A0A096N903_PAPAN Loading...

Hexosyltransferase

AlphaFold DB (A0A2K5UML0), UniProt , Accession A0A096N903, Species PAPAN (Papio anubis, Olive baboon), Gene B3GNT2, Length 397 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	53.7	Low	61.2	Low	251 Å²	251	146.1 Å²	146.1	100%	1.236	71%	0.709	S	S	*	*				0	66.9	0	-69.7	162.1	63.6	0	0	112.3
2	S	57.6	Low	62.2	Low	90 Å²	90	136.9 Å²	136.9	63%	0.629	68%	0.681	S	S	*	*			trans	-140.6	-13.8	-178.6	-174.3	0	0	0	0	115.4
3	V	56.2	Low	63.4	Low	108 Å²	108	135.4 Å²	135.4	66%	0.655	68%	0.675	S	S	*	*	H	α-helix	trans	-86.9	-34.7	-171	-173.9	0	0	0	0	113.5	R5	V3-R5 PolarHBondContact O-N 3.29Å
4	G	54.8	Low	64	Low	49 Å²	49	132.6 Å²	132.6	51%	0.505	66%	0.663	S	S	.	*	H	α-helix	trans	-68.1	-35.5	-179.3	0	0	0	0	0	114.2	R6 R7 I8	G4-R6 PolarHBondContact O-N 3.49Å; G4-R7 PolarHBondContact O-N 3.46Å; G4-I8 WeakPolarHBondContact O-CG1 3.39Å; G4-I8 PolarHBondContact O-N 3.22Å
5	R	56.4	Low	64.7	Low	208 Å²	208	132.5 Å²	132.5	79%	0.785	66%	0.662	S	S	*	*	H	α-helix	trans	-72.6	-27.9	-176.8	-135.7	175.7	-170.2	179.6	2.8	113	V3 K9	V3-R5 PolarHBondContact O-N 3.29Å; R5-K9 WeakPolarHBondContact O-CG 3.22Å; R5-K9 PolarHBondContact O-N 3.02Å
6	R	57.6	Low	65.5	Low	204 Å²	204	132.3 Å²	132.3	77%	0.77	66%	0.66	S	S	*	*	H	α-helix	trans	-75.4	-39.6	175.7	-103.1	-179.1	177.2	179.4	-0.3	112.4	G4 K9 L10	G4-R6 PolarHBondContact O-N 3.49Å; R6-K9 PolarHBondContact O-N 2.85Å; R6-L10 PolarHBondContact O-N 3.22Å
7	R	60.9	Low	66.1	Low	193 Å²	193	127.2 Å²	127.2	73%	0.728	64%	0.644	S	S	*	*	H	α-helix	trans	-67	-39.1	177.7	-75.4	-172.6	174.7	-174.8	-1.2	112.6	G4 L10 L11	G4-R7 PolarHBondContact O-N 3.46Å; R7-L10 PolarHBondContact O-N 3.49Å; R7-L11 WeakPolarHBondContact O-CB 3.13Å; R7-L11 PolarHBondContact O-N 3.19Å
8	I	65.4	Low	66.2	Low	127 Å²	127	125.6 Å²	125.6	65%	0.651	64%	0.637	S	S	*	*	H	α-helix	trans	-66.5	-39.4	176.5	-64.9	167	0	0	0	111.2	G4 L11 G12	G4-I8 WeakPolarHBondContact O-CG1 3.39Å; G4-I8 PolarHBondContact O-N 3.22Å; I8-L11 PolarHBondContact O-N 3.23Å; I8-G12 PolarHBondContact O-N 3.05Å
9	K	68.5	Low	66.8	Low	149 Å²	149	123.2 Å²	123.2	65%	0.648	63%	0.629	S	S	*	*	H	α-helix	trans	-65.4	-39.7	173.8	-77	-173.9	175.5	-169	0	112.6	R5 R6 G12 I13	R5-K9 WeakPolarHBondContact O-CG 3.22Å; R5-K9 PolarHBondContact O-N 3.02Å; R6-K9 PolarHBondContact O-N 2.85Å; K9-G12 PolarHBondContact O-N 3.48Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.44Å; K9-I13 PolarHBondContact O-N 2.96Å
10	L	71.1	Confident	67.2	Low	113 Å²	113	123.8 Å²	123.8	59%	0.592	63%	0.627	S	S	*	*	H	α-helix	trans	-66.6	-40.7	177.6	-149	85.8	0	0	0	111.7	R6 R7 I13 L14	R6-L10 PolarHBondContact O-N 3.22Å; R7-L10 PolarHBondContact O-N 3.49Å; L10-I13 PolarHBondContact O-N 2.88Å; L10-L14 PolarHBondContact O-N 3Å
11	L	70.8	Confident	67.5	Low	115 Å²	115	122.5 Å²	122.5	60%	0.602	62%	0.621	S	S	*	*	H	α-helix	trans	-64.5	-40.3	175.8	-149.6	86.8	0	0	0	111.6	R7 I8 L14 M15	R7-L11 WeakPolarHBondContact O-CB 3.13Å; R7-L11 PolarHBondContact O-N 3.19Å; I8-L11 PolarHBondContact O-N 3.23Å; L11-L14 PolarHBondContact O-N 3.33Å; L11-M15 PolarHBondContact O-N 3.37Å
12	G	74	Confident	68.3	Low	36 Å²	36	117.7 Å²	117.7	37%	0.371	59%	0.59	S	S	.	*	H	α-helix	trans	-63.9	-40.3	174.4	0	0	0	0	0	113.1	I8 K9 M15 M16	I8-G12 PolarHBondContact O-N 3.05Å; K9-G12 PolarHBondContact O-N 3.48Å; G12-M15 PolarHBondContact O-N 3.16Å; G12-M16 WeakPolarHBondContact O-CB 3.29Å; G12-M16 VanDerWaalsContact O-CG 3.24Å; G12-M16 WeakPolarHBondContact O-CG 3.47Å; G12-M16 PolarHBondContact O-N 3.11Å
13	I	76.9	Confident	69	Low	117 Å²	117	117.4 Å²	117.4	60%	0.6	58%	0.581	S	S	*	*	H	α-helix	trans	-66.8	-41.6	176.1	-68	164.4	0	0	0	111	K9 L10 M16 A17	K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.44Å; K9-I13 PolarHBondContact O-N 2.96Å; L10-I13 PolarHBondContact O-N 2.88Å; I13-M16 PolarHBondContact O-N 3.22Å; I13-A17 WeakPolarHBondContact O-CB 3.48Å; I13-A17 PolarHBondContact O-N 3.41Å
14	L	72.4	Confident	69.6	Low	97 Å²	97	116.9 Å²	116.9	51%	0.508	57%	0.574	S	S	.	*	H	α-helix	trans	-64.9	-40.6	176.5	-102.5	139	0	0	0	112.6	L10 L11 A17 N18	L10-L14 PolarHBondContact O-N 3Å; L11-L14 PolarHBondContact O-N 3.33Å; L14-A17 PolarHBondContact O-N 3.01Å; L14-N18 PolarHBondContact O-N 3.42Å; L14-N18 PolarHBondContact O-ND2 2.72Å
15	M	74.5	Confident	70	Confident	131 Å²	131	120.8 Å²	120.8	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-66	-42.6	174.4	-81.1	-165.4	161.7	0	0	111.9	L11 G12 A17 N18 V19	L11-M15 PolarHBondContact O-N 3.37Å; G12-M15 PolarHBondContact O-N 3.16Å; M15-A17 VanDerWaalsContact C-N 3.34Å; M15-A17 PolarHBondContact O-N 3Å; M15-N18 PolarHBondContact O-N 3.03Å; M15-V19 VanDerWaalsContact O-CG2 3.31Å; M15-V19 WeakPolarHBondContact O-CG2 3.06Å; M15-V19 PolarHBondContact O-N 2.95Å
16	M	76.4	Confident	70.2	Confident	128 Å²	128	115.6 Å²	115.6	63%	0.631	57%	0.565	S	S	*	*	H	α-helix	trans	-63	-39.3	175.8	-72.4	-73.1	-72.2	0	0	112.1	G12 I13 V19 F20	G12-M16 WeakPolarHBondContact O-CB 3.29Å; G12-M16 VanDerWaalsContact O-CG 3.24Å; G12-M16 WeakPolarHBondContact O-CG 3.47Å; G12-M16 PolarHBondContact O-N 3.11Å; I13-M16 PolarHBondContact O-N 3.22Å; M16-V19 PolarHBondContact O-N 3.33Å; M16-F20 WeakPolarHBondContact O-CB 3.12Å; M16-F20 PolarHBondContact O-N 2.76Å
17	A	76.6	Confident	70.5	Confident	47 Å²	47	110.2 Å²	110.2	39%	0.388	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-42.7	175.1	0	0	0	0	0	112.1	I13 L14 M15 F20 I21	I13-A17 WeakPolarHBondContact O-CB 3.48Å; I13-A17 PolarHBondContact O-N 3.41Å; L14-A17 PolarHBondContact O-N 3.01Å; M15-A17 VanDerWaalsContact C-N 3.34Å; M15-A17 PolarHBondContact O-N 3Å; A17-F20 PolarHBondContact O-N 2.83Å; A17-I21 VanDerWaalsContact O-CG1 3.26Å; A17-I21 WeakPolarHBondContact O-CG1 2.79Å; A17-I21 PolarHBondContact O-N 3.41Å
18	N	68.7	Low	70.2	Confident	97 Å²	97	104.5 Å²	104.5	52%	0.519	54%	0.544	S	S	.	.	H	α-helix	trans	-65.9	-37.5	176.1	-77.1	-30.6	0	0	0	112.5	L14 M15 I21 Y22	L14-N18 PolarHBondContact O-N 3.42Å; L14-N18 PolarHBondContact O-ND2 2.72Å; M15-N18 PolarHBondContact O-N 3.03Å; N18-I21 PolarHBondContact O-N 2.95Å; N18-Y22 WeakPolarHBondContact O-CB 3.39Å; N18-Y22 PolarHBondContact O-N 2.82Å
19	V	76.8	Confident	69.5	Low	81 Å²	81	105.8 Å²	105.8	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-39.6	173.5	172.2	0	0	0	0	111	M15 M16 Y22 L23	M15-V19 VanDerWaalsContact O-CG2 3.31Å; M15-V19 WeakPolarHBondContact O-CG2 3.06Å; M15-V19 PolarHBondContact O-N 2.95Å; M16-V19 PolarHBondContact O-N 3.33Å; V19-Y22 PolarHBondContact O-N 3.45Å; V19-L23 HydrophobicContact CG1-CD1 3.94Å; V19-L23 HydrophobicContact CG1-CG 4.46Å; V19-L23 WeakPolarHBondContact O-CB 3.41Å; V19-L23 WeakPolarHBondContact O-CG 3.47Å; V19-L23 PolarHBondContact O-N 3.41Å
20	F	75.1	Confident	68.3	Low	135 Å²	135	102.3 Å²	102.3	59%	0.592	54%	0.539	S	S	*	.	H	α-helix	trans	-65.9	-40.8	176.1	-127.2	-92.5	0	0	0	112.4	M16 A17 L23 I24	M16-F20 WeakPolarHBondContact O-CB 3.12Å; M16-F20 PolarHBondContact O-N 2.76Å; A17-F20 PolarHBondContact O-N 2.83Å; F20-L23 PolarHBondContact O-N 2.99Å; F20-I24 HydrophobicContact CD1-CD1 4.02Å; F20-I24 HydrophobicContact CD1-CG1 4.49Å; F20-I24 WeakPolarHBondContact O-CB 3.29Å; F20-I24 VanDerWaalsContact O-CG1 3.27Å; F20-I24 WeakPolarHBondContact O-CG1 3.24Å; F20-I24 PolarHBondContact O-N 3.5Å
21	I	72.6	Confident	66.9	Low	96 Å²	96	102 Å²	102	49%	0.492	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-42	174.5	-68.5	164.6	0	0	0	110.4	A17 N18 I24 M25	A17-I21 VanDerWaalsContact O-CG1 3.26Å; A17-I21 WeakPolarHBondContact O-CG1 2.79Å; A17-I21 PolarHBondContact O-N 3.41Å; N18-I21 PolarHBondContact O-N 2.95Å; I21-I24 PolarHBondContact O-N 2.95Å; I21-M25 PolarHBondContact O-N 3.01Å
22	Y	71.8	Confident	65.5	Low	151 Å²	151	101 Å²	101	59%	0.592	55%	0.549	S	S	*	.	H	α-helix	trans	-62.6	-44.9	176.4	-169.1	-88.4	0	0	0	111.4	N18 V19 M25 E26	N18-Y22 WeakPolarHBondContact O-CB 3.39Å; N18-Y22 PolarHBondContact O-N 2.82Å; V19-Y22 PolarHBondContact O-N 3.45Å; Y22-M25 PolarHBondContact O-N 3.41Å; Y22-E26 HydrophobicContact CE1-CG 4.35Å; Y22-E26 WeakPolarHBondContact O-CB 3.24Å; Y22-E26 PolarHBondContact O-N 2.88Å
23	L	71.9	Confident	64.1	Low	83 Å²	83	106.9 Å²	106.9	44%	0.435	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-39.6	175.9	-74.3	167.2	0	0	0	112.4	V19 F20 M25 E26 V27	V19-L23 HydrophobicContact CG1-CD1 3.94Å; V19-L23 HydrophobicContact CG1-CG 4.46Å; V19-L23 WeakPolarHBondContact O-CB 3.41Å; V19-L23 WeakPolarHBondContact O-CG 3.47Å; V19-L23 PolarHBondContact O-N 3.41Å; F20-L23 PolarHBondContact O-N 2.99Å; L23-M25 VanDerWaalsContact C-N 3.34Å; L23-E26 PolarHBondContact O-N 3.01Å; L23-V27 VanDerWaalsContact O-CB 3.31Å; L23-V27 WeakPolarHBondContact O-CB 3.44Å; L23-V27 WeakPolarHBondContact O-CG2 3.27Å; L23-V27 PolarHBondContact O-N 3.35Å
24	I	69.1	Low	62.2	Low	98 Å²	98	109.8 Å²	109.8	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-64.9	-39.3	174.5	-70.4	168	0	0	0	110.8	F20 I21 S28	F20-I24 HydrophobicContact CD1-CD1 4.02Å; F20-I24 HydrophobicContact CD1-CG1 4.49Å; F20-I24 WeakPolarHBondContact O-CB 3.29Å; F20-I24 VanDerWaalsContact O-CG1 3.27Å; F20-I24 WeakPolarHBondContact O-CG1 3.24Å; F20-I24 PolarHBondContact O-N 3.5Å; I21-I24 PolarHBondContact O-N 2.95Å; I24-S28 VanDerWaalsContact O-CB 3.23Å; I24-S28 WeakPolarHBondContact O-CB 3.16Å; I24-S28 PolarHBondContact O-N 3.34Å; I24-S28 PolarHBondContact O-OG 3.01Å
25	M	62.2	Low	60.5	Low	130 Å²	130	115.4 Å²	115.4	64%	0.64	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-38.9	174.1	-80	-169.5	69.1	0	0	112.5	I21 Y22 L23 K29	I21-M25 PolarHBondContact O-N 3.01Å; Y22-M25 PolarHBondContact O-N 3.41Å; L23-M25 VanDerWaalsContact C-N 3.34Å; M25-K29 WeakPolarHBondContact O-CB 3.3Å; M25-K29 PolarHBondContact O-N 3.43Å
26	E	61.8	Low	59	Low	100 Å²	100	116.7 Å²	116.7	47%	0.467	61%	0.608	S	S	.	*	H	α-helix	trans	-71.1	-41.8	178.4	-124.9	-174.5	-162.2	0	0	112	Y22 L23 S28 K29 S30	Y22-E26 HydrophobicContact CE1-CG 4.35Å; Y22-E26 WeakPolarHBondContact O-CB 3.24Å; Y22-E26 PolarHBondContact O-N 2.88Å; L23-E26 PolarHBondContact O-N 3.01Å; E26-S28 VanDerWaalsContact C-N 3.34Å; E26-K29 CarbonylContact O-C 3.39Å; E26-K29 WeakPolarHBondContact O-CB 3.29Å; E26-K29 PolarHBondContact O-N 3.19Å; E26-K29 VanDerWaalsContact O-N 3.17Å; E26-S30 PolarHBondContact O-N 2.78Å
27	V	63.7	Low	57.2	Low	90 Å²	90	113.7 Å²	113.7	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-68.2	-34	175.1	173.3	0	0	0	0	111.3	L23 K29 S30 S31	L23-V27 VanDerWaalsContact O-CB 3.31Å; L23-V27 WeakPolarHBondContact O-CB 3.44Å; L23-V27 WeakPolarHBondContact O-CG2 3.27Å; L23-V27 PolarHBondContact O-N 3.35Å; V27-K29 VanDerWaalsContact C-N 3.33Å; V27-S30 PolarHBondContact O-N 3.43Å; V27-S30 PolarHBondContact O-OG 3.33Å; V27-S31 VanDerWaalsContact O-CB 3.3Å; V27-S31 WeakPolarHBondContact O-CB 3.45Å; V27-S31 PolarHBondContact O-N 3.35Å
28	S	54.7	Low	55.5	Low	73 Å²	73	120.6 Å²	120.6	51%	0.51	63%	0.631	S	S	.	*	H	α-helix	trans	-68.8	-32.6	171.7	-60.4	0	0	0	0	112.1	I24 E26 S32	I24-S28 VanDerWaalsContact O-CB 3.23Å; I24-S28 WeakPolarHBondContact O-CB 3.16Å; I24-S28 PolarHBondContact O-N 3.34Å; I24-S28 PolarHBondContact O-OG 3.01Å; E26-S28 VanDerWaalsContact C-N 3.34Å; S28-S32 PolarHBondContact O-OG 2.83Å
