 R94	H83-R87 WeakPolarHBondContact NE2-CD 3.5Å; H83-R87 WeakPolarHBondContact O-CG 3.23Å; H83-R87 PolarHBondContact O-N 2.97Å; L84-R87 PolarHBondContact O-N 3.13Å; R87-H89 VanDerWaalsContact C-N 3.32Å; R87-H89 PolarHBondContact O-N 2.93Å; R87-L93 HydrophobicContact CG-CB 4.44Å; R87-L93 HydrophobicContact CG-CD1 4.18Å; R87-R94 WeakPolarHBondContact O-CG 3.24Å
88	H	84.4	Confident	75.4	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-64.1	-36	176.4	-174.5	-92.8	0	0	0	111.7	L84 W85 D86 R94	L84-H88 WeakPolarHBondContact O-CB 3.33Å; L84-H88 PolarHBondContact O-N 3.06Å; W85-H88 PolarHBondContact O-N 2.6Å; D86-H88 VanDerWaalsContact C-N 3.3Å; D86-H88 PolarHBondContact O-N 3Å; H88-R94 PolarHBondContact CD2-NH2 3.34Å; H88-R94 VanDerWaalsContact CD2-NH2 3.28Å; H88-R94 PolarHBondContact CE1-NH2 2.92Å; H88-R94 PolarHBondContact ND1-NH2 3.02Å; H88-R94 PolarHBondContact NE2-NH2 3.22Å; H88-R94 PolarHBondContact O-NE 3.19Å; H88-R94 PolarHBondContact O-NH2 2.97Å
89	H	83.1	Confident	72.9	Confident	60 Å²	60	80 Å²	80	28%	0.278	44%	0.442	S	S	.	.	H	α-helix	trans	-101.7	2.2	-175.5	-64.5	93.9	0	0	0	114.8	W85 D86 R87 P91	W85-H89 AromaticContact CD1-ND1 3.83Å; W85-H89 AromaticContact CD2-CE1 3.38Å; W85-H89 AromaticContact CD2-ND1 3.57Å; W85-H89 AromaticContact CE2-CE1 3.19Å; W85-H89 AromaticContact CE2-ND1 3.6Å; W85-H89 AromaticContact CE3-CE1 3.62Å; W85-H89 AromaticContact CG-ND1 3.75Å; W85-H89 AromaticContact CH2-CE1 3.56Å; W85-H89 AromaticContact CZ2-CE1 3.31Å; W85-H89 WeakPolarHBondContact CZ2-CE1 3.35Å; W85-H89 AromaticContact CZ3-CE1 3.68Å; W85-H89 AromaticContact NE1-CE1 3.74Å; W85-H89 AromaticContact NE1-ND1 3.73Å; W85-H89 PolarHBondContact O-N 2.98Å; W85-H89 PolarHBondContact O-ND1 3.33Å; D86-H89 PolarHBondContact O-N 2.81Å; R87-H89 VanDerWaalsContact C-N 3.32Å; R87-H89 PolarHBondContact O-N 2.93Å; H89-P91 WeakPolarHBondContact O-CD 3.48Å
90	N	79.2	Confident	70.2	Confident	56 Å²	56	81.3 Å²	81.3	30%	0.299	46%	0.464	S	S	.	.			trans	-105.7	108.4	179	-170.9	-27.4	0	0	0	110.9	D86 I92 L93 R94	D86-N90 WeakPolarHBondContact O-CB 3.27Å; D86-N90 PolarHBondContact O-N 2.74Å; N90-I92 PolarHBondContact O-N 3.11Å; N90-I92 VanDerWaalsContact O-N 3.16Å; N90-I92 WeakPolarHBondContact OD1-CB 3.46Å; N90-I92 PolarHBondContact OD1-N 3.05Å; N90-L93 HydrophobicContact CB-CB 4.12Å; N90-L93 HydrophobicContact CB-CD1 3.96Å; N90-L93 HydrophobicContact CB-CG 4.01Å; N90-L93 PolarHBondContact O-N 3.47Å; N90-R94 PolarHBondContact O-N 2.96Å; N90-R94 VanDerWaalsContact O-N 3.08Å
91	P	71.9	Confident	67.6	Low	110 Å²	110	89 Å²	89	71%	0.714	50%	0.503	S	S	*	.	H	α-helix	trans	-57	-30.7	179.5	-24.9	34.1	0	0	0	114	H89 L93	H89-P91 WeakPolarHBondContact O-CD 3.48Å; P91-L93 VanDerWaalsContact C-N 3.34Å
92	I	71.3	Confident	65	Low	152 Å²	152	94.8 Å²	94.8	78%	0.779	53%	0.532	S	S	*	.	H	α-helix	trans	-69.6	-36.1	179.1	-58.7	166.7	0	0	0	110.5	N90	N90-I92 PolarHBondContact O-N 3.11Å; N90-I92 VanDerWaalsContact O-N 3.16Å; N90-I92 WeakPolarHBondContact OD1-CB 3.46Å; N90-I92 PolarHBondContact OD1-N 3.05Å
93	L	66.4	Low	62.2	Low	87 Å²	87	100.3 Å²	100.3	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-86.4	-16.9	-178.3	-59.9	179.9	0	0	0	113.4	R87 N90 P91 G95	R87-L93 HydrophobicContact CG-CB 4.44Å; R87-L93 HydrophobicContact CG-CD1 4.18Å; N90-L93 HydrophobicContact CB-CB 4.12Å; N90-L93 HydrophobicContact CB-CD1 3.96Å; N90-L93 HydrophobicContact CB-CG 4.01Å; N90-L93 PolarHBondContact O-N 3.47Å; P91-L93 VanDerWaalsContact C-N 3.34Å; L93-G95 VanDerWaalsContact C-N 3.34Å
94	R	61.8	Low	59.6	Low	144 Å²	144	109.6 Å²	109.6	54%	0.543	60%	0.6	S	S	.	*	H	α-helix	trans	-69.3	-28.7	178.5	-85.1	-170.2	165.7	-177.9	-0.4	113.3	R87 H88 N90	R87-R94 WeakPolarHBondContact O-CG 3.24Å; H88-R94 PolarHBondContact CD2-NH2 3.34Å; H88-R94 VanDerWaalsContact CD2-NH2 3.28Å; H88-R94 PolarHBondContact CE1-NH2 2.92Å; H88-R94 PolarHBondContact ND1-NH2 3.02Å; H88-R94 PolarHBondContact NE2-NH2 3.22Å; H88-R94 PolarHBondContact O-NE 3.19Å; H88-R94 PolarHBondContact O-NH2 2.97Å; N90-R94 PolarHBondContact O-N 2.96Å; N90-R94 VanDerWaalsContact O-N 3.08Å
95	G	49.9	Very low	57.1	Low	49 Å²	49	111.3 Å²	111.3	51%	0.505	61%	0.609	S	S	.	*			trans	61.8	153.6	-174.9	0	0	0	0	0	112.8	L93 S97	L93-G95 VanDerWaalsContact C-N 3.34Å; G95-S97 PolarHBondContact O-N 3.41Å
96	N	43.2	Very low	54.6	Low	156 Å²	156	114.4 Å²	114.4	83%	0.834	64%	0.639	S	S	*	*			trans	-65.5	120.1	170	-118.8	-1.6	0	0	0	107.6	T98	N96-T98 PolarHBondContact O-N 3.22Å
97	S	45.6	Very low	52.1	Low	122 Å²	122	117.4 Å²	117.4	85%	0.853	66%	0.658	S	S	*	*			trans	-69.6	73.3	175.8	-48.2	0	0	0	0	110.2	G95 A99	G95-S97 PolarHBondContact O-N 3.41Å; S97-A99 PolarHBondContact O-N 3.11Å
98	T	37.9	Very low	49.5	Very low	121 Å²	121	119.4 Å²	119.4	74%	0.742	67%	0.672	S	S	*	*			trans	-79.2	112.7	164.8	42.6	0	0	0	0	108.3	N96 G100	N96-T98 PolarHBondContact O-N 3.22Å; T98-G100 PolarHBondContact O-N 2.89Å; T98-G100 VanDerWaalsContact O-N 3.17Å
99	A	42	Very low	47.3	Very low	111 Å²	111	118.7 Å²	118.7	92%	0.917	68%	0.675	S	S	*	*			trans	-49.4	114.4	173	0	0	0	0	0	111.1	S97	S97-A99 PolarHBondContact O-N 3.11Å
100	G	35.6	Very low	45.2	Very low	66 Å²	66	119.6 Å²	119.6	68%	0.68	69%	0.686	S	S	*	*	S	Bend	trans	168.7	98.2	175.6	0	0	0	0	0	112.4	T98	T98-G100 PolarHBondContact O-N 2.89Å; T98-G100 VanDerWaalsContact O-N 3.17Å
101	M	35.6	Very low	43.1	Very low	192 Å²	192	124.5 Å²	124.5	95%	0.946	71%	0.707	S	S	*	*			trans	56.7	74.7	165.9	-74.4	-176	164.2	0	0	116.9
102	I	35.6	Very low	41.8	Very low	134 Å²	134	123.5 Å²	123.5	69%	0.687	69%	0.694	S	S	*	*			trans	-93.3	98.8	146.6	-62.2	176.9	0	0	0	106.7	R104	I102-R104 PolarHBondContact O-N 3.44Å
103	T	31.3	Very low	40.3	Very low	129 Å²	129	124 Å²	124	79%	0.791	69%	0.693	S	S	*	*			trans	-50.7	131.3	158	15.6	0	0	0	0	108.7	L105	T103-L105 VanDerWaalsContact C-N 3.3Å; T103-L105 PolarHBondContact O-N 2.72Å
104	R	33.2	Very low	39.3	Very low	249 Å²	249	122.6 Å²	122.6	94%	0.94	69%	0.688	S	S	*	*	S	Bend	trans	-50.8	77.4	-175.8	-64.5	174.3	175.6	177.5	-2.9	114.1	I102	I102-R104 PolarHBondContact O-N 3.44Å
105	L	33.2	Very low	38.4	Very low	123 Å²	123	119.2 Å²	119.2	64%	0.644	69%	0.686	S	S	*	*			trans	-92.8	123.8	136.8	-100.5	83.9	0	0	0	105.5	T103 T107	T103-L105 VanDerWaalsContact C-N 3.3Å; T103-L105 PolarHBondContact O-N 2.72Å; L105-T107 PolarHBondContact O-N 3.08Å; L105-T107 PolarHBondContact O-OG1 2.84Å
106	S	35.1	Very low	38.5	Very low	119 Å²	119	123 Å²	123	83%	0.832	71%	0.705	S	S	*	*			trans	-50.6	89.9	173.8	-171.2	0	0	0	0	109.8
107	T	33.2	Very low	39.5	Very low	101 Å²	101	121 Å²	121	62%	0.62	69%	0.694	S	S	*	*			trans	-108.9	11.3	-177.4	34.4	0	0	0	0	110.9	L105	L105-T107 PolarHBondContact O-N 3.08Å; L105-T107 PolarHBondContact O-OG1 2.84Å
108	Q	29.1	Very low	40.7	Very low	146 Å²	146	117.5 Å²	117.5	68%	0.682	67%	0.669	S	S	*	*	S	Bend	trans	-72.2	125.9	151	-73	177.3	-31.8	0	0	106
109	P	38.9	Very low	42.1	Very low	66 Å²	66	112.8 Å²	112.8	43%	0.429	65%	0.645	S	S	.	*			trans	-49.2	138.8	156.3	7	-0.7	0	0	0	105.5	E111	P109-E111 PolarHBondContact O-N 3.42Å
110	P	39.7	Very low	43.4	Very low	79 Å²	79	112.1 Å²	112.1	51%	0.513	63%	0.632	S	S	.	*			trans	-45.8	122.7	169.1	22	-30.7	0	0	0	105.1	M112 W124	P110-M112 PolarHBondContact O-N 2.93Å; P110-W124 HydrophobicContact CG-CZ3 4.45Å
111	E	35.7	Very low	45	Very low	158 Å²	158	110.2 Å²	110.2	74%	0.738	61%	0.605	S	S	*	*			trans	-41.6	114.3	-179.9	-80.3	172.2	146.4	0	0	105.7	P109 E113	P109-E111 PolarHBondContact O-N 3.42Å; E111-E113 PolarHBondContact O-N 2.75Å
112	M	43.8	Very low	46.6	Very low	89 Å²	89	108 Å²	108	44%	0.438	59%	0.591	S	S	.	*			trans	-70.2	63.7	172.1	-83.4	-175.4	-151.8	0	0	106.3	W85 P110 V114 W124	W85-M112 HydrophobicContact CE3-CE 3.58Å; W85-M112 HydrophobicContact CE3-SD 4.3Å; W85-M112 HydrophobicContact CH2-CE 4.38Å; W85-M112 HydrophobicContact CH2-SD 4.03Å; W85-M112 HydrophobicContact CZ3-CE 3.32Å; W85-M112 HydrophobicContact CZ3-SD 3.45Å; W85-M112 WeakPolarHBondContact CZ3-SD 3.33Å; P110-M112 PolarHBondContact O-N 2.93Å; M112-V114 HydrophobicContact CB-CG2 3.98Å; M112-V114 HydrophobicContact CG-CG2 4.05Å; M112-V114 PolarHBondContact O-N 3.46Å; M112-W124 HydrophobicContact CE-CH2 4.34Å
113	E	39.1	Very low	48.2	Very low	164 Å²	164	104.9 Å²	104.9	77%	0.766	58%	0.58	S	S	*	*			trans	-66.9	61.6	140.8	-68.4	-166.2	159.5	0	0	106.5	E111 S115	E111-E113 PolarHBondContact O-N 2.75Å; E113-S115 PolarHBondContact O-N 3.12Å
114	V	46.1	Very low	50.3	Low	56 Å²	56	99.9 Å²	99.9	34%	0.339	55%	0.546	S	S	.	.			trans	-64.4	96.8	155.3	179.8	0	0	0	0	102.3	M112 S116 H146	M112-V114 HydrophobicContact CB-CG2 3.98Å; M112-V114 HydrophobicContact CG-CG2 4.05Å; M112-V114 PolarHBondContact O-N 3.46Å; V114-S116 PolarHBondContact O-N 3.47Å; V114-H146 HydrophobicContact CG1-CB 4.21Å; V114-H146 VanDerWaalsContact CG1-CD2 3.47Å; V114-H146 WeakPolarHBondContact CG1-CD2 3.29Å
115	S	43.5	Very low	52.3	Low	73 Å²	73	89.7 Å²	89.7	51%	0.51	51%	0.51	S	S	.	.			trans	-41.5	133.3	171.8	176.2	0	0	0	0	107.8	E113 D117	E113-S115 PolarHBondContact O-N 3.12Å; S115-D117 PolarHBondContact O-N 2.97Å; S115-D117 VanDerWaalsContact OG-CB 3.31Å; S115-D117 WeakPolarHBondContact OG-CB 3.34Å; S115-D117 PolarHBondContact OG-N 3.08Å; S115-D117 VanDerWaalsContact OG-N 3.16Å
116	S	51.6	Low	54.5	Low	130 Å²	130	88.8 Å²	88.8	91%	0.909	51%	0.512	S	S	*	.	S	Bend	trans	-59.6	-9.1	171.7	55	0	0	0	0	112.5	V114	V114-S116 PolarHBondContact O-N 3.47Å
117	D	63.7	Low	56.7	Low	113 Å²	113	88.4 Å²	88.4	60%	0.604	50%	0.497	S	S	*	.	S	Bend	trans	-85.6	117.9	172.3	-165	10.7	0	0	0	110.4	S115 G119	S115-D117 PolarHBondContact O-N 2.97Å; S115-D117 VanDerWaalsContact OG-CB 3.31Å; S115-D117 WeakPolarHBondContact OG-CB 3.34Å; S115-D117 PolarHBondContact OG-N 3.08Å; S115-D117 VanDerWaalsContact OG-N 3.16Å; D117-G119 PolarHBondContact O-N 3.27Å
118	C	70.5	Confident	59.2	Low	48 Å²	48	83.7 Å²	83.7	32%	0.324	47%	0.468	S	S	.	.			trans	-71.8	33.8	177	-66.1	0	0	0	0	113.4	C147 Y150	C118-C147 HydrophobicContact CB-CB 3.57Å; C118-C147 WeakPolarHBondContact CB-SG 3.42Å; C118-C147 WeakPolarHBondContact SG-CB 3.3Å; C118-C147 CovalentContact SG-SG 2.02Å; C118-C147 PolarHBondContact SG-SG 2.64Å; C118-Y150 HydrophobicContact CB-CE1 4.4Å
119	G	68.4	Low	61.8	Low	23 Å²	23	82.7 Å²	82.7	24%	0.237	47%	0.474	C	S	.	.	S	Bend	trans	-71.7	172.1	173.1	0	0	0	0	0	112.1	D117 D121 H146	D117-G119 PolarHBondContact O-N 3.27Å; G119-D121 PolarHBondContact O-N 3.02Å; G119-H146 PolarHBondContact O-CE1 3.41Å
120	P	68.9	Low	64.2	Low	97 Å²	97	81.5 Å²	81.5	63%	0.63	46%	0.464	S	S	*	.			trans	-64.2	108.3	178.6	25.1	-31.9	0	0	0	110.6	Q143	P120-Q143 HydrophobicContact CB-CB 4.41Å
121	D	68.8	Low	66.7	Low	25 Å²	25	78.7 Å²	78.7	13%	0.134	44%	0.444	C	S	.	.			trans	-84	131.6	176.2	-178	9.9	0	0	0	109.8	G119 C123 W124 Q143 H146	G119-D121 PolarHBondContact O-N 3.02Å; D121-C123 VanDerWaalsContact OD1-CB 3.25Å; D121-C123 WeakPolarHBondContact OD1-CB 3.37Å; D121-C123 PolarHBondContact OD1-N 3.35Å; D121-C123 PolarHBondContact OD1-SG 3.36Å; D121-W124 PolarHBondContact OD2-NE1 3.24Å; D121-Q143 PolarHBondContact N-O 3.14Å; D121-H146 WeakPolarHBondContact CB-CE1 3.49Å; D121-H146 VanDerWaalsContact CB-ND1 3.31Å; D121-H146 WeakPolarHBondContact CB-ND1 3.45Å; D121-H146 IonicContact OD2-CG 2.65Å; D121-H146 IonicContact OD2-ND1 3.85Å
122	K	68.5	Low	69.4	Low	147 Å²	147	77.6 Å²	77.6	64%	0.639	44%	0.443	S	S	*	.			trans	-104.6	-3.1	-179.4	-61.6	-172.8	-178	174.6	0	113.1	W124 L125 P126	K122-W124 PolarHBondContact O-N 3.42Å; K122-W124 VanDerWaalsContact O-N 3.08Å; K122-L125 HydrophobicContact CB-CD1 3.85Å; K122-L125 HydrophobicContact CB-CG 4.4Å; K122-L125 HydrophobicContact CD-CD1 4.37Å; K122-L125 HydrophobicContact CG-CD1 3.73Å; K122-L125 PolarHBondContact O-N 3.5Å; K122-L125 VanDerWaalsContact O-N 3.11Å; K122-P126 WeakPolarHBondContact O-CD 3.47Å
123	C	69.8	Low	71.7	Confident	68 Å²	68	78.8 Å²	78.8	46%	0.459	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-33	-175.2	-77.3	0	0	0	0	113.2	D121	D121-C123 VanDerWaalsContact OD1-CB 3.25Å; D121-C123 WeakPolarHBondContact OD1-CB 3.37Å; D121-C123 PolarHBondContact OD1-N 3.35Å; D121-C123 PolarHBondContact OD1-SG 3.36Å
124	W	74.6	Confident	74.3	Confident	23 Å²	23	71.2 Å²	71.2	9%	0.087	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-12.6	-175	-36.3	104.7	0	0	0	114	L77 L81 P110 M112 D121 K122 P126 H127 M145	L77-W124 HydrophobicContact CD1-CB 4.12Å; L77-W124 HydrophobicContact CD2-CB 4.27Å; L81-W124 HydrophobicContact CD1-CD2 4.18Å; L81-W124 HydrophobicContact CD1-CE3 4.16Å; L81-W124 HydrophobicContact CD1-CG 4.41Å; L81-W124 HydrophobicContact CD2-CD2 4.08Å; L81-W124 HydrophobicContact CD2-CE3 3.24Å; L81-W124 HydrophobicContact CD2-CH2 4.25Å; L81-W124 HydrophobicContact CD2-CZ3 3.34Å; L81-W124 HydrophobicContact CG-CE3 4.33Å; P110-W124 HydrophobicContact CG-CZ3 4.45Å; M112-W124 HydrophobicContact CE-CH2 4.34Å; D121-W124 PolarHBondContact OD2-NE1 3.24Å; K122-W124 PolarHBondContact O-N 3.42Å; K122-W124 VanDerWaalsContact O-N 3.08Å; W124-P126 VanDerWaalsContact C-CD 3.49Å; W124-H127 PolarHBondContact O-N 3.44Å; W124-H127 VanDerWaalsContact O-N 3.17Å; W124-M145 HydrophobicContact CG-CE 4.45Å
125	L	75.9	Confident	76.6	Confident	35 Å²	35	70.7 Å²	70.7	18%	0.183	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-63	-37.2	-174.2	-64.3	-179.7	0	0	0	114.7	K122 H127 L128 F131 V142	K122-L125 HydrophobicContact CB-CD1 3.85Å; K122-L125 HydrophobicContact CB-CG 4.4Å; K122-L125 HydrophobicContact CD-CD1 4.37Å; K122-L125 HydrophobicContact CG-CD1 3.73Å; K122-L125 PolarHBondContact O-N 3.5Å; K122-L125 VanDerWaalsContact O-N 3.11Å; L125-H127 PolarHBondContact O-N 3.11Å; L125-H127 VanDerWaalsContact O-N 3.13Å; L125-L128 PolarHBondContact O-N 2.72Å; L125-F131 HydrophobicContact CD2-CD1 4.02Å; L125-F131 HydrophobicContact CD2-CD2 3.54Å; L125-F131 HydrophobicContact CD2-CE1 3.98Å; L125-F131 HydrophobicContact CD2-CE2 3.45Å; L125-F131 VanDerWaalsContact CD2-CE2 3.45Å; L125-F131 HydrophobicContact CD2-CG 3.81Å; L125-F131 HydrophobicContact CD2-CZ 3.69Å; L125-V142 HydrophobicContact CD2-CG1 4.13Å
126	P	79.1	Confident	78.9	Confident	105 Å²	105	72.2 Å²	72.2	68%	0.682	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-60.2	-22.7	176.5	-24.9	35.7	0	0	0	113.7	K122 W124 L128	K122-P126 WeakPolarHBondContact O-CD 3.47Å; W124-P126 VanDerWaalsContact C-CD 3.49Å; P126-L128 VanDerWaalsContact C-N 3.33Å
127	H	81	Confident	80.8	Confident	111 Å²	111	70.2 Å²	70.2	51%	0.514	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-89.5	2.9	179	-62.1	-75.6	0	0	0	113.2	L77 W124 L125	L77-H127 HydrophobicContact CD1-CB 3.72Å; W124-H127 PolarHBondContact O-N 3.44Å; W124-H127 VanDerWaalsContact O-N 3.17Å; L125-H127 PolarHBondContact O-N 3.11Å; L125-H127 VanDerWaalsContact O-N 3.13Å
128	L	86.3	Confident	82.2	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	37%	0.365	C	S	.	.			trans	-126.5	79	179.5	-166.8	62.8	0	0	0	110.1	L77 L125 P126 D130 F131 L134 V142 S342	L77-L128 HydrophobicContact CB-CD1 4.28Å; L77-L128 HydrophobicContact CD2-CB 4.28Å; L77-L128 HydrophobicContact CD2-CD2 4.08Å; L125-L128 PolarHBondContact O-N 2.72Å; P126-L128 VanDerWaalsContact C-N 3.33Å; L128-D130 PolarHBondContact O-N 3.48Å; L128-F131 HydrophobicContact CB-CB 4.39Å; L128-F131 HydrophobicContact CD2-CB 4.25Å; L128-F131 HydrophobicContact CD2-CD2 3.95Å; L128-F131 HydrophobicContact CG-CB 4.19Å; L128-F131 VanDerWaalsContact O-CB 3.25Å; L128-F131 WeakPolarHBondContact O-CB 3.35Å; L128-F131 PolarHBondContact O-N 2.79Å; L128-L134 HydrophobicContact CD2-CD1 3.75Å; L128-L134 HydrophobicContact CG-CD1 4.23Å; L128-V142 HydrophobicContact CD2-CB 4.47Å; L128-V142 HydrophobicContact CD2-CG1 3.95Å; L128-V142 HydrophobicContact CD2-CG2 3.92Å; L128-S342 WeakPolarHBondContact CD1-O 3.41Å; L128-S342 VanDerWaalsContact CD1-OG 3.28Å; L128-S342 WeakPolarHBondContact CD1-OG 3.19Å
129	P	83.8	Confident	83.2	Confident	125 Å²	125	66.7 Å²	66.7	81%	0.812	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-26.6	-167.6	25.1	-34.8	0	0	0	113.8
130	D	90.3	Very high	84.3	Confident	40 Å²	40	67 Å²	67	21%	0.214	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	7.6	179.3	68.2	-32.6	0	0	0	113.5	L128 N132 T133 L134 S340 S342	L128-D130 PolarHBondContact O-N 3.48Å; D130-N132 VanDerWaalsContact C-N 3.27Å; D130-N132 PolarHBondContact O-N 3.04Å; D130-N132 VanDerWaalsContact O-N 3.08Å; D130-T133 PolarHBondContact O-N 3.04Å; D130-T133 PolarHBondContact O-OG1 3.35Å; D130-L134 PolarHBondContact O-N 3.37Å; D130-S340 PolarHBondContact OD2-OG 2.92Å; D130-S342 WeakPolarHBondContact OD1-CB 3.36Å; D130-S342 PolarHBondContact OD1-OG 2.81Å; D130-S342 PolarHBondContact OD2-OG 2.7Å
131	F	91.9	Very high	85.5	Confident	20 Å²	20	62.6 Å²	62.6	9%	0.088	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-46.5	-45.8	-173.6	174.4	-101.7	0	0	0	114.1	L125 L128 T133 L134 R139 V142 Q143	L125-F131 HydrophobicContact CD2-CD1 4.02Å; L125-F131 HydrophobicContact CD2-CD2 3.54Å; L125-F131 HydrophobicContact CD2-CE1 3.98Å; L125-F131 HydrophobicContact CD2-CE2 3.45Å; L125-F131 VanDerWaalsContact CD2-CE2 3.45Å; L125-F131 HydrophobicContact CD2-CG 3.81Å; L125-F131 HydrophobicContact CD2-CZ 3.69Å; L128-F131 HydrophobicContact CB-CB 4.39Å; L128-F131 HydrophobicContact CD2-CB 4.25Å; L128-F131 HydrophobicContact CD2-CD2 3.95Å; L128-F131 HydrophobicContact CG-CB 4.19Å; L128-F131 VanDerWaalsContact O-CB 3.25Å; L128-F131 WeakPolarHBondContact O-CB 3.35Å; L128-F131 PolarHBondContact O-N 2.79Å; F131-T133 PolarHBondContact O-N 3.26Å; F131-L134 WeakPolarHBondContact O-CB 3.47Å; F131-L134 PolarHBondContact O-N 3.05Å; F131-L134 VanDerWaalsContact O-N 3.14Å; F131-R139 HydrophobicContact CD2-CG 4.1Å; F131-R139 HydrophobicContact CE1-CG 4.35Å; F131-R139 HydrophobicContact CE2-CB 3.72Å; F131-R139 HydrophobicContact CE2-CG 3.78Å; F131-R139 HydrophobicContact CZ-CB 3.72Å; F131-R139 HydrophobicContact CZ-CG 3.9Å; F131-R139 WeakPolarHBondContact O-CD 3.5Å; F131-R139 WeakPolarHBondContact O-CG 3.35Å; F131-V142 HydrophobicContact CD2-CG1 4.44Å; F131-V142 HydrophobicContact CE2-CB 4.27Å; F131-V142 HydrophobicContact CE2-CG1 4.29Å; F131-Q143 HydrophobicContact CE2-CG 4.28Å; F131-Q143 HydrophobicContact CZ-CG 3.91Å
132	N	91.9	Very high	86.6	Confident	135 Å²	135	61.4 Å²	61.4	72%	0.722	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-67.6	-17.7	-177.8	-69.2	-37.4	0	0	0	114	D130	D130-N132 VanDerWaalsContact C-N 3.27Å; D130-N132 PolarHBondContact O-N 3.04Å; D130-N132 VanDerWaalsContact O-N 3.08Å
133	T	92.4	Very high	87.6	Confident	114 Å²	114	57.3 Å²	57.3	70%	0.699	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-93.4	-10.6	177.6	70.1	0	0	0	0	112.8	D130 F131	D130-T133 PolarHBondContact O-N 3.04Å; D130-T133 PolarHBondContact O-OG1 3.35Å; F131-T133 PolarHBondContact O-N 3.26Å
134	L	93.8	Very high	88.6	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	30%	0.3	C	S	.	.	S	Bend	trans	-71.5	149.1	-179.6	-62.1	178.5	0	0	0	111.8	L128 D130 F131 M138 R139 Y338	L128-L134 HydrophobicContact CD2-CD1 3.75Å; L128-L134 HydrophobicContact CG-CD1 4.23Å; D130-L134 PolarHBondContact O-N 3.37Å; F131-L134 WeakPolarHBondContact O-CB 3.47Å; F131-L134 PolarHBondContact O-N 3.05Å; F131-L134 VanDerWaalsContact O-N 3.14Å; L134-M138 HydrophobicContact CB-CB 4.21Å; L134-M138 HydrophobicContact CB-CG 4.31Å; L134-M138 HydrophobicContact CD1-CG 3.93Å; L134-R139 HydrophobicContact CB-CG 3.91Å; L134-R139 WeakPolarHBondContact O-CD 3.38Å; L134-R139 PolarHBondContact O-NE 2.93Å; L134-R139 VanDerWaalsContact O-NE 3.13Å; L134-Y338 HydrophobicContact CD2-CE1 4.45Å
135	P	93.6	Very high	89.4	Confident	44 Å²	44	54.6 Å²	54.6	29%	0.286	30%	0.298	S	S	.	.			trans	-53	149.1	171.3	-25.7	35.5	0	0	0	112.1	Q137 M138 R139 P333 Y338	P135-Q137 VanDerWaalsContact C-N 3.29Å; P135-Q137 PolarHBondContact O-N 2.79Å; P135-M138 WeakPolarHBondContact O-CB 3.43Å; P135-M138 PolarHBondContact O-N 3.28Å; P135-R139 PolarHBondContact O-N 3.33Å; P135-P333 HydrophobicContact CG-CB 4.28Å; P135-Y338 HydrophobicContact CG-CD1 3.79Å; P135-Y338 HydrophobicContact CG-CE1 3.81Å
136	E	91.5	Very high	90	Very high	106 Å²	106	54.3 Å²	54.3	50%	0.495	30%	0.295	S	S	.	.	H	α-helix	trans	-52.8	-43.9	-176.8	-173.7	-172.7	161.5	0	0	113.2	M138 R139 A140	E136-M138 VanDerWaalsContact C-N 3.29Å; E136-M138 PolarHBondContact O-N 3.17Å; E136-R139 PolarHBondContact O-N 2.64Å; E136-A140 WeakPolarHBondContact O-CB 3.37Å; E136-A140 PolarHBondContact O-N 3.23Å
137	Q	91.3	Very high	90.5	Very high	88 Å²	88	49.6 Å²	49.6	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-41.1	179.1	-67.5	179	-10.9	0	0	112.1	P135 F141 F254	P135-Q137 VanDerWaalsContact C-N 3.29Å; P135-Q137 PolarHBondContact O-N 2.79Å; Q137-F141 WeakPolarHBondContact O-CB 3.39Å; Q137-F141 PolarHBondContact O-N 3.44Å; Q137-F254 HydrophobicContact CB-CD2 3.97Å; Q137-F254 HydrophobicContact CB-CE2 4.03Å; Q137-F254 WeakPolarHBondContact O-CD2 3.43Å
138	M	93.5	Very high	91	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68.4	-42.7	178	-167.5	68.5	163.3	0	0	111.4	L134 P135 E136 F141 V142 F254 I339 F343 P378	L134-M138 HydrophobicContact CB-CB 4.21Å; L134-M138 HydrophobicContact CB-CG 4.31Å; L134-M138 HydrophobicContact CD1-CG 3.93Å; P135-M138 WeakPolarHBondContact O-CB 3.43Å; P135-M138 PolarHBondContact O-N 3.28Å; E136-M138 VanDerWaalsContact C-N 3.29Å; E136-M138 PolarHBondContact O-N 3.17Å; M138-F141 PolarHBondContact O-N 2.9Å; M138-V142 WeakPolarHBondContact O-CG2 3.46Å; M138-V142 PolarHBondContact O-N 2.81Å; M138-F254 HydrophobicContact CB-CE2 4.07Å; M138-F254 HydrophobicContact SD-CD2 4.47Å; M138-F254 HydrophobicContact SD-CE2 3.76Å; M138-F254 HydrophobicContact SD-CZ 4.48Å; M138-I339 HydrophobicContact CE-CG2 4.47Å; M138-F343 HydrophobicContact CE-CB 3.25Å; M138-F343 HydrophobicContact CE-CD1 3.38Å; M138-F343 HydrophobicContact CE-CD2 3.77Å; M138-F343 HydrophobicContact CE-CE1 4.13Å; M138-F343 HydrophobicContact CE-CE2 4.47Å; M138-F343 HydrophobicContact CE-CG 3.15Å; M138-P378 HydrophobicContact SD-CG 4.33Å
139	R	92.4	Very high	91.3	Very high	86 Å²	86	52.5 Å²	52.5	33%	0.325	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-47.2	176.1	-68.7	-172.6	-70.7	149.2	3.5	111.2	F131 L134 P135 E136 F141 V142 Q143	F131-R139 HydrophobicContact CD2-CG 4.1Å; F131-R139 HydrophobicContact CE1-CG 4.35Å; F131-R139 HydrophobicContact CE2-CB 3.72Å; F131-R139 HydrophobicContact CE2-CG 3.78Å; F131-R139 HydrophobicContact CZ-CB 3.72Å; F131-R139 HydrophobicContact CZ-CG 3.9Å; F131-R139 WeakPolarHBondContact O-CD 3.5Å; F131-R139 WeakPolarHBondContact O-CG 3.35Å; L134-R139 HydrophobicContact CB-CG 3.91Å; L134-R139 WeakPolarHBondContact O-CD 3.38Å; L134-R139 PolarHBondContact O-NE 2.93Å; L134-R139 VanDerWaalsContact O-NE 3.13Å; P135-R139 PolarHBondContact O-N 3.33Å; E136-R139 PolarHBondContact O-N 2.64Å; R139-F141 VanDerWaalsContact C-N 3.35Å; R139-F141 PolarHBondContact O-N 3.35Å; R139-V142 PolarHBondContact O-N 3.22Å; R139-Q143 VanDerWaalsContact O-CG 3.27Å; R139-Q143 WeakPolarHBondContact O-CG 3.38Å; R139-Q143 PolarHBondContact O-N 3.42Å; R139-Q143 VanDerWaalsContact O-N 3.11Å; R139-Q143 PolarHBondContact O-OE1 3.41Å
140	A	91.1	Very high	91.7	Very high	29 Å²	29	48.2 Å²	48.2	24%	0.24	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-41.5	178	0	0	0	0	0	112.2	E136 Q143 S144	E136-A140 WeakPolarHBondContact O-CB 3.37Å; E136-A140 PolarHBondContact O-N 3.23Å; A140-Q143 PolarHBondContact O-N 3.45Å; A140-S144 PolarHBondContact O-N 3.34Å; A140-S144 PolarHBondContact O-OG 3.41Å
141	F	93.2	Very high	92	Very high	5 Å²	5	50.2 Å²	50.2	2%	0.022	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-52.3	175.2	179	-89.8	0	0	0	111.7	Q137 M138 R139 Q143 S144 M145 F254 F343 L376 P378	Q137-F141 WeakPolarHBondContact O-CB 3.39Å; Q137-F141 PolarHBondContact O-N 3.44Å; M138-F141 PolarHBondContact O-N 2.9Å; R139-F141 VanDerWaalsContact C-N 3.35Å; R139-F141 PolarHBondContact O-N 3.35Å; F141-Q143 PolarHBondContact O-N 2.86Å; F141-S144 CarbonylContact O-C 3.57Å; F141-S144 PolarHBondContact O-N 3.22Å; F141-S144 PolarHBondContact O-OG 2.97Å; F141-M145 HydrophobicContact CD1-CB 4.04Å; F141-M145 HydrophobicContact CD1-SD 4.26Å; F141-M145 HydrophobicContact CE1-CB 3.56Å; F141-M145 HydrophobicContact CE1-CG 4.22Å; F141-M145 HydrophobicContact CE1-SD 3.73Å; F141-M145 HydrophobicContact CE2-CB 4.25Å; F141-M145 HydrophobicContact CZ-CB 3.69Å; F141-M145 WeakPolarHBondContact O-CB 3.35Å; F141-M145 PolarHBondContact O-N 2.76Å; F141-F254 HydrophobicContact CB-CB 4.13Å; F141-F254 HydrophobicContact CB-CD2 3.93Å; F141-F254 HydrophobicContact CD2-CB 3.86Å; F141-F254 WeakPolarHBondContact CD2-O 3.48Å; F141-F254 WeakPolarHBondContact CE2-O 3.46Å; F141-F254 HydrophobicContact CG-CB 4.27Å; F141-F254 HydrophobicContact CG-CD2 4.46Å; F141-F343 HydrophobicContact CD1-CE2 4.41Å; F141-F343 HydrophobicContact CD1-CZ 4.23Å; F141-F343 HydrophobicContact CE1-CE2 4.23Å; F141-F343 AromaticContact CE1-CZ 3.74Å; F141-F343 HydrophobicContact CE1-CZ 3.74Å; F141-L376 HydrophobicContact CE2-CB 4.46Å; F141-L376 HydrophobicContact CZ-CB 4.02Å; F141-P378 HydrophobicContact CD1-CB 4.44Å; F141-P378 HydrophobicContact CD1-CG 3.68Å; F141-P378 HydrophobicContact CD2-CB 4.36Å; F141-P378 HydrophobicContact CD2-CG 4.4Å; F141-P378 HydrophobicContact CE1-CB 4.48Å; F141-P378 HydrophobicContact CE1-CG 3.59Å; F141-P378 HydrophobicContact CE2-CB 4.37Å; F141-P378 HydrophobicContact CE2-CG 4.3Å; F141-P378 HydrophobicContact CG-CB 4.38Å; F141-P378 HydrophobicContact CG-CG 4.09Å; F141-P378 HydrophobicContact CZ-CB 4.43Å; F141-P378 HydrophobicContact CZ-CG 3.91Å
142	V	92.6	Very high	92.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-57.3	-37.2	-179	170.5	0	0	0	0	111.8	L77 L125 L128 F131 M138 R139 S144 F343	L77-V142 HydrophobicContact CD2-CG1 4.1Å; L125-V142 HydrophobicContact CD2-CG1 4.13Å; L128-V142 HydrophobicContact CD2-CB 4.47Å; L128-V142 HydrophobicContact CD2-CG1 3.95Å; L128-V142 HydrophobicContact CD2-CG2 3.92Å; F131-V142 HydrophobicContact CD2-CG1 4.44Å; F131-V142 HydrophobicContact CE2-CB 4.27Å; F131-V142 HydrophobicContact CE2-CG1 4.29Å; M138-V142 WeakPolarHBondContact O-CG2 3.46Å; M138-V142 PolarHBondContact O-N 2.81Å; R139-V142 PolarHBondContact O-N 3.22Å; V142-S144 VanDerWaalsContact C-N 3.29Å; V142-S144 PolarHBondContact O-N 2.63Å; V142-F343 HydrophobicContact CG2-CD2 3.84Å; V142-F343 HydrophobicContact CG2-CE2 3.89Å
143	Q	90.3	Very high	92.4	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-69.7	-22.1	178.1	-72.2	174	-37.6	0	0	114.1	P120 D121 F131 R139 A140 F141 H146	P120-Q143 HydrophobicContact CB-CB 4.41Å; D121-Q143 PolarHBondContact N-O 3.14Å; F131-Q143 HydrophobicContact CE2-CG 4.28Å; F131-Q143 HydrophobicContact CZ-CG 3.91Å; R139-Q143 VanDerWaalsContact O-CG 3.27Å; R139-Q143 WeakPolarHBondContact O-CG 3.38Å; R139-Q143 PolarHBondContact O-N 3.42Å; R139-Q143 VanDerWaalsContact O-N 3.11Å; R139-Q143 PolarHBondContact O-OE1 3.41Å; A140-Q143 PolarHBondContact O-N 3.45Å; F141-Q143 PolarHBondContact O-N 2.86Å; Q143-H146 PolarHBondContact O-CE1 2.76Å; Q143-H146 VanDerWaalsContact O-CE1 3.28Å; Q143-H146 PolarHBondContact O-ND1 3.08Å
144	S	90.1	Very high	92.6	Very high	27 Å²	27	46.2 Å²	46.2	19%	0.189	24%	0.238	C	C	.	.	H	α-helix	trans	-121.6	-8	-171.5	58.1	0	0	0	0	114.7	A140 F141 V142 H146 C147	A140-S144 PolarHBondContact O-N 3.34Å; A140-S144 PolarHBondContact O-OG 3.41Å; F141-S144 CarbonylContact O-C 3.57Å; F141-S144 PolarHBondContact O-N 3.22Å; F141-S144 PolarHBondContact O-OG 2.97Å; V142-S144 VanDerWaalsContact C-N 3.29Å; V142-S144 PolarHBondContact O-N 2.63Å; S144-H146 PolarHBondContact O-N 3.35Å; S144-C147 PolarHBondContact O-N 2.84Å
145	M	91.2	Very high	92.8	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.039	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-11.1	-174.6	69.2	177.2	-167.5	0	0	115.2	L77 L81 W124 F141 F343 L376	L77-M145 HydrophobicContact CD2-CE 4.24Å; L81-M145 HydrophobicContact CD1-CE 3.41Å; L81-M145 VanDerWaalsContact CD1-CE 3.41Å; W124-M145 HydrophobicContact CG-CE 4.45Å; F141-M145 HydrophobicContact CD1-CB 4.04Å; F141-M145 HydrophobicContact CD1-SD 4.26Å; F141-M145 HydrophobicContact CE1-CB 3.56Å; F141-M145 HydrophobicContact CE1-CG 4.22Å; F141-M145 HydrophobicContact CE1-SD 3.73Å; F141-M145 HydrophobicContact CE2-CB 4.25Å; F141-M145 HydrophobicContact CZ-CB 3.69Å; F141-M145 WeakPolarHBondContact O-CB 3.35Å; F141-M145 PolarHBondContact O-N 2.76Å; M145-F343 HydrophobicContact SD-CE2 3.93Å; M145-F343 HydrophobicContact SD-CZ 4.32Å; M145-L376 HydrophobicContact CB-CB 4.43Å; M145-L376 WeakPolarHBondContact O-CD1 3.46Å
146	H	88.5	Confident	92.9	Very high	28 Å²	28	48 Å²	48	13%	0.13	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-30.4	172.5	66.3	-83.3	0	0	0	111.9	V114 G119 D121 Q143 S144	V114-H146 HydrophobicContact CG1-CB 4.21Å; V114-H146 VanDerWaalsContact CG1-CD2 3.47Å; V114-H146 WeakPolarHBondContact CG1-CD2 3.29Å; G119-H146 PolarHBondContact O-CE1 3.41Å; D121-H146 WeakPolarHBondContact CB-CE1 3.49Å; D121-H146 VanDerWaalsContact CB-ND1 3.31Å; D121-H146 WeakPolarHBondContact CB-ND1 3.45Å; D121-H146 IonicContact OD2-CG 2.65Å; D121-H146 IonicContact OD2-ND1 3.85Å; Q143-H146 PolarHBondContact O-CE1 2.76Å; Q143-H146 VanDerWaalsContact O-CE1 3.28Å; Q143-H146 PolarHBondContact O-ND1 3.08Å; S144-H146 PolarHBondContact O-N 3.35Å
147	C	90.6	Very high	92.9	Very high	6 Å²	6	45.7 Å²	45.7	4%	0.041	24%	0.238	C	C	.	.			trans	-81.1	126.6	-176.8	175.3	0	0	0	0	111	C118 S144 Y150	C118-C147 HydrophobicContact CB-CB 3.57Å; C118-C147 WeakPolarHBondContact CB-SG 3.42Å; C118-C147 WeakPolarHBondContact SG-CB 3.3Å; C118-C147 CovalentContact SG-SG 2.02Å; C118-C147 PolarHBondContact SG-SG 2.64Å; S144-C147 PolarHBondContact O-N 2.84Å; C147-Y150 HydrophobicContact CB-CE2 4.21Å; C147-Y150 WeakPolarHBondContact SG-CE2 3.4Å; C147-Y150 PolarHBondContact SG-OH 3.08Å; C147-Y150 VanDerWaalsContact SG-OH 3.34Å
148	R	91.8	Very high	92.8	Very high	53 Å²	53	51.8 Å²	51.8	20%	0.2	26%	0.257	C	S	.	.			trans	-124.9	-7.6	-176.6	-63.3	173.4	178.4	-123.9	5.4	113.3	L261 S371 V374 L376	R148-L261 HydrophobicContact CB-CD1 4.42Å; R148-L261 HydrophobicContact CB-CD2 4.31Å; R148-L261 HydrophobicContact CG-CD1 4.31Å; R148-S371 PolarHBondContact NH1-O 3.36Å; R148-V374 PolarHBondContact NH1-O 3.04Å; R148-V374 PolarHBondContact NH2-O 2.73Å; R148-L376 HydrophobicContact CG-CD1 4.28Å; R148-L376 HydrophobicContact CG-CG 4.49Å