29	K	49.3	Very low	54.4	Low	155 Å²	155	119.8 Å²	119.8	67%	0.674	65%	0.646	S	S	*	*	H	α-helix	trans	-71.6	-38.6	172.2	-110.7	-179.4	173.7	-179.2	0	112.5	M25 E26 V27 S32	M25-K29 WeakPolarHBondContact O-CB 3.3Å; M25-K29 PolarHBondContact O-N 3.43Å; E26-K29 CarbonylContact O-C 3.39Å; E26-K29 WeakPolarHBondContact O-CB 3.29Å; E26-K29 PolarHBondContact O-N 3.19Å; E26-K29 VanDerWaalsContact O-N 3.17Å; V27-K29 VanDerWaalsContact C-N 3.33Å; K29-S32 PolarHBondContact O-N 3.09Å; K29-S32 PolarHBondContact O-OG 3Å
30	S	44.8	Very low	52.6	Low	76 Å²	76	123.8 Å²	123.8	53%	0.531	66%	0.659	S	S	.	*	H	α-helix	trans	-78	-28.6	-179.7	80.1	0	0	0	0	112.5	E26 V27 S32 Q33	E26-S30 PolarHBondContact O-N 2.78Å; V27-S30 PolarHBondContact O-N 3.43Å; V27-S30 PolarHBondContact O-OG 3.33Å; S30-S32 PolarHBondContact O-N 2.9Å; S30-Q33 PolarHBondContact O-N 3.16Å
31	S	40.6	Very low	51.3	Low	106 Å²	106	123 Å²	123	74%	0.741	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-10.7	173.2	-177.3	0	0	0	0	113.4	V27	V27-S31 VanDerWaalsContact O-CB 3.3Å; V27-S31 WeakPolarHBondContact O-CB 3.45Å; V27-S31 PolarHBondContact O-N 3.35Å
32	S	42	Very low	50.4	Low	94 Å²	94	125.8 Å²	125.8	66%	0.657	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	5.1	178	35.6	0	0	0	0	113.5	S28 K29 S30	S28-S32 PolarHBondContact O-OG 2.83Å; K29-S32 PolarHBondContact O-N 3.09Å; K29-S32 PolarHBondContact O-OG 3Å; S30-S32 PolarHBondContact O-N 2.9Å
33	Q	45	Very low	49.6	Very low	159 Å²	159	124.5 Å²	124.5	74%	0.743	68%	0.682	S	S	*	*	S	Bend	trans	-115	98.3	171.1	-79.2	-172.9	-45.1	0	0	111.1	S30	S30-Q33 PolarHBondContact O-N 3.16Å
34	E	37.1	Very low	48.6	Very low	179 Å²	179	124.6 Å²	124.6	84%	0.836	69%	0.687	S	S	*	*			trans	129	86.8	149.8	-74	-173.1	161.1	0	0	114.3
35	K	36.8	Very low	47.8	Very low	214 Å²	214	130.2 Å²	130.2	93%	0.93	71%	0.708	S	S	*	*				-130.1	106	118.3	-97.4	-173.7	-179.6	178.8	0	108.7	G37	K35-G37 PolarHBondContact O-N 2.82Å; K35-G37 VanDerWaalsContact O-N 3.17Å
36	D	41.3	Very low	47.4	Very low	158 Å²	158	129.6 Å²	129.6	85%	0.845	70%	0.704	S	S	*	*			trans	-56.9	105.8	174.9	-155.7	5.6	0	0	0	110.4
37	G	40.1	Very low	46.9	Very low	65 Å²	65	132.9 Å²	132.9	67%	0.67	72%	0.716	S	S	*	*			trans	-122.5	99.9	156.4	0	0	0	0	0	105.1	K35 G39	K35-G37 PolarHBondContact O-N 2.82Å; K35-G37 VanDerWaalsContact O-N 3.17Å; G37-G39 PolarHBondContact O-N 2.74Å
38	K	40.2	Very low	46.4	Very low	192 Å²	192	137.2 Å²	137.2	84%	0.835	73%	0.728	S	S	*	*			trans	3.8	106.9	171	-73.6	177	175.6	178.2	0	112.7	E40	K38-E40 PolarHBondContact O-N 3.23Å
39	G	46	Very low	46	Very low	81 Å²	81	141.7 Å²	141.7	84%	0.835	73%	0.734	S	S	*	*			trans	-63.1	73.9	170.6	0	0	0	0	0	111.2	G37 V41	G37-G39 PolarHBondContact O-N 2.74Å; G39-V41 PolarHBondContact O-N 3.31Å
40	E	39.7	Very low	46	Very low	165 Å²	165	140.2 Å²	140.2	77%	0.771	73%	0.727	S	S	*	*			trans	-58.6	120	152.6	-82.4	-171.6	160.8	0	0	105.2	K38 I42	K38-E40 PolarHBondContact O-N 3.23Å; E40-I42 VanDerWaalsContact C-N 3.34Å; E40-I42 PolarHBondContact O-N 2.79Å
41	V	46.4	Very low	46.2	Very low	119 Å²	119	143.7 Å²	143.7	72%	0.721	74%	0.739	S	S	*	*			trans	-48.9	110.9	157.5	179.7	0	0	0	0	105	G39 I43	G39-V41 PolarHBondContact O-N 3.31Å; V41-I43 HydrophobicContact CB-CG1 4.19Å; V41-I43 HydrophobicContact CG1-CD1 4.48Å; V41-I43 HydrophobicContact CG1-CG1 3.62Å; V41-I43 PolarHBondContact O-N 2.88Å
42	I	54	Low	46.9	Very low	154 Å²	154	142.5 Å²	142.5	79%	0.79	73%	0.731	S	S	*	*			trans	-71.7	78.4	171.1	-55.8	177.2	0	0	0	105.1	E40 P44	E40-I42 VanDerWaalsContact C-N 3.34Å; E40-I42 PolarHBondContact O-N 2.79Å; I42-P44 VanDerWaalsContact O-CD 3.3Å; I42-P44 WeakPolarHBondContact O-CD 3.42Å
43	I	55.1	Low	47.8	Very low	124 Å²	124	144 Å²	144	64%	0.636	74%	0.736	S	S	*	*			trans	-64.6	118.9	161.2	-56	177.7	0	0	0	103.2	V41 K45	V41-I43 HydrophobicContact CB-CG1 4.19Å; V41-I43 HydrophobicContact CG1-CD1 4.48Å; V41-I43 HydrophobicContact CG1-CG1 3.62Å; V41-I43 PolarHBondContact O-N 2.88Å; I43-K45 PolarHBondContact O-N 3.15Å
44	P	50.5	Low	48.4	Very low	85 Å²	85	141 Å²	141	55%	0.552	73%	0.73	S	S	*	*			trans	-48.9	115.7	172.8	-25.3	34.4	0	0	0	107.8	I42 E46	I42-P44 VanDerWaalsContact O-CD 3.3Å; I42-P44 WeakPolarHBondContact O-CD 3.42Å; P44-E46 CarbonylContact C-O 3.57Å; P44-E46 VanDerWaalsContact CB-O 3.31Å; P44-E46 WeakPolarHBondContact CB-O 3.42Å; P44-E46 CarbonylContact O-C 3.58Å; P44-E46 PolarHBondContact O-N 3.42Å; P44-E46 VanDerWaalsContact O-N 3.08Å
45	K	53.7	Low	49.6	Very low	215 Å²	215	134.1 Å²	134.1	94%	0.935	70%	0.701	S	S	*	*	S	Bend	trans	-59.2	-22	177.6	-74.2	-175.4	177.8	178.5	0	110.9	I43	I43-K45 PolarHBondContact O-N 3.15Å
46	E	52.8	Low	51.5	Low	118 Å²	118	132.6 Å²	132.6	55%	0.551	70%	0.697	S	S	*	*	S	Bend	trans	-94	129.9	170.3	-52.7	-147.8	136.9	0	0	110.1	P44 F48 K50	P44-E46 CarbonylContact C-O 3.57Å; P44-E46 VanDerWaalsContact CB-O 3.31Å; P44-E46 WeakPolarHBondContact CB-O 3.42Å; P44-E46 CarbonylContact O-C 3.58Å; P44-E46 PolarHBondContact O-N 3.42Å; P44-E46 VanDerWaalsContact O-N 3.08Å; E46-F48 PolarHBondContact O-N 3.48Å; E46-F48 VanDerWaalsContact O-N 3.15Å; E46-K50 IonicContact OE1-NZ 2.83Å; E46-K50 PolarHBondContact OE1-NZ 3.03Å; E46-K50 WeakPolarHBondContact OE2-CE 3.03Å; E46-K50 IonicContact OE2-NZ 3.62Å; E46-K50 PolarHBondContact OE2-NZ 3.31Å
47	K	50.6	Low	54.1	Low	168 Å²	168	125.1 Å²	125.1	73%	0.73	66%	0.657	S	S	*	*			trans	-51.7	125.4	170.2	-66.3	-179.5	177.1	-179.8	0	108.5	W49 K50	K47-W49 WeakPolarHBondContact CB-O 3.18Å; K47-W49 CarbonylContact O-C 3.59Å; K47-W49 PolarHBondContact O-N 3.02Å; K47-K50 PolarHBondContact O-N 3.12Å
48	F	53.5	Low	56.7	Low	181 Å²	181	122.3 Å²	122.3	79%	0.794	63%	0.626	S	S	*	*	S	Bend	trans	-49.9	-33	171.7	-177	-93.8	0	0	0	111.2	E46	E46-F48 PolarHBondContact O-N 3.48Å; E46-F48 VanDerWaalsContact O-N 3.15Å
49	W	46	Very low	59.5	Low	167 Å²	167	113.9 Å²	113.9	63%	0.633	59%	0.589	S	S	*	*	S	Bend	trans	-103.4	97.4	165.4	-57.3	104.3	0	0	0	110.4	K47 I51	K47-W49 WeakPolarHBondContact CB-O 3.18Å; K47-W49 CarbonylContact O-C 3.59Å; K47-W49 PolarHBondContact O-N 3.02Å; W49-I51 PolarHBondContact O-N 3.24Å
50	K	50.6	Low	61.9	Low	124 Å²	124	111.3 Å²	111.3	54%	0.539	56%	0.556	S	S	.	*			trans	-77.3	118.8	159.8	-87	177.4	172.7	169.1	0	107.7	E46 K47 S52	E46-K50 IonicContact OE1-NZ 2.83Å; E46-K50 PolarHBondContact OE1-NZ 3.03Å; E46-K50 WeakPolarHBondContact OE2-CE 3.03Å; E46-K50 IonicContact OE2-NZ 3.62Å; E46-K50 PolarHBondContact OE2-NZ 3.31Å; K47-K50 PolarHBondContact O-N 3.12Å; K50-S52 PolarHBondContact O-N 3.01Å
51	I	48.8	Very low	64.5	Low	149 Å²	149	108 Å²	108	76%	0.764	54%	0.537	S	S	*	.			trans	-67.2	95.5	156	-61.8	170.4	0	0	0	103.8	W49 T53	W49-I51 PolarHBondContact O-N 3.24Å; I51-T53 PolarHBondContact O-N 3.43Å
52	S	55.6	Low	66.7	Low	82 Å²	82	102.8 Å²	102.8	57%	0.573	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-53.9	139.2	175.6	-64.8	0	0	0	0	108.7	K50	K50-S52 PolarHBondContact O-N 3.01Å
53	T	60.4	Low	68.7	Low	125 Å²	125	96.1 Å²	96.1	77%	0.767	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-47.7	130.4	164.3	42.4	0	0	0	0	108	I51	I51-T53 PolarHBondContact O-N 3.43Å
54	P	57.6	Low	70.4	Confident	95 Å²	95	92.6 Å²	92.6	62%	0.617	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-50.1	131	-176.4	-26.2	32.4	0	0	0	109.4	E56	P54-E56 PolarHBondContact O-N 2.03Å
55	P	62.9	Low	72.3	Confident	35 Å²	35	92.2 Å²	92.2	23%	0.227	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-52.6	137.6	176.3	-23.7	32.3	0	0	0	109.8	A57 N60 R61 E64	P55-A57 VanDerWaalsContact C-N 3.34Å; P55-N60 HydrophobicContact CB-CB 3.24Å; P55-N60 HydrophobicContact CG-CB 3.82Å; P55-R61 HydrophobicContact CB-CG 4.47Å; P55-R61 WeakPolarHBondContact O-CD 3.43Å; P55-R61 WeakPolarHBondContact O-CG 3.27Å; P55-E64 WeakPolarHBondContact CD-OE2 3.19Å
56	E	75.7	Confident	74	Confident	183 Å²	183	82.2 Å²	82.2	86%	0.855	40%	0.397	S	S	*	.	S	Bend	trans	-72.3	-34.6	-177.4	-64.4	-172.6	164.4	0	0	111.7	P54	P54-E56 PolarHBondContact O-N 2.03Å
57	A	95.2	Very high	75.8	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	39%	0.385	C	S	.	.	S	Bend	trans	-76.1	144.8	-174.3	0	0	0	0	0	113.3	P55 W59 N60 R61 E293 V294	P55-A57 VanDerWaalsContact C-N 3.34Å; A57-W59 PolarHBondContact O-N 3.05Å; A57-N60 WeakPolarHBondContact CB-OD1 3.38Å; A57-N60 PolarHBondContact O-N 3.39Å; A57-R61 WeakPolarHBondContact O-CG 3.47Å; A57-R61 PolarHBondContact O-N 3.49Å; A57-R61 VanDerWaalsContact O-N 3.14Å; A57-E293 WeakPolarHBondContact CB-O 3.12Å; A57-V294 WeakPolarHBondContact CA-O 3.38Å
58	Y	96.4	Very high	77.6	Confident	7 Å²	7	74.2 Å²	74.2	3%	0.027	36%	0.362	C	S	.	.	H	α-helix	trans	-57.6	-50.5	-174.6	177.2	-99.6	0	0	0	113.3	N60 R61 E62 V102 V105 V106 L120 L123 V294	Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 2.93Å; Y58-R61 PolarHBondContact O-N 2.84Å; Y58-E62 HydrophobicContact CD1-CG 4.33Å; Y58-E62 HydrophobicContact CD2-CG 4.29Å; Y58-E62 HydrophobicContact CE1-CG 3.88Å; Y58-E62 HydrophobicContact CE2-CG 3.8Å; Y58-E62 PolarHBondContact O-N 3.4Å; Y58-V102 HydrophobicContact CE1-CG1 4.28Å; Y58-V102 HydrophobicContact CE2-CG1 4.09Å; Y58-V102 WeakPolarHBondContact OH-CG1 3.45Å; Y58-V105 HydrophobicContact CD2-CG2 3.78Å; Y58-V105 HydrophobicContact CE2-CG2 3.64Å; Y58-V106 HydrophobicContact CD1-CG2 4.33Å; Y58-V106 HydrophobicContact CD2-CG2 3.6Å; Y58-V106 HydrophobicContact CE2-CG2 4.22Å; Y58-V106 HydrophobicContact CG-CG2 3.67Å; Y58-L120 HydrophobicContact CD1-CD2 3.34Å; Y58-L120 HydrophobicContact CE1-CD2 3.63Å; Y58-L120 HydrophobicContact CG-CD2 4.23Å; Y58-L123 HydrophobicContact CE1-CD2 3.87Å; Y58-V294 PolarHBondContact N-O 3.23Å
59	W	97.4	Very high	79.1	Confident	15 Å²	15	70.8 Å²	70.8	6%	0.057	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-43.7	-177	-174.8	95.4	0	0	0	111.4	A57 R61 E62 Q63 V295 Y296 V326 H327 L328 Y329 M338	A57-W59 PolarHBondContact O-N 3.05Å; W59-R61 VanDerWaalsContact C-N 3.34Å; W59-R61 PolarHBondContact O-N 3.06Å; W59-E62 PolarHBondContact O-N 2.87Å; W59-Q63 HydrophobicContact CD2-CB 4.47Å; W59-Q63 HydrophobicContact CE3-CB 4.07Å; W59-Q63 HydrophobicContact CH2-CB 3.93Å; W59-Q63 HydrophobicContact CH2-CG 3.67Å; W59-Q63 HydrophobicContact CZ2-CB 4.35Å; W59-Q63 HydrophobicContact CZ2-CG 4.27Å; W59-Q63 HydrophobicContact CZ3-CB 3.78Å; W59-Q63 HydrophobicContact CZ3-CG 3.88Å; W59-Q63 WeakPolarHBondContact O-CB 3.3Å; W59-Q63 PolarHBondContact O-N 3.44Å; W59-V295 WeakPolarHBondContact CB-O 3.44Å; W59-V295 PolarHBondContact N-O 3.14Å; W59-Y296 HydrophobicContact CD2-CD2 4.05Å; W59-Y296 HydrophobicContact CD2-CE2 4.38Å; W59-Y296 AromaticContact CE3-CD2 3.56Å; W59-Y296 HydrophobicContact CE3-CD2 3.56Å; W59-Y296 AromaticContact CE3-CE2 3.58Å; W59-Y296 HydrophobicContact CE3-CE2 3.58Å; W59-Y296 HydrophobicContact CG-CD2 4.45Å; W59-Y296 HydrophobicContact CZ3-CD2 4.17Å; W59-Y296 AromaticContact CZ3-CE2 3.69Å; W59-Y296 HydrophobicContact CZ3-CE2 3.69Å; W59-V326 HydrophobicContact CZ2-CG1 4.3Å; W59-H327 HydrophobicContact CZ2-CB 4.43Å; W59-H327 PolarHBondContact NE1-O 3.12Å; W59-L328 PolarHBondContact NE1-O 3.28Å; W59-Y329 HydrophobicContact CD2-CD2 4.24Å; W59-Y329 HydrophobicContact CG-CD2 4.27Å; W59-Y329 AromaticContact NE1-CD2 3.81Å; W59-M338 HydrophobicContact CH2-CE 3.98Å; W59-M338 HydrophobicContact CH2-SD 3.33Å; W59-M338 WeakPolarHBondContact CH2-SD 3.43Å; W59-M338 HydrophobicContact CZ2-CE 4.11Å; W59-M338 HydrophobicContact CZ2-SD 3.37Å; W59-M338 WeakPolarHBondContact CZ2-SD 3.42Å; W59-M338 HydrophobicContact CZ3-CE 4.4Å; W59-M338 HydrophobicContact CZ3-SD 4.27Å
60	N	96.3	Very high	81	Confident	26 Å²	26	66.8 Å²	66.8	14%	0.139	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-39.4	-179.8	-60.6	77.4	0	0	0	111.8	P55 A57 Y58 Q63 E64 Y296 S297	P55-N60 HydrophobicContact CB-CB 3.24Å; P55-N60 HydrophobicContact CG-CB 3.82Å; A57-N60 WeakPolarHBondContact CB-OD1 3.38Å; A57-N60 PolarHBondContact O-N 3.39Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 2.93Å; N60-Q63 PolarHBondContact O-N 3.46Å; N60-E64 WeakPolarHBondContact O-CB 3Å; N60-E64 PolarHBondContact O-N 3.34Å; N60-Y296 WeakPolarHBondContact OD1-CA 3.19Å; N60-S297 VanDerWaalsContact CG-OG 3.32Å; N60-S297 PolarHBondContact ND2-O 2.98Å; N60-S297 PolarHBondContact OD1-N 2.97Å; N60-S297 PolarHBondContact OD1-OG 3.39Å
61	R	94	Very high	82.6	Confident	96 Å²	96	63.9 Å²	63.9	36%	0.362	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-44.5	175.6	-68.3	172.3	65	-168.9	-0.8	112.1	P55 A57 Y58 W59 E64 K65	P55-R61 HydrophobicContact CB-CG 4.47Å; P55-R61 WeakPolarHBondContact O-CD 3.43Å; P55-R61 WeakPolarHBondContact O-CG 3.27Å; A57-R61 WeakPolarHBondContact O-CG 3.47Å; A57-R61 PolarHBondContact O-N 3.49Å; A57-R61 VanDerWaalsContact O-N 3.14Å; Y58-R61 PolarHBondContact O-N 2.84Å; W59-R61 VanDerWaalsContact C-N 3.34Å; W59-R61 PolarHBondContact O-N 3.06Å; R61-E64 PolarHBondContact O-N 3.12Å; R61-K65 WeakPolarHBondContact O-CG 3.34Å; R61-K65 PolarHBondContact O-N 3.4Å; R61-K65 VanDerWaalsContact O-N 3.1Å
62	E	94	Very high	83.9	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.047	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-41.1	177.4	-65.1	-54.2	117.4	0	0	111.2	Y58 W59 E64 K65 L66 R124 H327	Y58-E62 HydrophobicContact CD1-CG 4.33Å; Y58-E62 HydrophobicContact CD2-CG 4.29Å; Y58-E62 HydrophobicContact CE1-CG 3.88Å; Y58-E62 HydrophobicContact CE2-CG 3.8Å; Y58-E62 PolarHBondContact O-N 3.4Å; W59-E62 PolarHBondContact O-N 2.87Å; E62-E64 VanDerWaalsContact C-N 3.31Å; E62-E64 PolarHBondContact O-N 3.02Å; E62-K65 WeakPolarHBondContact O-CB 3.47Å; E62-K65 PolarHBondContact O-N 3.02Å; E62-K65 WeakPolarHBondContact OE1-CE 3.35Å; E62-K65 IonicContact OE1-NZ 2.8Å; E62-K65 PolarHBondContact OE1-NZ 3.4Å; E62-K65 IonicContact OE2-NZ 2.97Å; E62-L66 WeakPolarHBondContact O-CB 3.3Å; E62-L66 PolarHBondContact O-N 3.35Å; E62-R124 IonicContact OE2-CZ 3.09Å; E62-R124 IonicContact OE2-NH1 3.12Å; E62-R124 IonicContact OE2-NH2 2.72Å; E62-R124 PolarHBondContact OE2-NH2 3.03Å; E62-H327 PolarHBondContact O-NE2 3.45Å
63	Q	94.8	Very high	84.8	Confident	14 Å²	14	62 Å²	62	7%	0.065	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-34.6	174.7	-172.5	60	52	0	0	112.4	W59 N60 L66 N67 Q325	W59-Q63 HydrophobicContact CD2-CB 4.47Å; W59-Q63 HydrophobicContact CE3-CB 4.07Å; W59-Q63 HydrophobicContact CH2-CB 3.93Å; W59-Q63 HydrophobicContact CH2-CG 3.67Å; W59-Q63 HydrophobicContact CZ2-CB 4.35Å; W59-Q63 HydrophobicContact CZ2-CG 4.27Å; W59-Q63 HydrophobicContact CZ3-CB 3.78Å; W59-Q63 HydrophobicContact CZ3-CG 3.88Å; W59-Q63 WeakPolarHBondContact O-CB 3.3Å; W59-Q63 PolarHBondContact O-N 3.44Å; N60-Q63 PolarHBondContact O-N 3.46Å; Q63-L66 PolarHBondContact O-N 3.38Å; Q63-N67 PolarHBondContact NE2-OD1 3.16Å; Q63-N67 WeakPolarHBondContact O-CB 3.41Å; Q63-N67 PolarHBondContact O-N 2.91Å; Q63-N67 PolarHBondContact O-ND2 3.38Å; Q63-N67 PolarHBondContact O-OD1 3.33Å; Q63-Q325 PolarHBondContact NE2-O 3.1Å
64	E	91.5	Very high	85.3	Confident	49 Å²	49	58.5 Å²	58.5	23%	0.229	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-45	173.7	-168	-169.4	162.2	0	0	111.8	P55 N60 R61 E62 L66 N67 R68	P55-E64 WeakPolarHBondContact CD-OE2 3.19Å; N60-E64 WeakPolarHBondContact O-CB 3Å; N60-E64 PolarHBondContact O-N 3.34Å; R61-E64 PolarHBondContact O-N 3.12Å; E62-E64 VanDerWaalsContact C-N 3.31Å; E62-E64 PolarHBondContact O-N 3.02Å; E64-L66 VanDerWaalsContact C-N 3.26Å; E64-L66 PolarHBondContact O-N 3.47Å; E64-N67 PolarHBondContact O-N 3.24Å; E64-R68 WeakPolarHBondContact O-CG 3.35Å; E64-R68 PolarHBondContact O-N 3.33Å; E64-R68 IonicContact OE1-CZ 2.83Å; E64-R68 IonicContact OE1-NE 2.75Å; E64-R68 PolarHBondContact OE1-NE 3.4Å; E64-R68 IonicContact OE1-NH2 3.92Å; E64-R68 PolarHBondContact OE1-NH2 2.93Å
65	K	90.1	Very high	85.7	Confident	78 Å²	78	56 Å²	56	34%	0.339	27%	0.274	S	S	.	.	H	α-helix	trans	-56.4	-45.2	174.2	-68.5	171.8	-176.3	172.1	0	110.9	R61 E62 R68 Q69 L87	R61-K65 WeakPolarHBondContact O-CG 3.34Å; R61-K65 PolarHBondContact O-N 3.4Å; R61-K65 VanDerWaalsContact O-N 3.1Å; E62-K65 WeakPolarHBondContact O-CB 3.47Å; E62-K65 PolarHBondContact O-N 3.02Å; E62-K65 WeakPolarHBondContact OE1-CE 3.35Å; E62-K65 IonicContact OE1-NZ 2.8Å; E62-K65 PolarHBondContact OE1-NZ 3.4Å; E62-K65 IonicContact OE2-NZ 2.97Å; K65-R68 PolarHBondContact O-N 3.13Å; K65-Q69 PolarHBondContact O-N 3.46Å; K65-Q69 VanDerWaalsContact O-N 3.1Å; K65-L87 HydrophobicContact CB-CD2 4.39Å
66	L	90.5	Very high	85.8	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-41.4	179.1	-160.2	155.2	0	0	0	111.4	E62 Q63 E64 R68 Q69 Y70 H92 Q325 H327	E62-L66 WeakPolarHBondContact O-CB 3.3Å; E62-L66 PolarHBondContact O-N 3.35Å; Q63-L66 PolarHBondContact O-N 3.38Å; E64-L66 VanDerWaalsContact C-N 3.26Å; E64-L66 PolarHBondContact O-N 3.47Å; L66-R68 VanDerWaalsContact C-N 3.31Å; L66-R68 PolarHBondContact O-N 3.17Å; L66-Q69 WeakPolarHBondContact O-CB 3.33Å; L66-Q69 PolarHBondContact O-N 2.92Å; L66-Y70 HydrophobicContact CD2-CD2 3.63Å; L66-Y70 HydrophobicContact CD2-CE2 3.92Å; L66-Y70 HydrophobicContact CG-CD2 4.14Å; L66-Y70 HydrophobicContact CG-CE2 4.17Å; L66-Y70 WeakPolarHBondContact O-CD2 3.42Å; L66-Y70 PolarHBondContact O-N 3.29Å; L66-Y70 VanDerWaalsContact O-N 3.1Å; L66-H92 HydrophobicContact CD1-CB 4.46Å; L66-H92 WeakPolarHBondContact CD1-CD2 3.49Å; L66-Q325 VanDerWaalsContact CD2-CA 3.5Å; L66-Q325 HydrophobicContact CD2-CB 4.37Å; L66-Q325 WeakPolarHBondContact CD2-O 3.43Å; L66-H327 WeakPolarHBondContact CD1-NE2 3.49Å
67	N	90.4	Very high	85.2	Confident	55 Å²	55	55.9 Å²	55.9	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-39.3	173.7	-71.4	-19.7	0	0	0	112.3	Q63 E64 Q69 N71 K342	Q63-N67 PolarHBondContact NE2-OD1 3.16Å; Q63-N67 WeakPolarHBondContact O-CB 3.41Å; Q63-N67 PolarHBondContact O-N 2.91Å; Q63-N67 PolarHBondContact O-ND2 3.38Å; Q63-N67 PolarHBondContact O-OD1 3.33Å; E64-N67 PolarHBondContact O-N 3.24Å; N67-Q69 VanDerWaalsContact C-N 3.34Å; N67-N71 WeakPolarHBondContact O-CB 3.43Å; N67-N71 PolarHBondContact O-N 2.9Å; N67-K342 PolarHBondContact OD1-NZ 3.01Å
68	R	87	Confident	83.5	Confident	64 Å²	64	56.3 Å²	56.3	24%	0.242	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-35.1	175.9	-70.1	174	-178.4	-112.7	5.1	112.4	E64 K65 L66 L74 S75 E83	E64-R68 WeakPolarHBondContact O-CG 3.35Å; E64-R68 PolarHBondContact O-N 3.33Å; E64-R68 IonicContact OE1-CZ 2.83Å; E64-R68 IonicContact OE1-NE 2.75Å; E64-R68 PolarHBondContact OE1-NE 3.4Å; E64-R68 IonicContact OE1-NH2 3.92Å; E64-R68 PolarHBondContact OE1-NH2 2.93Å; K65-R68 PolarHBondContact O-N 3.13Å; L66-R68 VanDerWaalsContact C-N 3.31Å; L66-R68 PolarHBondContact O-N 3.17Å; R68-L74 HydrophobicContact CB-CB 4.46Å; R68-L74 HydrophobicContact CG-CB 4.26Å; R68-L74 HydrophobicContact CG-CD1 4.34Å; R68-S75 PolarHBondContact O-N 3.16Å; R68-E83 IonicContact NH1-OE2 2.75Å; R68-E83 PolarHBondContact NH1-OE2 2.77Å
69	Q	86.4	Confident	81.7	Confident	108 Å²	108	61.1 Å²	61.1	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-68.4	-43.4	178.2	-174.8	178.2	-1.9	0	0	112.5	K65 L66 N67	K65-Q69 PolarHBondContact O-N 3.46Å; K65-Q69 VanDerWaalsContact O-N 3.1Å; L66-Q69 WeakPolarHBondContact O-CB 3.33Å; L66-Q69 PolarHBondContact O-N 2.92Å; N67-Q69 VanDerWaalsContact C-N 3.34Å
70	Y	86.1	Confident	79.9	Confident	84 Å²	84	68.1 Å²	68.1	33%	0.329	34%	0.337	S	S	.	.	H	α-helix	trans	-92.9	-10.4	-175.5	-75.1	-89.3	0	0	0	114.3	L66 P72 H92 Q325	L66-Y70 HydrophobicContact CD2-CD2 3.63Å; L66-Y70 HydrophobicContact CD2-CE2 3.92Å; L66-Y70 HydrophobicContact CG-CD2 4.14Å; L66-Y70 HydrophobicContact CG-CE2 4.17Å; L66-Y70 WeakPolarHBondContact O-CD2 3.42Å; L66-Y70 PolarHBondContact O-N 3.29Å; L66-Y70 VanDerWaalsContact O-N 3.1Å; Y70-P72 WeakPolarHBondContact O-CD 3.36Å; Y70-H92 AromaticContact CE2-CE1 3.74Å; Y70-H92 AromaticContact CE2-NE2 3.88Å; Y70-H92 AromaticContact CZ-CE1 3.97Å; Y70-H92 PolarHBondContact OH-CE1 2.63Å; Y70-H92 VanDerWaalsContact OH-CE1 3.25Å; Y70-Q325 HydrophobicContact CD1-CG 3.79Å; Y70-Q325 HydrophobicContact CD2-CG 4.45Å; Y70-Q325 HydrophobicContact CE1-CG 4.15Å; Y70-Q325 HydrophobicContact CG-CG 3.94Å
71	N	82.8	Confident	78	Confident	63 Å²	63	71.2 Å²	71.2	34%	0.337	36%	0.357	S	S	.	.			trans	-94.1	115.4	175.7	-172.4	-58.3	0	0	0	110.5	N67 I73 L74 S75	N67-N71 WeakPolarHBondContact O-CB 3.43Å; N67-N71 PolarHBondContact O-N 2.9Å; N71-I73 VanDerWaalsContact C-N 3.27Å; N71-I73 PolarHBondContact O-N 3.27Å; N71-I73 WeakPolarHBondContact OD1-CB 3.45Å; N71-I73 PolarHBondContact OD1-N 3.45Å; N71-L74 HydrophobicContact CB-CB 4.06Å; N71-L74 HydrophobicContact CB-CD1 3.93Å; N71-L74 HydrophobicContact CB-CG 4.06Å; N71-L74 PolarHBondContact O-N 2.91Å; N71-L74 PolarHBondContact OD1-N 3.38Å; N71-L74 VanDerWaalsContact OD1-N 3.14Å; N71-S75 VanDerWaalsContact O-CB 3.3Å; N71-S75 WeakPolarHBondContact O-CB 3.31Å; N71-S75 PolarHBondContact O-N 2.98Å
72	P	76	Confident	75.9	Confident	95 Å²	95	69.6 Å²	69.6	62%	0.617	37%	0.37	S	S	*	.	H	α-helix	trans	-59.3	-36.9	-176.7	-21.8	31	0	0	0	113.3	Y70 M76	Y70-P72 WeakPolarHBondContact O-CD 3.36Å; P72-M76 WeakPolarHBondContact O-CG 3.47Å; P72-M76 PolarHBondContact O-N 3.32Å; P72-M76 VanDerWaalsContact O-N 3.09Å
73	I	74.9	Confident	73.9	Confident	97 Å²	97	74.1 Å²	74.1	50%	0.497	39%	0.391	S	S	.	.	H	α-helix	trans	-70.1	-46.6	-177.9	-58.2	173.7	0	0	0	109.9	N71 M76 L77	N71-I73 VanDerWaalsContact C-N 3.27Å; N71-I73 PolarHBondContact O-N 3.27Å; N71-I73 WeakPolarHBondContact OD1-CB 3.45Å; N71-I73 PolarHBondContact OD1-N 3.45Å; I73-M76 PolarHBondContact O-N 2.92Å; I73-L77 HydrophobicContact CG2-CD1 4.16Å; I73-L77 WeakPolarHBondContact O-CG 3.41Å; I73-L77 PolarHBondContact O-N 3.46Å; I73-L77 VanDerWaalsContact O-N 3.13Å
74	L	70.5	Confident	71.6	Confident	51 Å²	51	75.1 Å²	75.1	27%	0.267	40%	0.402	S	S	.	.	H	α-helix	trans	-69.3	-35.5	178.9	-62.6	177.2	0	0	0	112.2	R68 N71 L77 A78	R68-L74 HydrophobicContact CB-CB 4.46Å; R68-L74 HydrophobicContact CG-CB 4.26Å; R68-L74 HydrophobicContact CG-CD1 4.34Å; N71-L74 HydrophobicContact CB-CB 4.06Å; N71-L74 HydrophobicContact CB-CD1 3.93Å; N71-L74 HydrophobicContact CB-CG 4.06Å; N71-L74 PolarHBondContact O-N 2.91Å; N71-L74 PolarHBondContact OD1-N 3.38Å; N71-L74 VanDerWaalsContact OD1-N 3.14Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L74-L77 PolarHBondContact O-N 2.91Å; L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.15Å