149	V	90.8	Very high	92.7	Very high	121 Å²	121	52.7 Å²	52.7	73%	0.733	26%	0.263	S	S	*	.			trans	-117.2	118.8	-173.5	-176.9	0	0	0	0	108.1
150	Y	93.9	Very high	92.6	Very high	36 Å²	36	48.9 Å²	48.9	14%	0.141	25%	0.25	C	C	.	.			trans	-132	138.8	175	-71	-92	0	0	0	108.8	C118 C147 D248 F249 L258 L262	C118-Y150 HydrophobicContact CB-CE1 4.4Å; C147-Y150 HydrophobicContact CB-CE2 4.21Å; C147-Y150 WeakPolarHBondContact SG-CE2 3.4Å; C147-Y150 PolarHBondContact SG-OH 3.08Å; C147-Y150 VanDerWaalsContact SG-OH 3.34Å; Y150-D248 WeakPolarHBondContact CD1-O 3.46Å; Y150-F249 HydrophobicContact CD1-CB 3.64Å; Y150-F249 HydrophobicContact CD2-CB 3.99Å; Y150-F249 HydrophobicContact CE1-CB 3.74Å; Y150-F249 HydrophobicContact CE2-CB 4.08Å; Y150-F249 HydrophobicContact CG-CB 3.76Å; Y150-L258 HydrophobicContact CD2-CD1 3.9Å; Y150-L258 HydrophobicContact CD2-CD2 3.69Å; Y150-L258 HydrophobicContact CD2-CG 4.22Å; Y150-L258 HydrophobicContact CE2-CD1 3.81Å; Y150-L258 HydrophobicContact CE2-CD2 3.23Å; Y150-L258 HydrophobicContact CE2-CG 4.08Å; Y150-L262 HydrophobicContact CD2-CD1 4.3Å
151	P	95.1	Very high	92.1	Very high	82 Å²	82	50.1 Å²	50.1	53%	0.532	26%	0.26	S	S	.	.			trans	-68.3	156.1	177.5	29	-34.1	0	0	0	111.1	W247 D248	P151-W247 WeakPolarHBondContact O-CA 3.05Å; P151-D248 HydrophobicContact CG-CB 3.82Å; P151-D248 PolarHBondContact O-N 3.03Å
152	F	96.1	Very high	90.9	Very high	71 Å²	71	50.8 Å²	50.8	31%	0.311	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	134.2	169.6	-72.6	-84.7	0	0	0	110.3	N155 Q246 W247 W266	F152-N155 HydrophobicContact CB-CB 4.14Å; F152-N155 HydrophobicContact CD1-CB 3.84Å; F152-N155 HydrophobicContact CE1-CB 4.35Å; F152-N155 HydrophobicContact CG-CB 3.93Å; F152-Q246 CarbonylContact C-O 3.59Å; F152-Q246 WeakPolarHBondContact CA-O 3.39Å; F152-W247 AromaticContact CD1-CD1 3.89Å; F152-W247 HydrophobicContact CD1-CD2 4.25Å; F152-W247 AromaticContact CD1-CE2 3.74Å; F152-W247 HydrophobicContact CD1-CG 4.36Å; F152-W247 HydrophobicContact CD1-CZ2 4.23Å; F152-W247 AromaticContact CD1-NE1 3.48Å; F152-W247 AromaticContact CE1-CD1 3.96Å; F152-W247 HydrophobicContact CE1-CD2 4.08Å; F152-W247 AromaticContact CE1-CE2 3.16Å; F152-W247 HydrophobicContact CE1-CH2 4.22Å; F152-W247 AromaticContact CE1-CZ2 3.28Å; F152-W247 HydrophobicContact CE1-CZ2 3.28Å; F152-W247 AromaticContact CE1-NE1 3.08Å; F152-W247 AromaticContact CE2-NE1 3.79Å; F152-W247 AromaticContact CZ-CE2 3.65Å; F152-W247 AromaticContact CZ-CZ2 3.72Å; F152-W247 HydrophobicContact CZ-CZ2 3.72Å; F152-W247 AromaticContact CZ-NE1 3.22Å; F152-W266 AromaticContact CE1-CD1 3.69Å; F152-W266 HydrophobicContact CE1-CG 4.43Å; F152-W266 HydrophobicContact CZ-CB 4.07Å; F152-W266 AromaticContact CZ-CD1 3.56Å; F152-W266 HydrophobicContact CZ-CG 4.21Å
153	L	96.8	Very high	89.6	Confident	83 Å²	83	56.3 Å²	56.3	44%	0.435	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-36.8	161.3	-61.1	178.9	0	0	0	110.4	R219 Q246 D248	L153-R219 HydrophobicContact CD1-CG 3.79Å; L153-Q246 HydrophobicContact CB-CB 4.25Å; L153-Q246 HydrophobicContact CB-CG 4.13Å; L153-Q246 HydrophobicContact CD1-CG 4.16Å; L153-Q246 PolarHBondContact N-O 2.91Å; L153-D248 HydrophobicContact CD1-CB 4.28Å; L153-D248 HydrophobicContact CD2-CB 3.95Å; L153-D248 HydrophobicContact CG-CB 3.99Å
154	M	97.3	Very high	88.2	Confident	31 Å²	31	63.6 Å²	63.6	15%	0.153	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	130.6	174.7	-58.4	-175.3	-169	0	0	109.3	L234 M235 S238 I244 Q246	M154-L234 HydrophobicContact CE-CB 4.35Å; M154-L234 HydrophobicContact CE-CD2 4.1Å; M154-L234 HydrophobicContact CE-CG 4.12Å; M154-L234 HydrophobicContact SD-CD2 4.43Å; M154-L234 HydrophobicContact SD-CG 4.3Å; M154-M235 HydrophobicContact CE-CB 3.99Å; M154-S238 VanDerWaalsContact SD-CB 3.53Å; M154-I244 HydrophobicContact SD-CG2 4.35Å; M154-Q246 HydrophobicContact CB-CB 4Å; M154-Q246 HydrophobicContact CG-CB 4.29Å; M154-Q246 PolarHBondContact N-O 2.65Å; M154-Q246 VanDerWaalsContact N-O 3.14Å; M154-Q246 PolarHBondContact O-N 2.9Å
155	N	96.9	Very high	86.7	Confident	51 Å²	51	67.4 Å²	67.4	27%	0.273	36%	0.359	S	S	.	.			trans	-131.5	147.9	179.4	-172.6	13.5	0	0	0	110.4	F152 P157 W266 H270	F152-N155 HydrophobicContact CB-CB 4.14Å; F152-N155 HydrophobicContact CD1-CB 3.84Å; F152-N155 HydrophobicContact CE1-CB 4.35Å; F152-N155 HydrophobicContact CG-CB 3.93Å; N155-P157 WeakPolarHBondContact O-CD 3.41Å; N155-W266 PolarHBondContact OD1-NE1 2.63Å; N155-H270 PolarHBondContact ND2-NE2 3.23Å
156	Q	95.8	Very high	85.4	Confident	35 Å²	35	72.1 Å²	72.1	16%	0.164	39%	0.388	C	S	.	.			trans	-125.5	67	-179.3	-55.4	-64.6	-10.3	0	0	111	R158 V159 S238 G242 I244 L245 W266	Q156-R158 PolarHBondContact O-N 3.07Å; Q156-V159 HydrophobicContact CB-CG2 3.56Å; Q156-V159 WeakPolarHBondContact O-CG2 3.19Å; Q156-V159 PolarHBondContact O-N 3.33Å; Q156-S238 PolarHBondContact NE2-OG 3.46Å; Q156-G242 WeakPolarHBondContact CB-O 3.33Å; Q156-G242 VanDerWaalsContact CD-C 3.41Å; Q156-G242 VanDerWaalsContact CG-O 3.27Å; Q156-G242 WeakPolarHBondContact CG-O 3.17Å; Q156-G242 PolarHBondContact OE1-O 2.99Å; Q156-I244 VanDerWaalsContact CG-O 3.27Å; Q156-I244 WeakPolarHBondContact CG-O 3.34Å; Q156-L245 HydrophobicContact CB-CD2 3.9Å; Q156-L245 HydrophobicContact CG-CD2 4.07Å; Q156-W266 WeakPolarHBondContact O-CZ2 3.46Å
157	P	92.4	Very high	84.2	Confident	59 Å²	59	72.3 Å²	72.3	38%	0.383	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.6	-173.9	28.1	-36.6	0	0	0	113.7	N155	N155-P157 WeakPolarHBondContact O-CD 3.41Å
158	R	89.6	Confident	83.1	Confident	215 Å²	215	76.5 Å²	76.5	81%	0.811	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-2	-177.2	-63.3	-174.4	-176.4	162.7	0.3	114.9	Q156 C160 A161	Q156-R158 PolarHBondContact O-N 3.07Å; R158-C160 PolarHBondContact O-N 3.26Å; R158-C160 VanDerWaalsContact O-N 3.16Å; R158-A161 HydrophobicContact CB-CB 4.44Å; R158-A161 PolarHBondContact O-N 3.08Å
159	V	91.3	Very high	82.5	Confident	20 Å²	20	77.9 Å²	77.9	12%	0.121	43%	0.433	C	S	.	.	S	Bend	trans	-55.4	-37.8	-177.6	170.7	0	0	0	0	112.7	Q156 L174 R212 V214 W266	Q156-V159 HydrophobicContact CB-CG2 3.56Å; Q156-V159 WeakPolarHBondContact O-CG2 3.19Å; Q156-V159 PolarHBondContact O-N 3.33Å; V159-L174 HydrophobicContact CG1-CD1 4.45Å; V159-R212 HydrophobicContact CG1-CB 3.99Å; V159-R212 HydrophobicContact CG1-CG 4.38Å; V159-V214 HydrophobicContact CB-CG1 4.35Å; V159-V214 HydrophobicContact CG1-CG1 3.83Å; V159-V214 HydrophobicContact CG2-CG1 3.85Å; V159-W266 HydrophobicContact CB-CH2 4.05Å; V159-W266 HydrophobicContact CB-CZ2 4.23Å; V159-W266 HydrophobicContact CG1-CH2 4.26Å; V159-W266 HydrophobicContact CG2-CH2 4.44Å; V159-W266 HydrophobicContact CG2-CZ2 4.34Å
160	C	90	Very high	82.3	Confident	6 Å²	6	76.3 Å²	76.3	4%	0.041	42%	0.42	C	S	.	.	S	Bend	trans	-116.6	2.6	176.9	-54.8	0	0	0	0	113.1	R158 G162 C271	R158-C160 PolarHBondContact O-N 3.26Å; R158-C160 VanDerWaalsContact O-N 3.16Å; C160-G162 PolarHBondContact O-N 2.88Å; C160-C271 HydrophobicContact CB-CB 3.59Å; C160-C271 WeakPolarHBondContact CB-SG 3.49Å; C160-C271 WeakPolarHBondContact SG-CB 3.3Å; C160-C271 CovalentContact SG-SG 2.02Å; C160-C271 PolarHBondContact SG-SG 2.93Å
161	A	79.4	Confident	82.3	Confident	55 Å²	55	74.6 Å²	74.6	46%	0.455	41%	0.413	S	S	.	.			trans	-79.8	104.8	168.1	0	0	0	0	0	106.5	R158	R158-A161 HydrophobicContact CB-CB 4.44Å; R158-A161 PolarHBondContact O-N 3.08Å
162	G	68.1	Low	82.3	Confident	19 Å²	19	71.2 Å²	71.2	20%	0.196	39%	0.391	C	S	.	.			trans	-66.4	-177.9	173.3	0	0	0	0	0	111.3	C160 G167	C160-G162 PolarHBondContact O-N 2.88Å; G162-G167 VanDerWaalsContact CA-O 3.27Å; G162-G167 WeakPolarHBondContact CA-O 3.48Å
163	N	65.3	Low	82.4	Confident	116 Å²	116	67.8 Å²	67.8	62%	0.62	38%	0.376	S	S	*	.			trans	-69.8	148.1	179.4	-66.1	-18.1	0	0	0	111	S165 T166 G167	N163-S165 PolarHBondContact O-N 3.39Å; N163-T166 PolarHBondContact O-N 2.9Å; N163-T166 PolarHBondContact O-OG1 2.79Å; N163-G167 PolarHBondContact O-N 2.88Å; N163-G167 VanDerWaalsContact O-N 3.09Å
164	E	60.4	Low	82.5	Confident	213 Å²	213	63.9 Å²	63.9	100%	0.995	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.6	177.9	-66.6	-176.5	172.3	0	0	112.9
165	S	59.9	Low	82.6	Confident	108 Å²	108	62.4 Å²	62.4	76%	0.755	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-22.4	179.6	53.6	0	0	0	0	115.4	N163	N163-S165 PolarHBondContact O-N 3.39Å
166	T	63.8	Low	82.7	Confident	106 Å²	106	60 Å²	60	65%	0.65	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-5.1	-172.8	54	0	0	0	0	113.9	N163	N163-T166 PolarHBondContact O-N 2.9Å; N163-T166 PolarHBondContact O-OG1 2.79Å
167	G	63.2	Low	82.8	Confident	32 Å²	32	58.3 Å²	58.3	33%	0.33	33%	0.327	S	S	.	.			trans	76.6	179.6	-174.5	0	0	0	0	0	112.8	G162 N163 E169	G162-G167 VanDerWaalsContact CA-O 3.27Å; G162-G167 WeakPolarHBondContact CA-O 3.48Å; N163-G167 PolarHBondContact O-N 2.88Å; N163-G167 VanDerWaalsContact O-N 3.09Å; G167-E169 PolarHBondContact O-N 2.55Å
168	P	68.2	Low	83.1	Confident	94 Å²	94	56 Å²	56	61%	0.61	31%	0.311	S	S	*	.			trans	-62.8	129.3	-176.5	24.2	-31.9	0	0	0	111.8	L170	P168-L170 HydrophobicContact CB-CD2 4.16Å; P168-L170 PolarHBondContact O-N 3.48Å
169	E	77.7	Confident	83.5	Confident	83 Å²	83	45.9 Å²	45.9	39%	0.388	27%	0.273	S	S	.	.			trans	-88	86.9	179.4	-146.1	-164.5	163.9	0	0	109	G167 P171 L210 R212	G167-E169 PolarHBondContact O-N 2.55Å; E169-P171 VanDerWaalsContact O-CD 3.28Å; E169-P171 WeakPolarHBondContact O-CD 3.3Å; E169-L210 HydrophobicContact CB-CD2 4.15Å; E169-L210 VanDerWaalsContact CD-CD2 3.45Å; E169-L210 HydrophobicContact CG-CD2 3.43Å; E169-L210 VanDerWaalsContact CG-CD2 3.43Å; E169-L210 WeakPolarHBondContact OE1-CD1 3.38Å; E169-L210 VanDerWaalsContact OE1-CD2 3.29Å; E169-L210 WeakPolarHBondContact OE1-CD2 3.31Å; E169-R212 IonicContact OE1-NH2 3.76Å; E169-R212 IonicContact OE2-CZ 3.5Å; E169-R212 IonicContact OE2-NH2 2.74Å; E169-R212 PolarHBondContact OE2-NH2 3.32Å
170	L	87.4	Confident	83.8	Confident	87 Å²	87	49.2 Å²	49.2	46%	0.455	29%	0.287	S	S	.	.			trans	-73.9	115	-174.2	-61.1	-177.3	0	0	0	110.7	P168	P168-L170 HydrophobicContact CB-CD2 4.16Å; P168-L170 PolarHBondContact O-N 3.48Å
171	P	94.5	Very high	84.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.288	C	S	.	.			trans	-68.6	140.3	179.8	28.1	-32.9	0	0	0	110.5	E169 L173 L174 L210 R212 A274 Q275	E169-P171 VanDerWaalsContact O-CD 3.28Å; E169-P171 WeakPolarHBondContact O-CD 3.3Å; P171-L173 VanDerWaalsContact C-N 3.27Å; P171-L174 HydrophobicContact CG-CB 4.35Å; P171-L210 HydrophobicContact CB-CG 4.5Å; P171-R212 HydrophobicContact CB-CB 4.18Å; P171-R212 HydrophobicContact CB-CG 3.94Å; P171-R212 HydrophobicContact CG-CB 4.47Å; P171-R212 HydrophobicContact CG-CG 4.35Å; P171-A274 HydrophobicContact CG-CB 3.93Å; P171-A274 WeakPolarHBondContact O-CA 3.36Å; P171-Q275 PolarHBondContact O-N 3.31Å; P171-Q275 VanDerWaalsContact O-N 3.08Å
172	M	95.2	Very high	84.8	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.054	29%	0.285	C	S	.	.	S	Bend	trans	-66.1	-39.1	165	178.8	179.1	165.3	0	0	109.8	L210 F276 L292 L295 H296	M172-L210 PolarHBondContact N-O 3.25Å; M172-F276 PolarHBondContact O-N 3.06Å; M172-L292 HydrophobicContact CE-CB 4.49Å; M172-L292 HydrophobicContact CE-CD2 3.8Å; M172-L292 HydrophobicContact CG-CD2 4.21Å; M172-L292 HydrophobicContact SD-CD2 3.78Å; M172-L295 HydrophobicContact CE-CB 3.94Å; M172-H296 WeakPolarHBondContact CE-CD2 3.31Å; M172-H296 VanDerWaalsContact CE-CE1 3.45Å; M172-H296 WeakPolarHBondContact CE-CE1 3.45Å; M172-H296 WeakPolarHBondContact CE-NE2 3.23Å; M172-H296 PolarHBondContact SD-CE1 3.3Å; M172-H296 PolarHBondContact SD-NE2 3.09Å
173	L	98.1	Very high	86.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	119	178.8	-176.7	63	0	0	0	110.3	P171 M175 L210 V211 R212 F276 F278 T288 L291 L292 L295 V358	P171-L173 VanDerWaalsContact C-N 3.27Å; L173-M175 HydrophobicContact CD2-CE 3.85Å; L173-M175 HydrophobicContact CD2-CG 4.35Å; L173-M175 HydrophobicContact CG-CG 4.33Å; L173-L210 PolarHBondContact N-O 2.86Å; L173-V211 HydrophobicContact CB-CG2 4.36Å; L173-V211 WeakPolarHBondContact O-CA 3.37Å; L173-R212 PolarHBondContact O-N 2.75Å; L173-F276 WeakPolarHBondContact CA-O 3.44Å; L173-F276 HydrophobicContact CD1-CB 3.97Å; L173-F278 HydrophobicContact CD1-CB 3.87Å; L173-F278 HydrophobicContact CG-CB 4.48Å; L173-T288 HydrophobicContact CD2-CG2 4.46Å; L173-L291 HydrophobicContact CD2-CD2 4Å; L173-L292 HydrophobicContact CB-CD2 4.01Å; L173-L292 HydrophobicContact CD2-CD2 4.25Å; L173-L295 HydrophobicContact CD1-CD1 4.06Å; L173-V358 HydrophobicContact CD1-CG2 4.35Å
174	L	98.5	Very high	87.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.6	165.6	179.4	70.9	0	0	0	109	V159 P171 R212 V214 F263 W266 L267 C271 A274 F276 V277 F278	V159-L174 HydrophobicContact CG1-CD1 4.45Å; P171-L174 HydrophobicContact CG-CB 4.35Å; L174-R212 CarbonylContact C-O 3.56Å; L174-R212 WeakPolarHBondContact CA-O 3.48Å; L174-R212 HydrophobicContact CD1-CB 3.96Å; L174-V214 HydrophobicContact CD1-CG2 4.4Å; L174-F263 HydrophobicContact CD2-CE2 4.06Å; L174-F263 HydrophobicContact CD2-CZ 4.01Å; L174-W266 HydrophobicContact CD2-CZ3 4.15Å; L174-L267 HydrophobicContact CD2-CD1 3.39Å; L174-C271 HydrophobicContact CD2-CB 4.46Å; L174-A274 HydrophobicContact CB-CB 4.07Å; L174-F276 PolarHBondContact N-O 3.22Å; L174-V277 CarbonylContact O-C 2.98Å; L174-V277 VanDerWaalsContact O-CA 3.3Å; L174-V277 WeakPolarHBondContact O-CA 3.36Å; L174-F278 PolarHBondContact O-N 3.13Å
175	M	98.6	Very high	89.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.3	171.7	-67.3	-175.8	164.4	0	0	109.8	L173 I177 W194 V211 R212 T213 V214 F278 T288	L173-M175 HydrophobicContact CD2-CE 3.85Å; L173-M175 HydrophobicContact CD2-CG 4.35Å; L173-M175 HydrophobicContact CG-CG 4.33Å; M175-I177 HydrophobicContact CB-CD1 4.14Å; M175-I177 HydrophobicContact CB-CG1 4.45Å; M175-W194 HydrophobicContact CE-CE3 4.3Å; M175-W194 HydrophobicContact SD-CE3 4.12Å; M175-W194 HydrophobicContact SD-CZ3 4.13Å; M175-V211 HydrophobicContact CE-CG1 4.3Å; M175-V211 HydrophobicContact CG-CG1 4.13Å; M175-V211 HydrophobicContact SD-CG1 3.99Å; M175-R212 PolarHBondContact N-O 3.45Å; M175-T213 HydrophobicContact CB-CG2 4.04Å; M175-T213 CarbonylContact O-C 3.28Å; M175-T213 WeakPolarHBondContact O-CA 3.42Å; M175-V214 PolarHBondContact O-N 2.7Å; M175-F278 CarbonylContact C-O 3.56Å; M175-F278 WeakPolarHBondContact CA-O 3.32Å; M175-F278 HydrophobicContact CB-CD1 4.41Å; M175-F278 HydrophobicContact CG-CB 4.32Å; M175-F278 HydrophobicContact CG-CD1 4.14Å; M175-T288 HydrophobicContact CE-CG2 3.49Å; M175-T288 VanDerWaalsContact CE-CG2 3.49Å; M175-T288 WeakPolarHBondContact CE-OG1 3.23Å
176	A	98.6	Very high	91.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	100.7	178.3	0	0	0	0	0	108.6	V214 L216 F263 V277 F278 K279 G280	A176-V214 HydrophobicContact CB-CG2 4.37Å; A176-L216 HydrophobicContact CB-CD1 4.18Å; A176-F263 HydrophobicContact CB-CD1 4.28Å; A176-F263 HydrophobicContact CB-CD2 4Å; A176-F263 HydrophobicContact CB-CE1 3.78Å; A176-F263 HydrophobicContact CB-CE2 3.45Å; A176-F263 VanDerWaalsContact CB-CE2 3.45Å; A176-F263 HydrophobicContact CB-CG 4.38Å; A176-F263 HydrophobicContact CB-CZ 3.34Å; A176-V277 HydrophobicContact CB-CG1 4.48Å; A176-F278 PolarHBondContact N-O 3.37Å; A176-K279 WeakPolarHBondContact O-CA 3.47Å; A176-G280 PolarHBondContact O-N 2.83Å; A176-G280 VanDerWaalsContact O-N 3.15Å
177	I	98.8	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116	-168.6	-51.9	-50.3	0	0	0	109.8	M175 S179 I190 W194 T213 V214 F215 L216 F278 G280 D282	M175-I177 HydrophobicContact CB-CD1 4.14Å; M175-I177 HydrophobicContact CB-CG1 4.45Å; I177-S179 PolarHBondContact O-N 3.13Å; I177-I190 HydrophobicContact CG2-CD1 4Å; I177-W194 HydrophobicContact CD1-CH2 3.68Å; I177-W194 HydrophobicContact CD1-CZ3 3.76Å; I177-W194 HydrophobicContact CG1-CH2 4.19Å; I177-W194 HydrophobicContact CG1-CZ3 4.39Å; I177-T213 HydrophobicContact CG1-CG2 4.05Å; I177-V214 PolarHBondContact N-O 3.13Å; I177-F215 HydrophobicContact CB-CD1 3.71Å; I177-F215 HydrophobicContact CB-CE1 3.94Å; I177-F215 HydrophobicContact CG1-CD1 4.47Å; I177-F215 HydrophobicContact CG1-CE1 4.3Å; I177-F215 HydrophobicContact CG2-CD1 3.94Å; I177-F215 HydrophobicContact CG2-CE1 3.99Å; I177-F215 CarbonylContact O-C 3.54Å; I177-F215 WeakPolarHBondContact O-CA 3.32Å; I177-L216 PolarHBondContact O-N 2.78Å; I177-F278 HydrophobicContact CD1-CD1 3.94Å; I177-F278 HydrophobicContact CD1-CE1 3.73Å; I177-G280 CarbonylContact C-O 3.56Å; I177-G280 WeakPolarHBondContact CA-O 3.38Å; I177-D282 HydrophobicContact CG2-CB 3.91Å
178	K	98.6	Very high	94.8	Very high	11 Å²	11	35.5 Å²	35.5	5%	0.048	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	121.7	174.3	-65.9	179.7	-75.6	157.1	0	108.7	L216 L256 K259 G280 D281 D282 D380	K178-L216 HydrophobicContact CG-CD1 4.45Å; K178-L256 HydrophobicContact CD-CD2 4.32Å; K178-K259 HydrophobicContact CB-CD 4.21Å; K178-K259 HydrophobicContact CD-CD 4.49Å; K178-K259 HydrophobicContact CG-CD 3.92Å; K178-G280 PolarHBondContact N-O 3Å; K178-D281 WeakPolarHBondContact CE-OD1 3.44Å; K178-D281 IonicContact NZ-OD1 3.01Å; K178-D281 PolarHBondContact NZ-OD1 3.02Å; K178-D282 WeakPolarHBondContact O-CB 3.09Å; K178-D282 PolarHBondContact O-N 2.83Å; K178-D282 VanDerWaalsContact O-N 3.14Å; K178-D380 IonicContact NZ-OD2 3.29Å; K178-D380 PolarHBondContact NZ-OD2 3.33Å
179	S	98.1	Very high	96.2	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.014	16%	0.161	C	C	.	.			trans	-138.3	175.8	178.9	-168	0	0	0	0	110.5	I177 R187 L216 K259 D282	I177-S179 PolarHBondContact O-N 3.13Å; S179-R187 PolarHBondContact OG-NH1 2.87Å; S179-R187 VanDerWaalsContact OG-NH1 3.16Å; S179-L216 PolarHBondContact N-O 3.15Å; S179-L216 VanDerWaalsContact O-O 3.06Å; S179-K259 PolarHBondContact O-NZ 2.92Å; S179-D282 WeakPolarHBondContact CA-OD2 2.84Å; S179-D282 VanDerWaalsContact CB-OD2 3.25Å; S179-D282 WeakPolarHBondContact CB-OD2 3.26Å; S179-D282 PolarHBondContact OG-OD2 2.72Å
180	Q	96.5	Very high	97.2	Very high	90 Å²	90	27.2 Å²	27.2	42%	0.421	14%	0.143	S	C	.	.			trans	-124.7	156.9	176.5	-64.4	-178.5	-1.5	0	0	110	G182 N183 R187	Q180-G182 VanDerWaalsContact C-N 3.26Å; Q180-G182 PolarHBondContact O-N 3.47Å; Q180-G182 VanDerWaalsContact O-N 3.13Å; Q180-N183 PolarHBondContact O-N 2.67Å; Q180-R187 PolarHBondContact O-NH1 3.4Å
181	V	96.3	Very high	97.8	Very high	10 Å²	10	24.4 Å²	24.4	6%	0.061	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-47.1	-176.1	175.7	0	0	0	0	112.1	N183 F184 R187 L217 Q220 L230 L234	V181-N183 VanDerWaalsContact C-N 3.32Å; V181-N183 PolarHBondContact O-N 3.29Å; V181-F184 WeakPolarHBondContact O-CE2 3.29Å; V181-R187 PolarHBondContact O-NH2 3.2Å; V181-R187 VanDerWaalsContact O-NH2 3.1Å; V181-L217 HydrophobicContact CG2-CD2 4.38Å; V181-Q220 HydrophobicContact CG2-CB 4.42Å; V181-L230 HydrophobicContact CG1-CB 3.76Å; V181-L230 HydrophobicContact CG1-CD1 4.35Å; V181-L234 HydrophobicContact CG1-CD2 4.22Å; V181-L234 HydrophobicContact CG2-CD2 4.23Å
182	G	95.1	Very high	97.9	Very high	37 Å²	37	29.5 Å²	29.5	38%	0.381	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.4	-178.5	0	0	0	0	0	117	Q180 F184	Q180-G182 VanDerWaalsContact C-N 3.26Å; Q180-G182 PolarHBondContact O-N 3.47Å; Q180-G182 VanDerWaalsContact O-N 3.13Å; G182-F184 PolarHBondContact O-N 3.34Å
183	N	97.2	Very high	98	Very high	43 Å²	43	29 Å²	29	23%	0.23	15%	0.147	C	C	.	.			trans	-84.1	45.8	-171.1	-69.5	1.7	0	0	0	113.7	Q180 V181 E185 N186 R187 D282	Q180-N183 PolarHBondContact O-N 2.67Å; V181-N183 VanDerWaalsContact C-N 3.32Å; V181-N183 PolarHBondContact O-N 3.29Å; N183-E185 PolarHBondContact O-N 3.04Å; N183-N186 HydrophobicContact CB-CB 4.21Å; N183-N186 PolarHBondContact O-N 3Å; N183-R187 WeakPolarHBondContact O-CG 3.27Å; N183-R187 PolarHBondContact O-N 3.09Å; N183-R187 VanDerWaalsContact O-N 3.15Å; N183-R187 PolarHBondContact O-NH1 2.84Å; N183-D282 VanDerWaalsContact CB-OD2 3.24Å; N183-D282 WeakPolarHBondContact CB-OD2 3.34Å; N183-D282 PolarHBondContact ND2-OD1 3.23Å; N183-D282 PolarHBondContact ND2-OD2 3.22Å
184	F	98.2	Very high	98	Very high	51 Å²	51	29.1 Å²	29.1	22%	0.224	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-44	-179.7	-68.8	-85.4	0	0	0	112.5	V181 G182 N186 R187 Q188 L230 L233 L234 E237	V181-F184 WeakPolarHBondContact O-CE2 3.29Å; G182-F184 PolarHBondContact O-N 3.34Å; F184-N186 PolarHBondContact O-N 2.98Å; F184-R187 VanDerWaalsContact CD1-NH2 3.28Å; F184-R187 PolarHBondContact O-N 3.39Å; F184-Q188 WeakPolarHBondContact O-CB 3.45Å; F184-Q188 PolarHBondContact O-N 2.91Å; F184-L230 HydrophobicContact CE2-CB 4.23Å; F184-L230 HydrophobicContact CE2-CD1 4.16Å; F184-L230 HydrophobicContact CE2-CD2 4.35Å; F184-L230 HydrophobicContact CE2-CG 4.47Å; F184-L230 HydrophobicContact CZ-CB 4.44Å; F184-L233 HydrophobicContact CE1-CB 4.22Å; F184-L233 HydrophobicContact CZ-CB 3.84Å; F184-L234 HydrophobicContact CE1-CB 4.49Å; F184-L234 HydrophobicContact CE1-CD1 4.22Å; F184-L234 HydrophobicContact CZ-CB 4.22Å; F184-L234 HydrophobicContact CZ-CD1 4.32Å; F184-E237 WeakPolarHBondContact CD1-OE2 3.46Å; F184-E237 HydrophobicContact CE1-CB 4.22Å; F184-E237 WeakPolarHBondContact CE1-OE2 3.47Å
185	E	98.5	Very high	98	Very high	148 Å²	148	29.2 Å²	29.2	69%	0.692	15%	0.148	S	C	*	.	H	α-helix	trans	-64.8	-40.1	-178.9	-64.3	-171.2	171.2	0	0	112.3	N183 Q188 A189 P428	N183-E185 PolarHBondContact O-N 3.04Å; E185-Q188 PolarHBondContact O-N 3.47Å; E185-A189 WeakPolarHBondContact O-CB 3.29Å; E185-A189 PolarHBondContact O-N 2.88Å; E185-P428 HydrophobicContact CB-CB 4.24Å; E185-P428 HydrophobicContact CB-CG 3.85Å
186	N	98.6	Very high	97.8	Very high	26 Å²	26	37.5 Å²	37.5	14%	0.139	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-52.6	175.6	-65.7	58.1	0	0	0	110.5	N183 F184 Q188 A189 I190 D282 P428	N183-N186 HydrophobicContact CB-CB 4.21Å; N183-N186 PolarHBondContact O-N 3Å; F184-N186 PolarHBondContact O-N 2.98Å; N186-Q188 VanDerWaalsContact C-N 3.28Å; N186-Q188 PolarHBondContact O-N 2.74Å; N186-A189 PolarHBondContact O-N 2.96Å; N186-I190 WeakPolarHBondContact O-CG1 3.27Å; N186-I190 PolarHBondContact O-N 2.83Å; N186-D282 HydrophobicContact CB-CB 4.11Å; N186-D282 WeakPolarHBondContact CB-O 3.43Å; N186-D282 PolarHBondContact ND2-O 3.43Å; N186-P428 HydrophobicContact CB-CG 4.44Å; N186-P428 WeakPolarHBondContact OD1-CG 3.29Å
187	R	98.8	Very high	97.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.6	-43.2	178.4	-66.1	-167.1	-68.1	-82.2	5.6	111.5	S179 Q180 V181 N183 F184 I190 R191 F215 E237	S179-R187 PolarHBondContact OG-NH1 2.87Å; S179-R187 VanDerWaalsContact OG-NH1 3.16Å; Q180-R187 PolarHBondContact O-NH1 3.4Å; V181-R187 PolarHBondContact O-NH2 3.2Å; V181-R187 VanDerWaalsContact O-NH2 3.1Å; N183-R187 WeakPolarHBondContact O-CG 3.27Å; N183-R187 PolarHBondContact O-N 3.09Å; N183-R187 VanDerWaalsContact O-N 3.15Å; N183-R187 PolarHBondContact O-NH1 2.84Å; F184-R187 VanDerWaalsContact CD1-NH2 3.28Å; F184-R187 PolarHBondContact O-N 3.39Å; R187-I190 PolarHBondContact O-N 3.09Å; R187-R191 WeakPolarHBondContact O-CG 3.27Å; R187-R191 PolarHBondContact O-N 2.96Å; R187-F215 HydrophobicContact CB-CD1 4.27Å; R187-F215 HydrophobicContact CB-CD2 4.34Å; R187-F215 HydrophobicContact CB-CE1 3.94Å; R187-F215 HydrophobicContact CB-CE2 4Å; R187-F215 HydrophobicContact CB-CG 4.46Å; R187-F215 HydrophobicContact CB-CZ 3.79Å; R187-F215 VanDerWaalsContact CD-CG 3.5Å; R187-F215 HydrophobicContact CG-CD1 3.57Å; R187-F215 HydrophobicContact CG-CD2 4.16Å; R187-F215 HydrophobicContact CG-CE1 3.69Å; R187-F215 HydrophobicContact CG-CE2 4.26Å; R187-F215 HydrophobicContact CG-CG 3.82Å; R187-F215 HydrophobicContact CG-CZ 4.03Å; R187-E237 IonicContact CZ-OE1 2.7Å; R187-E237 IonicContact CZ-OE2 3.15Å; R187-E237 VanDerWaalsContact CZ-OE2 3.31Å; R187-E237 IonicContact NE-OE1 2.81Å; R187-E237 PolarHBondContact NE-OE1 2.99Å; R187-E237 IonicContact NE-OE2 3.3Å; R187-E237 PolarHBondContact NE-OE2 3.19Å; R187-E237 VanDerWaalsContact NE-OE2 3.13Å; R187-E237 IonicContact NH2-OE1 3.89Å; R187-E237 IonicContact NH2-OE2 2.78Å; R187-E237 PolarHBondContact NH2-OE2 3.38Å
188	Q	98.8	Very high	97.5	Very high	52 Å²	52	40.8 Å²	40.8	24%	0.243	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-45.5	178.9	-172.7	57.3	22.5	0	0	112.6	F184 E185 N186 I190 R191 E192 Y241	F184-Q188 WeakPolarHBondContact O-CB 3.45Å; F184-Q188 PolarHBondContact O-N 2.91Å; E185-Q188 PolarHBondContact O-N 3.47Å; N186-Q188 VanDerWaalsContact C-N 3.28Å; N186-Q188 PolarHBondContact O-N 2.74Å; Q188-I190 VanDerWaalsContact C-N 3.28Å; Q188-I190 PolarHBondContact O-N 2.79Å; Q188-R191 PolarHBondContact O-N 3.41Å; Q188-E192 PolarHBondContact NE2-OE1 2.93Å; Q188-E192 WeakPolarHBondContact O-CG 3.27Å; Q188-E192 PolarHBondContact O-N 3.01Å; Q188-Y241 PolarHBondContact OE1-OH 3.27Å; Q188-Y241 VanDerWaalsContact OE1-OH 3.14Å
189	A	98.8	Very high	97.4	Very high	4 Å²	4	48.9 Å²	48.9	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-39	175.5	0	0	0	0	0	111.7	E185 N186 E192 T193 P428 M431 L432	E185-A189 WeakPolarHBondContact O-CB 3.29Å; E185-A189 PolarHBondContact O-N 2.88Å; N186-A189 PolarHBondContact O-N 2.96Å; A189-E192 PolarHBondContact O-N 3.27Å; A189-T193 WeakPolarHBondContact O-CB 3.46Å; A189-T193 VanDerWaalsContact O-CG2 3.3Å; A189-T193 WeakPolarHBondContact O-CG2 3.43Å; A189-T193 PolarHBondContact O-N 3.48Å; A189-T193 PolarHBondContact O-OG1 2.8Å; A189-P428 HydrophobicContact CB-CB 3.78Å; A189-M431 HydrophobicContact CB-SD 4.36Å; A189-L432 HydrophobicContact CB-CD1 4.49Å; A189-L432 HydrophobicContact CB-CG 4.29Å
190	I	98.8	Very high	97.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.2	-67.6	172.1	0	0	0	110.9	I177 N186 R187 Q188 E192 T193 W194 G195 F215 D282 M431	I177-I190 HydrophobicContact CG2-CD1 4Å; N186-I190 WeakPolarHBondContact O-CG1 3.27Å; N186-I190 PolarHBondContact O-N 2.83Å; R187-I190 PolarHBondContact O-N 3.09Å; Q188-I190 VanDerWaalsContact C-N 3.28Å; Q188-I190 PolarHBondContact O-N 2.79Å; I190-E192 VanDerWaalsContact C-N 3.31Å; I190-E192 PolarHBondContact O-N 3.29Å; I190-T193 CarbonylContact O-C 3.55Å; I190-T193 PolarHBondContact O-N 2.95Å; I190-W194 HydrophobicContact CB-CZ2 4.28Å; I190-W194 HydrophobicContact CD1-CH2 3.98Å; I190-W194 HydrophobicContact CD1-CZ2 3.51Å; I190-W194 HydrophobicContact CG1-CH2 4.18Å; I190-W194 HydrophobicContact CG1-CZ2 3.43Å; I190-W194 VanDerWaalsContact CG1-CZ2 3.43Å; I190-W194 HydrophobicContact CG2-CD2 4.29Å; I190-W194 HydrophobicContact CG2-CE3 4.3Å; I190-W194 HydrophobicContact CG2-CH2 3.97Å; I190-W194 HydrophobicContact CG2-CZ2 3.95Å; I190-W194 HydrophobicContact CG2-CZ3 4.14Å; I190-G195 CarbonylContact O-C 3.59Å; I190-G195 VanDerWaalsContact O-CA 3.31Å; I190-G195 WeakPolarHBondContact O-CA 3.43Å; I190-G195 PolarHBondContact O-N 2.98Å; I190-F215 HydrophobicContact CB-CE1 4.24Å; I190-F215 HydrophobicContact CB-CZ 4.1Å; I190-F215 HydrophobicContact CD1-CE1 4.06Å; I190-F215 HydrophobicContact CG2-CE1 4.03Å; I190-F215 HydrophobicContact CG2-CZ 3.9Å; I190-D282 HydrophobicContact CD1-CB 3.95Å; I190-M431 HydrophobicContact CG1-CE 4.45Å; I190-M431 HydrophobicContact CG1-SD 3.88Å
191	R	98.6	Very high	97.1	Very high	28 Å²	28	53.4 Å²	53.4	11%	0.106	26%	0.257	C	S	.	.	H	α-helix	trans	-59.5	-39.6	176.4	-71	178.4	-170.4	112.1	4.6	112.9	R187 Q188 T193 R196 F215 E237 D243	R187-R191 WeakPolarHBondContact O-CG 3.27Å; R187-R191 PolarHBondContact O-N 2.96Å; Q188-R191 PolarHBondContact O-N 3.41Å; R191-T193 VanDerWaalsContact C-N 3.31Å; R191-R196 WeakPolarHBondContact O-CB 3.43Å; R191-F215 HydrophobicContact CG-CE2 4.12Å; R191-F215 HydrophobicContact CG-CZ 4.31Å; R191-E237 IonicContact CZ-OE1 2.9Å; R191-E237 IonicContact NH1-OE1 3.83Å; R191-E237 PolarHBondContact NH1-OE1 3.26Å; R191-E237 IonicContact NH2-OE1 3.9Å; R191-E237 PolarHBondContact NH2-OE1 3.24Å; R191-D243 IonicContact CZ-OD1 2.66Å; R191-D243 IonicContact CZ-OD2 3.31Å; R191-D243 IonicContact NE-OD1 2.7Å; R191-D243 IonicContact NE-OD2 3.13Å; R191-D243 PolarHBondContact NE-OD2 2.81Å; R191-D243 IonicContact NH2-OD1 3.54Å; R191-D243 PolarHBondContact NH2-OD1 3.49Å; R191-D243 IonicContact NH2-OD2 2.72Å; R191-D243 PolarHBondContact NH2-OD2 3.05Å
192	E	97.9	Very high	96.8	Very high	106 Å²	106	53.5 Å²	53.5	50%	0.495	26%	0.259	S	S	.	.	H	α-helix	trans	-79.2	-14.9	-179	-70.7	-180	-164	0	0	113.5	Q188 A189 I190 L432	Q188-E192 PolarHBondContact NE2-OE1 2.93Å; Q188-E192 WeakPolarHBondContact O-CG 3.27Å; Q188-E192 PolarHBondContact O-N 3.01Å; A189-E192 PolarHBondContact O-N 3.27Å; I190-E192 VanDerWaalsContact C-N 3.31Å; I190-E192 PolarHBondContact O-N 3.29Å; E192-L432 HydrophobicContact CB-CD2 4.25Å
193	T	97.8	Very high	96.3	Very high	1 Å²	1	55 Å²	55	1%	0.006	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-113.6	-174	64.3	0	0	0	0	112	A189 I190 R191 L432 W435	A189-T193 WeakPolarHBondContact O-CB 3.46Å; A189-T193 VanDerWaalsContact O-CG2 3.3Å; A189-T193 WeakPolarHBondContact O-CG2 3.43Å; A189-T193 PolarHBondContact O-N 3.48Å; A189-T193 PolarHBondContact O-OG1 2.8Å; I190-T193 CarbonylContact O-C 3.55Å; I190-T193 PolarHBondContact O-N 2.95Å; R191-T193 VanDerWaalsContact C-N 3.31Å; T193-L432 HydrophobicContact CG2-CD2 3.62Å; T193-L432 HydrophobicContact CG2-CG 4.26Å; T193-W435 HydrophobicContact CG2-CB 3.59Å; T193-W435 HydrophobicContact CG2-CD2 4.35Å; T193-W435 HydrophobicContact CG2-CG 3.62Å