75	S	66.4	Low	69.2	Low	43 Å²	43	76.4 Å²	76.4	30%	0.301	43%	0.428	S	S	.	.	H	α-helix	trans	-61.5	-45	174.9	177.7	0	0	0	0	111.6	R68 N71 L77 A78 N79	R68-S75 PolarHBondContact O-N 3.16Å; N71-S75 VanDerWaalsContact O-CB 3.3Å; N71-S75 WeakPolarHBondContact O-CB 3.31Å; N71-S75 PolarHBondContact O-N 2.98Å; S75-L77 PolarHBondContact O-N 3.4Å; S75-A78 PolarHBondContact O-N 2.88Å; S75-N79 PolarHBondContact O-N 3.45Å
76	M	64.9	Low	67.1	Low	131 Å²	131	83.8 Å²	83.8	65%	0.645	45%	0.454	S	S	*	.	H	α-helix	trans	-61.8	-43.4	174.6	-74.1	-178	178.6	0	0	112.4	P72 I73 N79 Q80	P72-M76 WeakPolarHBondContact O-CG 3.47Å; P72-M76 PolarHBondContact O-N 3.32Å; P72-M76 VanDerWaalsContact O-N 3.09Å; I73-M76 PolarHBondContact O-N 2.92Å; M76-N79 PolarHBondContact O-N 2.72Å; M76-Q80 WeakPolarHBondContact O-CG 3.4Å; M76-Q80 PolarHBondContact O-N 3.48Å; M76-Q80 VanDerWaalsContact O-N 3.15Å
77	L	63.6	Low	65.3	Low	84 Å²	84	87 Å²	87	44%	0.44	47%	0.471	S	S	.	.	H	α-helix	trans	-64.8	-40.5	177.7	-73.6	163.2	0	0	0	112.2	I73 L74 S75 N79 Q80 T81	I73-L77 HydrophobicContact CG2-CD1 4.16Å; I73-L77 WeakPolarHBondContact O-CG 3.41Å; I73-L77 PolarHBondContact O-N 3.46Å; I73-L77 VanDerWaalsContact O-N 3.13Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L74-L77 PolarHBondContact O-N 2.91Å; S75-L77 PolarHBondContact O-N 3.4Å; L77-N79 VanDerWaalsContact C-N 3.34Å; L77-N79 PolarHBondContact O-N 2.78Å; L77-Q80 PolarHBondContact O-N 2.73Å; L77-T81 PolarHBondContact O-N 3.06Å; L77-T81 VanDerWaalsContact O-N 3.1Å; L77-T81 PolarHBondContact O-OG1 2.9Å
78	A	60	Low	63.6	Low	8 Å²	8	86.7 Å²	86.7	7%	0.066	47%	0.473	C	S	.	.	H	α-helix	trans	-67.4	-32.8	177.9	0	0	0	0	0	113	L74 S75 T81 G82 E83 A84	L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.15Å; S75-A78 PolarHBondContact O-N 2.88Å; A78-T81 PolarHBondContact O-OG1 3.29Å; A78-G82 PolarHBondContact O-N 2.76Å; A78-E83 PolarHBondContact O-N 3.37Å; A78-A84 PolarHBondContact O-N 2.75Å
79	N	59.1	Low	62.2	Low	109 Å²	109	92 Å²	92	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-68.7	-34.6	172.5	-77.9	-15.4	0	0	0	111.9	S75 M76 L77 A84	S75-N79 PolarHBondContact O-N 3.45Å; M76-N79 PolarHBondContact O-N 2.72Å; L77-N79 VanDerWaalsContact C-N 3.34Å; L77-N79 PolarHBondContact O-N 2.78Å; N79-A84 WeakPolarHBondContact OD1-CB 3.49Å
80	Q	58.6	Low	61.1	Low	161 Å²	161	89.3 Å²	89.3	75%	0.752	50%	0.495	S	S	*	.	H	α-helix	trans	-73.3	-31.2	177.2	-72.6	179.7	-7.4	0	0	113.3	M76 L77	M76-Q80 WeakPolarHBondContact O-CG 3.4Å; M76-Q80 PolarHBondContact O-N 3.48Å; M76-Q80 VanDerWaalsContact O-N 3.15Å; L77-Q80 PolarHBondContact O-N 2.73Å
81	T	57	Low	60.9	Low	92 Å²	92	87.4 Å²	87.4	56%	0.564	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-2	179.7	56	0	0	0	0	114.2	L77 A78 E83	L77-T81 PolarHBondContact O-N 3.06Å; L77-T81 VanDerWaalsContact O-N 3.1Å; L77-T81 PolarHBondContact O-OG1 2.9Å; A78-T81 PolarHBondContact O-OG1 3.29Å; T81-E83 PolarHBondContact O-N 3.27Å
82	G	49.3	Very low	60.9	Low	61 Å²	61	85 Å²	85	63%	0.629	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	7.5	-176.5	0	0	0	0	0	114.4	A78 A84	A78-G82 PolarHBondContact O-N 2.76Å; G82-A84 VanDerWaalsContact C-N 3.26Å; G82-A84 PolarHBondContact O-N 2.77Å
83	E	51.9	Low	61.4	Low	105 Å²	105	82.2 Å²	82.2	49%	0.491	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-74.9	-15.8	177.3	-71.3	-171.5	149.6	0	0	113	R68 A78 T81 G85 R86	R68-E83 IonicContact NH1-OE2 2.75Å; R68-E83 PolarHBondContact NH1-OE2 2.77Å; A78-E83 PolarHBondContact O-N 3.37Å; T81-E83 PolarHBondContact O-N 3.27Å; E83-G85 PolarHBondContact O-N 3.16Å; E83-G85 VanDerWaalsContact O-N 3.12Å; E83-R86 PolarHBondContact O-N 3.31Å; E83-R86 VanDerWaalsContact O-N 3.17Å
84	A	45.7	Very low	62.2	Low	36 Å²	36	82 Å²	82	30%	0.298	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-55.4	-28.8	179.1	0	0	0	0	0	114	A78 N79 G82 R86	A78-A84 PolarHBondContact O-N 2.75Å; N79-A84 WeakPolarHBondContact OD1-CB 3.49Å; G82-A84 VanDerWaalsContact C-N 3.26Å; G82-A84 PolarHBondContact O-N 2.77Å; A84-R86 VanDerWaalsContact C-N 3.26Å; A84-R86 PolarHBondContact O-N 3.01Å
85	G	41.4	Very low	63.3	Low	75 Å²	75	82.6 Å²	82.6	77%	0.773	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-74	-2.5	180	0	0	0	0	0	116	E83	E83-G85 PolarHBondContact O-N 3.16Å; E83-G85 VanDerWaalsContact O-N 3.12Å
86	R	47.3	Very low	64.7	Low	233 Å²	233	83.1 Å²	83.1	88%	0.879	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-106.3	1.1	179.7	-76.6	-176.6	175.6	-179.5	-0.5	114.6	E83 A84 S88	E83-R86 PolarHBondContact O-N 3.31Å; E83-R86 VanDerWaalsContact O-N 3.17Å; A84-R86 VanDerWaalsContact C-N 3.26Å; A84-R86 PolarHBondContact O-N 3.01Å; R86-S88 PolarHBondContact O-N 3.39Å
87	L	52.3	Low	66.1	Low	72 Å²	72	83.3 Å²	83.3	38%	0.377	46%	0.461	S	S	.	.	S	Bend	trans	-73.3	118	171.6	-81.6	142	0	0	0	108.7	K65 N89	K65-L87 HydrophobicContact CB-CD2 4.39Å; L87-N89 PolarHBondContact O-N 3.07Å
88	S	54	Low	67.7	Low	48 Å²	48	81.7 Å²	81.7	34%	0.336	46%	0.456	S	S	.	.			trans	-65.9	131.4	177.3	57	0	0	0	0	110.5	R86 I90 R101	R86-S88 PolarHBondContact O-N 3.39Å; S88-I90 PolarHBondContact O-N 2.9Å; S88-R101 PolarHBondContact OG-NH1 3.1Å
89	N	58.7	Low	69.4	Low	175 Å²	175	81.5 Å²	81.5	94%	0.936	45%	0.454	S	S	*	.	S	Bend	trans	-61.6	6.8	173.7	-74.7	-13.5	0	0	0	115	L87 S91	L87-N89 PolarHBondContact O-N 3.07Å; N89-S91 PolarHBondContact O-N 2.98Å
90	I	62.8	Low	71.1	Confident	53 Å²	53	82.1 Å²	82.1	27%	0.272	46%	0.456	S	S	.	.			trans	-83.4	117	-178.5	-62.1	174.2	0	0	0	108.3	S88 Y95	S88-I90 PolarHBondContact O-N 2.9Å; I90-Y95 HydrophobicContact CG2-CD1 3.92Å; I90-Y95 HydrophobicContact CG2-CD2 3.66Å; I90-Y95 HydrophobicContact CG2-CE1 4.42Å; I90-Y95 HydrophobicContact CG2-CE2 4.19Å; I90-Y95 HydrophobicContact CG2-CG 3.49Å; I90-Y95 VanDerWaalsContact CG2-CG 3.49Å
91	S	80.6	Confident	72.8	Confident	43 Å²	43	78.2 Å²	78.2	30%	0.301	44%	0.435	S	S	.	.			trans	-55	135.8	174.1	173.3	0	0	0	0	111.4	N89 L93 N94 Y95	N89-S91 PolarHBondContact O-N 2.98Å; S91-L93 VanDerWaalsContact C-N 3.33Å; S91-L93 PolarHBondContact OG-N 2.88Å; S91-N94 WeakPolarHBondContact CB-OD1 3.42Å; S91-N94 PolarHBondContact OG-N 2.88Å; S91-N94 PolarHBondContact OG-OD1 3.22Å; S91-Y95 VanDerWaalsContact O-CB 3.3Å; S91-Y95 WeakPolarHBondContact O-CB 3.44Å
92	H	83.1	Confident	74.6	Confident	13 Å²	13	73.9 Å²	73.9	6%	0.06	41%	0.408	C	S	.	.	S	Bend	trans	-87.9	1.2	175.7	63.7	-72.8	0	0	0	113.9	L66 Y70 R124 D324	L66-H92 HydrophobicContact CD1-CB 4.46Å; L66-H92 WeakPolarHBondContact CD1-CD2 3.49Å; Y70-H92 AromaticContact CE2-CE1 3.74Å; Y70-H92 AromaticContact CE2-NE2 3.88Å; Y70-H92 AromaticContact CZ-CE1 3.97Å; Y70-H92 PolarHBondContact OH-CE1 2.63Å; Y70-H92 VanDerWaalsContact OH-CE1 3.25Å; H92-R124 CarbonylContact C-O 3.5Å; H92-R124 WeakPolarHBondContact O-CA 3.23Å; H92-D324 PolarHBondContact NE2-O 3.32Å
93	L	87.2	Confident	76.8	Confident	36 Å²	36	74.3 Å²	74.3	19%	0.188	40%	0.399	C	S	.	.	S	Bend	trans	-114.2	-29.7	-173.5	-57.2	177.9	0	0	0	114	S91 R124 R126 D324	S91-L93 VanDerWaalsContact C-N 3.33Å; S91-L93 PolarHBondContact OG-N 2.88Å; L93-R124 CarbonylContact C-O 3.48Å; L93-R124 PolarHBondContact N-O 3.45Å; L93-R126 HydrophobicContact CB-CG 4.47Å; L93-R126 HydrophobicContact CD2-CG 4.47Å; L93-R126 VanDerWaalsContact CD2-CZ 3.47Å; L93-R126 WeakPolarHBondContact O-CG 3.48Å; L93-R126 PolarHBondContact O-N 3.27Å; L93-R126 VanDerWaalsContact O-N 3.14Å; L93-D324 HydrophobicContact CD1-CB 4.25Å; L93-D324 HydrophobicContact CD2-CB 4.26Å; L93-D324 WeakPolarHBondContact CD2-OD1 3.13Å
94	N	91.8	Very high	78.8	Confident	94 Å²	94	73.9 Å²	73.9	50%	0.503	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-137.6	16.5	-171.8	66.1	-1.9	0	0	0	114.4	S91 C96 R124 N127	S91-N94 WeakPolarHBondContact CB-OD1 3.42Å; S91-N94 PolarHBondContact OG-N 2.88Å; S91-N94 PolarHBondContact OG-OD1 3.22Å; N94-C96 PolarHBondContact O-N 3.49Å; N94-R124 PolarHBondContact N-O 3.13Å; N94-R124 VanDerWaalsContact N-O 3.11Å; N94-N127 WeakPolarHBondContact CA-OD1 3.13Å; N94-N127 HydrophobicContact CB-CB 4.35Å
95	Y	94	Very high	81	Confident	63 Å²	63	74.9 Å²	74.9	25%	0.247	41%	0.41	C	S	.	.			trans	-88.2	106.7	173.3	-177.3	-94	0	0	0	109.4	I90 S91 E97 D99 R124 C125	I90-Y95 HydrophobicContact CG2-CD1 3.92Å; I90-Y95 HydrophobicContact CG2-CD2 3.66Å; I90-Y95 HydrophobicContact CG2-CE1 4.42Å; I90-Y95 HydrophobicContact CG2-CE2 4.19Å; I90-Y95 HydrophobicContact CG2-CG 3.49Å; I90-Y95 VanDerWaalsContact CG2-CG 3.49Å; S91-Y95 VanDerWaalsContact O-CB 3.3Å; S91-Y95 WeakPolarHBondContact O-CB 3.44Å; Y95-E97 WeakPolarHBondContact CD1-O 3.34Å; Y95-E97 HydrophobicContact CE1-CB 4.13Å; Y95-E97 WeakPolarHBondContact CE1-O 3.5Å; Y95-E97 HydrophobicContact CE2-CB 4.28Å; Y95-D99 HydrophobicContact CE1-CB 4.22Å; Y95-R124 HydrophobicContact CD1-CB 4.41Å; Y95-R124 PolarHBondContact N-O 3.23Å; Y95-R124 VanDerWaalsContact N-O 3.11Å; Y95-R124 CarbonylContact O-C 3.39Å; Y95-C125 WeakPolarHBondContact O-CB 3.04Å; Y95-C125 PolarHBondContact O-N 3.41Å
96	C	94.3	Very high	83.6	Confident	54 Å²	54	71.6 Å²	71.6	37%	0.365	38%	0.375	S	S	.	.			trans	-110.7	-2.8	-171.2	-61.3	0	0	0	0	115	N94 C125 N127	N94-C96 PolarHBondContact O-N 3.49Å; C96-C125 HydrophobicContact CB-CB 3.83Å; C96-C125 WeakPolarHBondContact CB-SG 3.27Å; C96-C125 WeakPolarHBondContact SG-CB 3.44Å; C96-C125 CovalentContact SG-SG 2.04Å; C96-C125 PolarHBondContact SG-SG 2.87Å; C96-N127 PolarHBondContact SG-OD1 2.99Å
97	E	95.3	Very high	85.9	Confident	134 Å²	134	65.8 Å²	65.8	63%	0.626	37%	0.365	S	S	*	.	S	Bend	trans	-71.6	154	163.3	-66.8	-178.3	178	0	0	109.8	Y95 D99	Y95-E97 WeakPolarHBondContact CD1-O 3.34Å; Y95-E97 HydrophobicContact CE1-CB 4.13Å; Y95-E97 WeakPolarHBondContact CE1-O 3.5Å; Y95-E97 HydrophobicContact CE2-CB 4.28Å; E97-D99 PolarHBondContact O-N 2.92Å
98	P	96.5	Very high	87.9	Confident	51 Å²	51	64.1 Å²	64.1	33%	0.331	37%	0.365	S	S	.	.			trans	-58.8	124.1	175.8	-20.5	30.7	0	0	0	111.6	L100 L121 Y122	P98-L100 VanDerWaalsContact C-N 3.35Å; P98-L100 HydrophobicContact CB-CD2 4.2Å; P98-L100 PolarHBondContact O-N 3.3Å; P98-L121 HydrophobicContact CB-CB 4.47Å; P98-L121 HydrophobicContact CB-CD2 4.12Å; P98-Y122 HydrophobicContact CB-CE1 4.45Å; P98-Y122 HydrophobicContact CG-CE1 3.98Å
99	D	95.8	Very high	89.9	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	35%	0.353	C	S	.	.			trans	-76.4	83.9	173.9	-172.3	-4.8	0	0	0	110.3	Y95 E97 R101 V102 L121 R124	Y95-D99 HydrophobicContact CE1-CB 4.22Å; E97-D99 PolarHBondContact O-N 2.92Å; D99-R101 PolarHBondContact O-N 2.64Å; D99-R101 VanDerWaalsContact OD1-CB 3.3Å; D99-R101 WeakPolarHBondContact OD1-CB 3.07Å; D99-R101 WeakPolarHBondContact OD1-CG 3.5Å; D99-R101 IonicContact OD1-CZ 2.67Å; D99-R101 PolarHBondContact OD1-N 3.28Å; D99-R101 IonicContact OD1-NE 3.55Å; D99-R101 PolarHBondContact OD1-NE 3.27Å; D99-R101 IonicContact OD1-NH2 2.72Å; D99-R101 IonicContact OD2-CZ 2.96Å; D99-R101 IonicContact OD2-NE 3.64Å; D99-R101 IonicContact OD2-NH2 2.86Å; D99-R101 PolarHBondContact OD2-NH2 3.4Å; D99-V102 HydrophobicContact CB-CG1 4.48Å; D99-V102 WeakPolarHBondContact O-CG1 3.48Å; D99-V102 VanDerWaalsContact O-CG2 3.24Å; D99-V102 WeakPolarHBondContact O-CG2 3.34Å; D99-V102 PolarHBondContact O-N 3.1Å; D99-V102 VanDerWaalsContact O-N 3.16Å; D99-L121 PolarHBondContact N-O 2.89Å; D99-R124 IonicContact OD2-CZ 2.61Å; D99-R124 IonicContact OD2-NE 2.73Å; D99-R124 PolarHBondContact OD2-NE 2.83Å; D99-R124 IonicContact OD2-NH2 2.81Å; D99-R124 PolarHBondContact OD2-NH2 2.86Å
100	L	95.5	Very high	91.7	Very high	121 Å²	121	60.3 Å²	60.3	63%	0.634	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.5	-176	-62.4	-178.2	0	0	0	114.1	P98 V102 T103 L121	P98-L100 VanDerWaalsContact C-N 3.35Å; P98-L100 HydrophobicContact CB-CD2 4.2Å; P98-L100 PolarHBondContact O-N 3.3Å; L100-V102 PolarHBondContact O-N 3.47Å; L100-T103 WeakPolarHBondContact O-CB 3.47Å; L100-T103 WeakPolarHBondContact O-CG2 3.46Å; L100-T103 PolarHBondContact O-N 3.06Å; L100-T103 VanDerWaalsContact O-N 3.16Å; L100-T103 PolarHBondContact O-OG1 3.46Å; L100-L121 HydrophobicContact CD2-CD2 4.36Å
101	R	94.3	Very high	93.3	Very high	80 Å²	80	64.8 Å²	64.8	30%	0.302	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-31.7	176.2	-62.6	177.9	-64.4	176.2	1.8	111.7	S88 D99 T103 S104 V105	S88-R101 PolarHBondContact OG-NH1 3.1Å; D99-R101 PolarHBondContact O-N 2.64Å; D99-R101 VanDerWaalsContact OD1-CB 3.3Å; D99-R101 WeakPolarHBondContact OD1-CB 3.07Å; D99-R101 WeakPolarHBondContact OD1-CG 3.5Å; D99-R101 IonicContact OD1-CZ 2.67Å; D99-R101 PolarHBondContact OD1-N 3.28Å; D99-R101 IonicContact OD1-NE 3.55Å; D99-R101 PolarHBondContact OD1-NE 3.27Å; D99-R101 IonicContact OD1-NH2 2.72Å; D99-R101 IonicContact OD2-CZ 2.96Å; D99-R101 IonicContact OD2-NE 3.64Å; D99-R101 IonicContact OD2-NH2 2.86Å; D99-R101 PolarHBondContact OD2-NH2 3.4Å; R101-T103 PolarHBondContact O-N 3.31Å; R101-T103 VanDerWaalsContact O-N 3.14Å; R101-S104 PolarHBondContact O-N 2.66Å; R101-S104 PolarHBondContact O-OG 3.27Å; R101-V105 WeakPolarHBondContact O-CG2 3.41Å; R101-V105 PolarHBondContact O-N 3.26Å; R101-V105 VanDerWaalsContact O-N 3.08Å
102	V	95.5	Very high	94.2	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-57	-30.6	179.4	-55.6	0	0	0	0	112.5	Y58 D99 L100 S104 V106 F109 L120 L121	Y58-V102 HydrophobicContact CE1-CG1 4.28Å; Y58-V102 HydrophobicContact CE2-CG1 4.09Å; Y58-V102 WeakPolarHBondContact OH-CG1 3.45Å; D99-V102 HydrophobicContact CB-CG1 4.48Å; D99-V102 WeakPolarHBondContact O-CG1 3.48Å; D99-V102 VanDerWaalsContact O-CG2 3.24Å; D99-V102 WeakPolarHBondContact O-CG2 3.34Å; D99-V102 PolarHBondContact O-N 3.1Å; D99-V102 VanDerWaalsContact O-N 3.16Å; L100-V102 PolarHBondContact O-N 3.47Å; V102-S104 PolarHBondContact O-N 3.11Å; V102-V106 HydrophobicContact CB-CG2 4.03Å; V102-V106 WeakPolarHBondContact O-CB 3.44Å; V102-V106 VanDerWaalsContact O-CG2 3.28Å; V102-V106 WeakPolarHBondContact O-CG2 3.41Å; V102-V106 PolarHBondContact O-N 3.42Å; V102-F109 HydrophobicContact CB-CE2 4.35Å; V102-F109 HydrophobicContact CG2-CD2 4.18Å; V102-F109 HydrophobicContact CG2-CE2 3.58Å; V102-F109 HydrophobicContact CG2-CZ 3.97Å; V102-L120 HydrophobicContact CB-CB 4.29Å; V102-L120 HydrophobicContact CG1-CB 4.29Å; V102-L120 HydrophobicContact CG2-CB 4.26Å; V102-L121 HydrophobicContact CG2-CD2 3.62Å; V102-L121 HydrophobicContact CG2-CG 4.05Å
103	T	94.8	Very high	94.8	Very high	71 Å²	71	65.4 Å²	65.4	44%	0.436	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-26.5	177.8	70.4	0	0	0	0	112.8	L100 R101 F109	L100-T103 WeakPolarHBondContact O-CB 3.47Å; L100-T103 WeakPolarHBondContact O-CG2 3.46Å; L100-T103 PolarHBondContact O-N 3.06Å; L100-T103 VanDerWaalsContact O-N 3.16Å; L100-T103 PolarHBondContact O-OG1 3.46Å; R101-T103 PolarHBondContact O-N 3.31Å; R101-T103 VanDerWaalsContact O-N 3.14Å; T103-F109 HydrophobicContact CG2-CD1 3.99Å; T103-F109 HydrophobicContact CG2-CE1 3.73Å; T103-F109 HydrophobicContact CG2-CZ 4.25Å
104	S	93	Very high	95.3	Very high	96 Å²	96	68.7 Å²	68.7	67%	0.671	39%	0.386	S	S	*	.	H	α-helix	trans	-96.8	-32	-179.7	68.5	0	0	0	0	113.7	R101 V102	R101-S104 PolarHBondContact O-N 2.66Å; R101-S104 PolarHBondContact O-OG 3.27Å; V102-S104 PolarHBondContact O-N 3.11Å
105	V	93.8	Very high	95.6	Very high	57 Å²	57	69 Å²	69	35%	0.345	38%	0.38	S	S	.	.	H	α-helix	trans	-100	-18.3	-172.8	-56.1	0	0	0	0	114.2	Y58 R101	Y58-V105 HydrophobicContact CD2-CG2 3.78Å; Y58-V105 HydrophobicContact CE2-CG2 3.64Å; R101-V105 WeakPolarHBondContact O-CG2 3.41Å; R101-V105 PolarHBondContact O-N 3.26Å; R101-V105 VanDerWaalsContact O-N 3.08Å
106	V	95.3	Very high	95.8	Very high	6 Å²	6	66 Å²	66	4%	0.036	37%	0.369	C	S	.	.	S	Bend	trans	-91.6	110.7	177	-177.2	0	0	0	0	108.8	Y58 V102 G108 F109 L112 L120 V294	Y58-V106 HydrophobicContact CD1-CG2 4.33Å; Y58-V106 HydrophobicContact CD2-CG2 3.6Å; Y58-V106 HydrophobicContact CE2-CG2 4.22Å; Y58-V106 HydrophobicContact CG-CG2 3.67Å; V102-V106 HydrophobicContact CB-CG2 4.03Å; V102-V106 WeakPolarHBondContact O-CB 3.44Å; V102-V106 VanDerWaalsContact O-CG2 3.28Å; V102-V106 WeakPolarHBondContact O-CG2 3.41Å; V102-V106 PolarHBondContact O-N 3.42Å; V106-G108 PolarHBondContact O-N 3.42Å; V106-F109 HydrophobicContact CB-CB 4.23Å; V106-F109 HydrophobicContact CB-CD2 4.23Å; V106-F109 HydrophobicContact CG1-CD2 4.48Å; V106-F109 WeakPolarHBondContact O-CB 3.35Å; V106-F109 PolarHBondContact O-N 2.87Å; V106-F109 VanDerWaalsContact O-N 3.11Å; V106-L112 HydrophobicContact CG1-CD1 3.96Å; V106-L120 HydrophobicContact CG1-CD1 4.15Å; V106-L120 HydrophobicContact CG2-CD1 4.24Å; V106-V294 HydrophobicContact CG1-CG2 4.49Å
107	T	94.4	Very high	96	Very high	111 Å²	111	65.7 Å²	65.7	68%	0.681	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	122.4	178.5	-54.3	0	0	0	0	110.8	F109 V294	T107-F109 VanDerWaalsContact C-N 3.34Å; T107-F109 PolarHBondContact O-N 3.37Å; T107-V294 HydrophobicContact CG2-CG1 4.46Å
108	G	94.8	Very high	96.1	Very high	37 Å²	37	62 Å²	62	38%	0.381	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	24.5	178.1	0	0	0	0	0	114.8	V106 N110 N111	V106-G108 PolarHBondContact O-N 3.42Å; G108-N110 PolarHBondContact O-N 3.46Å; G108-N110 VanDerWaalsContact O-N 3.13Å; G108-N111 WeakPolarHBondContact O-CB 3.48Å; G108-N111 PolarHBondContact O-N 3.3Å
109	F	96.9	Very high	96.2	Very high	16 Å²	16	60 Å²	60	7%	0.07	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-44.8	-45.4	-180	-179	-97.2	0	0	0	114	V102 T103 V106 T107 N111 L112 K117 L120 L121	V102-F109 HydrophobicContact CB-CE2 4.35Å; V102-F109 HydrophobicContact CG2-CD2 4.18Å; V102-F109 HydrophobicContact CG2-CE2 3.58Å; V102-F109 HydrophobicContact CG2-CZ 3.97Å; T103-F109 HydrophobicContact CG2-CD1 3.99Å; T103-F109 HydrophobicContact CG2-CE1 3.73Å; T103-F109 HydrophobicContact CG2-CZ 4.25Å; V106-F109 HydrophobicContact CB-CB 4.23Å; V106-F109 HydrophobicContact CB-CD2 4.23Å; V106-F109 HydrophobicContact CG1-CD2 4.48Å; V106-F109 WeakPolarHBondContact O-CB 3.35Å; V106-F109 PolarHBondContact O-N 2.87Å; V106-F109 VanDerWaalsContact O-N 3.11Å; T107-F109 VanDerWaalsContact C-N 3.34Å; T107-F109 PolarHBondContact O-N 3.37Å; F109-N111 PolarHBondContact O-N 2.93Å; F109-N111 VanDerWaalsContact O-N 3.16Å; F109-L112 HydrophobicContact CD2-CD1 4.27Å; F109-L112 WeakPolarHBondContact O-CB 3.43Å; F109-L112 PolarHBondContact O-N 2.8Å; F109-K117 HydrophobicContact CE1-CB 4.4Å; F109-K117 HydrophobicContact CE1-CD 4.3Å; F109-K117 HydrophobicContact CE1-CG 4.05Å; F109-K117 HydrophobicContact CE2-CB 4.15Å; F109-K117 HydrophobicContact CE2-CG 4.09Å; F109-K117 HydrophobicContact CZ-CB 3.71Å; F109-K117 HydrophobicContact CZ-CD 4.42Å; F109-K117 HydrophobicContact CZ-CG 3.74Å; F109-L120 HydrophobicContact CD2-CD1 4.08Å; F109-L120 HydrophobicContact CE2-CB 4.29Å; F109-L120 HydrophobicContact CE2-CD1 4.04Å; F109-L121 HydrophobicContact CZ-CD1 4.28Å; F109-L121 HydrophobicContact CZ-CD2 4.47Å; F109-L121 HydrophobicContact CZ-CG 4.19Å
110	N	96.8	Very high	96.3	Very high	127 Å²	127	59.9 Å²	59.9	68%	0.679	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-62	-25.8	-178.6	-67.7	-18.4	0	0	0	113.5	G108 K117	G108-N110 PolarHBondContact O-N 3.46Å; G108-N110 VanDerWaalsContact O-N 3.13Å; N110-K117 PolarHBondContact O-NZ 3.26Å
111	N	96.8	Very high	96.4	Very high	146 Å²	146	55.5 Å²	55.5	78%	0.781	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-90.1	-3.7	-179.4	-59	-27.3	0	0	0	112.9	G108 F109	G108-N111 WeakPolarHBondContact O-CB 3.48Å; G108-N111 PolarHBondContact O-N 3.3Å; F109-N111 PolarHBondContact O-N 2.93Å; F109-N111 VanDerWaalsContact O-N 3.16Å
112	L	97.4	Very high	96.6	Very high	15 Å²	15	56.1 Å²	56.1	8%	0.079	31%	0.311	C	S	.	.	S	Bend	trans	-74.1	145.9	177.9	-63.3	179.2	0	0	0	110.7	V106 F109 F116 K117 L120 P292 V294 V295	V106-L112 HydrophobicContact CG1-CD1 3.96Å; F109-L112 HydrophobicContact CD2-CD1 4.27Å; F109-L112 WeakPolarHBondContact O-CB 3.43Å; F109-L112 PolarHBondContact O-N 2.8Å; L112-F116 HydrophobicContact CB-CB 4.08Å; L112-F116 HydrophobicContact CD1-CB 4.28Å; L112-K117 HydrophobicContact CB-CG 4.37Å; L112-K117 WeakPolarHBondContact O-CE 3.42Å; L112-K117 PolarHBondContact O-NZ 3.09Å; L112-L120 HydrophobicContact CD1-CD1 3.76Å; L112-P292 HydrophobicContact CD2-CB 4.21Å; L112-P292 HydrophobicContact CD2-CG 3.85Å; L112-V294 HydrophobicContact CD2-CG2 4.17Å; L112-V295 HydrophobicContact CD1-CG2 4.39Å
113	P	97.6	Very high	96.7	Very high	55 Å²	55	56.3 Å²	56.3	36%	0.357	31%	0.312	S	S	.	.			trans	-57	148.2	167.6	-22	31.2	0	0	0	111.5	R115 F116 K117	P113-R115 VanDerWaalsContact C-N 3.28Å; P113-R115 HydrophobicContact CB-CG 4.28Å; P113-R115 PolarHBondContact O-N 3.07Å; P113-F116 HydrophobicContact CB-CD2 4.08Å; P113-F116 HydrophobicContact CG-CD2 3.99Å; P113-F116 HydrophobicContact CG-CE2 4.32Å; P113-F116 WeakPolarHBondContact O-CB 3.15Å; P113-F116 PolarHBondContact O-N 3.07Å; P113-K117 PolarHBondContact O-N 3.39Å
114	D	97.3	Very high	96.7	Very high	105 Å²	105	53.5 Å²	53.5	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-61	-34.3	-170.1	-60.9	-31.3	0	0	0	113.7	F116 K117 D118	D114-F116 PolarHBondContact O-N 2.97Å; D114-F116 VanDerWaalsContact O-N 3.12Å; D114-K117 WeakPolarHBondContact O-CA 3.19Å; D114-K117 WeakPolarHBondContact O-CB 3.47Å; D114-K117 PolarHBondContact O-N 3.33Å; D114-K117 IonicContact OD1-NZ 3.98Å; D114-K117 PolarHBondContact OD1-NZ 3.08Å; D114-D118 PolarHBondContact O-N 3.09Å
115	R	96.9	Very high	97	Very high	101 Å²	101	49.1 Å²	49.1	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-53.7	-33.2	171.8	64.5	-179.9	-176.2	-157.9	3.3	113.7	P113 F119 F218	P113-R115 VanDerWaalsContact C-N 3.28Å; P113-R115 HydrophobicContact CB-CG 4.28Å; P113-R115 PolarHBondContact O-N 3.07Å; R115-F119 VanDerWaalsContact O-CB 3.23Å; R115-F119 WeakPolarHBondContact O-CB 3.39Å; R115-F119 PolarHBondContact O-N 3.26Å; R115-F218 HydrophobicContact CB-CD2 4.01Å; R115-F218 HydrophobicContact CB-CE2 4.16Å; R115-F218 HydrophobicContact CG-CD2 4.06Å; R115-F218 HydrophobicContact CG-CE2 3.68Å; R115-F218 HydrophobicContact CG-CZ 4.11Å; R115-F218 WeakPolarHBondContact O-CD2 3.04Å