194	W	97.5	Very high	95.1	Very high	3 Å²	3	61.6 Å²	61.6	1%	0.011	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-24.4	-166.4	57.1	-95.5	0	0	0	113.8	M175 I177 I190 F278 V284 F285 V286 T288 W435	M175-W194 HydrophobicContact CE-CE3 4.3Å; M175-W194 HydrophobicContact SD-CE3 4.12Å; M175-W194 HydrophobicContact SD-CZ3 4.13Å; I177-W194 HydrophobicContact CD1-CH2 3.68Å; I177-W194 HydrophobicContact CD1-CZ3 3.76Å; I177-W194 HydrophobicContact CG1-CH2 4.19Å; I177-W194 HydrophobicContact CG1-CZ3 4.39Å; I190-W194 HydrophobicContact CB-CZ2 4.28Å; I190-W194 HydrophobicContact CD1-CH2 3.98Å; I190-W194 HydrophobicContact CD1-CZ2 3.51Å; I190-W194 HydrophobicContact CG1-CH2 4.18Å; I190-W194 HydrophobicContact CG1-CZ2 3.43Å; I190-W194 VanDerWaalsContact CG1-CZ2 3.43Å; I190-W194 HydrophobicContact CG2-CD2 4.29Å; I190-W194 HydrophobicContact CG2-CE3 4.3Å; I190-W194 HydrophobicContact CG2-CH2 3.97Å; I190-W194 HydrophobicContact CG2-CZ2 3.95Å; I190-W194 HydrophobicContact CG2-CZ3 4.14Å; W194-F278 HydrophobicContact CH2-CE1 4.5Å; W194-F278 HydrophobicContact CZ3-CE1 4.14Å; W194-V284 HydrophobicContact CH2-CG2 4.1Å; W194-V284 HydrophobicContact CZ2-CG2 4.03Å; W194-V284 VanDerWaalsContact CZ2-O 3.23Å; W194-V284 WeakPolarHBondContact CZ2-O 3.49Å; W194-V284 PolarHBondContact NE1-O 3.49Å; W194-F285 AromaticContact CD1-CD2 3.51Å; W194-F285 AromaticContact CD1-CE2 3.93Å; W194-F285 HydrophobicContact CG-CD2 4.36Å; W194-V286 HydrophobicContact CB-CB 4.41Å; W194-V286 WeakPolarHBondContact CB-O 3.48Å; W194-V286 HydrophobicContact CD2-CB 3.99Å; W194-V286 HydrophobicContact CD2-CG2 4.09Å; W194-V286 HydrophobicContact CE3-CB 3.65Å; W194-V286 HydrophobicContact CE3-CG2 3.63Å; W194-V286 HydrophobicContact CG-CB 4.35Å; W194-V286 HydrophobicContact CH2-CG2 4.11Å; W194-V286 HydrophobicContact CZ3-CB 4.19Å; W194-V286 HydrophobicContact CZ3-CG2 3.65Å; W194-T288 PolarHBondContact O-OG1 3.35Å; W194-W435 HydrophobicContact CB-CE3 4.32Å; W194-W435 HydrophobicContact CB-CZ3 4.16Å
195	G	97.7	Very high	93.8	Very high	1 Å²	1	63 Å²	63	1%	0.01	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	19.4	178.7	0	0	0	0	0	113.9	I190 S197 T213	I190-G195 CarbonylContact O-C 3.59Å; I190-G195 VanDerWaalsContact O-CA 3.31Å; I190-G195 WeakPolarHBondContact O-CA 3.43Å; I190-G195 PolarHBondContact O-N 2.98Å; G195-S197 PolarHBondContact O-N 3.32Å; G195-T213 VanDerWaalsContact O-CB 3.31Å; G195-T213 WeakPolarHBondContact O-CB 3.42Å; G195-T213 PolarHBondContact O-OG1 3.16Å
196	R	95.7	Very high	92.7	Very high	174 Å²	174	57.5 Å²	57.5	66%	0.657	30%	0.303	S	S	*	.			trans	-61.6	122.5	178.2	-177.3	178.3	176.5	177.6	2.1	111.1	R191	R191-R196 WeakPolarHBondContact O-CB 3.43Å
197	S	95.6	Very high	91.9	Very high	47 Å²	47	63.1 Å²	63.1	33%	0.329	32%	0.322	S	S	.	.			trans	-72.7	144.8	172.6	-70.9	0	0	0	0	111.9	G195 V211 T213	G195-S197 PolarHBondContact O-N 3.32Å; S197-V211 CarbonylContact C-O 3.41Å; S197-V211 WeakPolarHBondContact CA-O 3.48Å; S197-T213 PolarHBondContact OG-N 3.21Å
198	G	94.8	Very high	91.6	Very high	22 Å²	22	63.7 Å²	63.7	23%	0.227	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124.3	-167.8	-179.8	0	0	0	0	0	112.7	V200 V211	G198-V200 PolarHBondContact O-N 2.94Å; G198-V211 PolarHBondContact N-O 3.31Å; G198-V211 PolarHBondContact O-N 2.97Å
199	W	95.4	Very high	91.4	Very high	181 Å²	181	61.3 Å²	61.3	69%	0.686	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	118	176.7	-173.6	-92.1	0	0	0	110.9	L210	W199-L210 HydrophobicContact CE3-CB 4.46Å
200	V	95.4	Very high	91.3	Very high	25 Å²	25	62 Å²	62	15%	0.152	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.9	176.2	179.5	0	0	0	0	108.6	G198 G208 G209 V211 T288 L292	G198-V200 PolarHBondContact O-N 2.94Å; V200-G208 CarbonylContact O-C 3.56Å; V200-G208 WeakPolarHBondContact O-CA 3.4Å; V200-G209 PolarHBondContact N-O 3.35Å; V200-G209 PolarHBondContact O-N 3.46Å; V200-V211 HydrophobicContact CB-CG2 3.92Å; V200-V211 HydrophobicContact CG2-CB 4.03Å; V200-V211 HydrophobicContact CG2-CG2 3.62Å; V200-T288 HydrophobicContact CG1-CG2 4.18Å; V200-L292 HydrophobicContact CB-CD1 3.78Å; V200-L292 HydrophobicContact CG1-CD1 3.85Å
201	K	93.4	Very high	91.2	Very high	163 Å²	163	62 Å²	62	71%	0.709	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-77.3	144.9	176	-64.8	-177.4	-179.6	-179.8	0	110.2	S289	K201-S289 VanDerWaalsContact O-CB 3.23Å; K201-S289 WeakPolarHBondContact O-CB 3.45Å; K201-S289 PolarHBondContact O-OG 3.41Å
202	G	90.4	Very high	91.2	Very high	11 Å²	11	63.5 Å²	63.5	11%	0.113	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.9	158.8	166.3	0	0	0	0	0	111	D293	G202-D293 WeakPolarHBondContact CA-OD1 3.19Å
203	E	85.2	Confident	91.2	Very high	69 Å²	69	58.6 Å²	58.6	32%	0.322	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-74.5	147	175.5	-171.7	164.3	-128.9	0	0	110.3	G205 G206 R287 S290 D293	E203-G205 PolarHBondContact O-N 2.83Å; E203-G206 PolarHBondContact O-N 2.76Å; E203-R287 IonicContact OE1-CZ 3.76Å; E203-R287 IonicContact OE1-NH2 3.87Å; E203-R287 PolarHBondContact OE1-NH2 3.35Å; E203-R287 IonicContact OE2-CZ 2.63Å; E203-R287 IonicContact OE2-NH2 3.7Å; E203-R287 PolarHBondContact OE2-NH2 2.88Å; E203-S290 WeakPolarHBondContact OE2-CB 3.31Å; E203-S290 PolarHBondContact OE2-OG 2.94Å; E203-D293 WeakPolarHBondContact CA-OD2 3.33Å; E203-D293 VanDerWaalsContact CB-OD2 3.24Å; E203-D293 WeakPolarHBondContact CB-OD2 3.38Å; E203-D293 PolarHBondContact N-OD2 3.5Å
204	L	71.1	Confident	91.2	Very high	181 Å²	181	58.6 Å²	58.6	95%	0.948	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	49.8	33.8	176.3	-63.6	168.8	0	0	0	115.7
205	G	70.8	Confident	91.3	Very high	80 Å²	80	58.4 Å²	58.4	83%	0.825	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	86.7	9.2	179.9	0	0	0	0	0	114.6	E203	E203-G205 PolarHBondContact O-N 2.83Å
206	G	75.4	Confident	91.3	Very high	34 Å²	34	58.4 Å²	58.4	35%	0.351	30%	0.302	S	S	.	.			trans	-63.9	167.2	171.9	0	0	0	0	0	113.9	E203 G208 D293	E203-G206 PolarHBondContact O-N 2.76Å; G206-G208 PolarHBondContact O-N 2.95Å; G206-D293 VanDerWaalsContact CA-OD1 3.27Å; G206-D293 WeakPolarHBondContact CA-OD1 3.3Å
207	R	82.6	Confident	91.5	Very high	144 Å²	144	50.1 Å²	50.1	54%	0.543	27%	0.271	S	S	.	.			trans	-71.8	123.6	-176.2	-69.8	178.5	176.8	-179.9	-3.6	108.6	H296 E300	R207-H296 HydrophobicContact CB-CB 4.45Å; R207-H296 WeakPolarHBondContact CB-CD2 3.34Å; R207-H296 VanDerWaalsContact CB-NE2 3.33Å; R207-H296 WeakPolarHBondContact CB-NE2 2.95Å; R207-H296 PolarHBondContact O-CD2 3.44Å; R207-H296 PolarHBondContact O-NE2 2.89Å; R207-E300 IonicContact CZ-OE1 3.21Å; R207-E300 IonicContact NE-OE1 3.47Å; R207-E300 IonicContact NH1-OE1 2.76Å; R207-E300 PolarHBondContact NH1-OE1 2.59Å
208	G	91.9	Very high	91.6	Very high	12 Å²	12	47.9 Å²	47.9	12%	0.124	26%	0.255	C	S	.	.			trans	-73.9	-172.3	173.4	0	0	0	0	0	113	V200 G206 H296	V200-G208 CarbonylContact O-C 3.56Å; V200-G208 WeakPolarHBondContact O-CA 3.4Å; G206-G208 PolarHBondContact O-N 2.95Å; G208-H296 PolarHBondContact O-NE2 3.43Å
209	G	94.8	Very high	91.6	Very high	2 Å²	2	52.4 Å²	52.4	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	158.8	174.6	0	0	0	0	0	112.5	V200 V211	V200-G209 PolarHBondContact N-O 3.35Å; V200-G209 PolarHBondContact O-N 3.46Å; G209-V211 PolarHBondContact O-N 3.3Å
210	L	95.9	Very high	91.4	Very high	17 Å²	17	46.4 Å²	46.4	9%	0.089	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	122.4	168.9	178.4	64.7	0	0	0	109.4	E169 P171 M172 L173 W199	E169-L210 HydrophobicContact CB-CD2 4.15Å; E169-L210 VanDerWaalsContact CD-CD2 3.45Å; E169-L210 HydrophobicContact CG-CD2 3.43Å; E169-L210 VanDerWaalsContact CG-CD2 3.43Å; E169-L210 WeakPolarHBondContact OE1-CD1 3.38Å; E169-L210 VanDerWaalsContact OE1-CD2 3.29Å; E169-L210 WeakPolarHBondContact OE1-CD2 3.31Å; P171-L210 HydrophobicContact CB-CG 4.5Å; M172-L210 PolarHBondContact N-O 3.25Å; L173-L210 PolarHBondContact N-O 2.86Å; W199-L210 HydrophobicContact CE3-CB 4.46Å
211	V	97.6	Very high	91	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135	174.5	-177.6	0	0	0	0	109.1	L173 M175 S197 G198 V200 G209 T288 L292	L173-V211 HydrophobicContact CB-CG2 4.36Å; L173-V211 WeakPolarHBondContact O-CA 3.37Å; M175-V211 HydrophobicContact CE-CG1 4.3Å; M175-V211 HydrophobicContact CG-CG1 4.13Å; M175-V211 HydrophobicContact SD-CG1 3.99Å; S197-V211 CarbonylContact C-O 3.41Å; S197-V211 WeakPolarHBondContact CA-O 3.48Å; G198-V211 PolarHBondContact N-O 3.31Å; G198-V211 PolarHBondContact O-N 2.97Å; V200-V211 HydrophobicContact CB-CG2 3.92Å; V200-V211 HydrophobicContact CG2-CB 4.03Å; V200-V211 HydrophobicContact CG2-CG2 3.62Å; G209-V211 PolarHBondContact O-N 3.3Å; V211-T288 HydrophobicContact CG2-CG2 4.11Å; V211-L292 HydrophobicContact CG2-CD1 4.07Å; V211-L292 HydrophobicContact CG2-CD2 4.46Å
212	R	97.5	Very high	90.5	Very high	61 Å²	61	42.3 Å²	42.3	23%	0.23	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.8	169.1	-68.5	-67.6	179.9	-167.3	-0.8	108.4	V159 E169 P171 L173 L174 M175	V159-R212 HydrophobicContact CG1-CB 3.99Å; V159-R212 HydrophobicContact CG1-CG 4.38Å; E169-R212 IonicContact OE1-NH2 3.76Å; E169-R212 IonicContact OE2-CZ 3.5Å; E169-R212 IonicContact OE2-NH2 2.74Å; E169-R212 PolarHBondContact OE2-NH2 3.32Å; P171-R212 HydrophobicContact CB-CB 4.18Å; P171-R212 HydrophobicContact CB-CG 3.94Å; P171-R212 HydrophobicContact CG-CB 4.47Å; P171-R212 HydrophobicContact CG-CG 4.35Å; L173-R212 PolarHBondContact O-N 2.75Å; L174-R212 CarbonylContact C-O 3.56Å; L174-R212 WeakPolarHBondContact CA-O 3.48Å; L174-R212 HydrophobicContact CD1-CB 3.96Å; M175-R212 PolarHBondContact N-O 3.45Å
213	T	98.3	Very high	89.9	Confident	3 Å²	3	45 Å²	45	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.6	-179	-55.9	0	0	0	0	109.8	M175 I177 G195 S197 F215 D243	M175-T213 HydrophobicContact CB-CG2 4.04Å; M175-T213 CarbonylContact O-C 3.28Å; M175-T213 WeakPolarHBondContact O-CA 3.42Å; I177-T213 HydrophobicContact CG1-CG2 4.05Å; G195-T213 VanDerWaalsContact O-CB 3.31Å; G195-T213 WeakPolarHBondContact O-CB 3.42Å; G195-T213 PolarHBondContact O-OG1 3.16Å; S197-T213 PolarHBondContact OG-N 3.21Å; T213-F215 HydrophobicContact CG2-CE2 4.45Å; T213-F215 HydrophobicContact CG2-CZ 4.25Å; T213-D243 WeakPolarHBondContact O-CB 3.32Å
214	V	98.7	Very high	89.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143	171.1	-65.1	0	0	0	0	110.1	V159 L174 M175 A176 I177 L216 D243 L245 F263 W266	V159-V214 HydrophobicContact CB-CG1 4.35Å; V159-V214 HydrophobicContact CG1-CG1 3.83Å; V159-V214 HydrophobicContact CG2-CG1 3.85Å; L174-V214 HydrophobicContact CD1-CG2 4.4Å; M175-V214 PolarHBondContact O-N 2.7Å; A176-V214 HydrophobicContact CB-CG2 4.37Å; I177-V214 PolarHBondContact N-O 3.13Å; V214-L216 HydrophobicContact CG2-CD2 4.26Å; V214-D243 CarbonylContact C-O 3.55Å; V214-D243 VanDerWaalsContact CA-O 3.27Å; V214-D243 WeakPolarHBondContact CA-O 3.43Å; V214-L245 HydrophobicContact CB-CD1 4.07Å; V214-L245 HydrophobicContact CB-CG 4.27Å; V214-L245 HydrophobicContact CG1-CD1 4.4Å; V214-L245 HydrophobicContact CG2-CD1 4.02Å; V214-F263 HydrophobicContact CG2-CE2 4.37Å; V214-W266 HydrophobicContact CG1-CH2 4.07Å
215	F	98.9	Very high	90.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.5	175.2	-62.5	-76	0	0	0	110.3	I177 R187 I190 R191 T213 L217 D243 L245	I177-F215 HydrophobicContact CB-CD1 3.71Å; I177-F215 HydrophobicContact CB-CE1 3.94Å; I177-F215 HydrophobicContact CG1-CD1 4.47Å; I177-F215 HydrophobicContact CG1-CE1 4.3Å; I177-F215 HydrophobicContact CG2-CD1 3.94Å; I177-F215 HydrophobicContact CG2-CE1 3.99Å; I177-F215 CarbonylContact O-C 3.54Å; I177-F215 WeakPolarHBondContact O-CA 3.32Å; R187-F215 HydrophobicContact CB-CD1 4.27Å; R187-F215 HydrophobicContact CB-CD2 4.34Å; R187-F215 HydrophobicContact CB-CE1 3.94Å; R187-F215 HydrophobicContact CB-CE2 4Å; R187-F215 HydrophobicContact CB-CG 4.46Å; R187-F215 HydrophobicContact CB-CZ 3.79Å; R187-F215 VanDerWaalsContact CD-CG 3.5Å; R187-F215 HydrophobicContact CG-CD1 3.57Å; R187-F215 HydrophobicContact CG-CD2 4.16Å; R187-F215 HydrophobicContact CG-CE1 3.69Å; R187-F215 HydrophobicContact CG-CE2 4.26Å; R187-F215 HydrophobicContact CG-CG 3.82Å; R187-F215 HydrophobicContact CG-CZ 4.03Å; I190-F215 HydrophobicContact CB-CE1 4.24Å; I190-F215 HydrophobicContact CB-CZ 4.1Å; I190-F215 HydrophobicContact CD1-CE1 4.06Å; I190-F215 HydrophobicContact CG2-CE1 4.03Å; I190-F215 HydrophobicContact CG2-CZ 3.9Å; R191-F215 HydrophobicContact CG-CE2 4.12Å; R191-F215 HydrophobicContact CG-CZ 4.31Å; T213-F215 HydrophobicContact CG2-CE2 4.45Å; T213-F215 HydrophobicContact CG2-CZ 4.25Å; F215-L217 HydrophobicContact CB-CD1 3.72Å; F215-D243 HydrophobicContact CD2-CB 4.44Å; F215-D243 PolarHBondContact N-O 3.03Å; F215-L245 PolarHBondContact O-N 3.05Å
216	L	98.8	Very high	90.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.4	-175.7	-50.2	-178.5	0	0	0	110.6	A176 I177 K178 S179 V214 L245 W247 K259 F263	A176-L216 HydrophobicContact CB-CD1 4.18Å; I177-L216 PolarHBondContact O-N 2.78Å; K178-L216 HydrophobicContact CG-CD1 4.45Å; S179-L216 PolarHBondContact N-O 3.15Å; S179-L216 VanDerWaalsContact O-O 3.06Å; V214-L216 HydrophobicContact CG2-CD2 4.26Å; L216-L245 HydrophobicContact CD2-CB 4.29Å; L216-L245 HydrophobicContact CD2-CD1 3.91Å; L216-W247 HydrophobicContact CB-CZ3 4.43Å; L216-W247 HydrophobicContact CD2-CH2 4.06Å; L216-W247 HydrophobicContact CD2-CZ3 4.06Å; L216-K259 HydrophobicContact CB-CD 3.83Å; L216-K259 HydrophobicContact CB-CG 3.86Å; L216-K259 HydrophobicContact CD1-CG 4.41Å; L216-K259 WeakPolarHBondContact O-CD 3.37Å; L216-K259 WeakPolarHBondContact O-CE 3.31Å; L216-K259 PolarHBondContact O-NZ 2.9Å; L216-F263 HydrophobicContact CD1-CB 3.68Å; L216-F263 HydrophobicContact CD1-CD1 4.45Å; L216-F263 HydrophobicContact CD1-CD2 4.09Å; L216-F263 HydrophobicContact CD1-CG 3.79Å; L216-F263 HydrophobicContact CD2-CB 4.08Å; L216-F263 HydrophobicContact CD2-CD2 3.67Å; L216-F263 HydrophobicContact CD2-CG 4.14Å; L216-F263 HydrophobicContact CG-CD2 4.49Å
217	L	98.6	Very high	91.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.1	-175.4	-74	72.4	0	0	0	111.6	V181 F215 L234 I244 L245 Q246 W247	V181-L217 HydrophobicContact CG2-CD2 4.38Å; F215-L217 HydrophobicContact CB-CD1 3.72Å; L217-L234 HydrophobicContact CD2-CD1 3.74Å; L217-L234 HydrophobicContact CD2-CD2 4.01Å; L217-I244 HydrophobicContact CD1-CG2 4.28Å; L217-I244 HydrophobicContact CD2-CG2 4.38Å; L217-L245 PolarHBondContact N-O 2.78Å; L217-Q246 HydrophobicContact CB-CB 4.33Å; L217-Q246 HydrophobicContact CB-CG 4.07Å; L217-Q246 WeakPolarHBondContact O-CA 3.33Å; L217-W247 PolarHBondContact O-N 3.46Å; L217-W247 VanDerWaalsContact O-N 3.09Å
218	G	97.3	Very high	91.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-165.1	156.6	0	0	0	0	0	111.5	Q246 W247 F249 D251	G218-Q246 PolarHBondContact O-NE2 3.32Å; G218-W247 WeakPolarHBondContact CA-O 3.5Å; G218-F249 CarbonylContact C-O 3.4Å; G218-F249 WeakPolarHBondContact CA-O 3.3Å; G218-D251 PolarHBondContact N-OD2 3.1Å
219	R	94.8	Very high	91.3	Very high	117 Å²	117	47.6 Å²	47.6	44%	0.442	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	148.2	165.9	-72.4	-172.7	-76	155.1	-10.6	110.9	L153 D221 D248 F249 D251	L153-R219 HydrophobicContact CD1-CG 3.79Å; R219-D221 PolarHBondContact O-N 3.21Å; R219-D248 WeakPolarHBondContact CD-OD1 3.4Å; R219-D248 IonicContact CZ-OD1 3.41Å; R219-D248 VanDerWaalsContact CZ-OD1 3.25Å; R219-D248 PolarHBondContact NE-O 3.19Å; R219-D248 IonicContact NE-OD1 2.73Å; R219-D248 PolarHBondContact NE-OD1 3.05Å; R219-D248 PolarHBondContact NH2-O 3.23Å; R219-D248 IonicContact NH2-OD1 3.65Å; R219-F249 PolarHBondContact N-O 3.22Å; R219-D251 WeakPolarHBondContact O-CB 3.4Å; R219-D251 PolarHBondContact O-N 3.39Å
220	Q	91.9	Very high	91.3	Very high	55 Å²	55	49.1 Å²	49.1	26%	0.257	28%	0.277	S	S	.	.			trans	-52.8	131.9	172.6	-171.8	63.9	23.4	0	0	111	V181 S222 H227	V181-Q220 HydrophobicContact CG2-CB 4.42Å; Q220-S222 PolarHBondContact O-N 3.06Å; Q220-H227 HydrophobicContact CG-CB 3.81Å; Q220-H227 PolarHBondContact NE2-CD2 2.75Å; Q220-H227 PolarHBondContact NE2-CE1 2.91Å; Q220-H227 VanDerWaalsContact NE2-CG 3.32Å; Q220-H227 PolarHBondContact NE2-ND1 3.38Å; Q220-H227 VanDerWaalsContact NE2-ND1 3.17Å; Q220-H227 PolarHBondContact NE2-NE2 3.4Å
221	D	88.1	Confident	91.2	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.053	29%	0.29	C	S	.	.			trans	-75.4	104.1	176.9	-177.2	4	0	0	0	111.2	R219 T223 T224 H227 R250 T252	R219-D221 PolarHBondContact O-N 3.21Å; D221-T223 PolarHBondContact O-N 3.47Å; D221-T223 PolarHBondContact OD1-N 3.26Å; D221-T223 PolarHBondContact OD1-OG1 2.84Å; D221-T223 PolarHBondContact OD2-OG1 3.45Å; D221-T224 HydrophobicContact CB-CG2 4.15Å; D221-T224 PolarHBondContact O-N 3.37Å; D221-T224 PolarHBondContact O-OG1 3.32Å; D221-H227 PolarHBondContact O-CD2 3.37Å; D221-H227 PolarHBondContact O-NE2 3Å; D221-R250 HydrophobicContact CB-CG 4.46Å; D221-R250 VanDerWaalsContact CG-NH2 3.35Å; D221-R250 IonicContact OD1-CZ 2.92Å; D221-R250 IonicContact OD1-NE 3.76Å; D221-R250 PolarHBondContact OD1-NE 2.97Å; D221-R250 IonicContact OD1-NH2 3.22Å; D221-R250 PolarHBondContact OD1-NH2 3.17Å; D221-R250 IonicContact OD2-CZ 2.81Å; D221-R250 IonicContact OD2-NE 2.75Å; D221-R250 IonicContact OD2-NH2 3.07Å; D221-R250 PolarHBondContact OD2-NH2 3.11Å; D221-R250 VanDerWaalsContact OD2-NH2 3.16Å; D221-T252 HydrophobicContact CB-CG2 4.36Å; D221-T252 WeakPolarHBondContact OD2-CG2 3.45Å
222	S	81.3	Confident	91.1	Very high	93 Å²	93	51.9 Å²	51.9	65%	0.65	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-64.4	-17	179.2	59.8	0	0	0	0	114.7	Q220 T224	Q220-S222 PolarHBondContact O-N 3.06Å; S222-T224 VanDerWaalsContact C-N 3.31Å
223	T	79.3	Confident	91.1	Very high	67 Å²	67	53.7 Å²	53.7	41%	0.411	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-83.2	-9.7	177.8	75.5	0	0	0	0	113	D221 G225 R250	D221-T223 PolarHBondContact O-N 3.47Å; D221-T223 PolarHBondContact OD1-N 3.26Å; D221-T223 PolarHBondContact OD1-OG1 2.84Å; D221-T223 PolarHBondContact OD2-OG1 3.45Å; T223-G225 PolarHBondContact O-N 2.92Å; T223-R250 PolarHBondContact OG1-NH2 3.26Å
224	T	80.3	Confident	91	Very high	87 Å²	87	53.6 Å²	53.6	53%	0.534	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-82.5	5.3	176.4	57.6	0	0	0	0	112.8	D221 S222 H227	D221-T224 HydrophobicContact CB-CG2 4.15Å; D221-T224 PolarHBondContact O-N 3.37Å; D221-T224 PolarHBondContact O-OG1 3.32Å; S222-T224 VanDerWaalsContact C-N 3.31Å; T224-H227 PolarHBondContact OG1-CE1 2.99Å; T224-H227 PolarHBondContact OG1-NE2 2.81Å
225	G	79.8	Confident	91	Very high	30 Å²	30	58.1 Å²	58.1	31%	0.309	35%	0.345	S	S	.	.			trans	121.9	-179.8	176.2	0	0	0	0	0	113	T223 H227	T223-G225 PolarHBondContact O-N 2.92Å; G225-H227 PolarHBondContact O-CD2 3.32Å; G225-H227 PolarHBondContact O-N 2.91Å; G225-H227 PolarHBondContact O-NE2 2.93Å
226	P	82.6	Confident	91	Very high	136 Å²	136	63 Å²	63	88%	0.883	37%	0.371	S	S	*	.			trans	-66.8	121	172.4	28.3	-32	0	0	0	109.2
227	H	83.3	Confident	90.9	Very high	76 Å²	76	63.7 Å²	63.7	35%	0.352	37%	0.374	S	S	.	.			trans	-109	144.7	173.7	-65	-71.2	0	0	0	109.8	Q220 D221 T224 G225	Q220-H227 HydrophobicContact CG-CB 3.81Å; Q220-H227 PolarHBondContact NE2-CD2 2.75Å; Q220-H227 PolarHBondContact NE2-CE1 2.91Å; Q220-H227 VanDerWaalsContact NE2-CG 3.32Å; Q220-H227 PolarHBondContact NE2-ND1 3.38Å; Q220-H227 VanDerWaalsContact NE2-ND1 3.17Å; Q220-H227 PolarHBondContact NE2-NE2 3.4Å; D221-H227 PolarHBondContact O-CD2 3.37Å; D221-H227 PolarHBondContact O-NE2 3Å; T224-H227 PolarHBondContact OG1-CE1 2.99Å; T224-H227 PolarHBondContact OG1-NE2 2.81Å; G225-H227 PolarHBondContact O-CD2 3.32Å; G225-H227 PolarHBondContact O-N 2.91Å; G225-H227 PolarHBondContact O-NE2 2.93Å
228	P	88.7	Confident	90.9	Very high	91 Å²	91	64.2 Å²	64.2	59%	0.591	38%	0.378	S	S	*	.			trans	-60.7	149.4	167.9	26.2	-31.7	0	0	0	109.9	L230	P228-L230 HydrophobicContact CB-CD2 4.26Å; P228-L230 HydrophobicContact CB-CG 4.35Å; P228-L230 HydrophobicContact CG-CD1 4.09Å; P228-L230 HydrophobicContact CG-CD2 3.97Å; P228-L230 HydrophobicContact CG-CG 3.94Å; P228-L230 PolarHBondContact O-N 3.18Å; P228-L230 VanDerWaalsContact O-N 3.11Å
229	D	90.3	Very high	90.9	Very high	154 Å²	154	70.9 Å²	70.9	82%	0.824	41%	0.409	S	S	*	.			trans	-71.5	105.8	168.5	-178	5.7	0	0	0	109.1	G231	D229-G231 PolarHBondContact OD1-N 2.87Å
230	L	94.6	Very high	91	Very high	34 Å²	34	72.1 Å²	72.1	18%	0.178	42%	0.42	C	S	.	.			trans	-103.1	5.3	-178.5	-62.5	170.6	0	0	0	112.1	V181 F184 P228 G232 L233 L234	V181-L230 HydrophobicContact CG1-CB 3.76Å; V181-L230 HydrophobicContact CG1-CD1 4.35Å; F184-L230 HydrophobicContact CE2-CB 4.23Å; F184-L230 HydrophobicContact CE2-CD1 4.16Å; F184-L230 HydrophobicContact CE2-CD2 4.35Å; F184-L230 HydrophobicContact CE2-CG 4.47Å; F184-L230 HydrophobicContact CZ-CB 4.44Å; P228-L230 HydrophobicContact CB-CD2 4.26Å; P228-L230 HydrophobicContact CB-CG 4.35Å; P228-L230 HydrophobicContact CG-CD1 4.09Å; P228-L230 HydrophobicContact CG-CD2 3.97Å; P228-L230 HydrophobicContact CG-CG 3.94Å; P228-L230 PolarHBondContact O-N 3.18Å; P228-L230 VanDerWaalsContact O-N 3.11Å; L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 2.82Å; L230-L233 HydrophobicContact CD2-CD1 3.95Å; L230-L233 PolarHBondContact O-N 3.17Å; L230-L234 WeakPolarHBondContact O-CB 3.47Å; L230-L234 PolarHBondContact O-N 3.46Å
231	G	93.7	Very high	91.3	Very high	34 Å²	34	74.3 Å²	74.3	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-59.4	-42.7	-174.7	0	0	0	0	0	113	D229 L234 M235	D229-G231 PolarHBondContact OD1-N 2.87Å; G231-L234 PolarHBondContact O-N 3.2Å; G231-M235 WeakPolarHBondContact O-CB 3.37Å; G231-M235 PolarHBondContact O-N 2.87Å
232	G	95.9	Very high	91.7	Very high	42 Å²	42	75 Å²	75	43%	0.433	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-42.2	176.4	0	0	0	0	0	113.3	L230 M235 L236	L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 2.82Å; G232-M235 PolarHBondContact O-N 3.1Å; G232-L236 WeakPolarHBondContact O-CG 3.45Å; G232-L236 PolarHBondContact O-N 2.85Å; G232-L236 VanDerWaalsContact O-N 3.13Å
233	L	97.3	Very high	92.5	Very high	98 Å²	98	71.2 Å²	71.2	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-67.6	-40.5	177.1	-68.9	176.5	0	0	0	111.8	F184 L230 M235 L236 E237	F184-L233 HydrophobicContact CE1-CB 4.22Å; F184-L233 HydrophobicContact CZ-CB 3.84Å; L230-L233 HydrophobicContact CD2-CD1 3.95Å; L230-L233 PolarHBondContact O-N 3.17Å; L233-M235 VanDerWaalsContact C-N 3.31Å; L233-M235 PolarHBondContact O-N 3.05Å; L233-L236 PolarHBondContact O-N 2.92Å; L233-E237 PolarHBondContact O-N 3.4Å
234	L	97.9	Very high	93.4	Very high	1 Å²	1	68 Å²	68	1%	0.005	39%	0.389	C	S	.	.	H	α-helix	trans	-63.9	-38.4	176.4	-170	70.6	0	0	0	111.6	M154 V181 F184 L217 L230 G231 E237 S238 I244	M154-L234 HydrophobicContact CE-CB 4.35Å; M154-L234 HydrophobicContact CE-CD2 4.1Å; M154-L234 HydrophobicContact CE-CG 4.12Å; M154-L234 HydrophobicContact SD-CD2 4.43Å; M154-L234 HydrophobicContact SD-CG 4.3Å; V181-L234 HydrophobicContact CG1-CD2 4.22Å; V181-L234 HydrophobicContact CG2-CD2 4.23Å; F184-L234 HydrophobicContact CE1-CB 4.49Å; F184-L234 HydrophobicContact CE1-CD1 4.22Å; F184-L234 HydrophobicContact CZ-CB 4.22Å; F184-L234 HydrophobicContact CZ-CD1 4.32Å; L217-L234 HydrophobicContact CD2-CD1 3.74Å; L217-L234 HydrophobicContact CD2-CD2 4.01Å; L230-L234 WeakPolarHBondContact O-CB 3.47Å; L230-L234 PolarHBondContact O-N 3.46Å; G231-L234 PolarHBondContact O-N 3.2Å; L234-E237 PolarHBondContact O-N 3.43Å; L234-S238 VanDerWaalsContact O-CB 3.31Å; L234-S238 WeakPolarHBondContact O-CB 3.4Å; L234-S238 PolarHBondContact O-N 3.25Å; L234-I244 HydrophobicContact CD1-CD1 3.72Å; L234-I244 HydrophobicContact CG-CD1 4.36Å
235	M	97.6	Very high	94.3	Very high	95 Å²	95	63.9 Å²	63.9	47%	0.468	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-42.8	175.5	-176.6	175.9	64.8	0	0	111.6	M154 G231 G232 L233 S238 Q239	M154-M235 HydrophobicContact CE-CB 3.99Å; G231-M235 WeakPolarHBondContact O-CB 3.37Å; G231-M235 PolarHBondContact O-N 2.87Å; G232-M235 PolarHBondContact O-N 3.1Å; L233-M235 VanDerWaalsContact C-N 3.31Å; L233-M235 PolarHBondContact O-N 3.05Å; M235-S238 PolarHBondContact O-N 3.46Å; M235-Q239 WeakPolarHBondContact O-CG 3.06Å; M235-Q239 PolarHBondContact O-N 2.98Å
236	L	98.1	Very high	95.2	Very high	103 Å²	103	63.2 Å²	63.2	54%	0.539	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-43.7	175.1	-70.1	171.9	0	0	0	111.6	G232 L233 S238 Q239 Q240	G232-L236 WeakPolarHBondContact O-CG 3.45Å; G232-L236 PolarHBondContact O-N 2.85Å; G232-L236 VanDerWaalsContact O-N 3.13Å; L233-L236 PolarHBondContact O-N 2.92Å; L236-S238 PolarHBondContact O-N 3.06Å; L236-Q239 PolarHBondContact O-N 2.78Å; L236-Q240 VanDerWaalsContact O-CB 3.32Å; L236-Q240 WeakPolarHBondContact O-CB 2.99Å; L236-Q240 PolarHBondContact O-N 3.29Å
237	E	98.4	Very high	95.9	Very high	15 Å²	15	56.9 Å²	56.9	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-46.6	174.8	-171	-169.6	-177.9	0	0	111.2	F184 R187 R191 L233 L234 Q239 Q240 Y241 I244	F184-E237 WeakPolarHBondContact CD1-OE2 3.46Å; F184-E237 HydrophobicContact CE1-CB 4.22Å; F184-E237 WeakPolarHBondContact CE1-OE2 3.47Å; R187-E237 IonicContact CZ-OE1 2.7Å; R187-E237 IonicContact CZ-OE2 3.15Å; R187-E237 VanDerWaalsContact CZ-OE2 3.31Å; R187-E237 IonicContact NE-OE1 2.81Å; R187-E237 PolarHBondContact NE-OE1 2.99Å; R187-E237 IonicContact NE-OE2 3.3Å; R187-E237 PolarHBondContact NE-OE2 3.19Å; R187-E237 VanDerWaalsContact NE-OE2 3.13Å; R187-E237 IonicContact NH2-OE1 3.89Å; R187-E237 IonicContact NH2-OE2 2.78Å; R187-E237 PolarHBondContact NH2-OE2 3.38Å; R191-E237 IonicContact CZ-OE1 2.9Å; R191-E237 IonicContact NH1-OE1 3.83Å; R191-E237 PolarHBondContact NH1-OE1 3.26Å; R191-E237 IonicContact NH2-OE1 3.9Å; R191-E237 PolarHBondContact NH2-OE1 3.24Å; L233-E237 PolarHBondContact O-N 3.4Å; L234-E237 PolarHBondContact O-N 3.43Å; E237-Q239 PolarHBondContact O-N 3.21Å; E237-Q240 PolarHBondContact O-N 3.41Å; E237-Y241 HydrophobicContact CG-CD2 3.72Å; E237-Y241 HydrophobicContact CG-CE2 4.07Å; E237-Y241 VanDerWaalsContact O-CD2 3.3Å; E237-Y241 WeakPolarHBondContact O-CD2 3.42Å; E237-Y241 PolarHBondContact O-N 3.32Å; E237-I244 HydrophobicContact CB-CD1 3.98Å; E237-I244 HydrophobicContact CG-CD1 3.77Å; E237-I244 WeakPolarHBondContact OE2-CD1 3.42Å
238	S	98	Very high	96.5	Very high	11 Å²	11	55.7 Å²	55.7	8%	0.077	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-41.4	178.8	-172.7	0	0	0	0	112.3	M154 Q156 L234 M235 L236 G242	M154-S238 VanDerWaalsContact SD-CB 3.53Å; Q156-S238 PolarHBondContact NE2-OG 3.46Å; L234-S238 VanDerWaalsContact O-CB 3.31Å; L234-S238 WeakPolarHBondContact O-CB 3.4Å; L234-S238 PolarHBondContact O-N 3.25Å; M235-S238 PolarHBondContact O-N 3.46Å; L236-S238 PolarHBondContact O-N 3.06Å; S238-G242 VanDerWaalsContact O-CA 3.29Å; S238-G242 WeakPolarHBondContact O-CA 3.28Å; S238-G242 PolarHBondContact O-N 2.95Å
239	Q	97.3	Very high	96.8	Very high	139 Å²	139	51.4 Å²	51.4	65%	0.65	28%	0.279	S	S	*	.	H	α-helix	trans	-67.6	-38.6	175.7	-73.3	175.6	3.7	0	0	112.5	M235 L236 E237	M235-Q239 WeakPolarHBondContact O-CG 3.06Å; M235-Q239 PolarHBondContact O-N 2.98Å; L236-Q239 PolarHBondContact O-N 2.78Å; E237-Q239 PolarHBondContact O-N 3.21Å
240	Q	97.4	Very high	97	Very high	143 Å²	143	47.4 Å²	47.4	67%	0.668	25%	0.253	S	S	*	.	H	α-helix	trans	-71.1	-42.9	-178.1	179.2	61.9	29.2	0	0	112.5	L236 E237	L236-Q240 VanDerWaalsContact O-CB 3.32Å; L236-Q240 WeakPolarHBondContact O-CB 2.99Å; L236-Q240 PolarHBondContact O-N 3.29Å; E237-Q240 PolarHBondContact O-N 3.41Å
241	Y	97.4	Very high	97	Very high	102 Å²	102	46.2 Å²	46.2	40%	0.4	25%	0.246	S	C	.	.	H	α-helix	trans	-106.9	-23.1	-171	-61.6	-72.5	0	0	0	114.3	Q188 E237 D243	Q188-Y241 PolarHBondContact OE1-OH 3.27Å; Q188-Y241 VanDerWaalsContact OE1-OH 3.14Å; E237-Y241 HydrophobicContact CG-CD2 3.72Å; E237-Y241 HydrophobicContact CG-CE2 4.07Å; E237-Y241 VanDerWaalsContact O-CD2 3.3Å; E237-Y241 WeakPolarHBondContact O-CD2 3.42Å; E237-Y241 PolarHBondContact O-N 3.32Å; Y241-D243 WeakPolarHBondContact CB-OD1 3.48Å; Y241-D243 PolarHBondContact O-N 3.4Å
242	G	97	Very high	97.1	Very high	25 Å²	25	45.4 Å²	45.4	26%	0.258	24%	0.235	S	C	.	.	S	Bend	trans	64.4	24.7	177.6	0	0	0	0	0	114.4	Q156 S238	Q156-G242 WeakPolarHBondContact CB-O 3.33Å; Q156-G242 VanDerWaalsContact CD-C 3.41Å; Q156-G242 VanDerWaalsContact CG-O 3.27Å; Q156-G242 WeakPolarHBondContact CG-O 3.17Å; Q156-G242 PolarHBondContact OE1-O 2.99Å; S238-G242 VanDerWaalsContact O-CA 3.29Å; S238-G242 WeakPolarHBondContact O-CA 3.28Å; S238-G242 PolarHBondContact O-N 2.95Å
243	D	97.9	Very high	97	Very high	12 Å²	12	45.7 Å²	45.7	6%	0.064	22%	0.224	C	C	.	.			trans	-123	9.1	-171.6	61.8	10	0	0	0	114.2	R191 T213 V214 F215 Y241	R191-D243 IonicContact CZ-OD1 2.66Å; R191-D243 IonicContact CZ-OD2 3.31Å; R191-D243 IonicContact NE-OD1 2.7Å; R191-D243 IonicContact NE-OD2 3.13Å; R191-D243 PolarHBondContact NE-OD2 2.81Å; R191-D243 IonicContact NH2-OD1 3.54Å; R191-D243 PolarHBondContact NH2-OD1 3.49Å; R191-D243 IonicContact NH2-OD2 2.72Å; R191-D243 PolarHBondContact NH2-OD2 3.05Å; T213-D243 WeakPolarHBondContact O-CB 3.32Å; V214-D243 CarbonylContact C-O 3.55Å; V214-D243 VanDerWaalsContact CA-O 3.27Å; V214-D243 WeakPolarHBondContact CA-O 3.43Å; F215-D243 HydrophobicContact CD2-CB 4.44Å; F215-D243 PolarHBondContact N-O 3.03Å; Y241-D243 WeakPolarHBondContact CB-OD1 3.48Å; Y241-D243 PolarHBondContact O-N 3.4Å
244	I	98.7	Very high	97	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.3	-178.7	-58.3	-174.5	0	0	0	111.2	M154 Q156 L217 L234 E237 Q246	M154-I244 HydrophobicContact SD-CG2 4.35Å; Q156-I244 VanDerWaalsContact CG-O 3.27Å; Q156-I244 WeakPolarHBondContact CG-O 3.34Å; L217-I244 HydrophobicContact CD1-CG2 4.28Å; L217-I244 HydrophobicContact CD2-CG2 4.38Å; L234-I244 HydrophobicContact CD1-CD1 3.72Å; L234-I244 HydrophobicContact CG-CD1 4.36Å; E237-I244 HydrophobicContact CB-CD1 3.98Å; E237-I244 HydrophobicContact CG-CD1 3.77Å; E237-I244 WeakPolarHBondContact OE2-CD1 3.42Å; I244-Q246 HydrophobicContact CG2-CB 4.49Å
245	L	98.8	Very high	96.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.6	167.2	-55.7	179.2	0	0	0	108.7	Q156 V214 F215 L216 L217 W247 W266	Q156-L245 HydrophobicContact CB-CD2 3.9Å; Q156-L245 HydrophobicContact CG-CD2 4.07Å; V214-L245 HydrophobicContact CB-CD1 4.07Å; V214-L245 HydrophobicContact CB-CG 4.27Å; V214-L245 HydrophobicContact CG1-CD1 4.4Å; V214-L245 HydrophobicContact CG2-CD1 4.02Å; F215-L245 PolarHBondContact O-N 3.05Å; L216-L245 HydrophobicContact CD2-CB 4.29Å; L216-L245 HydrophobicContact CD2-CD1 3.91Å; L217-L245 PolarHBondContact N-O 2.78Å; L245-W247 HydrophobicContact CB-CE3 4.43Å; L245-W247 HydrophobicContact CB-CH2 3.58Å; L245-W247 HydrophobicContact CB-CZ2 4.43Å; L245-W247 HydrophobicContact CB-CZ3 3.57Å; L245-W247 HydrophobicContact CD1-CH2 3.96Å; L245-W247 HydrophobicContact CG-CH2 4.4Å; L245-W266 HydrophobicContact CD1-CD2 3.44Å; L245-W266 VanDerWaalsContact CD1-CD2 3.44Å; L245-W266 HydrophobicContact CD1-CE3 3.74Å; L245-W266 HydrophobicContact CD1-CG 3.84Å; L245-W266 HydrophobicContact CD1-CH2 4.24Å; L245-W266 HydrophobicContact CD1-CZ2 3.96Å; L245-W266 HydrophobicContact CD1-CZ3 4.14Å; L245-W266 HydrophobicContact CD2-CD2 4.35Å; L245-W266 HydrophobicContact CD2-CZ2 4.02Å