116	F	98.3	Very high	97.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-77.8	-38.4	174.5	-75.1	-78.2	0	0	0	112	L112 P113 D114 F119 L120 F218 Y290 I291 P292 V295	L112-F116 HydrophobicContact CB-CB 4.08Å; L112-F116 HydrophobicContact CD1-CB 4.28Å; P113-F116 HydrophobicContact CB-CD2 4.08Å; P113-F116 HydrophobicContact CG-CD2 3.99Å; P113-F116 HydrophobicContact CG-CE2 4.32Å; P113-F116 WeakPolarHBondContact O-CB 3.15Å; P113-F116 PolarHBondContact O-N 3.07Å; D114-F116 PolarHBondContact O-N 2.97Å; D114-F116 VanDerWaalsContact O-N 3.12Å; F116-F119 PolarHBondContact O-N 3.12Å; F116-L120 WeakPolarHBondContact O-CB 3.37Å; F116-L120 WeakPolarHBondContact O-CD1 3.44Å; F116-L120 WeakPolarHBondContact O-CG 3.4Å; F116-L120 PolarHBondContact O-N 3.16Å; F116-F218 AromaticContact CD1-CE2 3.59Å; F116-F218 HydrophobicContact CD1-CE2 3.59Å; F116-F218 HydrophobicContact CD1-CZ 4.29Å; F116-F218 AromaticContact CD2-CE2 3.97Å; F116-F218 HydrophobicContact CD2-CE2 3.97Å; F116-F218 HydrophobicContact CD2-CZ 4.41Å; F116-F218 AromaticContact CE1-CE2 3.44Å; F116-F218 HydrophobicContact CE1-CE2 3.44Å; F116-F218 VanDerWaalsContact CE1-CE2 3.44Å; F116-F218 AromaticContact CE1-CZ 3.68Å; F116-F218 HydrophobicContact CE1-CZ 3.68Å; F116-F218 AromaticContact CE2-CE2 3.85Å; F116-F218 HydrophobicContact CE2-CE2 3.85Å; F116-F218 AromaticContact CE2-CZ 3.84Å; F116-F218 HydrophobicContact CE2-CZ 3.84Å; F116-F218 AromaticContact CG-CE2 3.84Å; F116-F218 HydrophobicContact CG-CE2 3.84Å; F116-F218 AromaticContact CZ-CE2 3.56Å; F116-F218 HydrophobicContact CZ-CE2 3.56Å; F116-F218 AromaticContact CZ-CZ 3.42Å; F116-F218 HydrophobicContact CZ-CZ 3.42Å; F116-F218 VanDerWaalsContact CZ-CZ 3.42Å; F116-Y290 AromaticContact CE2-CD1 4Å; F116-Y290 HydrophobicContact CE2-CD1 4Å; F116-Y290 HydrophobicContact CE2-CE1 4.21Å; F116-Y290 HydrophobicContact CZ-CD1 4.33Å; F116-Y290 VanDerWaalsContact CZ-O 3.31Å; F116-Y290 WeakPolarHBondContact CZ-O 3.44Å; F116-I291 HydrophobicContact CE1-CD1 4Å; F116-I291 HydrophobicContact CZ-CD1 4.16Å; F116-P292 HydrophobicContact CD1-CG 4.37Å; F116-P292 HydrophobicContact CD2-CG 4.41Å; F116-P292 HydrophobicContact CE1-CG 4.12Å; F116-P292 HydrophobicContact CE2-CG 4.13Å; F116-P292 HydrophobicContact CZ-CG 3.99Å; F116-V295 HydrophobicContact CD1-CG1 4.34Å; F116-V295 HydrophobicContact CD1-CG2 3.98Å; F116-V295 HydrophobicContact CE1-CG1 4.41Å; F116-V295 HydrophobicContact CE1-CG2 4.41Å
117	K	98.3	Very high	97.1	Very high	46 Å²	46	50.3 Å²	50.3	20%	0.2	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-50.4	176.5	-63.7	178.2	-175.6	149.2	0	110	F109 N110 L112 P113 D114 F119 L120 L121	F109-K117 HydrophobicContact CE1-CB 4.4Å; F109-K117 HydrophobicContact CE1-CD 4.3Å; F109-K117 HydrophobicContact CE1-CG 4.05Å; F109-K117 HydrophobicContact CE2-CB 4.15Å; F109-K117 HydrophobicContact CE2-CG 4.09Å; F109-K117 HydrophobicContact CZ-CB 3.71Å; F109-K117 HydrophobicContact CZ-CD 4.42Å; F109-K117 HydrophobicContact CZ-CG 3.74Å; N110-K117 PolarHBondContact O-NZ 3.26Å; L112-K117 HydrophobicContact CB-CG 4.37Å; L112-K117 WeakPolarHBondContact O-CE 3.42Å; L112-K117 PolarHBondContact O-NZ 3.09Å; P113-K117 PolarHBondContact O-N 3.39Å; D114-K117 WeakPolarHBondContact O-CA 3.19Å; D114-K117 WeakPolarHBondContact O-CB 3.47Å; D114-K117 PolarHBondContact O-N 3.33Å; D114-K117 IonicContact OD1-NZ 3.98Å; D114-K117 PolarHBondContact OD1-NZ 3.08Å; K117-F119 PolarHBondContact O-N 2.81Å; K117-L120 PolarHBondContact O-N 2.98Å; K117-L121 WeakPolarHBondContact O-CB 3.48Å; K117-L121 WeakPolarHBondContact O-CD1 3.39Å; K117-L121 VanDerWaalsContact O-CG 3.23Å; K117-L121 WeakPolarHBondContact O-CG 3.41Å; K117-L121 PolarHBondContact O-N 3.16Å
118	D	97.9	Very high	97.3	Very high	56 Å²	56	47.7 Å²	47.7	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-57.5	-50.7	176.4	-70.6	-14.3	0	0	0	111.2	D114 L120 L121 Y122 R214	D114-D118 PolarHBondContact O-N 3.09Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 2.98Å; D118-L121 PolarHBondContact O-N 2.68Å; D118-Y122 WeakPolarHBondContact O-CD2 3.39Å; D118-Y122 PolarHBondContact O-N 3.07Å; D118-R214 IonicContact OD2-CZ 3.97Å; D118-R214 IonicContact OD2-NH1 3.01Å; D118-R214 PolarHBondContact OD2-NH1 3.25Å
119	F	98.4	Very high	97.5	Very high	11 Å²	11	49.6 Å²	49.6	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-56.2	-43.5	178.9	174.6	-93.2	0	0	0	112.6	R115 F116 K117 L123 F218 L328 P330	R115-F119 VanDerWaalsContact O-CB 3.23Å; R115-F119 WeakPolarHBondContact O-CB 3.39Å; R115-F119 PolarHBondContact O-N 3.26Å; F116-F119 PolarHBondContact O-N 3.12Å; K117-F119 PolarHBondContact O-N 2.81Å; F119-L123 HydrophobicContact CE1-CD1 4.05Å; F119-L123 HydrophobicContact CE2-CD1 4.3Å; F119-L123 HydrophobicContact CZ-CD1 3.72Å; F119-L123 WeakPolarHBondContact O-CA 3.36Å; F119-L123 WeakPolarHBondContact O-CB 3.45Å; F119-L123 PolarHBondContact O-N 3.24Å; F119-L123 VanDerWaalsContact O-N 3.1Å; F119-F218 HydrophobicContact CB-CD2 4.1Å; F119-F218 HydrophobicContact CD2-CB 4.37Å; F119-F218 HydrophobicContact CG-CD2 4.46Å; F119-L328 HydrophobicContact CE2-CB 4.39Å; F119-L328 WeakPolarHBondContact CZ-O 3.44Å; F119-P330 HydrophobicContact CD1-CG 3.94Å; F119-P330 HydrophobicContact CD2-CG 4.12Å; F119-P330 HydrophobicContact CE1-CG 3.68Å; F119-P330 HydrophobicContact CE2-CB 4.48Å; F119-P330 HydrophobicContact CE2-CG 3.87Å; F119-P330 HydrophobicContact CG-CG 4.16Å; F119-P330 VanDerWaalsContact CZ-CD 3.41Å; F119-P330 HydrophobicContact CZ-CG 3.64Å
120	L	98.2	Very high	97.6	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-71.8	-42	-179.1	-69.1	166.8	0	0	0	112	Y58 V102 V106 F109 L112 F116 K117 D118 Y122 V295	Y58-L120 HydrophobicContact CD1-CD2 3.34Å; Y58-L120 HydrophobicContact CE1-CD2 3.63Å; Y58-L120 HydrophobicContact CG-CD2 4.23Å; V102-L120 HydrophobicContact CB-CB 4.29Å; V102-L120 HydrophobicContact CG1-CB 4.29Å; V102-L120 HydrophobicContact CG2-CB 4.26Å; V106-L120 HydrophobicContact CG1-CD1 4.15Å; V106-L120 HydrophobicContact CG2-CD1 4.24Å; F109-L120 HydrophobicContact CD2-CD1 4.08Å; F109-L120 HydrophobicContact CE2-CB 4.29Å; F109-L120 HydrophobicContact CE2-CD1 4.04Å; L112-L120 HydrophobicContact CD1-CD1 3.76Å; F116-L120 WeakPolarHBondContact O-CB 3.37Å; F116-L120 WeakPolarHBondContact O-CD1 3.44Å; F116-L120 WeakPolarHBondContact O-CG 3.4Å; F116-L120 PolarHBondContact O-N 3.16Å; K117-L120 PolarHBondContact O-N 2.98Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 2.98Å; L120-Y122 VanDerWaalsContact C-N 3.33Å; L120-Y122 PolarHBondContact O-N 2.92Å; L120-V295 HydrophobicContact CD1-CG2 4.49Å
121	L	98.1	Very high	97.6	Very high	28 Å²	28	49.4 Å²	49.4	15%	0.147	25%	0.25	C	S	.	.	H	α-helix	trans	-64.3	-36.8	-179.3	-74.3	166	0	0	0	112.2	P98 D99 L100 V102 F109 K117 D118	P98-L121 HydrophobicContact CB-CB 4.47Å; P98-L121 HydrophobicContact CB-CD2 4.12Å; D99-L121 PolarHBondContact N-O 2.89Å; L100-L121 HydrophobicContact CD2-CD2 4.36Å; V102-L121 HydrophobicContact CG2-CD2 3.62Å; V102-L121 HydrophobicContact CG2-CG 4.05Å; F109-L121 HydrophobicContact CZ-CD1 4.28Å; F109-L121 HydrophobicContact CZ-CD2 4.47Å; F109-L121 HydrophobicContact CZ-CG 4.19Å; K117-L121 WeakPolarHBondContact O-CB 3.48Å; K117-L121 WeakPolarHBondContact O-CD1 3.39Å; K117-L121 VanDerWaalsContact O-CG 3.23Å; K117-L121 WeakPolarHBondContact O-CG 3.41Å; K117-L121 PolarHBondContact O-N 3.16Å; D118-L121 PolarHBondContact O-N 2.68Å
122	Y	97.9	Very high	97.7	Very high	94 Å²	94	44 Å²	44	37%	0.369	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	13.7	-175.3	-60.5	-72.1	0	0	0	114.2	P98 D118 L120 R124 C125	P98-Y122 HydrophobicContact CB-CE1 4.45Å; P98-Y122 HydrophobicContact CG-CE1 3.98Å; D118-Y122 WeakPolarHBondContact O-CD2 3.39Å; D118-Y122 PolarHBondContact O-N 3.07Å; L120-Y122 VanDerWaalsContact C-N 3.33Å; L120-Y122 PolarHBondContact O-N 2.92Å; Y122-R124 PolarHBondContact O-N 2.88Å; Y122-C125 PolarHBondContact O-N 3.37Å
123	L	97.5	Very high	97.8	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.016	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.8	-178.1	-179.5	60.6	0	0	0	114.3	Y58 F119 H327 L328	Y58-L123 HydrophobicContact CE1-CD2 3.87Å; F119-L123 HydrophobicContact CE1-CD1 4.05Å; F119-L123 HydrophobicContact CE2-CD1 4.3Å; F119-L123 HydrophobicContact CZ-CD1 3.72Å; F119-L123 WeakPolarHBondContact O-CA 3.36Å; F119-L123 WeakPolarHBondContact O-CB 3.45Å; F119-L123 PolarHBondContact O-N 3.24Å; F119-L123 VanDerWaalsContact O-N 3.1Å; L123-H327 HydrophobicContact CD1-CB 4.49Å; L123-L328 HydrophobicContact CD1-CB 3.98Å
124	R	96.2	Very high	97.8	Very high	12 Å²	12	44.4 Å²	44.4	5%	0.045	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	1.8	-174.6	-57.3	-175.5	-169.9	-81.6	-10.5	114	E62 H92 L93 N94 Y95 D99 Y122	E62-R124 IonicContact OE2-CZ 3.09Å; E62-R124 IonicContact OE2-NH1 3.12Å; E62-R124 IonicContact OE2-NH2 2.72Å; E62-R124 PolarHBondContact OE2-NH2 3.03Å; H92-R124 CarbonylContact C-O 3.5Å; H92-R124 WeakPolarHBondContact O-CA 3.23Å; L93-R124 CarbonylContact C-O 3.48Å; L93-R124 PolarHBondContact N-O 3.45Å; N94-R124 PolarHBondContact N-O 3.13Å; N94-R124 VanDerWaalsContact N-O 3.11Å; Y95-R124 HydrophobicContact CD1-CB 4.41Å; Y95-R124 PolarHBondContact N-O 3.23Å; Y95-R124 VanDerWaalsContact N-O 3.11Å; Y95-R124 CarbonylContact O-C 3.39Å; D99-R124 IonicContact OD2-CZ 2.61Å; D99-R124 IonicContact OD2-NE 2.73Å; D99-R124 PolarHBondContact OD2-NE 2.83Å; D99-R124 IonicContact OD2-NH2 2.81Å; D99-R124 PolarHBondContact OD2-NH2 2.86Å; Y122-R124 PolarHBondContact O-N 2.88Å
125	C	97.4	Very high	97.8	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.027	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-106.6	116.3	179	-170.6	0	0	0	0	110.3	Y95 C96 Y122 Y128	Y95-C125 WeakPolarHBondContact O-CB 3.04Å; Y95-C125 PolarHBondContact O-N 3.41Å; C96-C125 HydrophobicContact CB-CB 3.83Å; C96-C125 WeakPolarHBondContact CB-SG 3.27Å; C96-C125 WeakPolarHBondContact SG-CB 3.44Å; C96-C125 CovalentContact SG-SG 2.04Å; C96-C125 PolarHBondContact SG-SG 2.87Å; Y122-C125 PolarHBondContact O-N 3.37Å; C125-Y128 HydrophobicContact CB-CE2 4.4Å; C125-Y128 VanDerWaalsContact SG-CZ 3.54Å
126	R	96.9	Very high	97.9	Very high	11 Å²	11	44.7 Å²	44.7	4%	0.042	23%	0.233	C	C	.	.			trans	-140.3	4.1	175.1	62.2	178.2	82.1	177.6	-2.7	114.3	L93 Y128 L222 L226 T323 V326 L328	L93-R126 HydrophobicContact CB-CG 4.47Å; L93-R126 HydrophobicContact CD2-CG 4.47Å; L93-R126 VanDerWaalsContact CD2-CZ 3.47Å; L93-R126 WeakPolarHBondContact O-CG 3.48Å; L93-R126 PolarHBondContact O-N 3.27Å; L93-R126 VanDerWaalsContact O-N 3.14Å; R126-Y128 VanDerWaalsContact C-N 3.27Å; R126-Y128 PolarHBondContact O-N 2.76Å; R126-L222 HydrophobicContact CB-CD1 3.65Å; R126-L226 WeakPolarHBondContact O-CD2 3.38Å; R126-T323 PolarHBondContact NH1-O 3.36Å; R126-V326 PolarHBondContact NH2-O 3.48Å; R126-L328 HydrophobicContact CB-CD1 4.49Å
127	N	95.6	Very high	97.9	Very high	78 Å²	78	45.9 Å²	45.9	42%	0.417	24%	0.238	S	C	.	.			trans	-89.8	43.7	-178.1	62.7	-45.2	0	0	0	112.8	N94 C96	N94-N127 WeakPolarHBondContact CA-OD1 3.13Å; N94-N127 HydrophobicContact CB-CB 4.35Å; C96-N127 PolarHBondContact SG-OD1 2.99Å