246	Q	98.5	Very high	96.9	Very high	16 Å²	16	38.7 Å²	38.7	8%	0.075	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.4	179.8	-168	-176.4	23.7	0	0	110.7	F152 L153 M154 L217 G218 I244	F152-Q246 CarbonylContact C-O 3.59Å; F152-Q246 WeakPolarHBondContact CA-O 3.39Å; L153-Q246 HydrophobicContact CB-CB 4.25Å; L153-Q246 HydrophobicContact CB-CG 4.13Å; L153-Q246 HydrophobicContact CD1-CG 4.16Å; L153-Q246 PolarHBondContact N-O 2.91Å; M154-Q246 HydrophobicContact CB-CB 4Å; M154-Q246 HydrophobicContact CG-CB 4.29Å; M154-Q246 PolarHBondContact N-O 2.65Å; M154-Q246 VanDerWaalsContact N-O 3.14Å; M154-Q246 PolarHBondContact O-N 2.9Å; L217-Q246 HydrophobicContact CB-CB 4.33Å; L217-Q246 HydrophobicContact CB-CG 4.07Å; L217-Q246 WeakPolarHBondContact O-CA 3.33Å; G218-Q246 PolarHBondContact O-NE2 3.32Å; I244-Q246 HydrophobicContact CG2-CB 4.49Å
247	W	98.2	Very high	96.8	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.015	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	157.7	175.4	-67.3	-94.8	0	0	0	111.9	P151 F152 L216 L217 G218 L245 F249 L262 W266	P151-W247 WeakPolarHBondContact O-CA 3.05Å; F152-W247 AromaticContact CD1-CD1 3.89Å; F152-W247 HydrophobicContact CD1-CD2 4.25Å; F152-W247 AromaticContact CD1-CE2 3.74Å; F152-W247 HydrophobicContact CD1-CG 4.36Å; F152-W247 HydrophobicContact CD1-CZ2 4.23Å; F152-W247 AromaticContact CD1-NE1 3.48Å; F152-W247 AromaticContact CE1-CD1 3.96Å; F152-W247 HydrophobicContact CE1-CD2 4.08Å; F152-W247 AromaticContact CE1-CE2 3.16Å; F152-W247 HydrophobicContact CE1-CH2 4.22Å; F152-W247 AromaticContact CE1-CZ2 3.28Å; F152-W247 HydrophobicContact CE1-CZ2 3.28Å; F152-W247 AromaticContact CE1-NE1 3.08Å; F152-W247 AromaticContact CE2-NE1 3.79Å; F152-W247 AromaticContact CZ-CE2 3.65Å; F152-W247 AromaticContact CZ-CZ2 3.72Å; F152-W247 HydrophobicContact CZ-CZ2 3.72Å; F152-W247 AromaticContact CZ-NE1 3.22Å; L216-W247 HydrophobicContact CB-CZ3 4.43Å; L216-W247 HydrophobicContact CD2-CH2 4.06Å; L216-W247 HydrophobicContact CD2-CZ3 4.06Å; L217-W247 PolarHBondContact O-N 3.46Å; L217-W247 VanDerWaalsContact O-N 3.09Å; G218-W247 WeakPolarHBondContact CA-O 3.5Å; L245-W247 HydrophobicContact CB-CE3 4.43Å; L245-W247 HydrophobicContact CB-CH2 3.58Å; L245-W247 HydrophobicContact CB-CZ2 4.43Å; L245-W247 HydrophobicContact CB-CZ3 3.57Å; L245-W247 HydrophobicContact CD1-CH2 3.96Å; L245-W247 HydrophobicContact CG-CH2 4.4Å; W247-F249 HydrophobicContact CB-CD1 3.65Å; W247-F249 HydrophobicContact CB-CE1 3.95Å; W247-F249 PolarHBondContact O-N 3.07Å; W247-L262 HydrophobicContact CB-CD1 3.84Å; W247-L262 HydrophobicContact CD2-CB 3.95Å; W247-L262 HydrophobicContact CD2-CD1 4.18Å; W247-L262 HydrophobicContact CG-CB 4.24Å; W247-L262 HydrophobicContact CG-CD1 3.75Å; W247-L262 HydrophobicContact CG-CG 4.4Å; W247-L262 HydrophobicContact CZ2-CB 3.99Å; W247-L262 WeakPolarHBondContact CZ2-O 3.35Å; W247-W266 HydrophobicContact CZ2-CB 3.96Å
248	D	95.6	Very high	96.8	Very high	51 Å²	51	33.2 Å²	33.2	27%	0.273	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	34.3	-175.4	-164.6	21.7	0	0	0	114.9	Y150 P151 L153 R219	Y150-D248 WeakPolarHBondContact CD1-O 3.46Å; P151-D248 HydrophobicContact CG-CB 3.82Å; P151-D248 PolarHBondContact O-N 3.03Å; L153-D248 HydrophobicContact CD1-CB 4.28Å; L153-D248 HydrophobicContact CD2-CB 3.95Å; L153-D248 HydrophobicContact CG-CB 3.99Å; R219-D248 WeakPolarHBondContact CD-OD1 3.4Å; R219-D248 IonicContact CZ-OD1 3.41Å; R219-D248 VanDerWaalsContact CZ-OD1 3.25Å; R219-D248 PolarHBondContact NE-O 3.19Å; R219-D248 IonicContact NE-OD1 2.73Å; R219-D248 PolarHBondContact NE-OD1 3.05Å; R219-D248 PolarHBondContact NH2-O 3.23Å; R219-D248 IonicContact NH2-OD1 3.65Å
249	F	94.8	Very high	96.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	155.9	173.5	77.7	-81.2	0	0	0	111.1	Y150 G218 R219 W247 D251 N255 L258 K259 L262	Y150-F249 HydrophobicContact CD1-CB 3.64Å; Y150-F249 HydrophobicContact CD2-CB 3.99Å; Y150-F249 HydrophobicContact CE1-CB 3.74Å; Y150-F249 HydrophobicContact CE2-CB 4.08Å; Y150-F249 HydrophobicContact CG-CB 3.76Å; G218-F249 CarbonylContact C-O 3.4Å; G218-F249 WeakPolarHBondContact CA-O 3.3Å; R219-F249 PolarHBondContact N-O 3.22Å; W247-F249 HydrophobicContact CB-CD1 3.65Å; W247-F249 HydrophobicContact CB-CE1 3.95Å; W247-F249 PolarHBondContact O-N 3.07Å; F249-D251 HydrophobicContact CE2-CB 4.43Å; F249-D251 PolarHBondContact O-N 2.99Å; F249-N255 HydrophobicContact CD2-CB 3.98Å; F249-N255 HydrophobicContact CE2-CB 3.98Å; F249-L258 HydrophobicContact CB-CD2 3.65Å; F249-L258 HydrophobicContact CD1-CD2 4.45Å; F249-L258 HydrophobicContact CD2-CD2 3.72Å; F249-L258 HydrophobicContact CD2-CG 4.45Å; F249-L258 HydrophobicContact CG-CD2 3.69Å; F249-L258 HydrophobicContact CG-CG 4.42Å; F249-K259 HydrophobicContact CE2-CB 4.42Å; F249-K259 HydrophobicContact CZ-CB 3.77Å; F249-K259 HydrophobicContact CZ-CG 4.09Å; F249-L262 HydrophobicContact CD1-CD1 3.63Å; F249-L262 HydrophobicContact CE1-CD1 3.89Å; F249-L262 HydrophobicContact CG-CD1 4.42Å
250	R	94	Very high	96.7	Very high	71 Å²	71	26.2 Å²	26.2	27%	0.268	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	118	176.3	-175.4	-178.6	162.3	-160.4	-19	110.4	D221 T223 T252 N255	D221-R250 HydrophobicContact CB-CG 4.46Å; D221-R250 VanDerWaalsContact CG-NH2 3.35Å; D221-R250 IonicContact OD1-CZ 2.92Å; D221-R250 IonicContact OD1-NE 3.76Å; D221-R250 PolarHBondContact OD1-NE 2.97Å; D221-R250 IonicContact OD1-NH2 3.22Å; D221-R250 PolarHBondContact OD1-NH2 3.17Å; D221-R250 IonicContact OD2-CZ 2.81Å; D221-R250 IonicContact OD2-NE 2.75Å; D221-R250 IonicContact OD2-NH2 3.07Å; D221-R250 PolarHBondContact OD2-NH2 3.11Å; D221-R250 VanDerWaalsContact OD2-NH2 3.16Å; T223-R250 PolarHBondContact OG1-NH2 3.26Å; R250-T252 HydrophobicContact CG-CG2 3.83Å; R250-T252 PolarHBondContact O-N 2.02Å; R250-T252 VanDerWaalsContact O-N 3.09Å; R250-N255 PolarHBondContact O-ND2 2.88Å
251	D	95.1	Very high	96.7	Very high	8 Å²	8	20.3 Å²	20.3	4%	0.043	10%	0.099	C	C	.	.			trans	-81.3	90.3	-173	-155.5	-16.3	0	0	0	111.8	G218 R219 F249 K259	G218-D251 PolarHBondContact N-OD2 3.1Å; R219-D251 WeakPolarHBondContact O-CB 3.4Å; R219-D251 PolarHBondContact O-N 3.39Å; F249-D251 HydrophobicContact CE2-CB 4.43Å; F249-D251 PolarHBondContact O-N 2.99Å; D251-K259 WeakPolarHBondContact OD1-CE 3.13Å; D251-K259 IonicContact OD1-NZ 3.69Å; D251-K259 PolarHBondContact OD1-NZ 3.49Å; D251-K259 WeakPolarHBondContact OD2-CE 3.22Å; D251-K259 IonicContact OD2-NZ 3.92Å; D251-K259 PolarHBondContact OD2-NZ 3.32Å
252	T	94.6	Very high	96.8	Very high	18 Å²	18	15.8 Å²	15.8	11%	0.11	8%	0.082	C	C	.	.			trans	-118.7	163.3	178.7	75.8	0	0	0	0	110.5	D221 R250 F254 N255 L256	D221-T252 HydrophobicContact CB-CG2 4.36Å; D221-T252 WeakPolarHBondContact OD2-CG2 3.45Å; R250-T252 HydrophobicContact CG-CG2 3.83Å; R250-T252 PolarHBondContact O-N 2.02Å; R250-T252 VanDerWaalsContact O-N 3.09Å; T252-F254 VanDerWaalsContact C-N 3.26Å; T252-F254 PolarHBondContact O-N 3.44Å; T252-F254 PolarHBondContact OG1-N 3.45Å; T252-N255 PolarHBondContact O-N 3.5Å; T252-N255 PolarHBondContact OG1-N 2.69Å; T252-L256 PolarHBondContact O-N 3.32Å
253	F	94.7	Very high	96.8	Very high	48 Å²	48	14.6 Å²	14.6	21%	0.211	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-55	-40.6	175.7	-176	-101.9	0	0	0	112.5	N255 L256 K336 Y337	F253-N255 VanDerWaalsContact C-N 3.28Å; F253-N255 PolarHBondContact O-N 2.81Å; F253-L256 HydrophobicContact CD2-CD1 3.72Å; F253-L256 HydrophobicContact CE2-CD1 3.95Å; F253-L256 WeakPolarHBondContact O-CB 3.41Å; F253-L256 VanDerWaalsContact O-CG 3.27Å; F253-L256 WeakPolarHBondContact O-CG 3.29Å; F253-L256 PolarHBondContact O-N 3.48Å; F253-K336 HydrophobicContact CD1-CB 4.39Å; F253-K336 WeakPolarHBondContact CD1-O 3.23Å; F253-K336 HydrophobicContact CE1-CG 4.46Å; F253-K336 WeakPolarHBondContact CE1-O 3.38Å; F253-K336 HydrophobicContact CE2-CD 4.29Å; F253-K336 HydrophobicContact CZ-CD 4.42Å; F253-Y337 HydrophobicContact CE1-CD1 4.06Å; F253-Y337 HydrophobicContact CE1-CE1 4.26Å; F253-Y337 HydrophobicContact CE2-CE1 4.36Å; F253-Y337 AromaticContact CZ-CD1 3.78Å; F253-Y337 HydrophobicContact CZ-CD1 3.78Å; F253-Y337 AromaticContact CZ-CE1 3.53Å; F253-Y337 HydrophobicContact CZ-CE1 3.53Å
254	F	96.1	Very high	96.8	Very high	6 Å²	6	14 Å²	14	3%	0.026	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-75.4	-14.1	178.5	-73.8	0.2	0	0	0	114.2	Q137 M138 F141 T252 K336 P378	Q137-F254 HydrophobicContact CB-CD2 3.97Å; Q137-F254 HydrophobicContact CB-CE2 4.03Å; Q137-F254 WeakPolarHBondContact O-CD2 3.43Å; M138-F254 HydrophobicContact CB-CE2 4.07Å; M138-F254 HydrophobicContact SD-CD2 4.47Å; M138-F254 HydrophobicContact SD-CE2 3.76Å; M138-F254 HydrophobicContact SD-CZ 4.48Å; F141-F254 HydrophobicContact CB-CB 4.13Å; F141-F254 HydrophobicContact CB-CD2 3.93Å; F141-F254 HydrophobicContact CD2-CB 3.86Å; F141-F254 WeakPolarHBondContact CD2-O 3.48Å; F141-F254 WeakPolarHBondContact CE2-O 3.46Å; F141-F254 HydrophobicContact CG-CB 4.27Å; F141-F254 HydrophobicContact CG-CD2 4.46Å; T252-F254 VanDerWaalsContact C-N 3.26Å; T252-F254 PolarHBondContact O-N 3.44Å; T252-F254 PolarHBondContact OG1-N 3.45Å; F254-K336 WeakPolarHBondContact CE1-O 3.2Å; F254-P378 WeakPolarHBondContact CA-O 3.32Å; F254-P378 HydrophobicContact CB-CB 4.09Å; F254-P378 HydrophobicContact CD1-CB 3.69Å; F254-P378 WeakPolarHBondContact CD1-O 3.48Å; F254-P378 HydrophobicContact CD2-CB 3.84Å; F254-P378 HydrophobicContact CE1-CB 3.99Å; F254-P378 HydrophobicContact CE2-CB 4.12Å; F254-P378 HydrophobicContact CG-CB 3.63Å; F254-P378 HydrophobicContact CZ-CB 4.21Å
255	N	96.8	Very high	96.8	Very high	18 Å²	18	18 Å²	18	10%	0.096	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-96.1	5.7	175	-72.3	-17.3	0	0	0	113.3	F249 R250 T252 F253 T257 L258 K259	F249-N255 HydrophobicContact CD2-CB 3.98Å; F249-N255 HydrophobicContact CE2-CB 3.98Å; R250-N255 PolarHBondContact O-ND2 2.88Å; T252-N255 PolarHBondContact O-N 3.5Å; T252-N255 PolarHBondContact OG1-N 2.69Å; F253-N255 VanDerWaalsContact C-N 3.28Å; F253-N255 PolarHBondContact O-N 2.81Å; N255-T257 PolarHBondContact O-N 2.88Å; N255-L258 WeakPolarHBondContact O-CB 3.25Å; N255-L258 PolarHBondContact O-N 3.48Å; N255-L258 VanDerWaalsContact O-N 3.08Å; N255-K259 PolarHBondContact O-N 2.94Å
256	L	96.9	Very high	96.7	Very high	22 Å²	22	18.1 Å²	18.1	12%	0.115	9%	0.086	C	C	.	.	H	α-helix	trans	-60.2	-33.4	173.5	-67	178.8	0	0	0	111.9	K178 T252 F253 L258 K259 D260 D380	K178-L256 HydrophobicContact CD-CD2 4.32Å; T252-L256 PolarHBondContact O-N 3.32Å; F253-L256 HydrophobicContact CD2-CD1 3.72Å; F253-L256 HydrophobicContact CE2-CD1 3.95Å; F253-L256 WeakPolarHBondContact O-CB 3.41Å; F253-L256 VanDerWaalsContact O-CG 3.27Å; F253-L256 WeakPolarHBondContact O-CG 3.29Å; F253-L256 PolarHBondContact O-N 3.48Å; L256-L258 VanDerWaalsContact C-N 3.3Å; L256-L258 PolarHBondContact O-N 3.49Å; L256-K259 HydrophobicContact CD2-CD 4.38Å; L256-K259 VanDerWaalsContact O-CB 3.28Å; L256-K259 WeakPolarHBondContact O-CB 3.37Å; L256-K259 PolarHBondContact O-N 3.4Å; L256-K259 VanDerWaalsContact O-N 3.15Å; L256-D260 PolarHBondContact O-N 2.96Å; L256-D380 HydrophobicContact CB-CB 3.8Å
257	T	97.2	Very high	96.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.1	-38.9	174.2	-53	0	0	0	0	112.5	N255 D260 L261 L376 F377 D380 Y383	N255-T257 PolarHBondContact O-N 2.88Å; T257-D260 PolarHBondContact O-N 3.27Å; T257-L261 PolarHBondContact O-N 3.14Å; T257-L261 VanDerWaalsContact O-N 3.13Å; T257-L376 HydrophobicContact CG2-CD2 3.95Å; T257-F377 VanDerWaalsContact CB-O 3.3Å; T257-F377 WeakPolarHBondContact CB-O 3.19Å; T257-F377 PolarHBondContact OG1-O 2.88Å; T257-D380 VanDerWaalsContact OG1-CA 3.23Å; T257-D380 WeakPolarHBondContact OG1-CA 3.03Å; T257-D380 PolarHBondContact OG1-N 2.75Å; T257-Y383 HydrophobicContact CG2-CD1 3.3Å; T257-Y383 HydrophobicContact CG2-CD2 3.72Å; T257-Y383 HydrophobicContact CG2-CE1 3.77Å; T257-Y383 HydrophobicContact CG2-CE2 4.17Å; T257-Y383 HydrophobicContact CG2-CG 3.24Å
258	L	96.9	Very high	96.5	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-67.1	-40.5	175	173.9	66.4	0	0	0	110.7	Y150 F249 N255 L256 D260 L261 L262	Y150-L258 HydrophobicContact CD2-CD1 3.9Å; Y150-L258 HydrophobicContact CD2-CD2 3.69Å; Y150-L258 HydrophobicContact CD2-CG 4.22Å; Y150-L258 HydrophobicContact CE2-CD1 3.81Å; Y150-L258 HydrophobicContact CE2-CD2 3.23Å; Y150-L258 HydrophobicContact CE2-CG 4.08Å; F249-L258 HydrophobicContact CB-CD2 3.65Å; F249-L258 HydrophobicContact CD1-CD2 4.45Å; F249-L258 HydrophobicContact CD2-CD2 3.72Å; F249-L258 HydrophobicContact CD2-CG 4.45Å; F249-L258 HydrophobicContact CG-CD2 3.69Å; F249-L258 HydrophobicContact CG-CG 4.42Å; N255-L258 WeakPolarHBondContact O-CB 3.25Å; N255-L258 PolarHBondContact O-N 3.48Å; N255-L258 VanDerWaalsContact O-N 3.08Å; L256-L258 VanDerWaalsContact C-N 3.3Å; L256-L258 PolarHBondContact O-N 3.49Å; L258-D260 VanDerWaalsContact C-N 3.3Å; L258-D260 PolarHBondContact O-N 2.89Å; L258-L261 PolarHBondContact O-N 3.34Å; L258-L262 HydrophobicContact CD1-CD1 4.11Å; L258-L262 HydrophobicContact CD1-CG 4.13Å; L258-L262 HydrophobicContact CG-CD1 3.89Å; L258-L262 HydrophobicContact CG-CG 4.36Å; L258-L262 WeakPolarHBondContact O-CB 3.28Å; L258-L262 VanDerWaalsContact O-CG 3.29Å; L258-L262 WeakPolarHBondContact O-CG 3.29Å; L258-L262 PolarHBondContact O-N 2.78Å
259	K	97.9	Very high	96.5	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-56.8	-43.6	174.3	-171.2	178.8	-74.4	-172.3	0	111.6	K178 S179 L216 F249 D251 N255 L256 F263	K178-K259 HydrophobicContact CB-CD 4.21Å; K178-K259 HydrophobicContact CD-CD 4.49Å; K178-K259 HydrophobicContact CG-CD 3.92Å; S179-K259 PolarHBondContact O-NZ 2.92Å; L216-K259 HydrophobicContact CB-CD 3.83Å; L216-K259 HydrophobicContact CB-CG 3.86Å; L216-K259 HydrophobicContact CD1-CG 4.41Å; L216-K259 WeakPolarHBondContact O-CD 3.37Å; L216-K259 WeakPolarHBondContact O-CE 3.31Å; L216-K259 PolarHBondContact O-NZ 2.9Å; F249-K259 HydrophobicContact CE2-CB 4.42Å; F249-K259 HydrophobicContact CZ-CB 3.77Å; F249-K259 HydrophobicContact CZ-CG 4.09Å; D251-K259 WeakPolarHBondContact OD1-CE 3.13Å; D251-K259 IonicContact OD1-NZ 3.69Å; D251-K259 PolarHBondContact OD1-NZ 3.49Å; D251-K259 WeakPolarHBondContact OD2-CE 3.22Å; D251-K259 IonicContact OD2-NZ 3.92Å; D251-K259 PolarHBondContact OD2-NZ 3.32Å; N255-K259 PolarHBondContact O-N 2.94Å; L256-K259 HydrophobicContact CD2-CD 4.38Å; L256-K259 VanDerWaalsContact O-CB 3.28Å; L256-K259 WeakPolarHBondContact O-CB 3.37Å; L256-K259 PolarHBondContact O-N 3.4Å; L256-K259 VanDerWaalsContact O-N 3.15Å; K259-F263 WeakPolarHBondContact O-CB 3.44Å; K259-F263 PolarHBondContact O-N 2.93Å
260	D	96.8	Very high	96.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.6	-45.5	175	-77.7	1.1	0	0	0	112.5	L256 T257 L258 F263 W264 K279	L256-D260 PolarHBondContact O-N 2.96Å; T257-D260 PolarHBondContact O-N 3.27Å; L258-D260 VanDerWaalsContact C-N 3.3Å; L258-D260 PolarHBondContact O-N 2.89Å; D260-F263 PolarHBondContact O-N 3.44Å; D260-W264 HydrophobicContact CB-CH2 4.31Å; D260-W264 HydrophobicContact CB-CZ2 4.35Å; D260-W264 PolarHBondContact O-N 3.34Å; D260-K279 VanDerWaalsContact OD1-CD 3.23Å; D260-K279 WeakPolarHBondContact OD1-CD 3.28Å; D260-K279 IonicContact OD1-NZ 3.69Å; D260-K279 PolarHBondContact OD1-NZ 2.93Å; D260-K279 IonicContact OD2-NZ 3.38Å; D260-K279 PolarHBondContact OD2-NZ 2.88Å
261	L	97.6	Very high	96.5	Very high	19 Å²	19	20.8 Å²	20.8	10%	0.099	10%	0.103	C	C	.	.	H	α-helix	trans	-62.4	-46.5	-180	-170.4	153.8	0	0	0	111.5	R148 T257 L258 F263 W264 H265 L376	R148-L261 HydrophobicContact CB-CD1 4.42Å; R148-L261 HydrophobicContact CB-CD2 4.31Å; R148-L261 HydrophobicContact CG-CD1 4.31Å; T257-L261 PolarHBondContact O-N 3.14Å; T257-L261 VanDerWaalsContact O-N 3.13Å; L258-L261 PolarHBondContact O-N 3.34Å; L261-F263 VanDerWaalsContact C-N 3.32Å; L261-F263 PolarHBondContact O-N 3.38Å; L261-W264 PolarHBondContact O-N 2.87Å; L261-H265 PolarHBondContact O-N 3.23Å; L261-L376 HydrophobicContact CD1-CD2 3.89Å
262	L	98	Very high	96.3	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-39.5	177.8	-68.7	170.7	0	0	0	111.4	Y150 W247 F249 L258 H265 W266	Y150-L262 HydrophobicContact CD2-CD1 4.3Å; W247-L262 HydrophobicContact CB-CD1 3.84Å; W247-L262 HydrophobicContact CD2-CB 3.95Å; W247-L262 HydrophobicContact CD2-CD1 4.18Å; W247-L262 HydrophobicContact CG-CB 4.24Å; W247-L262 HydrophobicContact CG-CD1 3.75Å; W247-L262 HydrophobicContact CG-CG 4.4Å; W247-L262 HydrophobicContact CZ2-CB 3.99Å; W247-L262 WeakPolarHBondContact CZ2-O 3.35Å; F249-L262 HydrophobicContact CD1-CD1 3.63Å; F249-L262 HydrophobicContact CE1-CD1 3.89Å; F249-L262 HydrophobicContact CG-CD1 4.42Å; L258-L262 HydrophobicContact CD1-CD1 4.11Å; L258-L262 HydrophobicContact CD1-CG 4.13Å; L258-L262 HydrophobicContact CG-CD1 3.89Å; L258-L262 HydrophobicContact CG-CG 4.36Å; L258-L262 WeakPolarHBondContact O-CB 3.28Å; L258-L262 VanDerWaalsContact O-CG 3.29Å; L258-L262 WeakPolarHBondContact O-CG 3.29Å; L258-L262 PolarHBondContact O-N 2.78Å; L262-H265 PolarHBondContact O-N 2.95Å; L262-W266 PolarHBondContact O-N 2.9Å
263	F	98.4	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-46.4	172.8	164.8	-108.6	0	0	0	112.4	L174 A176 V214 L216 K259 D260 L261 H265 W266 L267 V277	L174-F263 HydrophobicContact CD2-CE2 4.06Å; L174-F263 HydrophobicContact CD2-CZ 4.01Å; A176-F263 HydrophobicContact CB-CD1 4.28Å; A176-F263 HydrophobicContact CB-CD2 4Å; A176-F263 HydrophobicContact CB-CE1 3.78Å; A176-F263 HydrophobicContact CB-CE2 3.45Å; A176-F263 VanDerWaalsContact CB-CE2 3.45Å; A176-F263 HydrophobicContact CB-CG 4.38Å; A176-F263 HydrophobicContact CB-CZ 3.34Å; V214-F263 HydrophobicContact CG2-CE2 4.37Å; L216-F263 HydrophobicContact CD1-CB 3.68Å; L216-F263 HydrophobicContact CD1-CD1 4.45Å; L216-F263 HydrophobicContact CD1-CD2 4.09Å; L216-F263 HydrophobicContact CD1-CG 3.79Å; L216-F263 HydrophobicContact CD2-CB 4.08Å; L216-F263 HydrophobicContact CD2-CD2 3.67Å; L216-F263 HydrophobicContact CD2-CG 4.14Å; L216-F263 HydrophobicContact CG-CD2 4.49Å; K259-F263 WeakPolarHBondContact O-CB 3.44Å; K259-F263 PolarHBondContact O-N 2.93Å; D260-F263 PolarHBondContact O-N 3.44Å; L261-F263 VanDerWaalsContact C-N 3.32Å; L261-F263 PolarHBondContact O-N 3.38Å; F263-H265 VanDerWaalsContact C-N 3.26Å; F263-H265 PolarHBondContact O-N 2.81Å; F263-W266 HydrophobicContact CD2-CE3 4.34Å; F263-W266 HydrophobicContact CE2-CE3 4.2Å; F263-W266 HydrophobicContact CE2-CZ3 4.42Å; F263-W266 WeakPolarHBondContact O-CB 3.32Å; F263-W266 PolarHBondContact O-N 2.87Å; F263-W266 VanDerWaalsContact O-N 3.14Å; F263-L267 HydrophobicContact CE1-CD2 4.35Å; F263-L267 HydrophobicContact CE2-CB 4.41Å; F263-L267 HydrophobicContact CZ-CB 4.32Å; F263-L267 HydrophobicContact CZ-CD1 4.41Å; F263-L267 HydrophobicContact CZ-CD2 4.24Å; F263-L267 WeakPolarHBondContact O-CB 3.26Å; F263-L267 PolarHBondContact O-N 2.84Å; F263-V277 HydrophobicContact CE1-CG1 3.86Å; F263-V277 HydrophobicContact CZ-CG1 3.79Å
264	W	98.1	Very high	96.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.3	-34	178.3	-68.1	-32.7	0	0	0	112.9	D260 L261 L267 Q268 Y359 L367 R368 Y383 L384	D260-W264 HydrophobicContact CB-CH2 4.31Å; D260-W264 HydrophobicContact CB-CZ2 4.35Å; D260-W264 PolarHBondContact O-N 3.34Å; L261-W264 PolarHBondContact O-N 2.87Å; W264-L267 PolarHBondContact O-N 2.76Å; W264-Q268 PolarHBondContact O-N 3.47Å; W264-Q268 VanDerWaalsContact O-N 3.11Å; W264-Y359 AromaticContact NE1-CZ 3.88Å; W264-Y359 PolarHBondContact NE1-OH 3.49Å; W264-Y359 VanDerWaalsContact NE1-OH 3.08Å; W264-L367 HydrophobicContact CD2-CB 4.27Å; W264-L367 HydrophobicContact CE3-CB 4.4Å; W264-L367 HydrophobicContact CH2-CB 4.32Å; W264-L367 HydrophobicContact CZ2-CB 4.16Å; W264-L367 HydrophobicContact CZ2-CD1 4.03Å; W264-L367 HydrophobicContact CZ3-CB 4.42Å; W264-R368 HydrophobicContact CB-CB 4.01Å; W264-R368 HydrophobicContact CB-CG 4.46Å; W264-Y383 HydrophobicContact CH2-CE1 4.38Å; W264-Y383 HydrophobicContact CZ3-CE1 4.01Å; W264-L384 HydrophobicContact CH2-CD1 3.78Å; W264-L384 HydrophobicContact CZ2-CD1 3.66Å
265	H	96.9	Very high	96.1	Very high	84 Å²	84	26.3 Å²	26.3	39%	0.389	14%	0.143	S	C	.	.	H	α-helix	trans	-63.7	-46.4	172.2	-171.3	78	0	0	0	111.5	L261 L262 F263 L267 Q268 N269	L261-H265 PolarHBondContact O-N 3.23Å; L262-H265 PolarHBondContact O-N 2.95Å; F263-H265 VanDerWaalsContact C-N 3.26Å; F263-H265 PolarHBondContact O-N 2.81Å; H265-L267 PolarHBondContact O-N 2.71Å; H265-Q268 PolarHBondContact O-N 2.91Å; H265-N269 PolarHBondContact CD2-ND2 3.41Å; H265-N269 PolarHBondContact NE2-ND2 3.09Å; H265-N269 PolarHBondContact O-N 3.14Å; H265-N269 PolarHBondContact O-ND2 3.15Å
266	W	97.8	Very high	96.2	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-44.9	174.7	179.3	92.5	0	0	0	112.3	F152 N155 Q156 V159 L174 V214 L245 W247 L262 F263 Q268 N269 H270 C271	F152-W266 AromaticContact CE1-CD1 3.69Å; F152-W266 HydrophobicContact CE1-CG 4.43Å; F152-W266 HydrophobicContact CZ-CB 4.07Å; F152-W266 AromaticContact CZ-CD1 3.56Å; F152-W266 HydrophobicContact CZ-CG 4.21Å; N155-W266 PolarHBondContact OD1-NE1 2.63Å; Q156-W266 WeakPolarHBondContact O-CZ2 3.46Å; V159-W266 HydrophobicContact CB-CH2 4.05Å; V159-W266 HydrophobicContact CB-CZ2 4.23Å; V159-W266 HydrophobicContact CG1-CH2 4.26Å; V159-W266 HydrophobicContact CG2-CH2 4.44Å; V159-W266 HydrophobicContact CG2-CZ2 4.34Å; L174-W266 HydrophobicContact CD2-CZ3 4.15Å; V214-W266 HydrophobicContact CG1-CH2 4.07Å; L245-W266 HydrophobicContact CD1-CD2 3.44Å; L245-W266 VanDerWaalsContact CD1-CD2 3.44Å; L245-W266 HydrophobicContact CD1-CE3 3.74Å; L245-W266 HydrophobicContact CD1-CG 3.84Å; L245-W266 HydrophobicContact CD1-CH2 4.24Å; L245-W266 HydrophobicContact CD1-CZ2 3.96Å; L245-W266 HydrophobicContact CD1-CZ3 4.14Å; L245-W266 HydrophobicContact CD2-CD2 4.35Å; L245-W266 HydrophobicContact CD2-CZ2 4.02Å; W247-W266 HydrophobicContact CZ2-CB 3.96Å; L262-W266 PolarHBondContact O-N 2.9Å; F263-W266 HydrophobicContact CD2-CE3 4.34Å; F263-W266 HydrophobicContact CE2-CE3 4.2Å; F263-W266 HydrophobicContact CE2-CZ3 4.42Å; F263-W266 WeakPolarHBondContact O-CB 3.32Å; F263-W266 PolarHBondContact O-N 2.87Å; F263-W266 VanDerWaalsContact O-N 3.14Å; W266-Q268 VanDerWaalsContact C-N 3.31Å; W266-Q268 PolarHBondContact O-N 2.75Å; W266-N269 PolarHBondContact O-N 2.91Å; W266-N269 VanDerWaalsContact O-N 3.13Å; W266-H270 AromaticContact CD1-CD2 3.24Å; W266-H270 HydrophobicContact CD2-CB 4.17Å; W266-H270 AromaticContact CG-CD2 3.81Å; W266-H270 HydrophobicContact CZ2-CB 3.95Å; W266-H270 AromaticContact NE1-CD2 3.35Å; W266-H270 PolarHBondContact NE1-CD2 3.05Å; W266-H270 AromaticContact NE1-CG 3.79Å; W266-H270 WeakPolarHBondContact O-CB 3.31Å; W266-H270 PolarHBondContact O-N 3.19Å; W266-C271 HydrophobicContact CH2-CB 4.31Å; W266-C271 HydrophobicContact CZ3-CB 4.1Å
267	L	97.1	Very high	96.3	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-55.7	-46.6	179.3	177.3	65.9	0	0	0	111	L174 F263 W264 H265 N269 C271 P272 A274 V277 A364 M365	L174-L267 HydrophobicContact CD2-CD1 3.39Å; F263-L267 HydrophobicContact CE1-CD2 4.35Å; F263-L267 HydrophobicContact CE2-CB 4.41Å; F263-L267 HydrophobicContact CZ-CB 4.32Å; F263-L267 HydrophobicContact CZ-CD1 4.41Å; F263-L267 HydrophobicContact CZ-CD2 4.24Å; F263-L267 WeakPolarHBondContact O-CB 3.26Å; F263-L267 PolarHBondContact O-N 2.84Å; W264-L267 PolarHBondContact O-N 2.76Å; H265-L267 PolarHBondContact O-N 2.71Å; L267-N269 VanDerWaalsContact C-N 3.32Å; L267-N269 PolarHBondContact O-N 3.05Å; L267-C271 HydrophobicContact CD1-CB 4Å; L267-C271 WeakPolarHBondContact CD1-O 3.35Å; L267-C271 CarbonylContact O-C 3.57Å; L267-C271 WeakPolarHBondContact O-CA 3.32Å; L267-C271 PolarHBondContact O-N 2.81Å; L267-P272 VanDerWaalsContact O-N 3.08Å; L267-A274 HydrophobicContact CD1-CB 4.48Å; L267-V277 HydrophobicContact CD1-CG2 4.37Å; L267-V277 HydrophobicContact CD2-CG2 3.9Å; L267-A364 HydrophobicContact CD2-CB 3.41Å; L267-A364 VanDerWaalsContact CD2-CB 3.41Å; L267-M365 HydrophobicContact CB-CE 4.27Å; L267-M365 HydrophobicContact CD2-CE 3.6Å; L267-M365 HydrophobicContact CG-CE 3.6Å
268	Q	95.6	Very high	96.3	Very high	55 Å²	55	24.7 Å²	24.7	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-62.4	-40.3	179.2	-174.6	-177.1	12.1	0	0	112.5	W264 H265 W266 P272 M365 R368	W264-Q268 PolarHBondContact O-N 3.47Å; W264-Q268 VanDerWaalsContact O-N 3.11Å; H265-Q268 PolarHBondContact O-N 2.91Å; W266-Q268 VanDerWaalsContact C-N 3.31Å; W266-Q268 PolarHBondContact O-N 2.75Å; Q268-P272 WeakPolarHBondContact O-CB 3.39Å; Q268-M365 HydrophobicContact CB-CE 4.09Å; Q268-M365 HydrophobicContact CB-SD 3.8Å; Q268-M365 HydrophobicContact CG-SD 3.75Å; Q268-R368 VanDerWaalsContact CD-NH1 3.31Å; Q268-R368 VanDerWaalsContact NE2-NH1 3.17Å; Q268-R368 VanDerWaalsContact OE1-CZ 3.23Å
269	N	94.2	Very high	96.4	Very high	89 Å²	89	24.6 Å²	24.6	48%	0.476	13%	0.133	S	C	.	.	H	α-helix	trans	-82.9	-31.3	-174	-65.4	-25.6	0	0	0	113	H265 W266 L267	H265-N269 PolarHBondContact CD2-ND2 3.41Å; H265-N269 PolarHBondContact NE2-ND2 3.09Å; H265-N269 PolarHBondContact O-N 3.14Å; H265-N269 PolarHBondContact O-ND2 3.15Å; W266-N269 PolarHBondContact O-N 2.91Å; W266-N269 VanDerWaalsContact O-N 3.13Å; L267-N269 VanDerWaalsContact C-N 3.32Å; L267-N269 PolarHBondContact O-N 3.05Å
270	H	94.2	Very high	96.4	Very high	51 Å²	51	24.5 Å²	24.5	24%	0.236	13%	0.133	C	C	.	.	H	α-helix	trans	-119.8	-19.5	-168.8	-61.9	-63.5	0	0	0	114.4	N155 W266	N155-H270 PolarHBondContact ND2-NE2 3.23Å; W266-H270 AromaticContact CD1-CD2 3.24Å; W266-H270 HydrophobicContact CD2-CB 4.17Å; W266-H270 AromaticContact CG-CD2 3.81Å; W266-H270 HydrophobicContact CZ2-CB 3.95Å; W266-H270 AromaticContact NE1-CD2 3.35Å; W266-H270 PolarHBondContact NE1-CD2 3.05Å; W266-H270 AromaticContact NE1-CG 3.79Å; W266-H270 WeakPolarHBondContact O-CB 3.31Å; W266-H270 PolarHBondContact O-N 3.19Å
271	C	94.6	Very high	96.4	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.014	14%	0.142	C	C	.	.			trans	-145.6	48.3	179.1	-163.4	0	0	0	0	114.1	C160 L174 W266 L267 G273 A274	C160-C271 HydrophobicContact CB-CB 3.59Å; C160-C271 WeakPolarHBondContact CB-SG 3.49Å; C160-C271 WeakPolarHBondContact SG-CB 3.3Å; C160-C271 CovalentContact SG-SG 2.02Å; C160-C271 PolarHBondContact SG-SG 2.93Å; L174-C271 HydrophobicContact CD2-CB 4.46Å; W266-C271 HydrophobicContact CH2-CB 4.31Å; W266-C271 HydrophobicContact CZ3-CB 4.1Å; L267-C271 HydrophobicContact CD1-CB 4Å; L267-C271 WeakPolarHBondContact CD1-O 3.35Å; L267-C271 CarbonylContact O-C 3.57Å; L267-C271 WeakPolarHBondContact O-CA 3.32Å; L267-C271 PolarHBondContact O-N 2.81Å; C271-G273 PolarHBondContact O-N 3.42Å; C271-G273 VanDerWaalsContact O-N 3.15Å; C271-A274 PolarHBondContact O-N 2.99Å
272	P	92.7	Very high	96.4	Very high	80 Å²	80	26 Å²	26	52%	0.519	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.6	-174	26.8	-35.4	0	0	0	114.1	L267 Q268	L267-P272 VanDerWaalsContact O-N 3.08Å; Q268-P272 WeakPolarHBondContact O-CB 3.39Å
273	G	90.3	Very high	96.4	Very high	27 Å²	27	27.7 Å²	27.7	28%	0.278	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	7.8	-178.1	0	0	0	0	0	115.1	C271 Q275	C271-G273 PolarHBondContact O-N 3.42Å; C271-G273 VanDerWaalsContact O-N 3.15Å; G273-Q275 PolarHBondContact O-N 3.32Å
274	A	95.4	Very high	96.4	Very high	6 Å²	6	27.7 Å²	27.7	5%	0.05	15%	0.15	C	C	.	.			trans	-59.1	130.2	171.3	0	0	0	0	0	110.4	P171 L174 L267 C271 G361	P171-A274 HydrophobicContact CG-CB 3.93Å; P171-A274 WeakPolarHBondContact O-CA 3.36Å; L174-A274 HydrophobicContact CB-CB 4.07Å; L267-A274 HydrophobicContact CD1-CB 4.48Å; C271-A274 PolarHBondContact O-N 2.99Å; A274-G361 WeakPolarHBondContact O-CA 3.46Å
275	Q	95.3	Very high	96.4	Very high	82 Å²	82	27.7 Å²	27.7	38%	0.383	15%	0.15	S	C	.	.	S	Bend	trans	-75.1	-41.4	-178	-63.5	-172.9	32.6	0	0	112.2	P171 G273 G361	P171-Q275 PolarHBondContact O-N 3.31Å; P171-Q275 VanDerWaalsContact O-N 3.08Å; G273-Q275 PolarHBondContact O-N 3.32Å; Q275-G361 PolarHBondContact O-N 2.76Å
276	F	98	Very high	96.4	Very high	5 Å²	5	23.7 Å²	23.7	2%	0.022	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.1	175.5	-59.7	-78.9	0	0	0	110.3	M172 L173 L174 L295 I315 L318 V358 Y359	M172-F276 PolarHBondContact O-N 3.06Å; L173-F276 WeakPolarHBondContact CA-O 3.44Å; L173-F276 HydrophobicContact CD1-CB 3.97Å; L174-F276 PolarHBondContact N-O 3.22Å; F276-L295 HydrophobicContact CB-CD1 3.96Å; F276-L295 HydrophobicContact CD1-CD2 3.79Å; F276-L295 HydrophobicContact CD2-CB 4.13Å; F276-L295 HydrophobicContact CD2-CD1 3.97Å; F276-L295 HydrophobicContact CD2-CD2 4.31Å; F276-L295 HydrophobicContact CD2-CG 4.36Å; F276-L295 HydrophobicContact CE1-CD2 4.03Å; F276-L295 HydrophobicContact CE2-CB 4.02Å; F276-L295 HydrophobicContact CG-CD1 3.93Å; F276-L295 HydrophobicContact CG-CD2 3.95Å; F276-L295 HydrophobicContact CG-CG 4.37Å; F276-L295 HydrophobicContact CZ-CB 4.41Å; F276-L295 HydrophobicContact CZ-CD2 4.38Å; F276-I315 HydrophobicContact CE1-CD1 4.13Å; F276-I315 HydrophobicContact CZ-CD1 4.1Å; F276-L318 HydrophobicContact CD1-CD2 4.02Å; F276-L318 HydrophobicContact CE1-CD2 3.56Å; F276-V358 HydrophobicContact CB-CG2 4.45Å; F276-Y359 CarbonylContact C-O 3.52Å; F276-Y359 WeakPolarHBondContact CA-O 3.31Å
277	V	98.6	Very high	96.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.5	173.8	179.9	0	0	0	0	107.9	L174 A176 F263 L267 V358 Y359 A364	L174-V277 CarbonylContact O-C 2.98Å; L174-V277 VanDerWaalsContact O-CA 3.3Å; L174-V277 WeakPolarHBondContact O-CA 3.36Å; A176-V277 HydrophobicContact CB-CG1 4.48Å; F263-V277 HydrophobicContact CE1-CG1 3.86Å; F263-V277 HydrophobicContact CZ-CG1 3.79Å; L267-V277 HydrophobicContact CD1-CG2 4.37Å; L267-V277 HydrophobicContact CD2-CG2 3.9Å; V277-V358 CarbonylContact O-C 3.58Å; V277-V358 WeakPolarHBondContact O-CA 3.29Å; V277-Y359 HydrophobicContact CB-CD2 4.08Å; V277-Y359 HydrophobicContact CB-CE1 4.48Å; V277-Y359 HydrophobicContact CB-CE2 3.67Å; V277-Y359 HydrophobicContact CG1-CE1 4.29Å; V277-Y359 HydrophobicContact CG1-CE2 3.92Å; V277-Y359 HydrophobicContact CG2-CE2 4.23Å; V277-Y359 PolarHBondContact N-O 3.35Å; V277-Y359 PolarHBondContact O-N 3.35Å; V277-A364 HydrophobicContact CG2-CB 4.32Å
278	F	98.7	Very high	96.3	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.7	163.4	170.7	-95.8	0	0	0	108	L173 L174 M175 A176 I177 W194 V286 L291 V357 V358 L422	L173-F278 HydrophobicContact CD1-CB 3.87Å; L173-F278 HydrophobicContact CG-CB 4.48Å; L174-F278 PolarHBondContact O-N 3.13Å; M175-F278 CarbonylContact C-O 3.56Å; M175-F278 WeakPolarHBondContact CA-O 3.32Å; M175-F278 HydrophobicContact CB-CD1 4.41Å; M175-F278 HydrophobicContact CG-CB 4.32Å; M175-F278 HydrophobicContact CG-CD1 4.14Å; A176-F278 PolarHBondContact N-O 3.37Å; I177-F278 HydrophobicContact CD1-CD1 3.94Å; I177-F278 HydrophobicContact CD1-CE1 3.73Å; W194-F278 HydrophobicContact CH2-CE1 4.5Å; W194-F278 HydrophobicContact CZ3-CE1 4.14Å; F278-V286 HydrophobicContact CE1-CG2 3.82Å; F278-V286 HydrophobicContact CE2-CG2 4.15Å; F278-V286 HydrophobicContact CZ-CG2 3.5Å; F278-L291 HydrophobicContact CD2-CD2 4.19Å; F278-V357 CarbonylContact C-O 3.57Å; F278-V357 WeakPolarHBondContact CA-O 3.49Å; F278-V357 WeakPolarHBondContact CD2-O 3.49Å; F278-V358 HydrophobicContact CD2-CB 4.44Å; F278-L422 HydrophobicContact CE2-CD1 3.62Å; F278-L422 HydrophobicContact CZ-CD1 3.53Å
279	K	98	Very high	96.3	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.009	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.7	170.9	-174.9	-167.8	68.4	151.4	0	107.9	A176 D260 G356 V357 Y359 D380 D381	A176-K279 WeakPolarHBondContact O-CA 3.47Å; D260-K279 VanDerWaalsContact OD1-CD 3.23Å; D260-K279 WeakPolarHBondContact OD1-CD 3.28Å; D260-K279 IonicContact OD1-NZ 3.69Å; D260-K279 PolarHBondContact OD1-NZ 2.93Å; D260-K279 IonicContact OD2-NZ 3.38Å; D260-K279 PolarHBondContact OD2-NZ 2.88Å; K279-G356 CarbonylContact O-C 3.52Å; K279-G356 WeakPolarHBondContact O-CA 3.48Å; K279-V357 HydrophobicContact CB-CG2 4.04Å; K279-V357 PolarHBondContact N-O 3.4Å; K279-V357 PolarHBondContact O-N 3.43Å; K279-Y359 HydrophobicContact CB-CE1 3.99Å; K279-D380 IonicContact NZ-OD2 3.23Å; K279-D380 PolarHBondContact NZ-OD2 3.17Å; K279-D381 IonicContact NZ-OD1 3.44Å
280	G	97.4	Very high	96.3	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	175.1	178	0	0	0	0	0	113.8	A176 I177 K178 G355	A176-G280 PolarHBondContact O-N 2.83Å; A176-G280 VanDerWaalsContact O-N 3.15Å; I177-G280 CarbonylContact C-O 3.56Å; I177-G280 WeakPolarHBondContact CA-O 3.38Å; K178-G280 PolarHBondContact N-O 3Å; G280-G355 CarbonylContact C-O 3.52Å; G280-G355 WeakPolarHBondContact CA-O 3.45Å
281	D	97.9	Very high	96.5	Very high	35 Å²	35	17.4 Å²	17.4	19%	0.187	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	163.2	174.5	-62.8	-34.2	0	0	0	111.1	K178 D283 V284 G355	K178-D281 WeakPolarHBondContact CE-OD1 3.44Å; K178-D281 IonicContact NZ-OD1 3.01Å; K178-D281 PolarHBondContact NZ-OD1 3.02Å; D281-D283 VanDerWaalsContact CB-OD1 3.29Å; D281-D283 WeakPolarHBondContact CB-OD1 3.47Å; D281-D283 PolarHBondContact O-N 2.71Å; D281-V284 HydrophobicContact CB-CG1 4.45Å; D281-V284 WeakPolarHBondContact O-CG2 3.3Å; D281-G355 PolarHBondContact N-O 2.61Å
282	D	98.1	Very high	96.6	Very high	16 Å²	16	17.3 Å²	17.3	9%	0.086	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	7.8	178.4	68.9	-1.8	0	0	0	114	I177 K178 S179 N183 N186 I190 M431	I177-D282 HydrophobicContact CG2-CB 3.91Å; K178-D282 WeakPolarHBondContact O-CB 3.09Å; K178-D282 PolarHBondContact O-N 2.83Å; K178-D282 VanDerWaalsContact O-N 3.14Å; S179-D282 WeakPolarHBondContact CA-OD2 2.84Å; S179-D282 VanDerWaalsContact CB-OD2 3.25Å; S179-D282 WeakPolarHBondContact CB-OD2 3.26Å; S179-D282 PolarHBondContact OG-OD2 2.72Å; N183-D282 VanDerWaalsContact CB-OD2 3.24Å; N183-D282 WeakPolarHBondContact CB-OD2 3.34Å; N183-D282 PolarHBondContact ND2-OD1 3.23Å; N183-D282 PolarHBondContact ND2-OD2 3.22Å; N186-D282 HydrophobicContact CB-CB 4.11Å; N186-D282 WeakPolarHBondContact CB-O 3.43Å; N186-D282 PolarHBondContact ND2-O 3.43Å; I190-D282 HydrophobicContact CD1-CB 3.95Å; D282-M431 WeakPolarHBondContact O-CE 3.31Å
283	D	97.7	Very high	96.6	Very high	42 Å²	42	15.3 Å²	15.3	23%	0.225	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	22.4	175.8	73.1	-19.1	0	0	0	112.6	D281 H424 K425 R426	D281-D283 VanDerWaalsContact CB-OD1 3.29Å; D281-D283 WeakPolarHBondContact CB-OD1 3.47Å; D281-D283 PolarHBondContact O-N 2.71Å; D283-H424 VanDerWaalsContact CG-NE2 3.34Å; D283-H424 IonicContact OD1-CD2 3.91Å; D283-H424 PolarHBondContact OD1-CD2 3.08Å; D283-H424 VanDerWaalsContact OD1-CD2 3.29Å; D283-H424 IonicContact OD1-NE2 3.79Å; D283-H424 PolarHBondContact OD1-NE2 3.41Å; D283-H424 IonicContact OD2-CD2 3.57Å; D283-H424 IonicContact OD2-CE1 3.13Å; D283-H424 IonicContact OD2-NE2 3.07Å; D283-H424 PolarHBondContact OD2-NE2 3.42Å; D283-K425 CarbonylContact O-C 3.4Å; D283-K425 WeakPolarHBondContact O-CA 3.42Å; D283-R426 CarbonylContact C-O 3.51Å; D283-R426 PolarHBondContact O-N 2.73Å
284	V	97.7	Very high	96.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	166.2	171.7	-56.6	0	0	0	0	112.4	W194 D281 V286 G355 L422 V423 H424 M431	W194-V284 HydrophobicContact CH2-CG2 4.1Å; W194-V284 HydrophobicContact CZ2-CG2 4.03Å; W194-V284 VanDerWaalsContact CZ2-O 3.23Å; W194-V284 WeakPolarHBondContact CZ2-O 3.49Å; W194-V284 PolarHBondContact NE1-O 3.49Å; D281-V284 HydrophobicContact CB-CG1 4.45Å; D281-V284 WeakPolarHBondContact O-CG2 3.3Å; V284-V286 HydrophobicContact CG2-CG2 4.1Å; V284-G355 WeakPolarHBondContact CG1-O 3.5Å; V284-L422 HydrophobicContact CB-CD1 4.39Å; V284-L422 HydrophobicContact CB-CG 4.28Å; V284-L422 HydrophobicContact CG1-CD2 4.32Å; V284-L422 HydrophobicContact CG2-CD1 4.13Å; V284-L422 HydrophobicContact CG2-CG 4.46Å; V284-V423 WeakPolarHBondContact CA-O 3.27Å; V284-H424 HydrophobicContact CG1-CB 4.02Å; V284-M431 WeakPolarHBondContact O-CE 3.48Å
285	F	97.6	Very high	96.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.7	165.7	179.9	-85.9	0	0	0	110.6	W194 R287 L422 V423 R426 M431 L434 W435 L438	W194-F285 AromaticContact CD1-CD2 3.51Å; W194-F285 AromaticContact CD1-CE2 3.93Å; W194-F285 HydrophobicContact CG-CD2 4.36Å; F285-R287 HydrophobicContact CE1-CG 3.81Å; F285-L422 CarbonylContact O-C 3.54Å; F285-L422 WeakPolarHBondContact O-CA 3.17Å; F285-V423 HydrophobicContact CB-CG1 3.89Å; F285-V423 HydrophobicContact CD1-CG1 4.42Å; F285-V423 PolarHBondContact N-O 3.15Å; F285-V423 PolarHBondContact O-N 3Å; F285-R426 HydrophobicContact CB-CB 4.26Å; F285-R426 HydrophobicContact CB-CG 3.83Å; F285-M431 HydrophobicContact CD2-CB 4.22Å; F285-M431 HydrophobicContact CD2-CG 4.42Å; F285-L434 HydrophobicContact CB-CD2 4.19Å; F285-L434 HydrophobicContact CD1-CD2 3.53Å; F285-L434 HydrophobicContact CD1-CG 4.13Å; F285-L434 HydrophobicContact CD2-CB 4.42Å; F285-L434 HydrophobicContact CD2-CD2 4.15Å; F285-L434 HydrophobicContact CD2-CG 4.4Å; F285-L434 HydrophobicContact CE1-CD2 3.85Å; F285-L434 HydrophobicContact CE1-CG 3.93Å; F285-L434 HydrophobicContact CE2-CB 4.26Å; F285-L434 HydrophobicContact CE2-CD2 4.42Å; F285-L434 HydrophobicContact CE2-CG 4.21Å; F285-L434 HydrophobicContact CG-CD2 3.69Å; F285-L434 HydrophobicContact CG-CG 4.35Å; F285-L434 HydrophobicContact CZ-CB 4.45Å; F285-L434 HydrophobicContact CZ-CD2 4.28Å; F285-L434 HydrophobicContact CZ-CG 3.97Å; F285-W435 HydrophobicContact CE2-CB 3.97Å; F285-W435 HydrophobicContact CE2-CE3 4.06Å; F285-W435 HydrophobicContact CZ-CB 4.38Å; F285-W435 AromaticContact CZ-CE3 3.81Å; F285-W435 HydrophobicContact CZ-CE3 3.81Å; F285-L438 HydrophobicContact CE1-CD1 3.46Å; F285-L438 VanDerWaalsContact CE1-CD1 3.46Å; F285-L438 HydrophobicContact CZ-CD1 3.64Å
286	V	97.8	Very high	96.8	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.006	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.5	-178.9	-173.9	0	0	0	0	110.4	W194 F278 V284 T288 L291 L421 L422	W194-V286 HydrophobicContact CB-CB 4.41Å; W194-V286 WeakPolarHBondContact CB-O 3.48Å; W194-V286 HydrophobicContact CD2-CB 3.99Å; W194-V286 HydrophobicContact CD2-CG2 4.09Å; W194-V286 HydrophobicContact CE3-CB 3.65Å; W194-V286 HydrophobicContact CE3-CG2 3.63Å; W194-V286 HydrophobicContact CG-CB 4.35Å; W194-V286 HydrophobicContact CH2-CG2 4.11Å; W194-V286 HydrophobicContact CZ3-CB 4.19Å; W194-V286 HydrophobicContact CZ3-CG2 3.65Å; F278-V286 HydrophobicContact CE1-CG2 3.82Å; F278-V286 HydrophobicContact CE2-CG2 4.15Å; F278-V286 HydrophobicContact CZ-CG2 3.5Å; V284-V286 HydrophobicContact CG2-CG2 4.1Å; V286-T288 VanDerWaalsContact C-N 3.31Å; V286-T288 PolarHBondContact O-N 2.63Å; V286-T288 VanDerWaalsContact O-N 3.13Å; V286-L291 HydrophobicContact CG1-CD2 3.97Å; V286-L421 CarbonylContact C-O 3.55Å; V286-L421 WeakPolarHBondContact CA-O 3.36Å; V286-L421 WeakPolarHBondContact CG1-O 3.42Å; V286-L422 HydrophobicContact CG2-CD1 4.23Å
287	R	96.3	Very high	96.5	Very high	18 Å²	18	17 Å²	17	7%	0.068	9%	0.086	C	C	.	.			trans	-85.8	76.9	168.2	-74.6	-174.5	55.5	-130.2	15.1	109.6	E203 F285 S289 S290 L291 Y417 S418 V420 L421 L438	E203-R287 IonicContact OE1-CZ 3.76Å; E203-R287 IonicContact OE1-NH2 3.87Å; E203-R287 PolarHBondContact OE1-NH2 3.35Å; E203-R287 IonicContact OE2-CZ 2.63Å; E203-R287 IonicContact OE2-NH2 3.7Å; E203-R287 PolarHBondContact OE2-NH2 2.88Å; F285-R287 HydrophobicContact CE1-CG 3.81Å; R287-S289 VanDerWaalsContact C-N 3.31Å; R287-S289 PolarHBondContact O-N 2.98Å; R287-S290 PolarHBondContact NE-OG 3.49Å; R287-S290 PolarHBondContact NH2-OG 2.86Å; R287-S290 PolarHBondContact O-N 3.26Å; R287-S290 VanDerWaalsContact O-N 3.08Å; R287-L291 PolarHBondContact O-N 3.46Å; R287-Y417 WeakPolarHBondContact CD-O 3.15Å; R287-Y417 VanDerWaalsContact CZ-O 3.31Å; R287-Y417 PolarHBondContact NE-O 3.3Å; R287-Y417 PolarHBondContact NH1-O 3.14Å; R287-S418 PolarHBondContact NH1-O 2.83Å; R287-S418 PolarHBondContact NH2-O 2.95Å; R287-V420 VanDerWaalsContact CD-O 3.23Å; R287-V420 WeakPolarHBondContact CD-O 3.45Å; R287-V420 PolarHBondContact NH1-O 2.66Å; R287-L421 PolarHBondContact N-O 2.78Å; R287-L438 HydrophobicContact CG-CD1 3.85Å
288	T	97	Very high	96.1	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-54.6	-41.4	-171.9	-55.8	0	0	0	0	113.7	L173 M175 W194 V200 V211 V286 L291 L292	L173-T288 HydrophobicContact CD2-CG2 4.46Å; M175-T288 HydrophobicContact CE-CG2 3.49Å; M175-T288 VanDerWaalsContact CE-CG2 3.49Å; M175-T288 WeakPolarHBondContact CE-OG1 3.23Å; W194-T288 PolarHBondContact O-OG1 3.35Å; V200-T288 HydrophobicContact CG1-CG2 4.18Å; V211-T288 HydrophobicContact CG2-CG2 4.11Å; V286-T288 VanDerWaalsContact C-N 3.31Å; V286-T288 PolarHBondContact O-N 2.63Å; V286-T288 VanDerWaalsContact O-N 3.13Å; T288-L291 PolarHBondContact O-N 3.25Å; T288-L292 HydrophobicContact CG2-CD1 4.37Å; T288-L292 WeakPolarHBondContact O-CG 3.47Å; T288-L292 PolarHBondContact O-N 2.89Å
289	S	95.1	Very high	95.6	Very high	32 Å²	32	21.3 Å²	21.3	22%	0.224	10%	0.103	C	C	.	.	H	α-helix	trans	-59.9	-48.9	175.7	-66.1	0	0	0	0	112.1	K201 R287 L291 L292 D293	K201-S289 VanDerWaalsContact O-CB 3.23Å; K201-S289 WeakPolarHBondContact O-CB 3.45Å; K201-S289 PolarHBondContact O-OG 3.41Å; R287-S289 VanDerWaalsContact C-N 3.31Å; R287-S289 PolarHBondContact O-N 2.98Å; S289-L291 VanDerWaalsContact C-N 3.32Å; S289-L291 PolarHBondContact O-N 3.2Å; S289-L292 WeakPolarHBondContact O-CB 3.28Å; S289-L292 PolarHBondContact O-N 3.16Å; S289-D293 PolarHBondContact O-N 3.47Å; S289-D293 VanDerWaalsContact O-N 3.11Å
290	S	94.9	Very high	95	Very high	12 Å²	12	25.3 Å²	25.3	8%	0.084	12%	0.122	C	C	.	.	H	α-helix	trans	-65.4	-35.7	177.8	-38.7	0	0	0	0	112.1	E203 R287 D293 Y294	E203-S290 WeakPolarHBondContact OE2-CB 3.31Å; E203-S290 PolarHBondContact OE2-OG 2.94Å; R287-S290 PolarHBondContact NE-OG 3.49Å; R287-S290 PolarHBondContact NH2-OG 2.86Å; R287-S290 PolarHBondContact O-N 3.26Å; R287-S290 VanDerWaalsContact O-N 3.08Å; S290-D293 PolarHBondContact O-N 2.58Å; S290-Y294 PolarHBondContact O-N 2.74Å
291	L	96.6	Very high	94.3	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-41.9	174.3	179.8	61.7	0	0	0	111.2	L173 F278 V286 R287 T288 S289 Y294 L295 V358 L421	L173-L291 HydrophobicContact CD2-CD2 4Å; F278-L291 HydrophobicContact CD2-CD2 4.19Å; V286-L291 HydrophobicContact CG1-CD2 3.97Å; R287-L291 PolarHBondContact O-N 3.46Å; T288-L291 PolarHBondContact O-N 3.25Å; S289-L291 VanDerWaalsContact C-N 3.32Å; S289-L291 PolarHBondContact O-N 3.2Å; L291-Y294 HydrophobicContact CD1-CD1 4.36Å; L291-Y294 WeakPolarHBondContact O-CB 3.23Å; L291-Y294 PolarHBondContact O-N 3.42Å; L291-L295 HydrophobicContact CD1-CG 4.44Å; L291-L295 HydrophobicContact CG-CD1 4.26Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.41Å; L291-L295 PolarHBondContact O-N 3.24Å; L291-V358 HydrophobicContact CD1-CG1 4.18Å; L291-L421 HydrophobicContact CD1-CD1 4.41Å
292	L	96.7	Very high	93.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-42.6	175.8	-71.9	169.7	0	0	0	111.6	M172 L173 V200 V211 T288 S289 Y294 L295 H296	M172-L292 HydrophobicContact CE-CB 4.49Å; M172-L292 HydrophobicContact CE-CD2 3.8Å; M172-L292 HydrophobicContact CG-CD2 4.21Å; M172-L292 HydrophobicContact SD-CD2 3.78Å; L173-L292 HydrophobicContact CB-CD2 4.01Å; L173-L292 HydrophobicContact CD2-CD2 4.25Å; V200-L292 HydrophobicContact CB-CD1 3.78Å; V200-L292 HydrophobicContact CG1-CD1 3.85Å; V211-L292 HydrophobicContact CG2-CD1 4.07Å; V211-L292 HydrophobicContact CG2-CD2 4.46Å; T288-L292 HydrophobicContact CG2-CD1 4.37Å; T288-L292 WeakPolarHBondContact O-CG 3.47Å; T288-L292 PolarHBondContact O-N 2.89Å; S289-L292 WeakPolarHBondContact O-CB 3.28Å; S289-L292 PolarHBondContact O-N 3.16Å; L292-Y294 VanDerWaalsContact C-N 3.33Å; L292-Y294 PolarHBondContact O-N 2.93Å; L292-L295 PolarHBondContact O-N 3.22Å; L292-H296 PolarHBondContact O-CD2 2.99Å; L292-H296 PolarHBondContact O-N 2.82Å
293	D	94.6	Very high	91.5	Very high	37 Å²	37	31.2 Å²	31.2	20%	0.198	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-43.4	176.4	-64.2	-32.6	0	0	0	111.9	G202 E203 G206 S289 S290 L295 H296 K297	G202-D293 WeakPolarHBondContact CA-OD1 3.19Å; E203-D293 WeakPolarHBondContact CA-OD2 3.33Å; E203-D293 VanDerWaalsContact CB-OD2 3.24Å; E203-D293 WeakPolarHBondContact CB-OD2 3.38Å; E203-D293 PolarHBondContact N-OD2 3.5Å; G206-D293 VanDerWaalsContact CA-OD1 3.27Å; G206-D293 WeakPolarHBondContact CA-OD1 3.3Å; S289-D293 PolarHBondContact O-N 3.47Å; S289-D293 VanDerWaalsContact O-N 3.11Å; S290-D293 PolarHBondContact O-N 2.58Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.37Å; D293-H296 PolarHBondContact O-N 2.95Å; D293-K297 WeakPolarHBondContact O-CB 3.43Å; D293-K297 PolarHBondContact O-N 2.8Å
294	Y	94.9	Very high	89.1	Confident	31 Å²	31	35.6 Å²	35.6	12%	0.122	18%	0.178	C	C	.	.	H	α-helix	trans	-57.3	-46.7	173.5	170.3	-100.2	0	0	0	111.6	S290 L291 L292 K297 Q298 V320 H398 L421	S290-Y294 PolarHBondContact O-N 2.74Å; L291-Y294 HydrophobicContact CD1-CD1 4.36Å; L291-Y294 WeakPolarHBondContact O-CB 3.23Å; L291-Y294 PolarHBondContact O-N 3.42Å; L292-Y294 VanDerWaalsContact C-N 3.33Å; L292-Y294 PolarHBondContact O-N 2.93Å; Y294-K297 WeakPolarHBondContact O-CB 3.41Å; Y294-K297 PolarHBondContact O-N 3.22Å; Y294-Q298 HydrophobicContact CD1-CG 4.32Å; Y294-Q298 HydrophobicContact CD2-CG 4.41Å; Y294-Q298 HydrophobicContact CE1-CG 3.79Å; Y294-Q298 HydrophobicContact CE2-CG 3.88Å; Y294-Q298 WeakPolarHBondContact O-CG 3.18Å; Y294-Q298 PolarHBondContact O-N 2.85Å; Y294-V320 HydrophobicContact CE1-CG1 4.29Å; Y294-V320 HydrophobicContact CE1-CG2 4.2Å; Y294-V320 WeakPolarHBondContact OH-CG2 3.25Å; Y294-H398 AromaticContact CD2-NE2 3.85Å; Y294-H398 AromaticContact CE2-CD2 3.56Å; Y294-H398 AromaticContact CE2-NE2 3.78Å; Y294-H398 AromaticContact CZ-CD2 3.91Å; Y294-L421 HydrophobicContact CG-CD1 4.39Å
295	L	94.9	Very high	86.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-38.2	-179.5	-67.9	173.3	0	0	0	112.8	M172 L173 F276 L291 L292 D293 Q298 R299 L318 V358	M172-L295 HydrophobicContact CE-CB 3.94Å; L173-L295 HydrophobicContact CD1-CD1 4.06Å; F276-L295 HydrophobicContact CB-CD1 3.96Å; F276-L295 HydrophobicContact CD1-CD2 3.79Å; F276-L295 HydrophobicContact CD2-CB 4.13Å; F276-L295 HydrophobicContact CD2-CD1 3.97Å; F276-L295 HydrophobicContact CD2-CD2 4.31Å; F276-L295 HydrophobicContact CD2-CG 4.36Å; F276-L295 HydrophobicContact CE1-CD2 4.03Å; F276-L295 HydrophobicContact CE2-CB 4.02Å; F276-L295 HydrophobicContact CG-CD1 3.93Å; F276-L295 HydrophobicContact CG-CD2 3.95Å; F276-L295 HydrophobicContact CG-CG 4.37Å; F276-L295 HydrophobicContact CZ-CB 4.41Å; F276-L295 HydrophobicContact CZ-CD2 4.38Å; L291-L295 HydrophobicContact CD1-CG 4.44Å; L291-L295 HydrophobicContact CG-CD1 4.26Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.41Å; L291-L295 PolarHBondContact O-N 3.24Å; L292-L295 PolarHBondContact O-N 3.22Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.37Å; L295-Q298 PolarHBondContact O-N 2.63Å; L295-R299 WeakPolarHBondContact O-CB 3.43Å; L295-R299 PolarHBondContact O-N 2.96Å; L295-L318 HydrophobicContact CD2-CD2 3.98Å; L295-V358 HydrophobicContact CD1-CG2 4.14Å; L295-V358 HydrophobicContact CD2-CG1 4.44Å; L295-V358 HydrophobicContact CD2-CG2 3.91Å
296	H	93.4	Very high	84.1	Confident	13 Å²	13	49.2 Å²	49.2	6%	0.06	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-45.8	172.3	-80.7	-66.8	0	0	0	111.4	M172 R207 G208 L292 D293 Q298 R299 E300	M172-H296 WeakPolarHBondContact CE-CD2 3.31Å; M172-H296 VanDerWaalsContact CE-CE1 3.45Å; M172-H296 WeakPolarHBondContact CE-CE1 3.45Å; M172-H296 WeakPolarHBondContact CE-NE2 3.23Å; M172-H296 PolarHBondContact SD-CE1 3.3Å; M172-H296 PolarHBondContact SD-NE2 3.09Å; R207-H296 HydrophobicContact CB-CB 4.45Å; R207-H296 WeakPolarHBondContact CB-CD2 3.34Å; R207-H296 VanDerWaalsContact CB-NE2 3.33Å; R207-H296 WeakPolarHBondContact CB-NE2 2.95Å; R207-H296 PolarHBondContact O-CD2 3.44Å; R207-H296 PolarHBondContact O-NE2 2.89Å; G208-H296 PolarHBondContact O-NE2 3.43Å; L292-H296 PolarHBondContact O-CD2 2.99Å; L292-H296 PolarHBondContact O-N 2.82Å; D293-H296 PolarHBondContact O-N 2.95Å; H296-Q298 PolarHBondContact O-N 3.19Å; H296-R299 PolarHBondContact CE1-NH2 3.49Å; H296-R299 PolarHBondContact ND1-NH2 3.26Å; H296-R299 WeakPolarHBondContact O-CB 3.29Å; H296-R299 PolarHBondContact O-N 3.43Å; H296-R299 VanDerWaalsContact O-N 3.15Å; H296-E300 WeakPolarHBondContact O-CG 3.3Å; H296-E300 PolarHBondContact O-N 2.88Å
297	K	91.7	Very high	82.1	Confident	113 Å²	113	54.7 Å²	54.7	49%	0.491	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-47.3	176	-178.6	178.6	176.1	-179.6	0	111.5	D293 Y294 R299 E300 E301	D293-K297 WeakPolarHBondContact O-CB 3.43Å; D293-K297 PolarHBondContact O-N 2.8Å; Y294-K297 WeakPolarHBondContact O-CB 3.41Å; Y294-K297 PolarHBondContact O-N 3.22Å; K297-R299 VanDerWaalsContact C-N 3.28Å; K297-R299 PolarHBondContact O-N 2.85Å; K297-E300 PolarHBondContact O-N 2.76Å; K297-E301 WeakPolarHBondContact CE-OE1 3.06Å; K297-E301 HydrophobicContact CG-CG 4.32Å; K297-E301 IonicContact NZ-OE1 3.49Å; K297-E301 WeakPolarHBondContact O-CB 3.39Å; K297-E301 WeakPolarHBondContact O-CG 3.23Å; K297-E301 PolarHBondContact O-N 2.9Å
298	Q	91	Very high	80.2	Confident	30 Å²	30	57.1 Å²	57.1	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-58.2	-41.3	175.6	-71.3	-53	-54.7	0	0	112	Y294 L295 H296 N302 I315 L318	Y294-Q298 HydrophobicContact CD1-CG 4.32Å; Y294-Q298 HydrophobicContact CD2-CG 4.41Å; Y294-Q298 HydrophobicContact CE1-CG 3.79Å; Y294-Q298 HydrophobicContact CE2-CG 3.88Å; Y294-Q298 WeakPolarHBondContact O-CG 3.18Å; Y294-Q298 PolarHBondContact O-N 2.85Å; L295-Q298 PolarHBondContact O-N 2.63Å; H296-Q298 PolarHBondContact O-N 3.19Å; Q298-N302 VanDerWaalsContact O-CB 3.27Å; Q298-N302 WeakPolarHBondContact O-CB 3.04Å; Q298-N302 PolarHBondContact O-N 3.08Å; Q298-N302 VanDerWaalsContact O-N 3.11Å; Q298-N302 PolarHBondContact O-ND2 3Å; Q298-N302 PolarHBondContact OE1-ND2 3.12Å; Q298-I315 HydrophobicContact CB-CD1 4.15Å; Q298-L318 HydrophobicContact CB-CD2 4.4Å; Q298-L318 HydrophobicContact CG-CD1 4.27Å
299	R	87.4	Confident	78.5	Confident	61 Å²	61	67.6 Å²	67.6	23%	0.23	34%	0.335	C	S	.	.	H	α-helix	trans	-68.6	-37.5	177.9	-173.2	177.9	65.4	178.9	4.9	112.6	L295 H296 K297 G303	L295-R299 WeakPolarHBondContact O-CB 3.43Å; L295-R299 PolarHBondContact O-N 2.96Å; H296-R299 PolarHBondContact CE1-NH2 3.49Å; H296-R299 PolarHBondContact ND1-NH2 3.26Å; H296-R299 WeakPolarHBondContact O-CB 3.29Å; H296-R299 PolarHBondContact O-N 3.43Å; H296-R299 VanDerWaalsContact O-N 3.15Å; K297-R299 VanDerWaalsContact C-N 3.28Å; K297-R299 PolarHBondContact O-N 2.85Å; R299-G303 WeakPolarHBondContact O-CA 3.14Å; R299-G303 PolarHBondContact O-N 3.19Å
300	E	85.4	Confident	76.9	Confident	86 Å²	86	71.7 Å²	71.7	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-69.9	-46.8	178.7	-74.1	172.3	-170.1	0	0	111.5	R207 H296 K297 N302	R207-E300 IonicContact CZ-OE1 3.21Å; R207-E300 IonicContact NE-OE1 3.47Å; R207-E300 IonicContact NH1-OE1 2.76Å; R207-E300 PolarHBondContact NH1-OE1 2.59Å; H296-E300 WeakPolarHBondContact O-CG 3.3Å; H296-E300 PolarHBondContact O-N 2.88Å; K297-E300 PolarHBondContact O-N 2.76Å; E300-N302 VanDerWaalsContact C-N 3.29Å; E300-N302 PolarHBondContact O-N 3.07Å
301	E	83.5	Confident	75.1	Confident	109 Å²	109	75 Å²	75	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-30.7	-179.9	-69.7	176.1	165.6	0	0	112.6	K297	K297-E301 WeakPolarHBondContact CE-OE1 3.06Å; K297-E301 HydrophobicContact CG-CG 4.32Å; K297-E301 IonicContact NZ-OE1 3.49Å; K297-E301 WeakPolarHBondContact O-CB 3.39Å; K297-E301 WeakPolarHBondContact O-CG 3.23Å; K297-E301 PolarHBondContact O-N 2.9Å
302	N	75.2	Confident	73.4	Confident	32 Å²	32	77.6 Å²	77.6	17%	0.171	38%	0.383	C	S	.	.	H	α-helix	trans	-111.2	-10.1	-175.2	-60.6	-69.1	0	0	0	114.9	Q298 E300 K311 I315	Q298-N302 VanDerWaalsContact O-CB 3.27Å; Q298-N302 WeakPolarHBondContact O-CB 3.04Å; Q298-N302 PolarHBondContact O-N 3.08Å; Q298-N302 VanDerWaalsContact O-N 3.11Å; Q298-N302 PolarHBondContact O-ND2 3Å; Q298-N302 PolarHBondContact OE1-ND2 3.12Å; E300-N302 VanDerWaalsContact C-N 3.29Å; E300-N302 PolarHBondContact O-N 3.07Å; N302-K311 CarbonylContact O-C 3.5Å; N302-K311 VanDerWaalsContact O-C 3.26Å; N302-I315 HydrophobicContact CB-CB 3.97Å
303	G	62.1	Low	72.1	Confident	34 Å²	34	82 Å²	82	35%	0.351	40%	0.404	S	S	.	.	H	α-helix	trans	-120.7	-28	-165.4	0	0	0	0	0	117.8	R299	R299-G303 WeakPolarHBondContact O-CA 3.14Å; R299-G303 PolarHBondContact O-N 3.19Å
304	M	47.4	Very low	71.2	Confident	135 Å²	135	86.7 Å²	86.7	67%	0.665	42%	0.422	S	S	*	.	S	Bend	trans	-115.3	-10.4	-160.8	-154	78.1	88	0	0	116.8
305	W	45.7	Very low	70.8	Confident	247 Å²	247	86.4 Å²	86.4	94%	0.936	42%	0.422	S	S	*	.	S	Bend	trans	-140.3	12.4	-178.9	-105	143.3	0	0	0	117.9
306	S	45.1	Very low	70.5	Confident	38 Å²	38	90.3 Å²	90.3	27%	0.266	44%	0.439	S	S	.	.			trans	-96.7	115.8	179	-137.6	0	0	0	0	110.4	D308 K311	S306-D308 PolarHBondContact O-N 3.4Å; S306-D308 WeakPolarHBondContact OG-CB 3.17Å; S306-K311 VanDerWaalsContact OG-CD 3.26Å; S306-K311 WeakPolarHBondContact OG-CD 3.4Å; S306-K311 WeakPolarHBondContact OG-CE 3.38Å; S306-K311 PolarHBondContact OG-NZ 2.91Å
307	A	54.8	Low	70.5	Confident	116 Å²	116	91.8 Å²	91.8	96%	0.959	45%	0.448	S	S	*	.	S	Bend	trans	-62.1	1.9	161.4	0	0	0	0	0	112.9
308	D	57.4	Low	70.7	Confident	70 Å²	70	86.6 Å²	86.6	37%	0.374	43%	0.425	S	S	.	.			trans	-98.6	106.7	-179.3	-175.3	2.1	0	0	0	109.9	S306 N310 K311	S306-D308 PolarHBondContact O-N 3.4Å; S306-D308 WeakPolarHBondContact OG-CB 3.17Å; D308-N310 PolarHBondContact O-N 3.04Å; D308-N310 WeakPolarHBondContact OD1-CB 3.33Å; D308-N310 PolarHBondContact OD1-N 3.47Å; D308-N310 VanDerWaalsContact OD1-N 3.14Å; D308-K311 PolarHBondContact O-N 3.02Å
309	R	59.5	Low	71	Confident	222 Å²	222	85.2 Å²	85.2	84%	0.838	42%	0.419	S	S	*	.	H	α-helix	trans	-52.7	-26.8	178	-69.9	-178.7	177	-177	-1.1	112.7	K311	R309-K311 VanDerWaalsContact C-N 3.29Å; R309-K311 PolarHBondContact O-N 3.34Å
310	N	61.9	Low	71.5	Confident	117 Å²	117	82.3 Å²	82.3	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-66.7	-26.1	-179.9	-71.6	-27.1	0	0	0	113.4	D308	D308-N310 PolarHBondContact O-N 3.04Å; D308-N310 WeakPolarHBondContact OD1-CB 3.33Å; D308-N310 PolarHBondContact OD1-N 3.47Å; D308-N310 VanDerWaalsContact OD1-N 3.14Å
311	K	58.4	Low	72.1	Confident	83 Å²	83	78.2 Å²	78.2	36%	0.361	39%	0.389	S	S	.	.	H	α-helix	trans	-80.6	-37	179.4	-64.9	-162.5	-162.8	158.5	0	112.9	N302 S306 D308 R309 E313 K314	N302-K311 CarbonylContact O-C 3.5Å; N302-K311 VanDerWaalsContact O-C 3.26Å; S306-K311 VanDerWaalsContact OG-CD 3.26Å; S306-K311 WeakPolarHBondContact OG-CD 3.4Å; S306-K311 WeakPolarHBondContact OG-CE 3.38Å; S306-K311 PolarHBondContact OG-NZ 2.91Å; D308-K311 PolarHBondContact O-N 3.02Å; R309-K311 VanDerWaalsContact C-N 3.29Å; R309-K311 PolarHBondContact O-N 3.34Å; K311-E313 PolarHBondContact O-N 3.48Å; K311-K314 WeakPolarHBondContact O-CB 3.25Å; K311-K314 PolarHBondContact O-N 2.99Å
312	T	60.5	Low	72.7	Confident	56 Å²	56	74.3 Å²	74.3	34%	0.344	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-28.6	176.1	-49.4	0	0	0	0	112.3	I315	T312-I315 WeakPolarHBondContact O-CG2 3.46Å
313	E	69.3	Low	73.8	Confident	93 Å²	93	73.6 Å²	73.6	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-74.3	-30.6	172.5	-65.2	-56.4	128.8	0	0	112.3	K311 I315 K316 D317	K311-E313 PolarHBondContact O-N 3.48Å; E313-I315 PolarHBondContact O-N 3.48Å; E313-K316 WeakPolarHBondContact O-CB 3.31Å; E313-K316 PolarHBondContact O-N 3.49Å; E313-K316 IonicContact OE1-NZ 2.84Å; E313-K316 PolarHBondContact OE1-NZ 3.35Å; E313-K316 IonicContact OE2-NZ 3.71Å; E313-D317 PolarHBondContact O-N 2.97Å
314	K	76.6	Confident	75.4	Confident	135 Å²	135	74.6 Å²	74.6	59%	0.587	37%	0.365	S	S	*	.	H	α-helix	trans	-63.1	-39.2	179.2	-73.9	-176.1	178.5	-172.6	0	113.7	K311 K316 D317 L318	K311-K314 WeakPolarHBondContact O-CB 3.25Å; K311-K314 PolarHBondContact O-N 2.99Å; K314-K316 VanDerWaalsContact C-N 3.3Å; K314-K316 PolarHBondContact O-N 3.02Å; K314-D317 CarbonylContact O-C 3.26Å; K314-D317 PolarHBondContact O-N 3.27Å; K314-D317 VanDerWaalsContact O-N 3.14Å; K314-L318 PolarHBondContact O-N 2.97Å
315	I	84.6	Confident	77.6	Confident	24 Å²	24	74.4 Å²	74.4	12%	0.123	36%	0.362	C	S	.	.	H	α-helix	trans	-69.4	-31.6	178.5	-169.7	59.8	0	0	0	111.9	F276 Q298 N302 T312 E313 D317 L318 S360	F276-I315 HydrophobicContact CE1-CD1 4.13Å; F276-I315 HydrophobicContact CZ-CD1 4.1Å; Q298-I315 HydrophobicContact CB-CD1 4.15Å; N302-I315 HydrophobicContact CB-CB 3.97Å; T312-I315 WeakPolarHBondContact O-CG2 3.46Å; E313-I315 PolarHBondContact O-N 3.48Å; I315-D317 PolarHBondContact O-N 2.66Å; I315-L318 HydrophobicContact CD1-CB 4.35Å; I315-L318 HydrophobicContact CD1-CD2 4.22Å; I315-L318 WeakPolarHBondContact O-CB 3.39Å; I315-L318 PolarHBondContact O-N 2.98Å; I315-S360 WeakPolarHBondContact O-CB 3.27Å
316	K	88.6	Confident	79.8	Confident	82 Å²	82	69.4 Å²	69.4	36%	0.357	35%	0.354	S	S	.	.	H	α-helix	trans	-66.9	-23.9	173.4	-63.4	176.9	-173.1	167.9	0	111.6	E313 K314 S360 A362 L363	E313-K316 WeakPolarHBondContact O-CB 3.31Å; E313-K316 PolarHBondContact O-N 3.49Å; E313-K316 IonicContact OE1-NZ 2.84Å; E313-K316 PolarHBondContact OE1-NZ 3.35Å; E313-K316 IonicContact OE2-NZ 3.71Å; K314-K316 VanDerWaalsContact C-N 3.3Å; K314-K316 PolarHBondContact O-N 3.02Å; K316-S360 PolarHBondContact O-OG 2.81Å; K316-A362 HydrophobicContact CB-CB 4.05Å; K316-A362 HydrophobicContact CG-CB 4.21Å; K316-L363 WeakPolarHBondContact O-CB 2.99Å; K316-L363 PolarHBondContact O-N 3.16Å
317	D	93.7	Very high	82.1	Confident	45 Å²	45	68.4 Å²	68.4	24%	0.241	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	9.5	-179	-69.4	7.1	0	0	0	112.9	E313 K314 I315 F319 R366 V393	E313-D317 PolarHBondContact O-N 2.97Å; K314-D317 CarbonylContact O-C 3.26Å; K314-D317 PolarHBondContact O-N 3.27Å; K314-D317 VanDerWaalsContact O-N 3.14Å; I315-D317 PolarHBondContact O-N 2.66Å; D317-F319 PolarHBondContact O-N 3.29Å; D317-R366 IonicContact OD1-CZ 2.74Å; D317-R366 IonicContact OD1-NH1 2.65Å; D317-R366 PolarHBondContact OD1-NH1 2.9Å; D317-R366 IonicContact OD2-NH1 3.22Å; D317-R366 PolarHBondContact OD2-NH1 3.23Å; D317-V393 HydrophobicContact CB-CG1 4.22Å; D317-V393 HydrophobicContact CB-CG2 4.13Å; D317-V393 WeakPolarHBondContact O-CG1 3.23Å
318	L	96.1	Very high	84.1	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.021	33%	0.331	C	S	.	.			trans	-59.1	122.4	179	-173.4	77.4	0	0	0	110.7	F276 L295 Q298 K314 I315 V320 Y359 S360 L363 I396	F276-L318 HydrophobicContact CD1-CD2 4.02Å; F276-L318 HydrophobicContact CE1-CD2 3.56Å; L295-L318 HydrophobicContact CD2-CD2 3.98Å; Q298-L318 HydrophobicContact CB-CD2 4.4Å; Q298-L318 HydrophobicContact CG-CD1 4.27Å; K314-L318 PolarHBondContact O-N 2.97Å; I315-L318 HydrophobicContact CD1-CB 4.35Å; I315-L318 HydrophobicContact CD1-CD2 4.22Å; I315-L318 WeakPolarHBondContact O-CB 3.39Å; I315-L318 PolarHBondContact O-N 2.98Å; L318-V320 HydrophobicContact CD1-CG2 3.66Å; L318-V320 HydrophobicContact CD2-CG2 4.48Å; L318-V320 HydrophobicContact CG-CG2 3.91Å; L318-Y359 CarbonylContact O-C 3.44Å; L318-Y359 WeakPolarHBondContact O-CA 3.08Å; L318-Y359 WeakPolarHBondContact O-CB 3.06Å; L318-S360 PolarHBondContact O-N 3.3Å; L318-L363 WeakPolarHBondContact O-CD2 3.37Å; L318-I396 HydrophobicContact CD1-CD1 4.19Å