128	Y	98.3	Very high	97.9	Very high	56 Å²	56	44.6 Å²	44.6	22%	0.22	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72.6	140.8	178.4	-64.6	-84.1	0	0	0	111.8	C125 R126 N212 L222 R229	C125-Y128 HydrophobicContact CB-CE2 4.4Å; C125-Y128 VanDerWaalsContact SG-CZ 3.54Å; R126-Y128 VanDerWaalsContact C-N 3.27Å; R126-Y128 PolarHBondContact O-N 2.76Å; Y128-N212 WeakPolarHBondContact CD1-O 3.05Å; Y128-L222 HydrophobicContact CD2-CD1 3.95Å; Y128-L222 HydrophobicContact CD2-CD2 3.55Å; Y128-L222 HydrophobicContact CD2-CG 4.26Å; Y128-L222 HydrophobicContact CE2-CD1 4.21Å; Y128-L222 HydrophobicContact CE2-CD2 3.35Å; Y128-L222 HydrophobicContact CE2-CG 4.39Å; Y128-R229 PolarHBondContact O-NH2 3.31Å
129	S	98.2	Very high	97.8	Very high	76 Å²	76	46 Å²	46	53%	0.531	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-72.4	146.4	-179.3	-53.7	0	0	0	0	112.1	W211 N212	S129-W211 CarbonylContact O-C 2.96Å; S129-W211 VanDerWaalsContact O-CA 3.32Å; S129-W211 WeakPolarHBondContact O-CA 3.09Å; S129-N212 PolarHBondContact O-N 2.94Å
130	L	98.7	Very high	97.6	Very high	51 Å²	51	49.8 Å²	49.8	27%	0.267	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.1	167.3	-175.4	65.2	0	0	0	108.2	I132 D133 L209 M210 W211	L130-I132 VanDerWaalsContact CD1-O 3.27Å; L130-I132 WeakPolarHBondContact CD1-O 3.31Å; L130-D133 HydrophobicContact CD2-CB 3.51Å; L130-D133 WeakPolarHBondContact CD2-OD1 3.44Å; L130-D133 HydrophobicContact CG-CB 4.01Å; L130-L209 HydrophobicContact CD1-CB 4.34Å; L130-M210 WeakPolarHBondContact CD1-O 3.27Å; L130-W211 HydrophobicContact CD1-CD2 3.7Å; L130-W211 VanDerWaalsContact CD1-CE2 3.4Å; L130-W211 HydrophobicContact CD1-CE3 4.29Å; L130-W211 HydrophobicContact CD1-CG 4Å; L130-W211 HydrophobicContact CD1-CH2 4.36Å; L130-W211 HydrophobicContact CD1-CZ2 3.78Å
131	L	98.5	Very high	97.6	Very high	88 Å²	88	55 Å²	55	46%	0.461	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-40.3	-176.7	-61.5	-179.6	0	0	0	112.2	M210 N212	L131-M210 PolarHBondContact N-O 3.08Å; L131-N212 HydrophobicContact CD1-CB 3.72Å; L131-N212 HydrophobicContact CD2-CB 3.98Å; L131-N212 HydrophobicContact CG-CB 3.83Å
132	I	98.7	Very high	97.6	Very high	33 Å²	33	53.8 Å²	53.8	17%	0.169	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.8	175.2	-56.4	178.7	0	0	0	106.5	L130 S202 I208 L209 M210	L130-I132 VanDerWaalsContact CD1-O 3.27Å; L130-I132 WeakPolarHBondContact CD1-O 3.31Å; I132-S202 WeakPolarHBondContact CG2-OG 3.46Å; I132-I208 HydrophobicContact CG2-CB 4.47Å; I132-I208 HydrophobicContact CG2-CG2 4.41Å; I132-L209 WeakPolarHBondContact O-CA 3.47Å; I132-M210 HydrophobicContact CB-CB 3.88Å; I132-M210 HydrophobicContact CD1-CB 4.08Å; I132-M210 HydrophobicContact CD1-SD 3.9Å; I132-M210 HydrophobicContact CG1-CB 4.04Å; I132-M210 HydrophobicContact CG1-SD 4.43Å; I132-M210 PolarHBondContact N-O 3.12Å; I132-M210 PolarHBondContact O-N 3.3Å
133	D	98.7	Very high	97.6	Very high	59 Å²	59	50.2 Å²	50.2	32%	0.316	27%	0.273	S	S	.	.			trans	-119	159.1	178.7	-166.5	12.8	0	0	0	110.8	L130 W230	L130-D133 HydrophobicContact CD2-CB 3.51Å; L130-D133 WeakPolarHBondContact CD2-OD1 3.44Å; L130-D133 HydrophobicContact CG-CB 4.01Å; D133-W230 PolarHBondContact OD1-NE1 2.65Å
134	Q	98.4	Very high	97.7	Very high	19 Å²	19	50 Å²	50	9%	0.089	27%	0.272	C	S	.	.			trans	-124.7	70.8	170.6	-52.7	-58.1	-30.2	0	0	108	D136 K137 S202 Q206 I208 L209	Q134-D136 PolarHBondContact O-N 3.34Å; Q134-D136 VanDerWaalsContact O-N 3.16Å; Q134-K137 HydrophobicContact CB-CB 3.97Å; Q134-K137 WeakPolarHBondContact O-CB 3.26Å; Q134-K137 PolarHBondContact O-N 2.91Å; Q134-S202 PolarHBondContact NE2-OG 3.36Å; Q134-Q206 VanDerWaalsContact OE1-CA 3.27Å; Q134-Q206 PolarHBondContact OE1-O 2.88Å; Q134-I208 WeakPolarHBondContact CG-O 3.44Å; Q134-I208 PolarHBondContact NE2-O 3.42Å; Q134-I208 VanDerWaalsContact NE2-O 3.09Å; Q134-L209 HydrophobicContact CB-CD2 4.29Å; Q134-L209 HydrophobicContact CG-CD2 4.17Å
135	P	97.3	Very high	97.8	Very high	80 Å²	80	49.5 Å²	49.5	52%	0.519	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-31.3	-168.1	24.1	-34.7	0	0	0	112.8	K137	P135-K137 VanDerWaalsContact C-N 3.34Å
136	D	97.9	Very high	97.9	Very high	132 Å²	132	49.3 Å²	49.3	71%	0.706	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	4.3	-179.3	-60.9	-41.7	0	0	0	113.6	Q134 C138 A139	Q134-D136 PolarHBondContact O-N 3.34Å; Q134-D136 VanDerWaalsContact O-N 3.16Å; D136-C138 PolarHBondContact O-N 2.65Å; D136-C138 VanDerWaalsContact O-N 3.11Å; D136-A139 HydrophobicContact CB-CB 4.34Å; D136-A139 VanDerWaalsContact O-CB 3.22Å; D136-A139 WeakPolarHBondContact O-CB 3.45Å; D136-A139 PolarHBondContact O-N 3.33Å
137	K	98.3	Very high	98	Very high	26 Å²	26	48.8 Å²	48.8	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.9	-177.2	-179.4	58	58.9	-178.6	0	112.7	Q134 P135 E168 V177 R178 V179 Q206 W230	Q134-K137 HydrophobicContact CB-CB 3.97Å; Q134-K137 WeakPolarHBondContact O-CB 3.26Å; Q134-K137 PolarHBondContact O-N 2.91Å; P135-K137 VanDerWaalsContact C-N 3.34Å; K137-E168 IonicContact NZ-OE1 3.63Å; K137-E168 PolarHBondContact NZ-OE1 2.9Å; K137-E168 IonicContact NZ-OE2 2.82Å; K137-V177 HydrophobicContact CD-CB 3.84Å; K137-V177 HydrophobicContact CD-CG2 4.31Å; K137-V177 HydrophobicContact CG-CB 4.35Å; K137-V177 HydrophobicContact CG-CG2 4.28Å; K137-R178 WeakPolarHBondContact CE-O 3.49Å; K137-V179 HydrophobicContact CD-CG1 4.27Å; K137-V179 HydrophobicContact CG-CG1 3.76Å; K137-Q206 WeakPolarHBondContact CE-O 3.23Å; K137-Q206 PolarHBondContact NZ-O 2.92Å; K137-W230 HydrophobicContact CB-CH2 4.19Å; K137-W230 HydrophobicContact CB-CZ2 4.19Å; K137-W230 HydrophobicContact CG-CH2 4.19Å
138	C	97.9	Very high	98.2	Very high	18 Å²	18	45 Å²	45	12%	0.122	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	23.4	178.8	-58.8	0	0	0	0	113.2	D136 K140 P142 C235	D136-C138 PolarHBondContact O-N 2.65Å; D136-C138 VanDerWaalsContact O-N 3.11Å; C138-K140 CarbonylContact C-O 3.06Å; C138-K140 CarbonylContact O-C 3.53Å; C138-K140 PolarHBondContact O-N 3.46Å; C138-P142 HydrophobicContact CB-CG 4.02Å; C138-C235 HydrophobicContact CB-CB 3.7Å; C138-C235 WeakPolarHBondContact CB-SG 3.32Å; C138-C235 WeakPolarHBondContact SG-CB 3.12Å; C138-C235 CovalentContact SG-SG 2.03Å; C138-C235 PolarHBondContact SG-SG 3.35Å
139	A	96	Very high	98.2	Very high	85 Å²	85	43.1 Å²	43.1	70%	0.702	24%	0.24	S	C	*	.	S	Bend	trans	-54.8	-36.9	175.6	0	0	0	0	0	112.1	D136	D136-A139 HydrophobicContact CB-CB 4.34Å; D136-A139 VanDerWaalsContact O-CB 3.22Å; D136-A139 WeakPolarHBondContact O-CB 3.45Å; D136-A139 PolarHBondContact O-N 3.33Å
140	K	95.6	Very high	98.2	Very high	92 Å²	92	39.7 Å²	39.7	40%	0.4	22%	0.216	S	C	.	.	S	Bend	trans	-95.6	126.1	160.7	-175.3	178	179.5	-170.2	0	108.7	C138 P142 N170 N173 T175	C138-K140 CarbonylContact C-O 3.06Å; C138-K140 CarbonylContact O-C 3.53Å; C138-K140 PolarHBondContact O-N 3.46Å; K140-P142 WeakPolarHBondContact O-CD 3.47Å; K140-N170 VanDerWaalsContact NZ-CG 3.34Å; K140-N170 PolarHBondContact NZ-ND2 3.36Å; K140-N170 PolarHBondContact NZ-OD1 2.93Å; K140-N173 PolarHBondContact NZ-OD1 3.44Å; K140-T175 HydrophobicContact CD-CG2 4.34Å; K140-T175 VanDerWaalsContact CD-OG1 3.29Å; K140-T175 WeakPolarHBondContact CD-OG1 3.14Å; K140-T175 WeakPolarHBondContact CE-OG1 3.08Å; K140-T175 PolarHBondContact NZ-OG1 2.9Å
141	K	97.5	Very high	98.2	Very high	111 Å²	111	39.7 Å²	39.7	48%	0.483	22%	0.216	S	C	.	.			trans	-49	112.9	175.9	-174	-169.2	179	-155.9	0	110.8	D237 E239	K141-D237 HydrophobicContact CD-CB 4.33Å; K141-D237 WeakPolarHBondContact CE-O 3.34Å; K141-D237 HydrophobicContact CG-CB 3.97Å; K141-D237 VanDerWaalsContact CG-O 3.24Å; K141-D237 WeakPolarHBondContact CG-O 3.35Å; K141-E239 IonicContact NZ-OE1 3.7Å; K141-E239 PolarHBondContact NZ-OE1 3.18Å
142	P	98.3	Very high	98.2	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.013	20%	0.195	C	C	.	.			trans	-74.7	145.4	178.9	-15.8	31.1	0	0	0	111.6	C138 K140 T175 V177 T238 E239	C138-P142 HydrophobicContact CB-CG 4.02Å; K140-P142 WeakPolarHBondContact O-CD 3.47Å; P142-T175 CarbonylContact C-O 3.4Å; P142-T175 WeakPolarHBondContact CA-O 3.48Å; P142-V177 HydrophobicContact CB-CG1 4.35Å; P142-V177 HydrophobicContact CB-CG2 3.81Å; P142-V177 HydrophobicContact CG-CG1 4.19Å; P142-V177 HydrophobicContact CG-CG2 3.59Å; P142-T238 WeakPolarHBondContact O-CA 3.33Å; P142-E239 PolarHBondContact O-N 3.22Å
143	F	98.7	Very high	98.2	Very high	18 Å²	18	36.6 Å²	36.6	8%	0.079	20%	0.203	C	C	.	.	S	Bend	trans	-76.4	-41.1	162.2	-177.3	-105	0	0	0	110.5	Q174 T175 E239 F240 L256 L259	F143-Q174 HydrophobicContact CB-CB 3.78Å; F143-Q174 HydrophobicContact CB-CG 4.27Å; F143-Q174 HydrophobicContact CD1-CB 4.03Å; F143-Q174 HydrophobicContact CD1-CG 4.27Å; F143-Q174 HydrophobicContact CD2-CG 4.16Å; F143-Q174 VanDerWaalsContact CE2-NE2 3.29Å; F143-Q174 HydrophobicContact CG-CB 3.86Å; F143-Q174 HydrophobicContact CG-CG 3.97Å; F143-T175 PolarHBondContact N-O 3.24Å; F143-E239 HydrophobicContact CD2-CB 4.25Å; F143-E239 HydrophobicContact CD2-CG 4.45Å; F143-E239 WeakPolarHBondContact CD2-OE2 2.86Å; F143-E239 VanDerWaalsContact CE2-OE2 3.29Å; F143-E239 WeakPolarHBondContact CE2-OE2 3.19Å; F143-F240 HydrophobicContact CE1-CD2 4.35Å; F143-F240 HydrophobicContact CE2-CD2 4.1Å; F143-F240 AromaticContact CE2-CE2 3.85Å; F143-F240 HydrophobicContact CE2-CE2 3.85Å; F143-F240 HydrophobicContact CZ-CD2 4.01Å; F143-F240 AromaticContact CZ-CE2 3.84Å; F143-F240 HydrophobicContact CZ-CE2 3.84Å; F143-F240 PolarHBondContact O-N 3.48Å; F143-L256 HydrophobicContact CD1-CD2 3.72Å; F143-L256 HydrophobicContact CE1-CD2 3.85Å; F143-L259 HydrophobicContact CE1-CB 3.9Å; F143-L259 HydrophobicContact CE1-CD1 3.99Å; F143-L259 HydrophobicContact CZ-CB 3.84Å
144	L	98.9	Very high	98.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	123.8	179.2	179.6	61.9	0	0	0	110.7	L146 T175 V176 V177 F240 F242 T252 I255 L256 L259 L310	L144-L146 HydrophobicContact CD1-CD2 4.41Å; L144-L146 HydrophobicContact CD2-CD2 3.66Å; L144-L146 HydrophobicContact CG-CD2 3.82Å; L144-L146 HydrophobicContact CG-CG 4.48Å; L144-T175 PolarHBondContact N-O 2.9Å; L144-V176 HydrophobicContact CB-CG1 4.39Å; L144-V176 HydrophobicContact CB-CG2 4.26Å; L144-V176 HydrophobicContact CD2-CG1 4.39Å; L144-V176 HydrophobicContact CG-CG1 4.47Å; L144-V176 WeakPolarHBondContact O-CA 3.22Å; L144-V177 PolarHBondContact O-N 3.25Å; L144-F240 HydrophobicContact CD1-CB 4.01Å; L144-F242 HydrophobicContact CD1-CB 4.09Å; L144-T252 HydrophobicContact CD2-CG2 4.33Å; L144-I255 HydrophobicContact CD2-CG2 3.89Å; L144-L256 HydrophobicContact CB-CD2 4.4Å; L144-L256 HydrophobicContact CD2-CD2 4.09Å; L144-L259 HydrophobicContact CD1-CD1 4.2Å; L144-L310 HydrophobicContact CD1-CD1 3.95Å
145	L	98.9	Very high	98.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.9	167.6	172.9	63.3	0	0	0	109.3	V177 V179 F227 W230 V231 T238 F240 V241 F242	L145-V177 HydrophobicContact CB-CG2 4.49Å; L145-V177 HydrophobicContact CD1-CG2 3.68Å; L145-V179 HydrophobicContact CD1-CG2 4.07Å; L145-F227 HydrophobicContact CD2-CE2 4.08Å; L145-F227 HydrophobicContact CD2-CZ 4Å; L145-W230 HydrophobicContact CD1-CZ3 4.44Å; L145-W230 HydrophobicContact CD2-CZ3 4.06Å; L145-V231 HydrophobicContact CD2-CG2 3.96Å; L145-T238 HydrophobicContact CB-CG2 4.3Å; L145-T238 HydrophobicContact CD2-CG2 4.4Å; L145-F240 PolarHBondContact N-O 2.97Å; L145-V241 HydrophobicContact CB-CG2 4.35Å; L145-V241 HydrophobicContact CD2-CG1 4.45Å; L145-V241 HydrophobicContact CD2-CG2 4.3Å; L145-V241 WeakPolarHBondContact O-CA 3.48Å; L145-F242 PolarHBondContact O-N 2.87Å