319	F	97.7	Very high	86	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	120.4	170.5	-170.1	-77.6	0	0	0	108.8	D317 A352 V357 Y359 L363 L384 L388 P395 I396	D317-F319 PolarHBondContact O-N 3.29Å; F319-A352 HydrophobicContact CE1-CB 3.86Å; F319-V357 HydrophobicContact CE1-CB 4.22Å; F319-V357 HydrophobicContact CE1-CG1 4.09Å; F319-V357 HydrophobicContact CE2-CG2 4.35Å; F319-V357 HydrophobicContact CZ-CB 3.93Å; F319-V357 HydrophobicContact CZ-CG1 3.98Å; F319-V357 HydrophobicContact CZ-CG2 3.94Å; F319-Y359 HydrophobicContact CD2-CD1 4.1Å; F319-Y359 HydrophobicContact CD2-CG 4.07Å; F319-Y359 AromaticContact CE2-CD1 3.84Å; F319-Y359 HydrophobicContact CE2-CD1 3.84Å; F319-Y359 HydrophobicContact CE2-CG 4.23Å; F319-L363 HydrophobicContact CB-CD2 3.71Å; F319-L363 HydrophobicContact CD2-CD2 3.9Å; F319-L363 HydrophobicContact CG-CD2 4.29Å; F319-L384 HydrophobicContact CE2-CD1 3.94Å; F319-L384 HydrophobicContact CE2-CD2 3.62Å; F319-L384 HydrophobicContact CE2-CG 3.75Å; F319-L384 HydrophobicContact CZ-CD1 4.39Å; F319-L384 HydrophobicContact CZ-CD2 3.41Å; F319-L384 VanDerWaalsContact CZ-CD2 3.41Å; F319-L384 HydrophobicContact CZ-CG 3.69Å; F319-L388 HydrophobicContact CB-CD2 4.36Å; F319-L388 HydrophobicContact CD1-CD1 3.75Å; F319-L388 HydrophobicContact CD2-CD1 3.86Å; F319-L388 HydrophobicContact CD2-CD2 3.81Å; F319-L388 HydrophobicContact CD2-CG 4.37Å; F319-L388 HydrophobicContact CE1-CD1 3.78Å; F319-L388 HydrophobicContact CE2-CD1 3.91Å; F319-L388 HydrophobicContact CE2-CD2 4.36Å; F319-L388 HydrophobicContact CG-CD1 3.79Å; F319-L388 HydrophobicContact CG-CD2 4.09Å; F319-L388 HydrophobicContact CZ-CD1 3.87Å; F319-P395 HydrophobicContact CD1-CB 3.54Å; F319-P395 HydrophobicContact CE1-CB 4.02Å; F319-P395 HydrophobicContact CG-CB 4.47Å; F319-I396 WeakPolarHBondContact O-CB 3.29Å; F319-I396 PolarHBondContact O-N 3.19Å
320	V	97.8	Very high	87.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.9	-169.5	-175.7	0	0	0	0	110.5	Y294 L318 V357 V358 I396 H398 F401	Y294-V320 HydrophobicContact CE1-CG1 4.29Å; Y294-V320 HydrophobicContact CE1-CG2 4.2Å; Y294-V320 WeakPolarHBondContact OH-CG2 3.25Å; L318-V320 HydrophobicContact CD1-CG2 3.66Å; L318-V320 HydrophobicContact CD2-CG2 4.48Å; L318-V320 HydrophobicContact CG-CG2 3.91Å; V320-V357 WeakPolarHBondContact O-CA 3.49Å; V320-V358 HydrophobicContact CB-CG1 3.77Å; V320-V358 HydrophobicContact CG1-CG1 4.46Å; V320-V358 HydrophobicContact CG2-CG1 4.49Å; V320-V358 PolarHBondContact N-O 2.73Å; V320-V358 PolarHBondContact O-N 3.48Å; V320-I396 WeakPolarHBondContact CA-O 3.22Å; V320-I396 HydrophobicContact CG2-CB 4.23Å; V320-H398 HydrophobicContact CG1-CB 3.47Å; V320-H398 VanDerWaalsContact CG1-CB 3.47Å; V320-F401 HydrophobicContact CG1-CE2 4.05Å
321	G	97.6	Very high	89.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	-157.7	173.4	0	0	0	0	0	111.1	V323 I396 H397 H398	G321-V323 PolarHBondContact O-N 2.97Å; G321-I396 PolarHBondContact N-O 3.11Å; G321-I396 VanDerWaalsContact N-O 3.13Å; G321-H397 CarbonylContact O-C 3.59Å; G321-H397 WeakPolarHBondContact O-CA 3.41Å; G321-H398 PolarHBondContact O-N 3.13Å
322	D	97.3	Very high	91.1	Very high	27 Å²	27	57.8 Å²	57.8	14%	0.144	28%	0.284	C	S	.	.			trans	-88.6	96.6	170	-174.3	9.4	0	0	0	110.4	A352 G353 H397 F401 T403	D322-A352 VanDerWaalsContact O-CA 3.23Å; D322-A352 WeakPolarHBondContact O-CA 3.49Å; D322-G353 PolarHBondContact O-N 3.47Å; D322-H397 IonicContact OD1-CE1 3.67Å; D322-H397 PolarHBondContact OD1-CE1 2.97Å; D322-H397 IonicContact OD1-ND1 2.84Å; D322-H397 PolarHBondContact OD1-ND1 3.38Å; D322-F401 HydrophobicContact CB-CB 4.1Å; D322-T403 HydrophobicContact CB-CG2 3.47Å; D322-T403 VanDerWaalsContact CB-CG2 3.47Å; D322-T403 PolarHBondContact OD2-OG1 3.4Å
323	V	97.4	Very high	92.6	Very high	17 Å²	17	58.4 Å²	58.4	10%	0.103	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.3	-173.4	-178.2	0	0	0	0	112.3	G321 Q325 P350 Y351 A352 P395 I396 H397	G321-V323 PolarHBondContact O-N 2.97Å; V323-Q325 HydrophobicContact CG1-CG 4.23Å; V323-P350 HydrophobicContact CG1-CB 4.35Å; V323-Y351 CarbonylContact C-O 3.53Å; V323-Y351 WeakPolarHBondContact CA-O 3.31Å; V323-A352 HydrophobicContact CG2-CB 4.11Å; V323-P395 HydrophobicContact CG1-CB 4.46Å; V323-P395 HydrophobicContact CG1-CG 3.88Å; V323-P395 HydrophobicContact CG2-CB 3.76Å; V323-P395 HydrophobicContact CG2-CG 4.1Å; V323-I396 VanDerWaalsContact CG2-C 3.47Å; V323-H397 HydrophobicContact CB-CB 3.99Å; V323-H397 HydrophobicContact CG2-CB 4.13Å; V323-H397 PolarHBondContact N-ND1 3.37Å
324	I	95.4	Very high	93.6	Very high	55 Å²	55	59.6 Å²	59.6	28%	0.282	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.5	172.2	-56.1	170.8	0	0	0	108.6	A327 P350 Y351	I324-A327 HydrophobicContact CG2-CB 3.85Å; I324-P350 WeakPolarHBondContact O-CA 3.45Å; I324-Y351 HydrophobicContact CB-CE1 4.2Å; I324-Y351 HydrophobicContact CB-CE2 4.42Å; I324-Y351 HydrophobicContact CD1-CE2 3.85Å; I324-Y351 HydrophobicContact CG2-CE1 4.31Å; I324-Y351 PolarHBondContact N-O 3.42Å; I324-Y351 PolarHBondContact O-N 3.15Å
325	Q	94.3	Very high	94.5	Very high	131 Å²	131	55.3 Å²	55.3	61%	0.612	29%	0.288	S	S	*	.			trans	-118.4	155.8	176.8	-60.6	-175.9	34	0	0	110.7	V323 A327 P350	V323-Q325 HydrophobicContact CG1-CG 4.23Å; Q325-A327 PolarHBondContact O-N 3.4Å; Q325-A327 VanDerWaalsContact O-N 3.08Å; Q325-P350 HydrophobicContact CG-CB 4.35Å
326	N	91.7	Very high	94.9	Very high	142 Å²	142	59.5 Å²	59.5	76%	0.759	31%	0.305	S	S	*	.	S	Bend	trans	55.2	27.2	175.8	-52.8	-45.3	0	0	0	114.1
327	A	94	Very high	95.2	Very high	18 Å²	18	60.6 Å²	60.6	15%	0.149	31%	0.308	C	S	.	.			trans	-72.6	143.3	178.3	0	0	0	0	0	111.1	I324 Q325 Y348 Y351	I324-A327 HydrophobicContact CG2-CB 3.85Å; Q325-A327 PolarHBondContact O-N 3.4Å; Q325-A327 VanDerWaalsContact O-N 3.08Å; A327-Y348 HydrophobicContact CB-CD2 4Å; A327-Y348 PolarHBondContact O-N 2.94Å; A327-Y351 HydrophobicContact CB-CE1 3.85Å
328	M	96.1	Very high	95.3	Very high	122 Å²	122	59.7 Å²	59.7	60%	0.601	30%	0.302	S	S	*	.			trans	-110.6	150.1	173.6	-66.2	-62.6	-69.4	0	0	110.2	N330 A347	M328-N330 PolarHBondContact O-N 2.92Å; M328-A347 VanDerWaalsContact SD-CA 3.55Å; M328-A347 HydrophobicContact SD-CB 3.64Å
329	P	96.6	Very high	95.4	Very high	9 Å²	9	59.5 Å²	59.5	6%	0.058	30%	0.301	C	S	.	.			trans	-57.8	135.7	173.9	-19.5	28.7	0	0	0	111.8	R331 I339 Y344 G346 Y348	P329-R331 PolarHBondContact O-N 2.96Å; P329-I339 HydrophobicContact CB-CB 4.04Å; P329-I339 HydrophobicContact CB-CG2 4.31Å; P329-Y344 HydrophobicContact CG-CD1 3.58Å; P329-Y344 HydrophobicContact CG-CE1 3.84Å; P329-G346 VanDerWaalsContact CD-O 3.23Å; P329-G346 WeakPolarHBondContact CD-O 3.36Å; P329-Y348 WeakPolarHBondContact CA-OH 3.49Å; P329-Y348 HydrophobicContact CB-CE1 4.25Å; P329-Y348 HydrophobicContact CB-CE2 4.4Å; P329-Y348 WeakPolarHBondContact CB-OH 3.3Å; P329-Y348 HydrophobicContact CG-CD1 4.42Å; P329-Y348 HydrophobicContact CG-CE1 3.72Å; P329-Y348 HydrophobicContact CG-CE2 4.39Å
330	N	96.5	Very high	95.3	Very high	64 Å²	64	60 Å²	60	34%	0.342	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-73.3	122.1	174.6	-170	-32.5	0	0	0	109.4	M328 Q332 T335 Y338 I339	M328-N330 PolarHBondContact O-N 2.92Å; N330-Q332 WeakPolarHBondContact OD1-CB 3.38Å; N330-Q332 PolarHBondContact OD1-N 2.02Å; N330-T335 PolarHBondContact ND2-OG1 2.85Å; N330-Y338 CarbonylContact O-C 3.6Å; N330-Y338 WeakPolarHBondContact O-CA 3.38Å; N330-I339 PolarHBondContact O-N 2.7Å
331	R	95.9	Very high	95.1	Very high	85 Å²	85	64.8 Å²	64.8	32%	0.321	33%	0.326	S	S	.	.			trans	-96.2	5.8	-177.8	-53.8	-52.5	-170	-178.7	5.3	113.7	P329 P333 Y338 I339 S340 Y344	P329-R331 PolarHBondContact O-N 2.96Å; R331-P333 VanDerWaalsContact O-CD 3.31Å; R331-P333 WeakPolarHBondContact O-CD 3.26Å; R331-Y338 VanDerWaalsContact O-CE2 3.31Å; R331-Y338 WeakPolarHBondContact O-CE2 3.5Å; R331-I339 WeakPolarHBondContact CD-O 3.45Å; R331-I339 PolarHBondContact NH1-O 3.1Å; R331-S340 PolarHBondContact NH1-O 3.44Å; R331-Y344 VanDerWaalsContact CZ-O 3.3Å; R331-Y344 PolarHBondContact NH1-O 2.71Å; R331-Y344 PolarHBondContact NH2-O 3.36Å
332	Q	95.8	Very high	94.9	Very high	104 Å²	104	66.1 Å²	66.1	49%	0.486	34%	0.336	S	S	.	.			trans	-86	110.8	178.8	-175.6	64.3	28.1	0	0	110.8	N330 T334 T335 Y338	N330-Q332 WeakPolarHBondContact OD1-CB 3.38Å; N330-Q332 PolarHBondContact OD1-N 2.02Å; Q332-T334 WeakPolarHBondContact CG-OG1 3.42Å; Q332-T334 PolarHBondContact NE2-OG1 3.38Å; Q332-T334 PolarHBondContact O-N 2.77Å; Q332-T335 HydrophobicContact CB-CG2 3.9Å; Q332-T335 HydrophobicContact CG-CG2 3.85Å; Q332-T335 PolarHBondContact O-N 3.01Å; Q332-T335 VanDerWaalsContact O-N 3.14Å; Q332-T335 PolarHBondContact O-OG1 3.34Å; Q332-Y338 VanDerWaalsContact C-CD2 3.42Å; Q332-Y338 WeakPolarHBondContact O-CB 3.23Å; Q332-Y338 WeakPolarHBondContact O-CD2 3.33Å
333	P	92.1	Very high	94.8	Very high	69 Å²	69	64.9 Å²	64.9	45%	0.448	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.2	-172.5	-23.9	35.2	0	0	0	115.6	P135 R331 T335 Y338	P135-P333 HydrophobicContact CG-CB 4.28Å; R331-P333 VanDerWaalsContact O-CD 3.31Å; R331-P333 WeakPolarHBondContact O-CD 3.26Å; P333-T335 VanDerWaalsContact C-N 3.31Å; P333-Y338 VanDerWaalsContact CA-CD2 3.48Å; P333-Y338 HydrophobicContact CB-CD2 4.32Å; P333-Y338 HydrophobicContact CB-CE1 4.46Å; P333-Y338 HydrophobicContact CB-CE2 4.22Å; P333-Y338 HydrophobicContact CB-CG 4.45Å; P333-Y338 HydrophobicContact CG-CD2 4.27Å; P333-Y338 HydrophobicContact CG-CE2 3.83Å
334	T	90.9	Very high	94.6	Very high	119 Å²	119	64.8 Å²	64.8	73%	0.73	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.4	-178.7	56.1	0	0	0	0	113.5	Q332	Q332-T334 WeakPolarHBondContact CG-OG1 3.42Å; Q332-T334 PolarHBondContact NE2-OG1 3.38Å; Q332-T334 PolarHBondContact O-N 2.77Å
335	T	94.1	Very high	94.5	Very high	44 Å²	44	67.2 Å²	67.2	27%	0.27	34%	0.335	S	S	.	.	S	Bend	trans	-96	146.3	-178.6	71	0	0	0	0	111	N330 Q332 P333 Y337 Y338	N330-T335 PolarHBondContact ND2-OG1 2.85Å; Q332-T335 HydrophobicContact CB-CG2 3.9Å; Q332-T335 HydrophobicContact CG-CG2 3.85Å; Q332-T335 PolarHBondContact O-N 3.01Å; Q332-T335 VanDerWaalsContact O-N 3.14Å; Q332-T335 PolarHBondContact O-OG1 3.34Å; P333-T335 VanDerWaalsContact C-N 3.31Å; T335-Y337 PolarHBondContact O-N 3.04Å; T335-Y337 VanDerWaalsContact O-N 3.11Å; T335-Y338 VanDerWaalsContact O-CB 3.3Å; T335-Y338 WeakPolarHBondContact O-CB 3.48Å; T335-Y338 PolarHBondContact O-N 3.39Å; T335-Y338 VanDerWaalsContact O-N 3.09Å; T335-Y338 PolarHBondContact OG1-N 3.19Å
336	K	92.4	Very high	94.4	Very high	112 Å²	112	62.5 Å²	62.5	49%	0.487	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.4	173.5	70.9	175.7	-172	170.4	0	113.7	F253 F254	F253-K336 HydrophobicContact CD1-CB 4.39Å; F253-K336 WeakPolarHBondContact CD1-O 3.23Å; F253-K336 HydrophobicContact CE1-CG 4.46Å; F253-K336 WeakPolarHBondContact CE1-O 3.38Å; F253-K336 HydrophobicContact CE2-CD 4.29Å; F253-K336 HydrophobicContact CZ-CD 4.42Å; F254-K336 WeakPolarHBondContact CE1-O 3.2Å
337	Y	95.4	Very high	94.5	Very high	106 Å²	106	58.2 Å²	58.2	42%	0.416	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	11.8	178.7	-58.1	-68.4	0	0	0	113	F253 T335 I339	F253-Y337 HydrophobicContact CE1-CD1 4.06Å; F253-Y337 HydrophobicContact CE1-CE1 4.26Å; F253-Y337 HydrophobicContact CE2-CE1 4.36Å; F253-Y337 AromaticContact CZ-CD1 3.78Å; F253-Y337 HydrophobicContact CZ-CD1 3.78Å; F253-Y337 AromaticContact CZ-CE1 3.53Å; F253-Y337 HydrophobicContact CZ-CE1 3.53Å; T335-Y337 PolarHBondContact O-N 3.04Å; T335-Y337 VanDerWaalsContact O-N 3.11Å; Y337-I339 PolarHBondContact O-N 3.13Å
338	Y	96.9	Very high	94.6	Very high	26 Å²	26	58 Å²	58	10%	0.102	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-61.1	130.5	180	173.6	-113.9	0	0	0	112	L134 P135 N330 R331 Q332 P333 T335 S340	L134-Y338 HydrophobicContact CD2-CE1 4.45Å; P135-Y338 HydrophobicContact CG-CD1 3.79Å; P135-Y338 HydrophobicContact CG-CE1 3.81Å; N330-Y338 CarbonylContact O-C 3.6Å; N330-Y338 WeakPolarHBondContact O-CA 3.38Å; R331-Y338 VanDerWaalsContact O-CE2 3.31Å; R331-Y338 WeakPolarHBondContact O-CE2 3.5Å; Q332-Y338 VanDerWaalsContact C-CD2 3.42Å; Q332-Y338 WeakPolarHBondContact O-CB 3.23Å; Q332-Y338 WeakPolarHBondContact O-CD2 3.33Å; P333-Y338 VanDerWaalsContact CA-CD2 3.48Å; P333-Y338 HydrophobicContact CB-CD2 4.32Å; P333-Y338 HydrophobicContact CB-CE1 4.46Å; P333-Y338 HydrophobicContact CB-CE2 4.22Å; P333-Y338 HydrophobicContact CB-CG 4.45Å; P333-Y338 HydrophobicContact CG-CD2 4.27Å; P333-Y338 HydrophobicContact CG-CE2 3.83Å; T335-Y338 VanDerWaalsContact O-CB 3.3Å; T335-Y338 WeakPolarHBondContact O-CB 3.48Å; T335-Y338 PolarHBondContact O-N 3.39Å; T335-Y338 VanDerWaalsContact O-N 3.09Å; T335-Y338 PolarHBondContact OG1-N 3.19Å; Y338-S340 WeakPolarHBondContact OH-CB 3.01Å
339	I	97.2	Very high	94.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.			trans	-133.9	121.3	170.8	-60.3	-65.5	0	0	0	107.8	M138 P329 N330 R331 Y337 F343 Y348 F377 P378 I379	M138-I339 HydrophobicContact CE-CG2 4.47Å; P329-I339 HydrophobicContact CB-CB 4.04Å; P329-I339 HydrophobicContact CB-CG2 4.31Å; N330-I339 PolarHBondContact O-N 2.7Å; R331-I339 WeakPolarHBondContact CD-O 3.45Å; R331-I339 PolarHBondContact NH1-O 3.1Å; Y337-I339 PolarHBondContact O-N 3.13Å; I339-F343 HydrophobicContact CG2-CD1 3.89Å; I339-Y348 WeakPolarHBondContact CG1-OH 3.5Å; I339-F377 HydrophobicContact CD1-CE1 4.3Å; I339-F377 HydrophobicContact CD1-CZ 4.3Å; I339-F377 HydrophobicContact CG1-CE1 4.47Å; I339-F377 HydrophobicContact CG1-CZ 4.35Å; I339-F377 HydrophobicContact CG2-CZ 4.24Å; I339-P378 HydrophobicContact CD1-CB 3.84Å; I339-P378 HydrophobicContact CD1-CG 3.69Å; I339-I379 HydrophobicContact CD1-CD1 4.2Å; I339-I379 HydrophobicContact CD1-CG1 4.22Å; I339-I379 HydrophobicContact CG1-CD1 3.91Å; I339-I379 HydrophobicContact CG1-CG1 4.47Å
340	S	95.4	Very high	94.6	Very high	9 Å²	9	55.2 Å²	55.2	6%	0.063	29%	0.293	C	S	.	.			trans	-65.8	147.7	177.7	-174.1	0	0	0	0	111.7	D130 R331 Y338 S342 F343 Y344	D130-S340 PolarHBondContact OD2-OG 2.92Å; R331-S340 PolarHBondContact NH1-O 3.44Å; Y338-S340 WeakPolarHBondContact OH-CB 3.01Å; S340-S342 PolarHBondContact O-N 3.28Å; S340-S342 PolarHBondContact OG-N 2.98Å; S340-S342 PolarHBondContact OG-OG 2.81Å; S340-F343 PolarHBondContact O-N 2.89Å; S340-Y344 PolarHBondContact O-N 3.13Å; S340-Y344 VanDerWaalsContact O-N 3.07Å
341	E	93.6	Very high	94.6	Very high	101 Å²	101	53.7 Å²	53.7	47%	0.472	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-32.1	173.5	-173.1	170.8	-179.1	0	0	112	A76 F343 K345	A76-E341 WeakPolarHBondContact CB-O 3.5Å; E341-F343 PolarHBondContact O-N 2.82Å; E341-K345 HydrophobicContact CG-CD 4.36Å; E341-K345 WeakPolarHBondContact OE1-CE 3.32Å; E341-K345 IonicContact OE1-NZ 2.68Å; E341-K345 PolarHBondContact OE1-NZ 2.94Å
342	S	93.3	Very high	94.6	Very high	29 Å²	29	49.7 Å²	49.7	20%	0.203	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.9	174.9	63.8	0	0	0	0	113.3	A76 L77 L128 D130 S340	A76-S342 CarbonylContact C-O 3.57Å; A76-S342 WeakPolarHBondContact CA-O 3.03Å; A76-S342 WeakPolarHBondContact CB-O 3.27Å; L77-S342 PolarHBondContact N-O 3.3Å; L128-S342 WeakPolarHBondContact CD1-O 3.41Å; L128-S342 VanDerWaalsContact CD1-OG 3.28Å; L128-S342 WeakPolarHBondContact CD1-OG 3.19Å; D130-S342 WeakPolarHBondContact OD1-CB 3.36Å; D130-S342 PolarHBondContact OD1-OG 2.81Å; D130-S342 PolarHBondContact OD2-OG 2.7Å; S340-S342 PolarHBondContact O-N 3.28Å; S340-S342 PolarHBondContact OG-N 2.98Å; S340-S342 PolarHBondContact OG-OG 2.81Å
343	F	94.8	Very high	94.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-48.8	177	177.7	-96	0	0	0	113	A76 L77 W78 M138 F141 V142 M145 I339 S340 E341 F377 P378	A76-F343 WeakPolarHBondContact CB-O 3.45Å; L77-F343 HydrophobicContact CD2-CD2 4.33Å; L77-F343 PolarHBondContact N-O 2.98Å; W78-F343 HydrophobicContact CB-CD1 4.4Å; W78-F343 HydrophobicContact CB-CE1 4.04Å; W78-F343 HydrophobicContact CB-CE2 4.32Å; W78-F343 HydrophobicContact CB-CZ 3.99Å; W78-F343 WeakPolarHBondContact CB-O 3Å; W78-F343 AromaticContact CD1-CZ 3.94Å; W78-F343 HydrophobicContact CG-CE1 4.4Å; W78-F343 HydrophobicContact CG-CZ 4.3Å; W78-F343 PolarHBondContact N-O 2.85Å; M138-F343 HydrophobicContact CE-CB 3.25Å; M138-F343 HydrophobicContact CE-CD1 3.38Å; M138-F343 HydrophobicContact CE-CD2 3.77Å; M138-F343 HydrophobicContact CE-CE1 4.13Å; M138-F343 HydrophobicContact CE-CE2 4.47Å; M138-F343 HydrophobicContact CE-CG 3.15Å; F141-F343 HydrophobicContact CD1-CE2 4.41Å; F141-F343 HydrophobicContact CD1-CZ 4.23Å; F141-F343 HydrophobicContact CE1-CE2 4.23Å; F141-F343 AromaticContact CE1-CZ 3.74Å; F141-F343 HydrophobicContact CE1-CZ 3.74Å; V142-F343 HydrophobicContact CG2-CD2 3.84Å; V142-F343 HydrophobicContact CG2-CE2 3.89Å; M145-F343 HydrophobicContact SD-CE2 3.93Å; M145-F343 HydrophobicContact SD-CZ 4.32Å; I339-F343 HydrophobicContact CG2-CD1 3.89Å; S340-F343 PolarHBondContact O-N 2.89Å; E341-F343 PolarHBondContact O-N 2.82Å; F343-F377 HydrophobicContact CD1-CE2 4.5Å; F343-F377 HydrophobicContact CE1-CD2 4.12Å; F343-F377 AromaticContact CE1-CE2 3.85Å; F343-F377 HydrophobicContact CE1-CE2 3.85Å; F343-P378 HydrophobicContact CE1-CG 3.81Å; F343-P378 HydrophobicContact CZ-CG 4.04Å
344	Y	95	Very high	93.5	Very high	16 Å²	16	42.8 Å²	42.8	6%	0.063	24%	0.237	C	C	.	.			trans	-141	133.2	178.1	179.1	-92.8	0	0	0	111.6	W78 N79 P329 R331 S340 G346 A347 Y348 F377 M386	W78-Y344 HydrophobicContact CB-CD2 4.44Å; W78-Y344 AromaticContact CD2-CD2 4Å; W78-Y344 HydrophobicContact CD2-CD2 4Å; W78-Y344 HydrophobicContact CD2-CE2 4.38Å; W78-Y344 AromaticContact CE3-CD2 3.47Å; W78-Y344 HydrophobicContact CE3-CD2 3.47Å; W78-Y344 VanDerWaalsContact CE3-CD2 3.47Å; W78-Y344 AromaticContact CE3-CE2 3.56Å; W78-Y344 HydrophobicContact CE3-CE2 3.56Å; W78-Y344 HydrophobicContact CG-CD2 4.41Å; W78-Y344 HydrophobicContact CZ3-CD2 4.06Å; W78-Y344 AromaticContact CZ3-CE2 3.64Å; W78-Y344 HydrophobicContact CZ3-CE2 3.64Å; N79-Y344 WeakPolarHBondContact OD1-CA 3.39Å; P329-Y344 HydrophobicContact CG-CD1 3.58Å; P329-Y344 HydrophobicContact CG-CE1 3.84Å; R331-Y344 VanDerWaalsContact CZ-O 3.3Å; R331-Y344 PolarHBondContact NH1-O 2.71Å; R331-Y344 PolarHBondContact NH2-O 3.36Å; S340-Y344 PolarHBondContact O-N 3.13Å; S340-Y344 VanDerWaalsContact O-N 3.07Å; Y344-G346 WeakPolarHBondContact CE1-O 3.49Å; Y344-A347 PolarHBondContact OH-O 3.16Å; Y344-Y348 HydrophobicContact CD1-CD1 4.42Å; Y344-Y348 AromaticContact CD1-CE1 3.85Å; Y344-Y348 HydrophobicContact CD1-CE1 3.85Å; Y344-Y348 AromaticContact CE1-CD1 3.67Å; Y344-Y348 HydrophobicContact CE1-CD1 3.67Å; Y344-Y348 AromaticContact CE1-CE1 3.56Å; Y344-Y348 HydrophobicContact CE1-CE1 3.56Å; Y344-F377 HydrophobicContact CD1-CE2 4.31Å; Y344-F377 HydrophobicContact CD1-CZ 4.18Å; Y344-F377 HydrophobicContact CD2-CD2 4.45Å; Y344-F377 AromaticContact CD2-CE2 3.56Å; Y344-F377 HydrophobicContact CD2-CE2 3.56Å; Y344-F377 HydrophobicContact CD2-CZ 4.23Å; Y344-F377 HydrophobicContact CE2-CE2 4.18Å; Y344-F377 AromaticContact CG-CE2 3.62Å; Y344-F377 HydrophobicContact CG-CE2 3.62Å; Y344-F377 AromaticContact CG-CZ 3.92Å; Y344-F377 HydrophobicContact CG-CZ 3.92Å; Y344-M386 HydrophobicContact CD2-CE 4.29Å; Y344-M386 HydrophobicContact CE2-CE 3.62Å
345	K	92.7	Very high	93.2	Very high	105 Å²	105	37.2 Å²	37.2	46%	0.457	20%	0.203	S	C	.	.			trans	-126.5	141.7	177.9	-168.8	166.5	-175.7	147.5	0	111	A76 N79 E341	A76-K345 HydrophobicContact CB-CB 3.96Å; N79-K345 PolarHBondContact ND2-O 2.83Å; N79-K345 PolarHBondContact OD1-N 2.77Å; N79-K345 PolarHBondContact OD1-O 3.43Å; E341-K345 HydrophobicContact CG-CD 4.36Å; E341-K345 WeakPolarHBondContact OE1-CE 3.32Å; E341-K345 IonicContact OE1-NZ 2.68Å; E341-K345 PolarHBondContact OE1-NZ 2.94Å
346	G	91.4	Very high	93.3	Very high	33 Å²	33	35.4 Å²	35.4	34%	0.34	19%	0.193	S	C	.	.	S	Bend	trans	111.8	176.9	-176.1	0	0	0	0	0	112.9	P329 Y344	P329-G346 VanDerWaalsContact CD-O 3.23Å; P329-G346 WeakPolarHBondContact CD-O 3.36Å; Y344-G346 WeakPolarHBondContact CE1-O 3.49Å
347	A	93.6	Very high	93.6	Very high	52 Å²	52	30.1 Å²	30.1	43%	0.43	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-78.2	158.5	173.9	0	0	0	0	0	111	M328 Y344	M328-A347 VanDerWaalsContact SD-CA 3.55Å; M328-A347 HydrophobicContact SD-CB 3.64Å; Y344-A347 PolarHBondContact OH-O 3.16Å
348	Y	96.3	Very high	93.7	Very high	13 Å²	13	25.1 Å²	25.1	5%	0.051	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-78.6	145.9	167.1	-63.4	-36.1	0	0	0	110.8	A327 P329 I339 Y344 Y351 F377 V382	A327-Y348 HydrophobicContact CB-CD2 4Å; A327-Y348 PolarHBondContact O-N 2.94Å; P329-Y348 WeakPolarHBondContact CA-OH 3.49Å; P329-Y348 HydrophobicContact CB-CE1 4.25Å; P329-Y348 HydrophobicContact CB-CE2 4.4Å; P329-Y348 WeakPolarHBondContact CB-OH 3.3Å; P329-Y348 HydrophobicContact CG-CD1 4.42Å; P329-Y348 HydrophobicContact CG-CE1 3.72Å; P329-Y348 HydrophobicContact CG-CE2 4.39Å; I339-Y348 WeakPolarHBondContact CG1-OH 3.5Å; Y344-Y348 HydrophobicContact CD1-CD1 4.42Å; Y344-Y348 AromaticContact CD1-CE1 3.85Å; Y344-Y348 HydrophobicContact CD1-CE1 3.85Å; Y344-Y348 AromaticContact CE1-CD1 3.67Å; Y344-Y348 HydrophobicContact CE1-CD1 3.67Å; Y344-Y348 AromaticContact CE1-CE1 3.56Å; Y344-Y348 HydrophobicContact CE1-CE1 3.56Å; Y348-Y351 HydrophobicContact CD2-CE1 4.1Å; Y348-F377 AromaticContact CE1-CE1 3.78Å; Y348-F377 HydrophobicContact CE1-CE1 3.78Å; Y348-F377 AromaticContact CE1-CZ 3.62Å; Y348-F377 HydrophobicContact CE1-CZ 3.62Å; Y348-V382 HydrophobicContact CD1-CG1 3.42Å; Y348-V382 VanDerWaalsContact CD1-CG1 3.42Å; Y348-V382 HydrophobicContact CD1-CG2 4.41Å; Y348-V382 HydrophobicContact CD2-CG1 4.25Å; Y348-V382 HydrophobicContact CD2-CG2 3.77Å; Y348-V382 HydrophobicContact CE1-CG1 3.73Å; Y348-V382 HydrophobicContact CE1-CG2 4.46Å; Y348-V382 HydrophobicContact CE2-CG1 4.49Å; Y348-V382 HydrophobicContact CE2-CG2 3.81Å; Y348-V382 HydrophobicContact CG-CG1 3.71Å; Y348-V382 HydrophobicContact CG-CG2 4.07Å
349	P	96.4	Very high	93.8	Very high	20 Å²	20	23.9 Å²	23.9	13%	0.13	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-63.3	161.4	165.8	30.4	-34.7	0	0	0	109.7	Y351 M386 H389	P349-Y351 WeakPolarHBondContact O-CD1 3.02Å; P349-Y351 PolarHBondContact O-N 3.37Å; P349-M386 HydrophobicContact CG-CB 4.43Å; P349-M386 HydrophobicContact CG-CG 3.87Å; P349-H389 HydrophobicContact CB-CB 3.92Å
350	P	96.8	Very high	93.8	Very high	52 Å²	52	24.1 Å²	24.1	34%	0.338	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-52.8	130.7	169.7	-25.9	35.4	0	0	0	111.2	V323 I324 Q325 P395	V323-P350 HydrophobicContact CG1-CB 4.35Å; I324-P350 WeakPolarHBondContact O-CA 3.45Å; Q325-P350 HydrophobicContact CG-CB 4.35Å; P350-P395 HydrophobicContact CB-CG 4.11Å
351	Y	97.1	Very high	93.8	Very high	32 Å²	32	24 Å²	24	13%	0.125	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.6	178.8	69	-86.4	0	0	0	109.8	V323 I324 A327 Y348 P349 D381 V382	V323-Y351 CarbonylContact C-O 3.53Å; V323-Y351 WeakPolarHBondContact CA-O 3.31Å; I324-Y351 HydrophobicContact CB-CE1 4.2Å; I324-Y351 HydrophobicContact CB-CE2 4.42Å; I324-Y351 HydrophobicContact CD1-CE2 3.85Å; I324-Y351 HydrophobicContact CG2-CE1 4.31Å; I324-Y351 PolarHBondContact N-O 3.42Å; I324-Y351 PolarHBondContact O-N 3.15Å; A327-Y351 HydrophobicContact CB-CE1 3.85Å; Y348-Y351 HydrophobicContact CD2-CE1 4.1Å; P349-Y351 WeakPolarHBondContact O-CD1 3.02Å; P349-Y351 PolarHBondContact O-N 3.37Å; Y351-D381 VanDerWaalsContact CB-O 3.31Å; Y351-D381 WeakPolarHBondContact CB-O 3.21Å; Y351-D381 HydrophobicContact CD2-CB 3.81Å; Y351-D381 HydrophobicContact CE2-CB 4.14Å; Y351-V382 HydrophobicContact CD1-CG2 4.19Å; Y351-V382 HydrophobicContact CD2-CG2 4.46Å; Y351-V382 HydrophobicContact CE1-CG2 3.95Å; Y351-V382 HydrophobicContact CE2-CG2 4.21Å; Y351-V382 HydrophobicContact CG-CG2 4.45Å
352	A	96.1	Very high	93.9	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.017	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.9	166.6	0	0	0	0	0	109.2	F319 D322 V323 V357 D381	F319-A352 HydrophobicContact CE1-CB 3.86Å; D322-A352 VanDerWaalsContact O-CA 3.23Å; D322-A352 WeakPolarHBondContact O-CA 3.49Å; V323-A352 HydrophobicContact CG2-CB 4.11Å; A352-V357 HydrophobicContact CB-CG1 3.61Å; A352-D381 WeakPolarHBondContact O-CB 3.47Å
353	G	88.6	Confident	94.1	Very high	2 Å²	2	20 Å²	20	2%	0.021	13%	0.134	C	C	.	.			trans	-146.4	-170.1	179.4	0	0	0	0	0	114	D322 D381 T403	D322-G353 PolarHBondContact O-N 3.47Å; G353-D381 VanDerWaalsContact CA-CG 3.42Å; G353-D381 WeakPolarHBondContact CA-OD2 3.42Å; G353-T403 VanDerWaalsContact O-CG2 3.23Å; G353-T403 WeakPolarHBondContact O-CG2 2.99Å
354	G	75.2	Confident	94.3	Very high	26 Å²	26	20 Å²	20	27%	0.268	13%	0.134	S	C	.	.	S	Bend	trans	85.6	17.3	164	0	0	0	0	0	117.4	D381 T403 H424	G354-D381 PolarHBondContact N-OD2 3.11Å; G354-T403 VanDerWaalsContact O-CB 3.25Å; G354-T403 WeakPolarHBondContact O-CB 3.2Å; G354-H424 WeakPolarHBondContact O-CB 3.11Å
355	G	85.7	Confident	94.3	Very high	2 Å²	2	20.9 Å²	20.9	2%	0.021	14%	0.139	C	C	.	.	S	Bend	trans	149.3	-26.9	167.7	0	0	0	0	0	114.6	G280 D281 V284	G280-G355 CarbonylContact C-O 3.52Å; G280-G355 WeakPolarHBondContact CA-O 3.45Å; D281-G355 PolarHBondContact N-O 2.61Å; V284-G355 WeakPolarHBondContact CG1-O 3.5Å
356	G	95.6	Very high	94.6	Very high	6 Å²	6	19.4 Å²	19.4	6%	0.062	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.6	161.6	171.2	0	0	0	0	0	115.6	K279 F401	K279-G356 CarbonylContact O-C 3.52Å; K279-G356 WeakPolarHBondContact O-CA 3.48Å; G356-F401 WeakPolarHBondContact O-CD1 3.45Å
357	V	98	Very high	94.9	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	154.4	-179	-61.5	0	0	0	0	109.6	F278 K279 F319 V320 A352 Y359 L384	F278-V357 CarbonylContact C-O 3.57Å; F278-V357 WeakPolarHBondContact CA-O 3.49Å; F278-V357 WeakPolarHBondContact CD2-O 3.49Å; K279-V357 HydrophobicContact CB-CG2 4.04Å; K279-V357 PolarHBondContact N-O 3.4Å; K279-V357 PolarHBondContact O-N 3.43Å; F319-V357 HydrophobicContact CE1-CB 4.22Å; F319-V357 HydrophobicContact CE1-CG1 4.09Å; F319-V357 HydrophobicContact CE2-CG2 4.35Å; F319-V357 HydrophobicContact CZ-CB 3.93Å; F319-V357 HydrophobicContact CZ-CG1 3.98Å; F319-V357 HydrophobicContact CZ-CG2 3.94Å; V320-V357 WeakPolarHBondContact O-CA 3.49Å; A352-V357 HydrophobicContact CB-CG1 3.61Å; V357-Y359 HydrophobicContact CG2-CD1 3.93Å; V357-Y359 HydrophobicContact CG2-CE1 3.88Å; V357-L384 HydrophobicContact CG2-CD2 4.17Å
358	V	98.3	Very high	95	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.3	171	66.5	0	0	0	0	110.1	L173 F276 V277 F278 L291 L295 V320 F401	L173-V358 HydrophobicContact CD1-CG2 4.35Å; F276-V358 HydrophobicContact CB-CG2 4.45Å; V277-V358 CarbonylContact O-C 3.58Å; V277-V358 WeakPolarHBondContact O-CA 3.29Å; F278-V358 HydrophobicContact CD2-CB 4.44Å; L291-V358 HydrophobicContact CD1-CG1 4.18Å; L295-V358 HydrophobicContact CD1-CG2 4.14Å; L295-V358 HydrophobicContact CD2-CG1 4.44Å; L295-V358 HydrophobicContact CD2-CG2 3.91Å; V320-V358 HydrophobicContact CB-CG1 3.77Å; V320-V358 HydrophobicContact CG1-CG1 4.46Å; V320-V358 HydrophobicContact CG2-CG1 4.49Å; V320-V358 PolarHBondContact N-O 2.73Å; V320-V358 PolarHBondContact O-N 3.48Å; V358-F401 HydrophobicContact CG1-CZ 4.01Å
359	Y	98	Very high	95	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	161.2	-179.8	49.6	-87.4	0	0	0	111.7	W264 F276 V277 K279 L318 F319 V357 A364 L367	W264-Y359 AromaticContact NE1-CZ 3.88Å; W264-Y359 PolarHBondContact NE1-OH 3.49Å; W264-Y359 VanDerWaalsContact NE1-OH 3.08Å; F276-Y359 CarbonylContact C-O 3.52Å; F276-Y359 WeakPolarHBondContact CA-O 3.31Å; V277-Y359 HydrophobicContact CB-CD2 4.08Å; V277-Y359 HydrophobicContact CB-CE1 4.48Å; V277-Y359 HydrophobicContact CB-CE2 3.67Å; V277-Y359 HydrophobicContact CG1-CE1 4.29Å; V277-Y359 HydrophobicContact CG1-CE2 3.92Å; V277-Y359 HydrophobicContact CG2-CE2 4.23Å; V277-Y359 PolarHBondContact N-O 3.35Å; V277-Y359 PolarHBondContact O-N 3.35Å; K279-Y359 HydrophobicContact CB-CE1 3.99Å; L318-Y359 CarbonylContact O-C 3.44Å; L318-Y359 WeakPolarHBondContact O-CA 3.08Å; L318-Y359 WeakPolarHBondContact O-CB 3.06Å; F319-Y359 HydrophobicContact CD2-CD1 4.1Å; F319-Y359 HydrophobicContact CD2-CG 4.07Å; F319-Y359 AromaticContact CE2-CD1 3.84Å; F319-Y359 HydrophobicContact CE2-CD1 3.84Å; F319-Y359 HydrophobicContact CE2-CG 4.23Å; V357-Y359 HydrophobicContact CG2-CD1 3.93Å; V357-Y359 HydrophobicContact CG2-CE1 3.88Å; Y359-A364 HydrophobicContact CD2-CB 3.95Å; Y359-A364 HydrophobicContact CE2-CB 3.57Å; Y359-L367 HydrophobicContact CD2-CD1 4.22Å; Y359-L367 HydrophobicContact CE2-CD1 4.2Å
360	S	97.8	Very high	95	Very high	5 Å²	5	22.3 Å²	22.3	4%	0.035	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	149.5	177.7	93.4	0	0	0	0	111.2	I315 K316 L318 A362 L363 A364	I315-S360 WeakPolarHBondContact O-CB 3.27Å; K316-S360 PolarHBondContact O-OG 2.81Å; L318-S360 PolarHBondContact O-N 3.3Å; S360-A362 PolarHBondContact O-N 3.39Å; S360-A362 PolarHBondContact OG-N 2.78Å; S360-L363 PolarHBondContact O-N 3.46Å; S360-L363 WeakPolarHBondContact OG-CB 3.34Å; S360-L363 PolarHBondContact OG-N 2.88Å; S360-A364 PolarHBondContact O-N 3.01Å
361	G	96.2	Very high	95	Very high	6 Å²	6	20 Å²	20	6%	0.062	11%	0.108	C	C	.	.	H	α-helix	trans	-62	-32.4	172.8	0	0	0	0	0	112.7	A274 Q275 A364 M365	A274-G361 WeakPolarHBondContact O-CA 3.46Å; Q275-G361 PolarHBondContact O-N 2.76Å; G361-A364 VanDerWaalsContact O-CB 3.28Å; G361-A364 WeakPolarHBondContact O-CB 3.33Å; G361-A364 PolarHBondContact O-N 3Å; G361-M365 PolarHBondContact O-N 3.4Å; G361-M365 VanDerWaalsContact O-N 3.15Å
362	A	95.7	Very high	94.8	Very high	46 Å²	46	23.2 Å²	23.2	38%	0.38	13%	0.125	S	C	.	.	H	α-helix	trans	-64.1	-42.4	174.8	0	0	0	0	0	111.7	K316 S360 A364 M365 R366	K316-A362 HydrophobicContact CB-CB 4.05Å; K316-A362 HydrophobicContact CG-CB 4.21Å; S360-A362 PolarHBondContact O-N 3.39Å; S360-A362 PolarHBondContact OG-N 2.78Å; A362-A364 VanDerWaalsContact C-N 3.32Å; A362-M365 PolarHBondContact O-N 3.21Å; A362-R366 PolarHBondContact O-N 3.24Å
363	L	97.3	Very high	94.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-37.9	173.8	-177	56.2	0	0	0	110.9	K316 L318 F319 S360 M365 R366 L367 L388 L391 V393	K316-L363 WeakPolarHBondContact O-CB 2.99Å; K316-L363 PolarHBondContact O-N 3.16Å; L318-L363 WeakPolarHBondContact O-CD2 3.37Å; F319-L363 HydrophobicContact CB-CD2 3.71Å; F319-L363 HydrophobicContact CD2-CD2 3.9Å; F319-L363 HydrophobicContact CG-CD2 4.29Å; S360-L363 PolarHBondContact O-N 3.46Å; S360-L363 WeakPolarHBondContact OG-CB 3.34Å; S360-L363 PolarHBondContact OG-N 2.88Å; L363-M365 VanDerWaalsContact C-N 3.27Å; L363-M365 PolarHBondContact O-N 3.35Å; L363-R366 HydrophobicContact CD1-CB 4.42Å; L363-R366 CarbonylContact O-C 3.45Å; L363-R366 WeakPolarHBondContact O-CB 3.34Å; L363-R366 PolarHBondContact O-N 3.14Å; L363-R366 VanDerWaalsContact O-N 3.09Å; L363-L367 HydrophobicContact CD1-CG 4.3Å; L363-L367 HydrophobicContact CG-CD1 4.09Å; L363-L367 HydrophobicContact CG-CG 4.17Å; L363-L367 WeakPolarHBondContact O-CB 3.22Å; L363-L367 VanDerWaalsContact O-CG 3.31Å; L363-L367 WeakPolarHBondContact O-CG 3.25Å; L363-L367 PolarHBondContact O-N 2.91Å; L363-L388 HydrophobicContact CD1-CD2 4.34Å; L363-L388 HydrophobicContact CD2-CD2 3.93Å; L363-L391 HydrophobicContact CD1-CD1 3.84Å; L363-V393 HydrophobicContact CD1-CG2 4.15Å; L363-V393 HydrophobicContact CD2-CG1 4.22Å
364	A	97.7	Very high	95	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.4	-40.7	175.1	0	0	0	0	0	112.4	L267 V277 Y359 S360 G361 A362 L367 R368	L267-A364 HydrophobicContact CD2-CB 3.41Å; L267-A364 VanDerWaalsContact CD2-CB 3.41Å; V277-A364 HydrophobicContact CG2-CB 4.32Å; Y359-A364 HydrophobicContact CD2-CB 3.95Å; Y359-A364 HydrophobicContact CE2-CB 3.57Å; S360-A364 PolarHBondContact O-N 3.01Å; G361-A364 VanDerWaalsContact O-CB 3.28Å; G361-A364 WeakPolarHBondContact O-CB 3.33Å; G361-A364 PolarHBondContact O-N 3Å; A362-A364 VanDerWaalsContact C-N 3.32Å; A364-L367 WeakPolarHBondContact O-CB 3.33Å; A364-L367 PolarHBondContact O-N 3.06Å; A364-R368 PolarHBondContact O-N 3.2Å
365	M	96.9	Very high	96	Very high	36 Å²	36	29.3 Å²	29.3	18%	0.177	14%	0.14	C	C	.	.	H	α-helix	trans	-66.9	-39.3	175.9	-63.1	-58.8	97.6	0	0	112.2	L267 Q268 G361 A362 L363 R368 Q369	L267-M365 HydrophobicContact CB-CE 4.27Å; L267-M365 HydrophobicContact CD2-CE 3.6Å; L267-M365 HydrophobicContact CG-CE 3.6Å; Q268-M365 HydrophobicContact CB-CE 4.09Å; Q268-M365 HydrophobicContact CB-SD 3.8Å; Q268-M365 HydrophobicContact CG-SD 3.75Å; G361-M365 PolarHBondContact O-N 3.4Å; G361-M365 VanDerWaalsContact O-N 3.15Å; A362-M365 PolarHBondContact O-N 3.21Å; L363-M365 VanDerWaalsContact C-N 3.27Å; L363-M365 PolarHBondContact O-N 3.35Å; M365-R368 WeakPolarHBondContact O-CB 3.27Å; M365-R368 PolarHBondContact O-N 3.49Å; M365-Q369 WeakPolarHBondContact O-CG 3.24Å; M365-Q369 PolarHBondContact O-N 2.81Å
366	R	97.4	Very high	96.5	Very high	74 Å²	74	29.5 Å²	29.5	28%	0.279	14%	0.14	S	C	.	.	H	α-helix	trans	-67.3	-37.6	174.1	-66.8	177.4	63.1	-162.8	-2.5	111.8	D317 A362 L363 Q369 V370 L391	D317-R366 IonicContact OD1-CZ 2.74Å; D317-R366 IonicContact OD1-NH1 2.65Å; D317-R366 PolarHBondContact OD1-NH1 2.9Å; D317-R366 IonicContact OD2-NH1 3.22Å; D317-R366 PolarHBondContact OD2-NH1 3.23Å; A362-R366 PolarHBondContact O-N 3.24Å; L363-R366 HydrophobicContact CD1-CB 4.42Å; L363-R366 CarbonylContact O-C 3.45Å; L363-R366 WeakPolarHBondContact O-CB 3.34Å; L363-R366 PolarHBondContact O-N 3.14Å; L363-R366 VanDerWaalsContact O-N 3.09Å; R366-Q369 PolarHBondContact O-N 3.39Å; R366-V370 PolarHBondContact O-N 3.07Å; R366-L391 HydrophobicContact CB-CD1 3.94Å; R366-L391 HydrophobicContact CB-CD2 4.12Å; R366-L391 PolarHBondContact NH2-O 3.29Å; R366-L391 VanDerWaalsContact NH2-O 3.13Å
367	L	97.9	Very high	96.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-45.9	174.9	-75.6	170.8	0	0	0	110.8	W264 Y359 L363 A364 Q369 V370 S371 L384 C387 L388 L391	W264-L367 HydrophobicContact CD2-CB 4.27Å; W264-L367 HydrophobicContact CE3-CB 4.4Å; W264-L367 HydrophobicContact CH2-CB 4.32Å; W264-L367 HydrophobicContact CZ2-CB 4.16Å; W264-L367 HydrophobicContact CZ2-CD1 4.03Å; W264-L367 HydrophobicContact CZ3-CB 4.42Å; Y359-L367 HydrophobicContact CD2-CD1 4.22Å; Y359-L367 HydrophobicContact CE2-CD1 4.2Å; L363-L367 HydrophobicContact CD1-CG 4.3Å; L363-L367 HydrophobicContact CG-CD1 4.09Å; L363-L367 HydrophobicContact CG-CG 4.17Å; L363-L367 WeakPolarHBondContact O-CB 3.22Å; L363-L367 VanDerWaalsContact O-CG 3.31Å; L363-L367 WeakPolarHBondContact O-CG 3.25Å; L363-L367 PolarHBondContact O-N 2.91Å; A364-L367 WeakPolarHBondContact O-CB 3.33Å; A364-L367 PolarHBondContact O-N 3.06Å; L367-Q369 VanDerWaalsContact C-N 3.3Å; L367-Q369 PolarHBondContact O-N 2.95Å; L367-V370 WeakPolarHBondContact O-CG1 3.33Å; L367-V370 PolarHBondContact O-N 2.89Å; L367-S371 VanDerWaalsContact O-CB 3.29Å; L367-S371 WeakPolarHBondContact O-CB 3.49Å; L367-S371 PolarHBondContact O-N 3Å; L367-L384 HydrophobicContact CD1-CD1 3.76Å; L367-L384 HydrophobicContact CD2-CD1 3.73Å; L367-L384 HydrophobicContact CG-CD1 4.38Å; L367-C387 HydrophobicContact CD2-CB 3.7Å; L367-L388 HydrophobicContact CD2-CD2 4.18Å; L367-L391 HydrophobicContact CD2-CD1 4Å; L367-L391 HydrophobicContact CG-CD1 4.36Å
368	R	96.9	Very high	96.5	Very high	58 Å²	58	29.1 Å²	29.1	22%	0.219	14%	0.137	C	C	.	.	H	α-helix	trans	-52.4	-49.4	171.4	-179.5	-94.9	159.9	149.9	-12.8	111.5	W264 Q268 A364 M365 S371 E372	W264-R368 HydrophobicContact CB-CB 4.01Å; W264-R368 HydrophobicContact CB-CG 4.46Å; Q268-R368 VanDerWaalsContact CD-NH1 3.31Å; Q268-R368 VanDerWaalsContact NE2-NH1 3.17Å; Q268-R368 VanDerWaalsContact OE1-CZ 3.23Å; A364-R368 PolarHBondContact O-N 3.2Å; M365-R368 WeakPolarHBondContact O-CB 3.27Å; M365-R368 PolarHBondContact O-N 3.49Å; R368-S371 WeakPolarHBondContact O-CB 3.33Å; R368-S371 PolarHBondContact O-N 3.01Å; R368-S371 PolarHBondContact O-OG 2.84Å; R368-E372 IonicContact CZ-OE1 3.95Å; R368-E372 IonicContact NE-OE1 3.25Å; R368-E372 PolarHBondContact NE-OE1 2.84Å; R368-E372 IonicContact NH2-OE1 2.82Å; R368-E372 PolarHBondContact NH2-OE1 2.9Å
369	Q	96.3	Very high	96.5	Very high	112 Å²	112	29.7 Å²	29.7	52%	0.523	14%	0.139	S	C	.	.	H	α-helix	trans	-69	-44.2	-175.7	-69.9	173.7	-2.6	0	0	112.4	M365 R366 L367 S371 E372	M365-Q369 WeakPolarHBondContact O-CG 3.24Å; M365-Q369 PolarHBondContact O-N 2.81Å; R366-Q369 PolarHBondContact O-N 3.39Å; L367-Q369 VanDerWaalsContact C-N 3.3Å; L367-Q369 PolarHBondContact O-N 2.95Å; Q369-S371 PolarHBondContact O-N 2.99Å; Q369-E372 PolarHBondContact O-N 2.75Å
370	V	96.1	Very high	96.5	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	14%	0.14	C	C	.	.	H	α-helix	trans	-70.8	-24.7	179.3	78.9	0	0	0	0	111.9	R366 L367 E372 R373 V374 C387 R390 L391	R366-V370 PolarHBondContact O-N 3.07Å; L367-V370 WeakPolarHBondContact O-CG1 3.33Å; L367-V370 PolarHBondContact O-N 2.89Å; V370-E372 PolarHBondContact O-N 2.98Å; V370-R373 CarbonylContact O-C 3.52Å; V370-R373 WeakPolarHBondContact O-CA 3.48Å; V370-R373 WeakPolarHBondContact O-CB 3.49Å; V370-R373 PolarHBondContact O-N 3.16Å; V370-V374 HydrophobicContact CG2-CG2 4.45Å; V370-V374 PolarHBondContact O-N 2.72Å; V370-C387 HydrophobicContact CG1-CB 3.68Å; V370-R390 HydrophobicContact CG2-CB 3.9Å; V370-R390 HydrophobicContact CG2-CG 3.8Å; V370-L391 HydrophobicContact CB-CD1 4.42Å; V370-L391 HydrophobicContact CB-CD2 3.84Å; V370-L391 HydrophobicContact CB-CG 3.99Å; V370-L391 HydrophobicContact CG1-CD1 3.86Å; V370-L391 HydrophobicContact CG1-CD2 4.21Å; V370-L391 HydrophobicContact CG1-CG 3.85Å; V370-L391 HydrophobicContact CG2-CD2 4.12Å; V370-L391 HydrophobicContact CG2-CG 4.14Å
371	S	96.1	Very high	96.5	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.028	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-33.8	176.9	80.4	0	0	0	0	111.8	R148 L367 R368 Q369 R373 V374 Y383	R148-S371 PolarHBondContact NH1-O 3.36Å; L367-S371 VanDerWaalsContact O-CB 3.29Å; L367-S371 WeakPolarHBondContact O-CB 3.49Å; L367-S371 PolarHBondContact O-N 3Å; R368-S371 WeakPolarHBondContact O-CB 3.33Å; R368-S371 PolarHBondContact O-N 3.01Å; R368-S371 PolarHBondContact O-OG 2.84Å; Q369-S371 PolarHBondContact O-N 2.99Å; S371-R373 PolarHBondContact O-N 2.74Å; S371-R373 VanDerWaalsContact O-N 3.16Å; S371-V374 PolarHBondContact O-N 3.44Å; S371-Y383 WeakPolarHBondContact CA-OH 3.01Å; S371-Y383 VanDerWaalsContact CB-OH 3.32Å; S371-Y383 WeakPolarHBondContact CB-OH 3.38Å; S371-Y383 PolarHBondContact O-OH 2.97Å
372	E	93.8	Very high	96.5	Very high	99 Å²	99	30.4 Å²	30.4	46%	0.463	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.4	174.4	-61.6	175.9	179.5	0	0	112.6	W85 R368 Q369 V370	W85-E372 PolarHBondContact NE1-O 3.42Å; R368-E372 IonicContact CZ-OE1 3.95Å; R368-E372 IonicContact NE-OE1 3.25Å; R368-E372 PolarHBondContact NE-OE1 2.84Å; R368-E372 IonicContact NH2-OE1 2.82Å; R368-E372 PolarHBondContact NH2-OE1 2.9Å; Q369-E372 PolarHBondContact O-N 2.75Å; V370-E372 PolarHBondContact O-N 2.98Å
373	R	93.2	Very high	96.7	Very high	131 Å²	131	28.2 Å²	28.2	49%	0.494	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	2.4	-179.8	-57.3	-171.6	-179	-172.9	0.1	113.9	Q82 V370 S371	Q82-R373 PolarHBondContact NE2-O 3.22Å; V370-R373 CarbonylContact O-C 3.52Å; V370-R373 WeakPolarHBondContact O-CA 3.48Å; V370-R373 WeakPolarHBondContact O-CB 3.49Å; V370-R373 PolarHBondContact O-N 3.16Å; S371-R373 PolarHBondContact O-N 2.74Å; S371-R373 VanDerWaalsContact O-N 3.16Å
374	V	95.6	Very high	96.7	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.018	12%	0.124	C	C	.	.	S	Bend	trans	-127.3	127.8	179.7	-174.8	0	0	0	0	108.7	W78 R148 V370 S371 Y383 M386	W78-V374 HydrophobicContact CZ2-CG1 4.16Å; R148-V374 PolarHBondContact NH1-O 3.04Å; R148-V374 PolarHBondContact NH2-O 2.73Å; V370-V374 HydrophobicContact CG2-CG2 4.45Å; V370-V374 PolarHBondContact O-N 2.72Å; S371-V374 PolarHBondContact O-N 3.44Å; V374-Y383 HydrophobicContact CB-CE2 3.99Å; V374-Y383 HydrophobicContact CG1-CD2 4.07Å; V374-Y383 HydrophobicContact CG1-CE2 3.67Å; V374-M386 HydrophobicContact CG1-CB 4.12Å
375	H	95	Very high	96.7	Very high	24 Å²	24	28.3 Å²	28.3	11%	0.111	12%	0.124	C	C	.	.			trans	-65.1	140.9	174	-76.6	94.5	0	0	0	110.9	W78 L81 Q82 W85 F377 Y383	W78-H375 PolarHBondContact NE1-O 2.78Å; L81-H375 VanDerWaalsContact C-CE1 3.46Å; L81-H375 PolarHBondContact O-CE1 3.3Å; L81-H375 VanDerWaalsContact O-CE1 3.23Å; Q82-H375 PolarHBondContact OE1-ND1 3.15Å; W85-H375 AromaticContact CG-CE1 3.81Å; H375-F377 PolarHBondContact O-N 3.13Å; H375-Y383 VanDerWaalsContact O-CE2 3.31Å; H375-Y383 WeakPolarHBondContact O-CE2 3.46Å
376	L	96.7	Very high	96.7	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.026	12%	0.119	C	C	.	.			trans	-53.4	142.5	176.3	-62.3	-173.7	0	0	0	110	W78 F141 M145 R148 T257 L261 Y383	W78-L376 PolarHBondContact NE1-O 2.02Å; W78-L376 VanDerWaalsContact NE1-O 3.16Å; F141-L376 HydrophobicContact CE2-CB 4.46Å; F141-L376 HydrophobicContact CZ-CB 4.02Å; M145-L376 HydrophobicContact CB-CB 4.43Å; M145-L376 WeakPolarHBondContact O-CD1 3.46Å; R148-L376 HydrophobicContact CG-CD1 4.28Å; R148-L376 HydrophobicContact CG-CG 4.49Å; T257-L376 HydrophobicContact CG2-CD2 3.95Å; L261-L376 HydrophobicContact CD1-CD2 3.89Å; L376-Y383 HydrophobicContact CD2-CE2 4.3Å
377	F	97.7	Very high	96.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.106	C	C	.	.			trans	-124	144.8	178.2	-163.3	-99.9	0	0	0	109.1	W78 T257 I339 F343 Y344 Y348 H375 I379 V382 Y383 M386	W78-F377 AromaticContact CD1-CD2 3.9Å; W78-F377 HydrophobicContact CD2-CD2 4.15Å; W78-F377 HydrophobicContact CD2-CE2 4.5Å; W78-F377 AromaticContact CE2-CD2 3.93Å; W78-F377 HydrophobicContact CG-CD2 4.15Å; W78-F377 HydrophobicContact CG-CE2 4.45Å; W78-F377 AromaticContact NE1-CD2 3.73Å; T257-F377 VanDerWaalsContact CB-O 3.3Å; T257-F377 WeakPolarHBondContact CB-O 3.19Å; T257-F377 PolarHBondContact OG1-O 2.88Å; I339-F377 HydrophobicContact CD1-CE1 4.3Å; I339-F377 HydrophobicContact CD1-CZ 4.3Å; I339-F377 HydrophobicContact CG1-CE1 4.47Å; I339-F377 HydrophobicContact CG1-CZ 4.35Å; I339-F377 HydrophobicContact CG2-CZ 4.24Å; F343-F377 HydrophobicContact CD1-CE2 4.5Å; F343-F377 HydrophobicContact CE1-CD2 4.12Å; F343-F377 AromaticContact CE1-CE2 3.85Å; F343-F377 HydrophobicContact CE1-CE2 3.85Å; Y344-F377 HydrophobicContact CD1-CE2 4.31Å; Y344-F377 HydrophobicContact CD1-CZ 4.18Å; Y344-F377 HydrophobicContact CD2-CD2 4.45Å; Y344-F377 AromaticContact CD2-CE2 3.56Å; Y344-F377 HydrophobicContact CD2-CE2 3.56Å; Y344-F377 HydrophobicContact CD2-CZ 4.23Å; Y344-F377 HydrophobicContact CE2-CE2 4.18Å; Y344-F377 AromaticContact CG-CE2 3.62Å; Y344-F377 HydrophobicContact CG-CE2 3.62Å; Y344-F377 AromaticContact CG-CZ 3.92Å; Y344-F377 HydrophobicContact CG-CZ 3.92Å; Y348-F377 AromaticContact CE1-CE1 3.78Å; Y348-F377 HydrophobicContact CE1-CE1 3.78Å; Y348-F377 AromaticContact CE1-CZ 3.62Å; Y348-F377 HydrophobicContact CE1-CZ 3.62Å; H375-F377 PolarHBondContact O-N 3.13Å; F377-I379 HydrophobicContact CD1-CB 4.17Å; F377-I379 HydrophobicContact CE1-CB 4.26Å; F377-I379 HydrophobicContact CE1-CD1 4.39Å; F377-I379 HydrophobicContact CE1-CG1 4.27Å; F377-I379 PolarHBondContact O-N 3.04Å; F377-I379 VanDerWaalsContact O-N 3.14Å; F377-V382 HydrophobicContact CD1-CB 4Å; F377-V382 HydrophobicContact CD1-CG1 3.82Å; F377-V382 HydrophobicContact CE1-CB 4.14Å; F377-V382 HydrophobicContact CE1-CG1 3.76Å; F377-Y383 HydrophobicContact CB-CD2 4.09Å; F377-M386 HydrophobicContact CB-CE 4.49Å; F377-M386 HydrophobicContact CB-SD 4.16Å; F377-M386 HydrophobicContact CD1-CE 4.19Å; F377-M386 HydrophobicContact CD2-CE 3.54Å; F377-M386 HydrophobicContact CD2-SD 4.17Å; F377-M386 HydrophobicContact CE1-CE 4.34Å; F377-M386 HydrophobicContact CE2-CE 3.71Å; F377-M386 HydrophobicContact CG-CE 3.81Å; F377-M386 HydrophobicContact CG-SD 4.11Å; F377-M386 HydrophobicContact CZ-CE 4.13Å
378	P	97.2	Very high	96.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-67.3	-14.2	-173.4	-19.7	29.7	0	0	0	115.5	M138 F141 F254 I339 F343	M138-P378 HydrophobicContact SD-CG 4.33Å; F141-P378 HydrophobicContact CD1-CB 4.44Å; F141-P378 HydrophobicContact CD1-CG 3.68Å; F141-P378 HydrophobicContact CD2-CB 4.36Å; F141-P378 HydrophobicContact CD2-CG 4.4Å; F141-P378 HydrophobicContact CE1-CB 4.48Å; F141-P378 HydrophobicContact CE1-CG 3.59Å; F141-P378 HydrophobicContact CE2-CB 4.37Å; F141-P378 HydrophobicContact CE2-CG 4.3Å; F141-P378 HydrophobicContact CG-CB 4.38Å; F141-P378 HydrophobicContact CG-CG 4.09Å; F141-P378 HydrophobicContact CZ-CB 4.43Å; F141-P378 HydrophobicContact CZ-CG 3.91Å; F254-P378 WeakPolarHBondContact CA-O 3.32Å; F254-P378 HydrophobicContact CB-CB 4.09Å; F254-P378 HydrophobicContact CD1-CB 3.69Å; F254-P378 WeakPolarHBondContact CD1-O 3.48Å; F254-P378 HydrophobicContact CD2-CB 3.84Å; F254-P378 HydrophobicContact CE1-CB 3.99Å; F254-P378 HydrophobicContact CE2-CB 4.12Å; F254-P378 HydrophobicContact CG-CB 3.63Å; F254-P378 HydrophobicContact CZ-CB 4.21Å; I339-P378 HydrophobicContact CD1-CB 3.84Å; I339-P378 HydrophobicContact CD1-CG 3.69Å; F343-P378 HydrophobicContact CE1-CG 3.81Å; F343-P378 HydrophobicContact CZ-CG 4.04Å
379	I	97.7	Very high	96.7	Very high	11 Å²	11	27.4 Å²	27.4	6%	0.056	13%	0.125	C	C	.	.	S	Bend	trans	-113.8	112.6	179.2	-51.8	176.4	0	0	0	107.4	I339 F377 D381 V382 Y383	I339-I379 HydrophobicContact CD1-CD1 4.2Å; I339-I379 HydrophobicContact CD1-CG1 4.22Å; I339-I379 HydrophobicContact CG1-CD1 3.91Å; I339-I379 HydrophobicContact CG1-CG1 4.47Å; F377-I379 HydrophobicContact CD1-CB 4.17Å; F377-I379 HydrophobicContact CE1-CB 4.26Å; F377-I379 HydrophobicContact CE1-CD1 4.39Å; F377-I379 HydrophobicContact CE1-CG1 4.27Å; F377-I379 PolarHBondContact O-N 3.04Å; F377-I379 VanDerWaalsContact O-N 3.14Å; I379-D381 PolarHBondContact O-N 2.84Å; I379-V382 HydrophobicContact CB-CB 4.04Å; I379-V382 HydrophobicContact CB-CG2 3.92Å; I379-V382 HydrophobicContact CD1-CG2 4.4Å; I379-V382 HydrophobicContact CG2-CB 4.2Å; I379-V382 HydrophobicContact CG2-CG2 3.71Å; I379-V382 PolarHBondContact O-N 2.86Å; I379-Y383 PolarHBondContact O-N 3.16Å
380	D	97.4	Very high	96.6	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-43.5	-172.2	64.5	-39	0	0	0	112.8	K178 L256 T257 K279 V382 Y383 L384	K178-D380 IonicContact NZ-OD2 3.29Å; K178-D380 PolarHBondContact NZ-OD2 3.33Å; L256-D380 HydrophobicContact CB-CB 3.8Å; T257-D380 VanDerWaalsContact OG1-CA 3.23Å; T257-D380 WeakPolarHBondContact OG1-CA 3.03Å; T257-D380 PolarHBondContact OG1-N 2.75Å; K279-D380 IonicContact NZ-OD2 3.23Å; K279-D380 PolarHBondContact NZ-OD2 3.17Å; D380-V382 VanDerWaalsContact C-N 3.32Å; D380-V382 PolarHBondContact O-N 3.31Å; D380-Y383 WeakPolarHBondContact O-CB 3.48Å; D380-Y383 PolarHBondContact O-N 3.44Å; D380-L384 WeakPolarHBondContact O-CB 3.5Å; D380-L384 PolarHBondContact O-N 3.46Å
381	D	96.9	Very high	96.5	Very high	23 Å²	23	27.4 Å²	27.4	12%	0.123	12%	0.122	C	C	.	.	H	α-helix	trans	-64	-38.3	177.8	-67.6	-24.7	0	0	0	111.7	K279 Y351 A352 G353 G354 I379 L384 G385	K279-D381 IonicContact NZ-OD1 3.44Å; Y351-D381 VanDerWaalsContact CB-O 3.31Å; Y351-D381 WeakPolarHBondContact CB-O 3.21Å; Y351-D381 HydrophobicContact CD2-CB 3.81Å; Y351-D381 HydrophobicContact CE2-CB 4.14Å; A352-D381 WeakPolarHBondContact O-CB 3.47Å; G353-D381 VanDerWaalsContact CA-CG 3.42Å; G353-D381 WeakPolarHBondContact CA-OD2 3.42Å; G354-D381 PolarHBondContact N-OD2 3.11Å; I379-D381 PolarHBondContact O-N 2.84Å; D381-L384 WeakPolarHBondContact O-CB 3.45Å; D381-L384 PolarHBondContact O-N 3.35Å; D381-G385 PolarHBondContact O-N 3.2Å
382	V	97.9	Very high	96.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68	-43	174.8	175.9	0	0	0	0	110.8	Y348 Y351 F377 I379 D380 L384 G385 M386	Y348-V382 HydrophobicContact CD1-CG1 3.42Å; Y348-V382 VanDerWaalsContact CD1-CG1 3.42Å; Y348-V382 HydrophobicContact CD1-CG2 4.41Å; Y348-V382 HydrophobicContact CD2-CG1 4.25Å; Y348-V382 HydrophobicContact CD2-CG2 3.77Å; Y348-V382 HydrophobicContact CE1-CG1 3.73Å; Y348-V382 HydrophobicContact CE1-CG2 4.46Å; Y348-V382 HydrophobicContact CE2-CG1 4.49Å; Y348-V382 HydrophobicContact CE2-CG2 3.81Å; Y348-V382 HydrophobicContact CG-CG1 3.71Å; Y348-V382 HydrophobicContact CG-CG2 4.07Å; Y351-V382 HydrophobicContact CD1-CG2 4.19Å; Y351-V382 HydrophobicContact CD2-CG2 4.46Å; Y351-V382 HydrophobicContact CE1-CG2 3.95Å; Y351-V382 HydrophobicContact CE2-CG2 4.21Å; Y351-V382 HydrophobicContact CG-CG2 4.45Å; F377-V382 HydrophobicContact CD1-CB 4Å; F377-V382 HydrophobicContact CD1-CG1 3.82Å; F377-V382 HydrophobicContact CE1-CB 4.14Å; F377-V382 HydrophobicContact CE1-CG1 3.76Å; I379-V382 HydrophobicContact CB-CB 4.04Å; I379-V382 HydrophobicContact CB-CG2 3.92Å; I379-V382 HydrophobicContact CD1-CG2 4.4Å; I379-V382 HydrophobicContact CG2-CB 4.2Å; I379-V382 HydrophobicContact CG2-CG2 3.71Å; I379-V382 PolarHBondContact O-N 2.86Å; D380-V382 VanDerWaalsContact C-N 3.32Å; D380-V382 PolarHBondContact O-N 3.31Å; V382-L384 VanDerWaalsContact C-N 3.26Å; V382-L384 PolarHBondContact O-N 3Å; V382-G385 CarbonylContact O-C 3.55Å; V382-G385 WeakPolarHBondContact O-CA 3.41Å; V382-G385 PolarHBondContact O-N 3.36Å; V382-G385 VanDerWaalsContact O-N 3.1Å; V382-M386 HydrophobicContact CG1-CE 3.84Å; V382-M386 WeakPolarHBondContact O-CG 3.39Å; V382-M386 PolarHBondContact O-N 3.05Å
383	Y	98.1	Very high	96.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.4	-40.9	175.6	177.9	-102.1	0	0	0	111.8	T257 W264 S371 V374 H375 L376 F377 I379 D380 G385 M386 C387	T257-Y383 HydrophobicContact CG2-CD1 3.3Å; T257-Y383 HydrophobicContact CG2-CD2 3.72Å; T257-Y383 HydrophobicContact CG2-CE1 3.77Å; T257-Y383 HydrophobicContact CG2-CE2 4.17Å; T257-Y383 HydrophobicContact CG2-CG 3.24Å; W264-Y383 HydrophobicContact CH2-CE1 4.38Å; W264-Y383 HydrophobicContact CZ3-CE1 4.01Å; S371-Y383 WeakPolarHBondContact CA-OH 3.01Å; S371-Y383 VanDerWaalsContact CB-OH 3.32Å; S371-Y383 WeakPolarHBondContact CB-OH 3.38Å; S371-Y383 PolarHBondContact O-OH 2.97Å; V374-Y383 HydrophobicContact CB-CE2 3.99Å; V374-Y383 HydrophobicContact CG1-CD2 4.07Å; V374-Y383 HydrophobicContact CG1-CE2 3.67Å; H375-Y383 VanDerWaalsContact O-CE2 3.31Å; H375-Y383 WeakPolarHBondContact O-CE2 3.46Å; L376-Y383 HydrophobicContact CD2-CE2 4.3Å; F377-Y383 HydrophobicContact CB-CD2 4.09Å; I379-Y383 PolarHBondContact O-N 3.16Å; D380-Y383 WeakPolarHBondContact O-CB 3.48Å; D380-Y383 PolarHBondContact O-N 3.44Å; Y383-G385 VanDerWaalsContact C-N 3.35Å; Y383-M386 WeakPolarHBondContact O-CB 3.38Å; Y383-M386 PolarHBondContact O-N 3.27Å; Y383-C387 PolarHBondContact O-N 3.06Å; Y383-C387 PolarHBondContact O-SG 3.38Å; Y383-C387 VanDerWaalsContact O-SG 3.32Å
384	L	97.4	Very high	96.5	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-44.3	174.5	-172.7	50.8	0	0	0	111	W264 F319 V357 L367 D380 D381 V382 M386 C387 L388	W264-L384 HydrophobicContact CH2-CD1 3.78Å; W264-L384 HydrophobicContact CZ2-CD1 3.66Å; F319-L384 HydrophobicContact CE2-CD1 3.94Å; F319-L384 HydrophobicContact CE2-CD2 3.62Å; F319-L384 HydrophobicContact CE2-CG 3.75Å; F319-L384 HydrophobicContact CZ-CD1 4.39Å; F319-L384 HydrophobicContact CZ-CD2 3.41Å; F319-L384 VanDerWaalsContact CZ-CD2 3.41Å; F319-L384 HydrophobicContact CZ-CG 3.69Å; V357-L384 HydrophobicContact CG2-CD2 4.17Å; L367-L384 HydrophobicContact CD1-CD1 3.76Å; L367-L384 HydrophobicContact CD2-CD1 3.73Å; L367-L384 HydrophobicContact CG-CD1 4.38Å; D380-L384 WeakPolarHBondContact O-CB 3.5Å; D380-L384 PolarHBondContact O-N 3.46Å; D381-L384 WeakPolarHBondContact O-CB 3.45Å; D381-L384 PolarHBondContact O-N 3.35Å; V382-L384 VanDerWaalsContact C-N 3.26Å; V382-L384 PolarHBondContact O-N 3Å; L384-M386 VanDerWaalsContact C-N 3.34Å; L384-M386 PolarHBondContact O-N 3.01Å; L384-C387 WeakPolarHBondContact O-CB 3.4Å; L384-C387 PolarHBondContact O-N 3.22Å; L384-L388 VanDerWaalsContact O-CG 3.3Å; L384-L388 WeakPolarHBondContact O-CG 3.4Å; L384-L388 PolarHBondContact O-N 2.94Å
385	G	97.7	Very high	96.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-57.8	-41	170.8	0	0	0	0	0	113.8	D381 V382 Y383 L388 H389	D381-G385 PolarHBondContact O-N 3.2Å; V382-G385 CarbonylContact O-C 3.55Å; V382-G385 WeakPolarHBondContact O-CA 3.41Å; V382-G385 PolarHBondContact O-N 3.36Å; V382-G385 VanDerWaalsContact O-N 3.1Å; Y383-G385 VanDerWaalsContact C-N 3.35Å; G385-L388 PolarHBondContact O-N 3.31Å; G385-H389 WeakPolarHBondContact O-CB 3.35Å; G385-H389 PolarHBondContact O-N 3.23Å
386	M	98.2	Very high	96.7	Very high	13 Å²	13	27.2 Å²	27.2	6%	0.064	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-41.7	174.8	-65.5	174.6	173	0	0	111.9	W78 Y344 P349 V374 F377 V382 Y383 L384 R390	W78-M386 HydrophobicContact CH2-CE 3.8Å; W78-M386 HydrophobicContact CH2-SD 3.46Å; W78-M386 WeakPolarHBondContact CH2-SD 3.33Å; W78-M386 HydrophobicContact CZ2-CE 3.96Å; W78-M386 HydrophobicContact CZ2-SD 3.34Å; W78-M386 WeakPolarHBondContact CZ2-SD 3.39Å; W78-M386 HydrophobicContact CZ3-CE 4.17Å; W78-M386 HydrophobicContact CZ3-SD 4.4Å; Y344-M386 HydrophobicContact CD2-CE 4.29Å; Y344-M386 HydrophobicContact CE2-CE 3.62Å; P349-M386 HydrophobicContact CG-CB 4.43Å; P349-M386 HydrophobicContact CG-CG 3.87Å; V374-M386 HydrophobicContact CG1-CB 4.12Å; F377-M386 HydrophobicContact CB-CE 4.49Å; F377-M386 HydrophobicContact CB-SD 4.16Å; F377-M386 HydrophobicContact CD1-CE 4.19Å; F377-M386 HydrophobicContact CD2-CE 3.54Å; F377-M386 HydrophobicContact CD2-SD 4.17Å; F377-M386 HydrophobicContact CE1-CE 4.34Å; F377-M386 HydrophobicContact CE2-CE 3.71Å; F377-M386 HydrophobicContact CG-CE 3.81Å; F377-M386 HydrophobicContact CG-SD 4.11Å; F377-M386 HydrophobicContact CZ-CE 4.13Å; V382-M386 HydrophobicContact CG1-CE 3.84Å; V382-M386 WeakPolarHBondContact O-CG 3.39Å; V382-M386 PolarHBondContact O-N 3.05Å; Y383-M386 WeakPolarHBondContact O-CB 3.38Å; Y383-M386 PolarHBondContact O-N 3.27Å; L384-M386 VanDerWaalsContact C-N 3.34Å; L384-M386 PolarHBondContact O-N 3.01Å; M386-R390 WeakPolarHBondContact O-CB 3.18Å; M386-R390 PolarHBondContact O-N 2.86Å; M386-R390 VanDerWaalsContact O-N 3.08Å
387	C	98.3	Very high	96.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-46	175.2	-68.6	0	0	0	0	111.8	L367 V370 Y383 L384 R390 L391	L367-C387 HydrophobicContact CD2-CB 3.7Å; V370-C387 HydrophobicContact CG1-CB 3.68Å; Y383-C387 PolarHBondContact O-N 3.06Å; Y383-C387 PolarHBondContact O-SG 3.38Å; Y383-C387 VanDerWaalsContact O-SG 3.32Å; L384-C387 WeakPolarHBondContact O-CB 3.4Å; L384-C387 PolarHBondContact O-N 3.22Å; C387-R390 PolarHBondContact O-N 3.11Å; C387-L391 WeakPolarHBondContact O-CG 3.45Å; C387-L391 PolarHBondContact O-N 3.5Å
388	L	97.8	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-46	176.9	-70.1	173.9	0	0	0	111.8	F319 L363 L367 L384 G385 R390 L391 G392 V393 P395	F319-L388 HydrophobicContact CB-CD2 4.36Å; F319-L388 HydrophobicContact CD1-CD1 3.75Å; F319-L388 HydrophobicContact CD2-CD1 3.86Å; F319-L388 HydrophobicContact CD2-CD2 3.81Å; F319-L388 HydrophobicContact CD2-CG 4.37Å; F319-L388 HydrophobicContact CE1-CD1 3.78Å; F319-L388 HydrophobicContact CE2-CD1 3.91Å; F319-L388 HydrophobicContact CE2-CD2 4.36Å; F319-L388 HydrophobicContact CG-CD1 3.79Å; F319-L388 HydrophobicContact CG-CD2 4.09Å; F319-L388 HydrophobicContact CZ-CD1 3.87Å; L363-L388 HydrophobicContact CD1-CD2 4.34Å; L363-L388 HydrophobicContact CD2-CD2 3.93Å; L367-L388 HydrophobicContact CD2-CD2 4.18Å; L384-L388 VanDerWaalsContact O-CG 3.3Å; L384-L388 WeakPolarHBondContact O-CG 3.4Å; L384-L388 PolarHBondContact O-N 2.94Å; G385-L388 PolarHBondContact O-N 3.31Å; L388-R390 VanDerWaalsContact C-N 3.27Å; L388-R390 PolarHBondContact O-N 3.08Å; L388-L391 CarbonylContact O-C 3.57Å; L388-L391 WeakPolarHBondContact O-CA 3.33Å; L388-L391 PolarHBondContact O-N 2.76Å; L388-G392 PolarHBondContact O-N 3.09Å; L388-V393 CarbonylContact C-O 3.56Å; L388-V393 HydrophobicContact CD2-CB 4.07Å; L388-V393 HydrophobicContact CD2-CG1 3.92Å; L388-V393 PolarHBondContact O-N 3.13Å; L388-P395 HydrophobicContact CD1-CB 4.07Å; L388-P395 HydrophobicContact CD1-CG 4.39Å
389	H	95.9	Very high	96.5	Very high	136 Å²	136	37.8 Å²	37.8	63%	0.63	22%	0.219	S	C	*	.	H	α-helix	trans	-56.7	-43.7	176.4	-176.2	70.5	0	0	0	111.4	P349 G385 L391 G392	P349-H389 HydrophobicContact CB-CB 3.92Å; G385-H389 WeakPolarHBondContact O-CB 3.35Å; G385-H389 PolarHBondContact O-N 3.23Å; H389-L391 VanDerWaalsContact C-N 3.32Å; H389-L391 PolarHBondContact O-N 3.43Å; H389-G392 PolarHBondContact O-N 3.17Å; H389-G392 VanDerWaalsContact O-N 3.11Å
390	R	93.9	Very high	96.4	Very high	87 Å²	87	37.3 Å²	37.3	33%	0.328	22%	0.217	S	C	.	.	H	α-helix	trans	-69.7	-28.4	178	-166.2	166	-172.8	95.4	-11.9	113.6	D86 V370 M386 C387 L388 G392	D86-R390 IonicContact OD1-CZ 3.59Å; D86-R390 IonicContact OD1-NH1 3.06Å; D86-R390 PolarHBondContact OD1-NH1 3.33Å; D86-R390 IonicContact OD1-NH2 3.75Å; D86-R390 PolarHBondContact OD1-NH2 3.41Å; D86-R390 IonicContact OD2-CZ 3.88Å; D86-R390 IonicContact OD2-NH1 2.6Å; D86-R390 PolarHBondContact OD2-NH1 2.96Å; D86-R390 IonicContact OD2-NH2 2.65Å; V370-R390 HydrophobicContact CG2-CB 3.9Å; V370-R390 HydrophobicContact CG2-CG 3.8Å; M386-R390 WeakPolarHBondContact O-CB 3.18Å; M386-R390 PolarHBondContact O-N 2.86Å; M386-R390 VanDerWaalsContact O-N 3.08Å; C387-R390 PolarHBondContact O-N 3.11Å; L388-R390 VanDerWaalsContact C-N 3.27Å; L388-R390 PolarHBondContact O-N 3.08Å; R390-G392 VanDerWaalsContact C-N 3.26Å
391	L	93.9	Very high	96.3	Very high	34 Å²	34	37.5 Å²	37.5	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-78.8	-8.2	172.3	-71.9	174.9	0	0	0	113.4	L363 R366 L367 V370 C387 L388 H389 V393	L363-L391 HydrophobicContact CD1-CD1 3.84Å; R366-L391 HydrophobicContact CB-CD1 3.94Å; R366-L391 HydrophobicContact CB-CD2 4.12Å; R366-L391 PolarHBondContact NH2-O 3.29Å; R366-L391 VanDerWaalsContact NH2-O 3.13Å; L367-L391 HydrophobicContact CD2-CD1 4Å; L367-L391 HydrophobicContact CG-CD1 4.36Å; V370-L391 HydrophobicContact CB-CD1 4.42Å; V370-L391 HydrophobicContact CB-CD2 3.84Å; V370-L391 HydrophobicContact CB-CG 3.99Å; V370-L391 HydrophobicContact CG1-CD1 3.86Å; V370-L391 HydrophobicContact CG1-CD2 4.21Å; V370-L391 HydrophobicContact CG1-CG 3.85Å; V370-L391 HydrophobicContact CG2-CD2 4.12Å; V370-L391 HydrophobicContact CG2-CG 4.14Å; C387-L391 WeakPolarHBondContact O-CG 3.45Å; C387-L391 PolarHBondContact O-N 3.5Å; L388-L391 CarbonylContact O-C 3.57Å; L388-L391 WeakPolarHBondContact O-CA 3.33Å; L388-L391 PolarHBondContact O-N 2.76Å; H389-L391 VanDerWaalsContact C-N 3.32Å; H389-L391 PolarHBondContact O-N 3.43Å; L391-V393 HydrophobicContact CB-CB 4.44Å; L391-V393 HydrophobicContact CB-CG2 3.92Å; L391-V393 PolarHBondContact O-N 2.83Å
392	G	94.4	Very high	96.2	Very high	71 Å²	71	39 Å²	39	73%	0.732	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	22	-172.3	0	0	0	0	0	113.3	L388 H389 R390	L388-G392 PolarHBondContact O-N 3.09Å; H389-G392 PolarHBondContact O-N 3.17Å; H389-G392 VanDerWaalsContact O-N 3.11Å; R390-G392 VanDerWaalsContact C-N 3.26Å
393	V	95	Very high	96	Very high	10 Å²	10	39.4 Å²	39.4	6%	0.061	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-99.5	128	-179.3	177.4	0	0	0	0	108.9	D317 L363 L388 L391	D317-V393 HydrophobicContact CB-CG1 4.22Å; D317-V393 HydrophobicContact CB-CG2 4.13Å; D317-V393 WeakPolarHBondContact O-CG1 3.23Å; L363-V393 HydrophobicContact CD1-CG2 4.15Å; L363-V393 HydrophobicContact CD2-CG1 4.22Å; L388-V393 CarbonylContact C-O 3.56Å; L388-V393 HydrophobicContact CD2-CB 4.07Å; L388-V393 HydrophobicContact CD2-CG1 3.92Å; L388-V393 PolarHBondContact O-N 3.13Å; L391-V393 HydrophobicContact CB-CB 4.44Å; L391-V393 HydrophobicContact CB-CG2 3.92Å; L391-V393 PolarHBondContact O-N 2.83Å
394	A	94.9	Very high	95.6	Very high	78 Å²	78	47.7 Å²	47.7	65%	0.645	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-94.9	125.5	176	0	0	0	0	0	110.2
395	P	96.6	Very high	95.3	Very high	20 Å²	20	48.8 Å²	48.8	13%	0.13	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-68.6	146.2	174.8	31.1	-36	0	0	0	110.9	F319 V323 P350 L388	F319-P395 HydrophobicContact CD1-CB 3.54Å; F319-P395 HydrophobicContact CE1-CB 4.02Å; F319-P395 HydrophobicContact CG-CB 4.47Å; V323-P395 HydrophobicContact CG1-CB 4.46Å; V323-P395 HydrophobicContact CG1-CG 3.88Å; V323-P395 HydrophobicContact CG2-CB 3.76Å; V323-P395 HydrophobicContact CG2-CG 4.1Å; P350-P395 HydrophobicContact CB-CG 4.11Å; L388-P395 HydrophobicContact CD1-CB 4.07Å; L388-P395 HydrophobicContact CD1-CG 4.39Å
396	I	96.3	Very high	94.8	Very high	77 Å²	77	48.9 Å²	48.9	40%	0.395	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.5	-176.8	-57.3	172.1	0	0	0	109.4	L318 F319 V320 G321 V323	L318-I396 HydrophobicContact CD1-CD1 4.19Å; F319-I396 WeakPolarHBondContact O-CB 3.29Å; F319-I396 PolarHBondContact O-N 3.19Å; V320-I396 WeakPolarHBondContact CA-O 3.22Å; V320-I396 HydrophobicContact CG2-CB 4.23Å; G321-I396 PolarHBondContact N-O 3.11Å; G321-I396 VanDerWaalsContact N-O 3.13Å; V323-I396 VanDerWaalsContact CG2-C 3.47Å
397	H	97	Very high	94.3	Very high	98 Å²	98	51.5 Å²	51.5	45%	0.454	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.1	172.7	-178.4	83	0	0	0	110.2	G321 D322 V323	G321-H397 CarbonylContact O-C 3.59Å; G321-H397 WeakPolarHBondContact O-CA 3.41Å; D322-H397 IonicContact OD1-CE1 3.67Å; D322-H397 PolarHBondContact OD1-CE1 2.97Å; D322-H397 IonicContact OD1-ND1 2.84Å; D322-H397 PolarHBondContact OD1-ND1 3.38Å; V323-H397 HydrophobicContact CB-CB 3.99Å; V323-H397 HydrophobicContact CG2-CB 4.13Å; V323-H397 PolarHBondContact N-ND1 3.37Å
398	H	96.3	Very high	93.6	Very high	39 Å²	39	59.2 Å²	59.2	18%	0.181	32%	0.321	C	S	.	.			trans	-124.7	123.5	172.2	-173.7	-73.3	0	0	0	110.9	Y294 V320 G321 G400 F401 L421	Y294-H398 AromaticContact CD2-NE2 3.85Å; Y294-H398 AromaticContact CE2-CD2 3.56Å; Y294-H398 AromaticContact CE2-NE2 3.78Å; Y294-H398 AromaticContact CZ-CD2 3.91Å; V320-H398 HydrophobicContact CG1-CB 3.47Å; V320-H398 VanDerWaalsContact CG1-CB 3.47Å; G321-H398 PolarHBondContact O-N 3.13Å; H398-G400 WeakPolarHBondContact ND1-CA 3.48Å; H398-G400 PolarHBondContact ND1-N 2.96Å; H398-G400 PolarHBondContact O-N 3.47Å; H398-F401 HydrophobicContact CB-CD2 3.8Å; H398-F401 HydrophobicContact CB-CE2 4.1Å; H398-F401 AromaticContact ND1-CD2 3.94Å; H398-F401 PolarHBondContact O-N 3.35Å; H398-L421 WeakPolarHBondContact CE1-CD1 3.09Å
399	P	94.5	Very high	93	Very high	90 Å²	90	64.9 Å²	64.9	58%	0.584	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.8	-171.7	27.9	-36.5	0	0	0	114	F401 Y402	P399-F401 VanDerWaalsContact C-N 3.29Å; P399-F401 PolarHBondContact O-N 3.49Å; P399-Y402 VanDerWaalsContact O-CE2 3.29Å; P399-Y402 WeakPolarHBondContact O-CE2 3.47Å
400	G	95.1	Very high	92.5	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.021	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-4.6	173.2	0	0	0	0	0	115.3	H398 Y402 S419 L421 L422	H398-G400 WeakPolarHBondContact ND1-CA 3.48Å; H398-G400 PolarHBondContact ND1-N 2.96Å; H398-G400 PolarHBondContact O-N 3.47Å; G400-Y402 WeakPolarHBondContact O-CD2 3.24Å; G400-S419 WeakPolarHBondContact CA-O 3.49Å; G400-L421 PolarHBondContact O-N 3.16Å; G400-L422 PolarHBondContact O-N 2.68Å
401	F	96.7	Very high	92	Very high	7 Å²	7	62 Å²	62	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	95.1	174.8	-76.5	-110.7	0	0	0	109.3	V320 D322 G356 V358 H398 P399 T403 L421 L422	V320-F401 HydrophobicContact CG1-CE2 4.05Å; D322-F401 HydrophobicContact CB-CB 4.1Å; G356-F401 WeakPolarHBondContact O-CD1 3.45Å; V358-F401 HydrophobicContact CG1-CZ 4.01Å; H398-F401 HydrophobicContact CB-CD2 3.8Å; H398-F401 HydrophobicContact CB-CE2 4.1Å; H398-F401 AromaticContact ND1-CD2 3.94Å; H398-F401 PolarHBondContact O-N 3.35Å; P399-F401 VanDerWaalsContact C-N 3.29Å; P399-F401 PolarHBondContact O-N 3.49Å; F401-T403 PolarHBondContact O-N 3.27Å; F401-L421 HydrophobicContact CD2-CB 4.41Å; F401-L421 HydrophobicContact CD2-CD1 4.45Å; F401-L421 HydrophobicContact CE2-CB 4.24Å; F401-L421 HydrophobicContact CE2-CD1 3.93Å; F401-L422 HydrophobicContact CD1-CB 3.96Å; F401-L422 HydrophobicContact CD1-CD1 4.33Å; F401-L422 HydrophobicContact CE1-CB 4.34Å; F401-L422 HydrophobicContact CE1-CD1 4.44Å; F401-L422 HydrophobicContact CG-CB 4.39Å
402	Y	95	Very high	91.4	Very high	56 Å²	56	68.5 Å²	68.5	22%	0.22	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	89.9	-178	-69.9	-96.1	0	0	0	110.6	P399 G400 L406 V420 L422 V423 H424	P399-Y402 VanDerWaalsContact O-CE2 3.29Å; P399-Y402 WeakPolarHBondContact O-CE2 3.47Å; G400-Y402 WeakPolarHBondContact O-CD2 3.24Å; Y402-L406 HydrophobicContact CD1-CG 4.03Å; Y402-L406 HydrophobicContact CE1-CG 4.17Å; Y402-L406 HydrophobicContact CG-CG 4.42Å; Y402-V420 HydrophobicContact CD2-CB 4.33Å; Y402-V420 HydrophobicContact CD2-CG1 4.28Å; Y402-V420 HydrophobicContact CD2-CG2 3.75Å; Y402-V420 HydrophobicContact CE2-CB 4.41Å; Y402-V420 HydrophobicContact CE2-CG2 3.7Å; Y402-L422 PolarHBondContact N-O 3.38Å; Y402-V423 CarbonylContact O-C 3.6Å; Y402-V423 WeakPolarHBondContact O-CA 3.33Å; Y402-H424 PolarHBondContact O-N 2.96Å
403	T	92.8	Very high	90.8	Very high	7 Å²	7	70.1 Å²	70.1	4%	0.043	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.5	-176.4	65.3	0	0	0	0	113.8	D322 G353 G354 F401	D322-T403 HydrophobicContact CB-CG2 3.47Å; D322-T403 VanDerWaalsContact CB-CG2 3.47Å; D322-T403 PolarHBondContact OD2-OG1 3.4Å; G353-T403 VanDerWaalsContact O-CG2 3.23Å; G353-T403 WeakPolarHBondContact O-CG2 2.99Å; G354-T403 VanDerWaalsContact O-CB 3.25Å; G354-T403 WeakPolarHBondContact O-CB 3.2Å; F401-T403 PolarHBondContact O-N 3.27Å
404	F	90.6	Very high	89.9	Confident	174 Å²	174	73.3 Å²	73.3	76%	0.763	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	27.2	175.1	-64.5	-82.1	0	0	0	112.3
405	D	90.7	Very high	89.3	Confident	24 Å²	24	72 Å²	72	13%	0.128	37%	0.365	C	S	.	.			trans	59.5	174.4	-173.1	-149.3	-24.1	0	0	0	113.3	R411 V423 H424 R426	D405-R411 VanDerWaalsContact CB-NH2 3.32Å; D405-R411 IonicContact OD1-CZ 3.16Å; D405-R411 IonicContact OD1-NE 3.77Å; D405-R411 IonicContact OD1-NH2 2.78Å; D405-R411 IonicContact OD2-CZ 2.77Å; D405-R411 IonicContact OD2-NE 3.08Å; D405-R411 IonicContact OD2-NH1 3.53Å; D405-R411 PolarHBondContact OD2-NH1 2.87Å; D405-R411 IonicContact OD2-NH2 3.94Å; D405-R411 PolarHBondContact OD2-NH2 3.07Å; D405-R411 VanDerWaalsContact OD2-NH2 3.13Å; D405-V423 WeakPolarHBondContact OD1-CG2 3.25Å; D405-H424 WeakPolarHBondContact CA-O 3.32Å; D405-H424 VanDerWaalsContact CB-O 3.29Å; D405-H424 WeakPolarHBondContact CB-O 3.39Å; D405-H424 PolarHBondContact N-O 3.2Å; D405-R426 IonicContact OD1-CZ 2.83Å; D405-R426 IonicContact OD1-NH1 2.76Å; D405-R426 PolarHBondContact OD1-NH1 2.74Å; D405-R426 VanDerWaalsContact OD1-NH1 3.15Å; D405-R426 IonicContact OD1-NH2 3.59Å; D405-R426 PolarHBondContact OD1-NH2 3.21Å; D405-R426 IonicContact OD2-CZ 2.67Å; D405-R426 IonicContact OD2-NH1 3.55Å; D405-R426 PolarHBondContact OD2-NH1 3.46Å; D405-R426 IonicContact OD2-NH2 3.63Å
406	L	87.6	Confident	88.8	Confident	4 Å²	4	71.7 Å²	71.7	2%	0.021	36%	0.364	C	S	.	.			trans	-75.4	152.8	165.7	-68.7	94.8	0	0	0	109.8	Y402 E408 R411 A416 Y417 V420 V423	Y402-L406 HydrophobicContact CD1-CG 4.03Å; Y402-L406 HydrophobicContact CE1-CG 4.17Å; Y402-L406 HydrophobicContact CG-CG 4.42Å; L406-E408 PolarHBondContact O-N 3.37Å; L406-R411 HydrophobicContact CB-CG 4.01Å; L406-R411 PolarHBondContact O-NE 2.89Å; L406-R411 PolarHBondContact O-NH2 3.09Å; L406-A416 HydrophobicContact CD2-CB 4.22Å; L406-A416 WeakPolarHBondContact CD2-O 3.38Å; L406-Y417 HydrophobicContact CD1-CD1 4.06Å; L406-Y417 HydrophobicContact CD1-CE1 3.63Å; L406-V420 HydrophobicContact CD1-CG2 4Å; L406-V420 HydrophobicContact CD2-CG2 4.32Å; L406-V423 HydrophobicContact CD1-CG2 3.86Å
407	P	87.5	Confident	88.4	Confident	67 Å²	67	69.1 Å²	69.1	44%	0.435	35%	0.35	S	S	.	.			trans	-52.6	139.4	168.2	-21.5	31.7	0	0	0	110.4	T409 E410 R411	P407-T409 PolarHBondContact O-N 3.17Å; P407-T409 VanDerWaalsContact O-N 3.16Å; P407-E410 HydrophobicContact CB-CG 4.14Å; P407-E410 HydrophobicContact CG-CG 4.28Å; P407-E410 WeakPolarHBondContact O-CA 3.22Å; P407-E410 WeakPolarHBondContact O-CB 3.15Å; P407-E410 PolarHBondContact O-N 3.36Å; P407-R411 PolarHBondContact O-N 3.45Å
408	E	84.3	Confident	87.9	Confident	163 Å²	163	67.7 Å²	67.7	76%	0.762	35%	0.351	S	S	*	.	H	α-helix	trans	-54.1	-40.3	-175	-171.7	173.2	-170.5	0	0	112.4	L406 E410 R411	L406-E408 PolarHBondContact O-N 3.37Å; E408-E410 PolarHBondContact O-N 2.98Å; E408-R411 PolarHBondContact O-N 3.42Å
409	T	84.1	Confident	87.5	Confident	118 Å²	118	69 Å²	69	72%	0.724	37%	0.365	S	S	*	.	H	α-helix	trans	-65.9	-15	177.4	56.6	0	0	0	0	114.3	P407 K413	P407-T409 PolarHBondContact O-N 3.17Å; P407-T409 VanDerWaalsContact O-N 3.16Å; T409-K413 WeakPolarHBondContact O-CE 3.48Å
410	E	84.9	Confident	87.4	Confident	73 Å²	73	64.8 Å²	64.8	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-97.8	-28.6	178.8	-60.9	-163.2	156.1	0	0	112.9	P407 E408 E412 K413 A416	P407-E410 HydrophobicContact CB-CG 4.14Å; P407-E410 HydrophobicContact CG-CG 4.28Å; P407-E410 WeakPolarHBondContact O-CA 3.22Å; P407-E410 WeakPolarHBondContact O-CB 3.15Å; P407-E410 PolarHBondContact O-N 3.36Å; E408-E410 PolarHBondContact O-N 2.98Å; E410-E412 PolarHBondContact O-N 2.75Å; E410-E412 VanDerWaalsContact O-N 3.12Å; E410-K413 HydrophobicContact CB-CD 4.49Å; E410-K413 WeakPolarHBondContact O-CB 3.2Å; E410-K413 WeakPolarHBondContact O-CG 3.25Å; E410-K413 PolarHBondContact O-N 3.33Å; E410-K413 IonicContact OE1-NZ 3.67Å; E410-A416 WeakPolarHBondContact O-CB 3.42Å
411	R	83.7	Confident	87.4	Confident	91 Å²	91	65.2 Å²	65.2	34%	0.343	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-32.8	-171.4	-67.5	177.4	-166.3	-176.2	2	114.6	D405 L406 P407 E408 Y417	D405-R411 VanDerWaalsContact CB-NH2 3.32Å; D405-R411 IonicContact OD1-CZ 3.16Å; D405-R411 IonicContact OD1-NE 3.77Å; D405-R411 IonicContact OD1-NH2 2.78Å; D405-R411 IonicContact OD2-CZ 2.77Å; D405-R411 IonicContact OD2-NE 3.08Å; D405-R411 IonicContact OD2-NH1 3.53Å; D405-R411 PolarHBondContact OD2-NH1 2.87Å; D405-R411 IonicContact OD2-NH2 3.94Å; D405-R411 PolarHBondContact OD2-NH2 3.07Å; D405-R411 VanDerWaalsContact OD2-NH2 3.13Å; L406-R411 HydrophobicContact CB-CG 4.01Å; L406-R411 PolarHBondContact O-NE 2.89Å; L406-R411 PolarHBondContact O-NH2 3.09Å; P407-R411 PolarHBondContact O-N 3.45Å; E408-R411 PolarHBondContact O-N 3.42Å; R411-Y417 WeakPolarHBondContact O-CE2 3.33Å
412	E	80.6	Confident	87.4	Confident	169 Å²	169	65 Å²	65	79%	0.79	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-18.6	-177.8	-61.6	-167.6	164.7	0	0	112.8	E410 R437	E410-E412 PolarHBondContact O-N 2.75Å; E410-E412 VanDerWaalsContact O-N 3.12Å; E412-R437 PolarHBondContact O-NH2 3.29Å
413	K	83.4	Confident	87.5	Confident	105 Å²	105	62.3 Å²	62.3	46%	0.457	33%	0.327	S	S	.	.	S	Bend	trans	-59.3	143.8	-175.8	-64.4	178.6	-177.3	169.8	0	111	T409 E410 C415 A416 R437	T409-K413 WeakPolarHBondContact O-CE 3.48Å; E410-K413 HydrophobicContact CB-CD 4.49Å; E410-K413 WeakPolarHBondContact O-CB 3.2Å; E410-K413 WeakPolarHBondContact O-CG 3.25Å; E410-K413 PolarHBondContact O-N 3.33Å; E410-K413 IonicContact OE1-NZ 3.67Å; K413-C415 PolarHBondContact O-N 3.16Å; K413-C415 VanDerWaalsContact O-N 3.11Å; K413-A416 HydrophobicContact CB-CB 4.31Å; K413-A416 WeakPolarHBondContact O-CB 3.39Å; K413-A416 PolarHBondContact O-N 2.9Å; K413-R437 PolarHBondContact O-NH2 3.11Å; K413-R437 VanDerWaalsContact O-NH2 3.07Å
414	P	74.6	Confident	87.6	Confident	77 Å²	77	64 Å²	64	50%	0.5	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-41.7	-176.5	-32.1	37.3	0	0	0	114.3	P442 C445	P414-P442 HydrophobicContact CB-CB 4.28Å; P414-P442 HydrophobicContact CB-CG 3.7Å; P414-C445 PolarHBondContact O-SG 3.44Å
415	C	84.2	Confident	87.8	Confident	52 Å²	52	62.1 Å²	62.1	35%	0.351	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	15	-174.7	-44	0	0	0	0	114.2	K413 Y417 S418 C445	K413-C415 PolarHBondContact O-N 3.16Å; K413-C415 VanDerWaalsContact O-N 3.11Å; C415-Y417 PolarHBondContact O-N 2.77Å; C415-S418 WeakPolarHBondContact O-CB 3.47Å; C415-S418 PolarHBondContact O-N 3.11Å; C415-S418 PolarHBondContact O-OG 3.19Å; C415-C445 WeakPolarHBondContact CA-SG 3.35Å; C415-C445 HydrophobicContact CB-CB 3.8Å; C415-C445 WeakPolarHBondContact CB-SG 3.35Å; C415-C445 PolarHBondContact N-SG 2.77Å; C415-C445 WeakPolarHBondContact SG-CB 3.47Å; C415-C445 CovalentContact SG-SG 2.02Å; C415-C445 PolarHBondContact SG-SG 3.07Å
416	A	85.8	Confident	88	Confident	13 Å²	13	61.7 Å²	61.7	11%	0.107	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-33.3	-172.7	0	0	0	0	0	113.4	L406 E410 K413	L406-A416 HydrophobicContact CD2-CB 4.22Å; L406-A416 WeakPolarHBondContact CD2-O 3.38Å; E410-A416 WeakPolarHBondContact O-CB 3.42Å; K413-A416 HydrophobicContact CB-CB 4.31Å; K413-A416 WeakPolarHBondContact O-CB 3.39Å; K413-A416 PolarHBondContact O-N 2.9Å
417	Y	88.1	Confident	88.5	Confident	22 Å²	22	64.8 Å²	64.8	9%	0.086	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	5	-174.9	-63	-87.2	0	0	0	114.2	R287 L406 R411 C415 S419 V420 V423 R426 L434	R287-Y417 WeakPolarHBondContact CD-O 3.15Å; R287-Y417 VanDerWaalsContact CZ-O 3.31Å; R287-Y417 PolarHBondContact NE-O 3.3Å; R287-Y417 PolarHBondContact NH1-O 3.14Å; L406-Y417 HydrophobicContact CD1-CD1 4.06Å; L406-Y417 HydrophobicContact CD1-CE1 3.63Å; R411-Y417 WeakPolarHBondContact O-CE2 3.33Å; C415-Y417 PolarHBondContact O-N 2.77Å; Y417-S419 VanDerWaalsContact C-N 3.35Å; Y417-S419 PolarHBondContact O-N 3.37Å; Y417-V420 HydrophobicContact CD1-CB 4.49Å; Y417-V420 HydrophobicContact CD1-CG2 4.04Å; Y417-V420 PolarHBondContact O-N 3.5Å; Y417-V423 HydrophobicContact CE1-CG1 4.28Å; Y417-R426 PolarHBondContact OH-NH2 3.48Å; Y417-L434 HydrophobicContact CD1-CD1 3.93Å; Y417-L434 HydrophobicContact CD1-CD2 3.92Å; Y417-L434 HydrophobicContact CD2-CD1 3.76Å; Y417-L434 HydrophobicContact CE1-CD1 4.12Å; Y417-L434 HydrophobicContact CE1-CD2 3.81Å; Y417-L434 HydrophobicContact CE2-CD1 3.96Å; Y417-L434 HydrophobicContact CG-CD1 3.75Å
418	S	86.2	Confident	89	Confident	68 Å²	68	62.5 Å²	62.5	48%	0.476	33%	0.325	S	S	.	.	S	Bend	trans	-71.9	-25.6	-175.7	67.4	0	0	0	0	113.9	R287 C415	R287-S418 PolarHBondContact NH1-O 2.83Å; R287-S418 PolarHBondContact NH2-O 2.95Å; C415-S418 WeakPolarHBondContact O-CB 3.47Å; C415-S418 PolarHBondContact O-N 3.11Å; C415-S418 PolarHBondContact O-OG 3.19Å
419	S	86.5	Confident	89.6	Confident	68 Å²	68	62.5 Å²	62.5	48%	0.476	32%	0.322	S	S	.	.	S	Bend	trans	-96.9	-6.1	174.4	56.8	0	0	0	0	113.7	G400 Y417	G400-S419 WeakPolarHBondContact CA-O 3.49Å; Y417-S419 VanDerWaalsContact C-N 3.35Å; Y417-S419 PolarHBondContact O-N 3.37Å
420	V	92.9	Very high	90.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.			trans	-74.5	131.8	-177.2	175.2	0	0	0	0	109.6	R287 Y402 L406 Y417 V423	R287-V420 VanDerWaalsContact CD-O 3.23Å; R287-V420 WeakPolarHBondContact CD-O 3.45Å; R287-V420 PolarHBondContact NH1-O 2.66Å; Y402-V420 HydrophobicContact CD2-CB 4.33Å; Y402-V420 HydrophobicContact CD2-CG1 4.28Å; Y402-V420 HydrophobicContact CD2-CG2 3.75Å; Y402-V420 HydrophobicContact CE2-CB 4.41Å; Y402-V420 HydrophobicContact CE2-CG2 3.7Å; L406-V420 HydrophobicContact CD1-CG2 4Å; L406-V420 HydrophobicContact CD2-CG2 4.32Å; Y417-V420 HydrophobicContact CD1-CB 4.49Å; Y417-V420 HydrophobicContact CD1-CG2 4.04Å; Y417-V420 PolarHBondContact O-N 3.5Å; V420-V423 HydrophobicContact CG1-CB 3.95Å; V420-V423 HydrophobicContact CG1-CG1 4.24Å
421	L	95.6	Very high	90.8	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.063	29%	0.29	C	S	.	.	S	Bend	trans	-100.7	-39.9	163.9	-66.7	-173.9	0	0	0	110.8	V286 R287 L291 Y294 H398 G400 F401	V286-L421 CarbonylContact C-O 3.55Å; V286-L421 WeakPolarHBondContact CA-O 3.36Å; V286-L421 WeakPolarHBondContact CG1-O 3.42Å; R287-L421 PolarHBondContact N-O 2.78Å; L291-L421 HydrophobicContact CD1-CD1 4.41Å; Y294-L421 HydrophobicContact CG-CD1 4.39Å; H398-L421 WeakPolarHBondContact CE1-CD1 3.09Å; G400-L421 PolarHBondContact O-N 3.16Å; F401-L421 HydrophobicContact CD2-CB 4.41Å; F401-L421 HydrophobicContact CD2-CD1 4.45Å; F401-L421 HydrophobicContact CE2-CB 4.24Å; F401-L421 HydrophobicContact CE2-CD1 3.93Å
422	L	97	Very high	91.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.1	177.1	177.8	147.6	0	0	0	109.7	F278 V284 F285 V286 G400 F401 Y402	F278-L422 HydrophobicContact CE2-CD1 3.62Å; F278-L422 HydrophobicContact CZ-CD1 3.53Å; V284-L422 HydrophobicContact CB-CD1 4.39Å; V284-L422 HydrophobicContact CB-CG 4.28Å; V284-L422 HydrophobicContact CG1-CD2 4.32Å; V284-L422 HydrophobicContact CG2-CD1 4.13Å; V284-L422 HydrophobicContact CG2-CG 4.46Å; F285-L422 CarbonylContact O-C 3.54Å; F285-L422 WeakPolarHBondContact O-CA 3.17Å; V286-L422 HydrophobicContact CG2-CD1 4.23Å; G400-L422 PolarHBondContact O-N 2.68Å; F401-L422 HydrophobicContact CD1-CB 3.96Å; F401-L422 HydrophobicContact CD1-CD1 4.33Å; F401-L422 HydrophobicContact CE1-CB 4.34Å; F401-L422 HydrophobicContact CE1-CD1 4.44Å; F401-L422 HydrophobicContact CG-CB 4.39Å; Y402-L422 PolarHBondContact N-O 3.38Å
423	V	96.3	Very high	92	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.7	170.6	62.8	0	0	0	0	111.8	V284 F285 Y402 D405 L406 Y417 V420 R426 L434	V284-V423 WeakPolarHBondContact CA-O 3.27Å; F285-V423 HydrophobicContact CB-CG1 3.89Å; F285-V423 HydrophobicContact CD1-CG1 4.42Å; F285-V423 PolarHBondContact N-O 3.15Å; F285-V423 PolarHBondContact O-N 3Å; Y402-V423 CarbonylContact O-C 3.6Å; Y402-V423 WeakPolarHBondContact O-CA 3.33Å; D405-V423 WeakPolarHBondContact OD1-CG2 3.25Å; L406-V423 HydrophobicContact CD1-CG2 3.86Å; Y417-V423 HydrophobicContact CE1-CG1 4.28Å; V420-V423 HydrophobicContact CG1-CB 3.95Å; V420-V423 HydrophobicContact CG1-CG1 4.24Å; V423-R426 HydrophobicContact CG1-CG 4.19Å; V423-L434 HydrophobicContact CG1-CD2 4.29Å
424	H	95.5	Very high	92.5	Very high	44 Å²	44	46 Å²	46	20%	0.204	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.1	170.8	-175.8	-93	0	0	0	109.7	D283 V284 G354 Y402 D405	D283-H424 VanDerWaalsContact CG-NE2 3.34Å; D283-H424 IonicContact OD1-CD2 3.91Å; D283-H424 PolarHBondContact OD1-CD2 3.08Å; D283-H424 VanDerWaalsContact OD1-CD2 3.29Å; D283-H424 IonicContact OD1-NE2 3.79Å; D283-H424 PolarHBondContact OD1-NE2 3.41Å; D283-H424 IonicContact OD2-CD2 3.57Å; D283-H424 IonicContact OD2-CE1 3.13Å; D283-H424 IonicContact OD2-NE2 3.07Å; D283-H424 PolarHBondContact OD2-NE2 3.42Å; V284-H424 HydrophobicContact CG1-CB 4.02Å; G354-H424 WeakPolarHBondContact O-CB 3.11Å; Y402-H424 PolarHBondContact O-N 2.96Å; D405-H424 WeakPolarHBondContact CA-O 3.32Å; D405-H424 VanDerWaalsContact CB-O 3.29Å; D405-H424 WeakPolarHBondContact CB-O 3.39Å; D405-H424 PolarHBondContact N-O 3.2Å
425	K	94.4	Very high	93.4	Very high	133 Å²	133	45.2 Å²	45.2	58%	0.578	24%	0.236	S	C	*	.			cis	-108.7	152.4	-8.5	61.6	-177.8	-178.6	176.6	0	111.6	D283	D283-K425 CarbonylContact O-C 3.4Å; D283-K425 WeakPolarHBondContact O-CA 3.42Å
426	R	95.6	Very high	93.7	Very high	15 Å²	15	50 Å²	50	6%	0.057	25%	0.247	C	C	.	.			trans	-132.9	128	173.3	-62.8	-65.2	178.3	-93.2	5.8	109.2	D283 F285 D405 Y417 V423 E430 M431	D283-R426 CarbonylContact C-O 3.51Å; D283-R426 PolarHBondContact O-N 2.73Å; F285-R426 HydrophobicContact CB-CB 4.26Å; F285-R426 HydrophobicContact CB-CG 3.83Å; D405-R426 IonicContact OD1-CZ 2.83Å; D405-R426 IonicContact OD1-NH1 2.76Å; D405-R426 PolarHBondContact OD1-NH1 2.74Å; D405-R426 VanDerWaalsContact OD1-NH1 3.15Å; D405-R426 IonicContact OD1-NH2 3.59Å; D405-R426 PolarHBondContact OD1-NH2 3.21Å; D405-R426 IonicContact OD2-CZ 2.67Å; D405-R426 IonicContact OD2-NH1 3.55Å; D405-R426 PolarHBondContact OD2-NH1 3.46Å; D405-R426 IonicContact OD2-NH2 3.63Å; Y417-R426 PolarHBondContact OH-NH2 3.48Å; V423-R426 HydrophobicContact CG1-CG 4.19Å; R426-E430 WeakPolarHBondContact CA-OE2 3.11Å; R426-E430 HydrophobicContact CB-CB 4.18Å; R426-M431 HydrophobicContact CB-CE 4.49Å; R426-M431 HydrophobicContact CB-CG 3.78Å; R426-M431 WeakPolarHBondContact O-CE 3.49Å
427	N	96.9	Very high	93.9	Very high	69 Å²	69	53.9 Å²	53.9	37%	0.369	26%	0.259	S	S	.	.			trans	-77.4	169.1	169.2	72.1	47.6	0	0	0	110.8	K429 E430 M431	N427-K429 VanDerWaalsContact C-N 3.31Å; N427-K429 PolarHBondContact O-N 3.49Å; N427-K429 WeakPolarHBondContact OD1-CB 3.42Å; N427-K429 PolarHBondContact OD1-N 3.19Å; N427-K429 VanDerWaalsContact OD1-N 3.07Å; N427-E430 VanDerWaalsContact CG-CD 3.5Å; N427-E430 PolarHBondContact N-OE2 3.37Å; N427-E430 PolarHBondContact ND2-OE1 3.06Å; N427-E430 VanDerWaalsContact ND2-OE1 3.16Å; N427-E430 PolarHBondContact ND2-OE2 3.02Å; N427-E430 WeakPolarHBondContact O-CB 3.28Å; N427-E430 PolarHBondContact O-N 3.31Å; N427-E430 WeakPolarHBondContact OD1-CG 3.45Å; N427-E430 PolarHBondContact OD1-N 3.41Å; N427-M431 WeakPolarHBondContact O-CG 3.42Å; N427-M431 PolarHBondContact O-N 3.39Å
428	P	98.3	Very high	93.8	Very high	20 Å²	20	54.9 Å²	54.9	13%	0.13	27%	0.265	C	S	.	.	H	α-helix	trans	-53.1	-43	-176.3	-28.6	35.8	0	0	0	114.2	E185 N186 A189 M431 L432	E185-P428 HydrophobicContact CB-CB 4.24Å; E185-P428 HydrophobicContact CB-CG 3.85Å; N186-P428 HydrophobicContact CB-CG 4.44Å; N186-P428 WeakPolarHBondContact OD1-CG 3.29Å; A189-P428 HydrophobicContact CB-CB 3.78Å; P428-M431 PolarHBondContact O-N 2.86Å; P428-L432 WeakPolarHBondContact O-CG 3.39Å; P428-L432 PolarHBondContact O-N 3.22Å; P428-L432 VanDerWaalsContact O-N 3.09Å
429	K	97.9	Very high	93.8	Very high	162 Å²	162	57.6 Å²	57.6	70%	0.704	27%	0.27	S	S	*	.	H	α-helix	trans	-67	-40.2	179.2	-177.2	-179.5	178.2	-178.2	0	111.8	N427 T433	N427-K429 VanDerWaalsContact C-N 3.31Å; N427-K429 PolarHBondContact O-N 3.49Å; N427-K429 WeakPolarHBondContact OD1-CB 3.42Å; N427-K429 PolarHBondContact OD1-N 3.19Å; N427-K429 VanDerWaalsContact OD1-N 3.07Å; K429-T433 WeakPolarHBondContact O-CB 3.39Å; K429-T433 PolarHBondContact O-N 3.34Å; K429-T433 PolarHBondContact O-OG1 3.17Å
430	E	95.7	Very high	93.4	Very high	85 Å²	85	59 Å²	59	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-41.5	176.2	-70.4	166.4	170.3	0	0	111.3	R426 N427 T433 L434	R426-E430 WeakPolarHBondContact CA-OE2 3.11Å; R426-E430 HydrophobicContact CB-CB 4.18Å; N427-E430 VanDerWaalsContact CG-CD 3.5Å; N427-E430 PolarHBondContact N-OE2 3.37Å; N427-E430 PolarHBondContact ND2-OE1 3.06Å; N427-E430 VanDerWaalsContact ND2-OE1 3.16Å; N427-E430 PolarHBondContact ND2-OE2 3.02Å; N427-E430 WeakPolarHBondContact O-CB 3.28Å; N427-E430 PolarHBondContact O-N 3.31Å; N427-E430 WeakPolarHBondContact OD1-CG 3.45Å; N427-E430 PolarHBondContact OD1-N 3.41Å; E430-T433 PolarHBondContact O-N 3.17Å; E430-L434 VanDerWaalsContact O-CB 3.26Å; E430-L434 WeakPolarHBondContact O-CB 3.3Å; E430-L434 PolarHBondContact O-N 3.03Å
431	M	96.8	Very high	92.4	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-49.8	174.9	-66.2	-178.3	-168.5	0	0	111.4	A189 I190 D282 V284 F285 R426 N427 P428 T433 L434 W435	A189-M431 HydrophobicContact CB-SD 4.36Å; I190-M431 HydrophobicContact CG1-CE 4.45Å; I190-M431 HydrophobicContact CG1-SD 3.88Å; D282-M431 WeakPolarHBondContact O-CE 3.31Å; V284-M431 WeakPolarHBondContact O-CE 3.48Å; F285-M431 HydrophobicContact CD2-CB 4.22Å; F285-M431 HydrophobicContact CD2-CG 4.42Å; R426-M431 HydrophobicContact CB-CE 4.49Å; R426-M431 HydrophobicContact CB-CG 3.78Å; R426-M431 WeakPolarHBondContact O-CE 3.49Å; N427-M431 WeakPolarHBondContact O-CG 3.42Å; N427-M431 PolarHBondContact O-N 3.39Å; P428-M431 PolarHBondContact O-N 2.86Å; M431-T433 VanDerWaalsContact C-N 3.34Å; M431-T433 PolarHBondContact O-N 3.06Å; M431-L434 PolarHBondContact O-N 3.06Å; M431-W435 VanDerWaalsContact O-CB 3.28Å; M431-W435 WeakPolarHBondContact O-CB 3.37Å; M431-W435 PolarHBondContact O-N 3.19Å
432	L	96.9	Very high	91	Very high	38 Å²	38	63.8 Å²	63.8	20%	0.199	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-42.2	177.8	-73.2	164.7	0	0	0	112.1	A189 E192 T193 P428 R436	A189-L432 HydrophobicContact CB-CD1 4.49Å; A189-L432 HydrophobicContact CB-CG 4.29Å; E192-L432 HydrophobicContact CB-CD2 4.25Å; T193-L432 HydrophobicContact CG2-CD2 3.62Å; T193-L432 HydrophobicContact CG2-CG 4.26Å; P428-L432 WeakPolarHBondContact O-CG 3.39Å; P428-L432 PolarHBondContact O-N 3.22Å; P428-L432 VanDerWaalsContact O-N 3.09Å; L432-R436 WeakPolarHBondContact O-CG 3.18Å; L432-R436 PolarHBondContact O-N 2.63Å
433	T	94.1	Very high	89.5	Confident	76 Å²	76	69 Å²	69	47%	0.466	35%	0.349	S	S	.	.	H	α-helix	trans	-67	-46.6	180	-57.3	0	0	0	0	111.2	K429 E430 M431 R436 R437	K429-T433 WeakPolarHBondContact O-CB 3.39Å; K429-T433 PolarHBondContact O-N 3.34Å; K429-T433 PolarHBondContact O-OG1 3.17Å; E430-T433 PolarHBondContact O-N 3.17Å; M431-T433 VanDerWaalsContact C-N 3.34Å; M431-T433 PolarHBondContact O-N 3.06Å; T433-R436 PolarHBondContact O-N 3.2Å; T433-R437 PolarHBondContact O-N 3.01Å
434	L	92.5	Very high	88.3	Confident	12 Å²	12	74.9 Å²	74.9	6%	0.063	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-41.5	178.9	-177.8	55.6	0	0	0	111.4	F285 Y417 V423 E430 M431 R436 R437 L438	F285-L434 HydrophobicContact CB-CD2 4.19Å; F285-L434 HydrophobicContact CD1-CD2 3.53Å; F285-L434 HydrophobicContact CD1-CG 4.13Å; F285-L434 HydrophobicContact CD2-CB 4.42Å; F285-L434 HydrophobicContact CD2-CD2 4.15Å; F285-L434 HydrophobicContact CD2-CG 4.4Å; F285-L434 HydrophobicContact CE1-CD2 3.85Å; F285-L434 HydrophobicContact CE1-CG 3.93Å; F285-L434 HydrophobicContact CE2-CB 4.26Å; F285-L434 HydrophobicContact CE2-CD2 4.42Å; F285-L434 HydrophobicContact CE2-CG 4.21Å; F285-L434 HydrophobicContact CG-CD2 3.69Å; F285-L434 HydrophobicContact CG-CG 4.35Å; F285-L434 HydrophobicContact CZ-CB 4.45Å; F285-L434 HydrophobicContact CZ-CD2 4.28Å; F285-L434 HydrophobicContact CZ-CG 3.97Å; Y417-L434 HydrophobicContact CD1-CD1 3.93Å; Y417-L434 HydrophobicContact CD1-CD2 3.92Å; Y417-L434 HydrophobicContact CD2-CD1 3.76Å; Y417-L434 HydrophobicContact CE1-CD1 4.12Å; Y417-L434 HydrophobicContact CE1-CD2 3.81Å; Y417-L434 HydrophobicContact CE2-CD1 3.96Å; Y417-L434 HydrophobicContact CG-CD1 3.75Å; V423-L434 HydrophobicContact CG1-CD2 4.29Å; E430-L434 VanDerWaalsContact O-CB 3.26Å; E430-L434 WeakPolarHBondContact O-CB 3.3Å; E430-L434 PolarHBondContact O-N 3.03Å; M431-L434 PolarHBondContact O-N 3.06Å; L434-R436 PolarHBondContact O-N 3.14Å; L434-R437 PolarHBondContact O-N 2.94Å; L434-L438 HydrophobicContact CD1-CD1 4.08Å; L434-L438 HydrophobicContact CD1-CG 4.2Å; L434-L438 HydrophobicContact CG-CD1 4.04Å; L434-L438 WeakPolarHBondContact O-CG 3.31Å; L434-L438 PolarHBondContact O-N 2.79Å
435	W	93.3	Very high	86.9	Confident	60 Å²	60	76.1 Å²	76.1	23%	0.227	40%	0.399	C	S	.	.	H	α-helix	trans	-56.3	-49.7	175.2	-174.3	-115.7	0	0	0	112.1	T193 W194 F285 M431 R437 L438 Q439	T193-W435 HydrophobicContact CG2-CB 3.59Å; T193-W435 HydrophobicContact CG2-CD2 4.35Å; T193-W435 HydrophobicContact CG2-CG 3.62Å; W194-W435 HydrophobicContact CB-CE3 4.32Å; W194-W435 HydrophobicContact CB-CZ3 4.16Å; F285-W435 HydrophobicContact CE2-CB 3.97Å; F285-W435 HydrophobicContact CE2-CE3 4.06Å; F285-W435 HydrophobicContact CZ-CB 4.38Å; F285-W435 AromaticContact CZ-CE3 3.81Å; F285-W435 HydrophobicContact CZ-CE3 3.81Å; M431-W435 VanDerWaalsContact O-CB 3.28Å; M431-W435 WeakPolarHBondContact O-CB 3.37Å; M431-W435 PolarHBondContact O-N 3.19Å; W435-R437 PolarHBondContact O-N 2.87Å; W435-L438 PolarHBondContact O-N 3.38Å; W435-Q439 WeakPolarHBondContact O-CG 3.38Å; W435-Q439 PolarHBondContact O-N 3.21Å
436	R	92.2	Very high	86.5	Confident	153 Å²	153	73.3 Å²	73.3	58%	0.577	39%	0.39	S	S	*	.	H	α-helix	trans	-62.6	-41.9	178.1	-68.5	-179.1	-146.6	129.3	1.6	112	L432 T433 L434 L438 Q439	L432-R436 WeakPolarHBondContact O-CG 3.18Å; L432-R436 PolarHBondContact O-N 2.63Å; T433-R436 PolarHBondContact O-N 3.2Å; L434-R436 PolarHBondContact O-N 3.14Å; R436-L438 VanDerWaalsContact C-N 3.28Å; R436-L438 PolarHBondContact O-N 3.13Å; R436-Q439 PolarHBondContact O-N 2.85Å
437	R	88.4	Confident	86.1	Confident	94 Å²	94	76.3 Å²	76.3	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-38.3	177.5	-175.3	177.8	175.8	178.3	-1.2	111.7	E412 K413 T433 L434 W435 S440	E412-R437 PolarHBondContact O-NH2 3.29Å; K413-R437 PolarHBondContact O-NH2 3.11Å; K413-R437 VanDerWaalsContact O-NH2 3.07Å; T433-R437 PolarHBondContact O-N 3.01Å; L434-R437 PolarHBondContact O-N 2.94Å; W435-R437 PolarHBondContact O-N 2.87Å; R437-S440 CarbonylContact O-C 3.59Å; R437-S440 VanDerWaalsContact O-C 3.28Å; R437-S440 PolarHBondContact O-N 3.08Å
438	L	87.9	Confident	85.5	Confident	42 Å²	42	76.7 Å²	76.7	22%	0.22	41%	0.41	C	S	.	.	H	α-helix	trans	-76.5	-19.6	180	-72.6	171	0	0	0	114	F285 R287 L434 W435 R436 S440	F285-L438 HydrophobicContact CE1-CD1 3.46Å; F285-L438 VanDerWaalsContact CE1-CD1 3.46Å; F285-L438 HydrophobicContact CZ-CD1 3.64Å; R287-L438 HydrophobicContact CG-CD1 3.85Å; L434-L438 HydrophobicContact CD1-CD1 4.08Å; L434-L438 HydrophobicContact CD1-CG 4.2Å; L434-L438 HydrophobicContact CG-CD1 4.04Å; L434-L438 WeakPolarHBondContact O-CG 3.31Å; L434-L438 PolarHBondContact O-N 2.79Å; W435-L438 PolarHBondContact O-N 3.38Å; R436-L438 VanDerWaalsContact C-N 3.28Å; R436-L438 PolarHBondContact O-N 3.13Å; L438-S440 VanDerWaalsContact C-N 3.3Å
439	Q	84.3	Confident	84.7	Confident	126 Å²	126	80.1 Å²	80.1	59%	0.589	43%	0.427	S	S	*	.	H	α-helix	trans	-75.2	-19.9	172.9	-70.8	-176.5	11	0	0	113.3	W435 R436	W435-Q439 WeakPolarHBondContact O-CG 3.38Å; W435-Q439 PolarHBondContact O-N 3.21Å; R436-Q439 PolarHBondContact O-N 2.85Å
440	S	79	Confident	83.9	Confident	98 Å²	98	74.9 Å²	74.9	69%	0.685	41%	0.409	S	S	*	.	S	Bend	trans	-141.1	68.5	177.6	-62.8	0	0	0	0	108.5	R437 L438	R437-S440 CarbonylContact O-C 3.59Å; R437-S440 VanDerWaalsContact O-C 3.28Å; R437-S440 PolarHBondContact O-N 3.08Å; L438-S440 VanDerWaalsContact C-N 3.3Å
441	P	72	Confident	83.1	Confident	61 Å²	61	74.3 Å²	74.3	40%	0.396	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-62.6	143.9	-176.2	27.4	-33.1	0	0	0	109.8	S443 C445	P441-S443 PolarHBondContact O-N 3.14Å; P441-C445 HydrophobicContact CB-CB 4.27Å
442	P	66.9	Low	82.1	Confident	51 Å²	51	79.6 Å²	79.6	33%	0.331	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-63.6	124	172.8	24.2	-31.4	0	0	0	109.9	P414 C445	P414-P442 HydrophobicContact CB-CB 4.28Å; P414-P442 HydrophobicContact CB-CG 3.7Å; P442-C445 WeakPolarHBondContact O-CB 3.21Å; P442-C445 PolarHBondContact O-N 2.71Å; P442-C445 VanDerWaalsContact O-N 3.09Å; P442-C445 PolarHBondContact O-SG 3.29Å
443	S	64.4	Low	81	Confident	111 Å²	111	82.8 Å²	82.8	78%	0.776	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	136.4	170.4	175.6	0	0	0	0	110.2	P441	P441-S443 PolarHBondContact O-N 3.14Å
444	P	71.3	Confident	79.9	Confident	123 Å²	123	83.3 Å²	83.3	80%	0.799	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	cis	-101.8	28.1	15	40	-35.6	0	0	0	115
445	C	66.6	Low	78.7	Confident	69 Å²	69	89.8 Å²	89.8	47%	0.466	49%	0.493	S	S	.	.			trans	-76.9	0	165.4	-31.3	0	0	0	0	109.6	P414 C415 P441 P442	P414-C445 PolarHBondContact O-SG 3.44Å; C415-C445 WeakPolarHBondContact CA-SG 3.35Å; C415-C445 HydrophobicContact CB-CB 3.8Å; C415-C445 WeakPolarHBondContact CB-SG 3.35Å; C415-C445 PolarHBondContact N-SG 2.77Å; C415-C445 WeakPolarHBondContact SG-CB 3.47Å; C415-C445 CovalentContact SG-SG 2.02Å; C415-C445 PolarHBondContact SG-SG 3.07Å; P441-C445 HydrophobicContact CB-CB 4.27Å; P442-C445 WeakPolarHBondContact O-CB 3.21Å; P442-C445 PolarHBondContact O-N 2.71Å; P442-C445 VanDerWaalsContact O-N 3.09Å; P442-C445 PolarHBondContact O-SG 3.29Å

Retrieved 445 of 445 residues in 2125.8 ms (Link to these results)

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