146	L	98.9	Very high	98.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	110.4	170.8	-56.1	-179	0	0	0	109	L144 V176 V177 R178 V179 F242	L144-L146 HydrophobicContact CD1-CD2 4.41Å; L144-L146 HydrophobicContact CD2-CD2 3.66Å; L144-L146 HydrophobicContact CG-CD2 3.82Å; L144-L146 HydrophobicContact CG-CG 4.48Å; L146-V176 HydrophobicContact CD1-CG1 3.81Å; L146-V176 HydrophobicContact CG-CG1 3.87Å; L146-V177 PolarHBondContact N-O 3.18Å; L146-R178 HydrophobicContact CB-CB 4.34Å; L146-R178 HydrophobicContact CB-CG 4.33Å; L146-R178 CarbonylContact O-C 3.52Å; L146-R178 WeakPolarHBondContact O-CA 3.32Å; L146-V179 PolarHBondContact O-N 3.15Å; L146-F242 HydrophobicContact CD2-CB 3.83Å; L146-F242 HydrophobicContact CD2-CD1 4Å; L146-F242 HydrophobicContact CD2-CG 4.24Å
147	A	98.9	Very high	98.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	107	-179	0	0	0	0	0	110.7	V179 L181 F227 F242 K243 G244	A147-V179 WeakPolarHBondContact CA-O 3.43Å; A147-V179 HydrophobicContact CB-CG2 4.09Å; A147-L181 HydrophobicContact CB-CD1 4.27Å; A147-F227 HydrophobicContact CB-CD2 4.22Å; A147-F227 HydrophobicContact CB-CE1 3.9Å; A147-F227 HydrophobicContact CB-CE2 3.42Å; A147-F227 VanDerWaalsContact CB-CE2 3.42Å; A147-F227 HydrophobicContact CB-CZ 3.23Å; A147-F242 PolarHBondContact N-O 2.95Å; A147-K243 VanDerWaalsContact O-CA 3.3Å; A147-K243 WeakPolarHBondContact O-CA 3.21Å; A147-G244 PolarHBondContact O-N 3.15Å; A147-G244 VanDerWaalsContact O-N 3.11Å
148	I	98.9	Very high	98.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.4	-167.1	-49.8	-50.9	0	0	0	110.7	S150 I161 W165 V179 F180 L181 F242 G244 D246	I148-S150 PolarHBondContact O-N 2.68Å; I148-I161 HydrophobicContact CG2-CD1 4.04Å; I148-W165 HydrophobicContact CD1-CH2 3.57Å; I148-W165 HydrophobicContact CD1-CZ3 3.75Å; I148-W165 HydrophobicContact CG1-CH2 4.01Å; I148-W165 HydrophobicContact CG1-CZ3 4.31Å; I148-V179 PolarHBondContact N-O 3.35Å; I148-F180 HydrophobicContact CB-CD1 3.66Å; I148-F180 HydrophobicContact CB-CE1 3.86Å; I148-F180 HydrophobicContact CG1-CD1 4.43Å; I148-F180 HydrophobicContact CG1-CE1 4.24Å; I148-F180 HydrophobicContact CG2-CD1 3.95Å; I148-F180 HydrophobicContact CG2-CE1 3.95Å; I148-F180 CarbonylContact O-C 3.22Å; I148-F180 VanDerWaalsContact O-CA 3.31Å; I148-F180 WeakPolarHBondContact O-CA 3.38Å; I148-L181 PolarHBondContact O-N 3.12Å; I148-F242 HydrophobicContact CD1-CD1 4.02Å; I148-F242 HydrophobicContact CD1-CE1 3.81Å; I148-G244 CarbonylContact C-O 3.54Å; I148-G244 WeakPolarHBondContact CA-O 3.39Å; I148-D246 HydrophobicContact CG2-CB 3.89Å
149	K	98.8	Very high	98.4	Very high	15 Å²	15	34.2 Å²	34.2	7%	0.065	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.1	173.4	-68.3	178.7	-79.5	164.5	0	109.3	L181 L220 K223 G244 D245 D246 D332	K149-L181 HydrophobicContact CG-CD1 4.48Å; K149-L220 HydrophobicContact CD-CD2 4.4Å; K149-K223 HydrophobicContact CB-CD 4.33Å; K149-K223 HydrophobicContact CG-CD 3.93Å; K149-G244 PolarHBondContact N-O 3.06Å; K149-D245 WeakPolarHBondContact CE-OD1 3.31Å; K149-D245 IonicContact NZ-OD1 3.27Å; K149-D245 PolarHBondContact NZ-OD1 2.86Å; K149-D245 IonicContact NZ-OD2 2.76Å; K149-D246 WeakPolarHBondContact O-CB 3.39Å; K149-D246 PolarHBondContact O-N 2.88Å; K149-D332 IonicContact NZ-OD2 3.12Å; K149-D332 PolarHBondContact NZ-OD2 2.91Å
150	S	98.8	Very high	98.6	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.028	15%	0.153	C	C	.	.			trans	-142	170.1	177.4	-163	0	0	0	0	111.5	I148 R158 L181 K223 D246	I148-S150 PolarHBondContact O-N 2.68Å; S150-R158 PolarHBondContact OG-NH1 3.35Å; S150-R158 VanDerWaalsContact OG-NH1 3.08Å; S150-L181 PolarHBondContact N-O 3.09Å; S150-L181 VanDerWaalsContact N-O 3.12Å; S150-L181 VanDerWaalsContact O-O 3.1Å; S150-K223 PolarHBondContact O-NZ 3.29Å; S150-D246 VanDerWaalsContact CA-OD2 3.31Å; S150-D246 WeakPolarHBondContact CA-OD2 3.49Å; S150-D246 VanDerWaalsContact CB-OD2 3.29Å; S150-D246 WeakPolarHBondContact CB-OD2 3.27Å; S150-D246 PolarHBondContact OG-OD2 2.91Å
151	L	98.6	Very high	98.7	Very high	51 Å²	51	26 Å²	26	27%	0.267	13%	0.134	S	C	.	.			trans	-119.4	151.1	172	-73.7	170.6	0	0	0	109.4	P153 H154 R158 T185 D215	L151-P153 VanDerWaalsContact C-CD 3.46Å; L151-P153 HydrophobicContact CB-CG 4.4Å; L151-P153 VanDerWaalsContact O-N 3.14Å; L151-H154 WeakPolarHBondContact O-CB 3.49Å; L151-H154 PolarHBondContact O-N 2.83Å; L151-R158 PolarHBondContact O-NH1 3.03Å; L151-T185 HydrophobicContact CD2-CG2 4.14Å; L151-D215 HydrophobicContact CD2-CB 3.9Å
152	T	98.6	Very high	98.8	Very high	4 Å²	4	21.5 Å²	21.5	3%	0.025	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.6	-53	178.8	-48.3	0	0	0	0	114.6	H154 F155 R158 T185 L194 L198	T152-H154 PolarHBondContact O-N 3.4Å; T152-H154 VanDerWaalsContact O-N 3.12Å; T152-F155 WeakPolarHBondContact O-CE2 3.49Å; T152-R158 PolarHBondContact O-NH1 2.59Å; T152-R158 PolarHBondContact O-NH2 3.01Å; T152-T185 WeakPolarHBondContact CB-OG1 3.48Å; T152-T185 WeakPolarHBondContact OG1-CG2 3.41Å; T152-T185 PolarHBondContact OG1-OG1 3.03Å; T152-L194 HydrophobicContact CG2-CB 3.9Å; T152-L198 HydrophobicContact CG2-CB 4.26Å; T152-L198 HydrophobicContact CG2-CD2 4.12Å
153	P	98.3	Very high	98.8	Very high	52 Å²	52	26.2 Å²	26.2	34%	0.338	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-9.6	-176.7	28.4	-38	0	0	0	115.6	L151 F155 L194	L151-P153 VanDerWaalsContact C-CD 3.46Å; L151-P153 HydrophobicContact CB-CG 4.4Å; L151-P153 VanDerWaalsContact O-N 3.14Å; P153-F155 PolarHBondContact O-N 3.21Å; P153-L194 HydrophobicContact CB-CD1 3.91Å
154	H	98.8	Very high	98.8	Very high	47 Å²	47	25.3 Å²	25.3	22%	0.218	13%	0.132	C	C	.	.			trans	-80.5	39	-172.5	-67.1	-174.7	0	0	0	114.6	L151 T152 A156 R157 R158 D246	L151-H154 WeakPolarHBondContact O-CB 3.49Å; L151-H154 PolarHBondContact O-N 2.83Å; T152-H154 PolarHBondContact O-N 3.4Å; T152-H154 VanDerWaalsContact O-N 3.12Å; H154-A156 VanDerWaalsContact C-N 3.34Å; H154-A156 PolarHBondContact O-N 2.95Å; H154-R157 HydrophobicContact CB-CB 4.21Å; H154-R157 HydrophobicContact CB-CG 4.35Å; H154-R157 PolarHBondContact O-N 3.43Å; H154-R157 VanDerWaalsContact O-N 3.16Å; H154-R158 PolarHBondContact O-N 2.88Å; H154-D246 WeakPolarHBondContact CB-OD2 3.4Å; H154-D246 IonicContact CE1-OD1 2.68Å; H154-D246 IonicContact CE1-OD2 2.76Å; H154-D246 IonicContact CG-OD2 3.99Å; H154-D246 IonicContact ND1-OD1 3.06Å; H154-D246 PolarHBondContact ND1-OD1 3.47Å; H154-D246 IonicContact ND1-OD2 3.17Å; H154-D246 PolarHBondContact ND1-OD2 3.25Å
155	F	98.9	Very high	98.8	Very high	46 Å²	46	25.4 Å²	25.4	20%	0.202	13%	0.132	C	C	.	.	H	α-helix	trans	-53.7	-46.5	-179.9	-65.2	-80.2	0	0	0	112.9	T152 P153 R157 R158 Q159 L194 M197 L198 E201	T152-F155 WeakPolarHBondContact O-CE2 3.49Å; P153-F155 PolarHBondContact O-N 3.21Å; F155-R157 VanDerWaalsContact C-N 3.34Å; F155-R157 PolarHBondContact O-N 3.18Å; F155-R158 VanDerWaalsContact CD1-NH2 3.29Å; F155-R158 PolarHBondContact O-N 2.78Å; F155-Q159 WeakPolarHBondContact O-CB 3.24Å; F155-Q159 PolarHBondContact O-N 3Å; F155-L194 HydrophobicContact CE2-CB 4.24Å; F155-L194 HydrophobicContact CE2-CD1 4.16Å; F155-L194 HydrophobicContact CZ-CB 4.39Å; F155-M197 HydrophobicContact CE1-CB 4.13Å; F155-M197 HydrophobicContact CE2-CB 4.43Å; F155-M197 HydrophobicContact CE2-CE 4.43Å; F155-M197 HydrophobicContact CZ-CB 3.68Å; F155-L198 HydrophobicContact CZ-CB 4.45Å; F155-E201 HydrophobicContact CD1-CB 4.49Å; F155-E201 WeakPolarHBondContact CD1-OE2 2.96Å; F155-E201 HydrophobicContact CE1-CB 4.23Å; F155-E201 WeakPolarHBondContact CE1-OE2 3.16Å
156	A	98.9	Very high	98.8	Very high	65 Å²	65	25.4 Å²	25.4	54%	0.537	13%	0.132	S	C	.	.	H	α-helix	trans	-65.1	-36.6	-179.2	0	0	0	0	0	112.7	H154 A160 P380	H154-A156 VanDerWaalsContact C-N 3.34Å; H154-A156 PolarHBondContact O-N 2.95Å; A156-A160 WeakPolarHBondContact O-CB 3.28Å; A156-A160 PolarHBondContact O-N 3.37Å; A156-P380 HydrophobicContact CB-CG 4.19Å
157	R	98.9	Very high	98.8	Very high	71 Å²	71	29.7 Å²	29.7	27%	0.268	15%	0.152	S	C	.	.	H	α-helix	trans	-65.7	-52	176	-64.7	-174.7	-179.2	-161	-9	110.2	H154 F155 Q159 A160 I161 D246 D247 P380	H154-R157 HydrophobicContact CB-CB 4.21Å; H154-R157 HydrophobicContact CB-CG 4.35Å; H154-R157 PolarHBondContact O-N 3.43Å; H154-R157 VanDerWaalsContact O-N 3.16Å; F155-R157 VanDerWaalsContact C-N 3.34Å; F155-R157 PolarHBondContact O-N 3.18Å; R157-Q159 VanDerWaalsContact C-N 3.32Å; R157-Q159 PolarHBondContact O-N 3.31Å; R157-A160 PolarHBondContact O-N 2.61Å; R157-I161 VanDerWaalsContact O-CG1 3.25Å; R157-I161 WeakPolarHBondContact O-CG1 3.45Å; R157-I161 PolarHBondContact O-N 3.14Å; R157-D246 HydrophobicContact CB-CB 4.17Å; R157-D246 WeakPolarHBondContact CB-O 3.27Å; R157-D246 VanDerWaalsContact CD-CG 3.46Å; R157-D246 WeakPolarHBondContact CD-OD1 3.3Å; R157-D246 IonicContact CZ-OD1 3.78Å; R157-D246 IonicContact NE-OD1 2.64Å; R157-D246 IonicContact NH1-OD1 2.64Å; R157-D246 PolarHBondContact NH1-OD1 2.93Å; R157-D247 IonicContact CZ-OD2 3.74Å; R157-D247 IonicContact NH1-OD2 2.83Å; R157-D247 PolarHBondContact NH1-OD2 3.12Å; R157-D247 IonicContact NH2-OD2 2.86Å; R157-P380 HydrophobicContact CG-CG 4.09Å
158	R	98.9	Very high	98.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-48.2	177.4	-67.3	-166.5	-69.4	-82.2	4.8	111.2	S150 L151 T152 H154 F155 A160 I161 R162 F180 E201	S150-R158 PolarHBondContact OG-NH1 3.35Å; S150-R158 VanDerWaalsContact OG-NH1 3.08Å; L151-R158 PolarHBondContact O-NH1 3.03Å; T152-R158 PolarHBondContact O-NH1 2.59Å; T152-R158 PolarHBondContact O-NH2 3.01Å; H154-R158 PolarHBondContact O-N 2.88Å; F155-R158 VanDerWaalsContact CD1-NH2 3.29Å; F155-R158 PolarHBondContact O-N 2.78Å; R158-A160 PolarHBondContact O-N 2.96Å; R158-I161 WeakPolarHBondContact O-CB 3.43Å; R158-I161 PolarHBondContact O-N 3.17Å; R158-I161 VanDerWaalsContact O-N 3.17Å; R158-R162 WeakPolarHBondContact O-CG 3.37Å; R158-R162 PolarHBondContact O-N 3.48Å; R158-F180 HydrophobicContact CB-CD1 4.32Å; R158-F180 HydrophobicContact CB-CD2 4.32Å; R158-F180 HydrophobicContact CB-CE1 3.92Å; R158-F180 HydrophobicContact CB-CE2 3.89Å; R158-F180 HydrophobicContact CB-CZ 3.69Å; R158-F180 HydrophobicContact CG-CD1 3.61Å; R158-F180 HydrophobicContact CG-CD2 4.14Å; R158-F180 HydrophobicContact CG-CE1 3.65Å; R158-F180 HydrophobicContact CG-CE2 4.15Å; R158-F180 HydrophobicContact CG-CG 3.87Å; R158-F180 HydrophobicContact CG-CZ 3.92Å; R158-F180 WeakPolarHBondContact O-CZ 3.46Å; R158-E201 IonicContact CZ-OE1 2.75Å; R158-E201 IonicContact CZ-OE2 3.26Å; R158-E201 VanDerWaalsContact CZ-OE2 3.27Å; R158-E201 VanDerWaalsContact NE-CD 3.34Å; R158-E201 IonicContact NE-OE1 3.16Å; R158-E201 PolarHBondContact NE-OE1 3.09Å; R158-E201 IonicContact NE-OE2 3.78Å; R158-E201 PolarHBondContact NE-OE2 3.06Å; R158-E201 IonicContact NH2-OE1 2.77Å; R158-E201 IonicContact NH2-OE2 2.86Å; R158-E201 PolarHBondContact NH2-OE2 2.92Å
159	Q	98.9	Very high	98.6	Very high	56 Å²	56	35.9 Å²	35.9	26%	0.262	19%	0.186	S	C	.	.	H	α-helix	trans	-62.5	-44.8	-179	-170.7	59	21.3	0	0	112.9	F155 R157 I161 R162 E163 H205	F155-Q159 WeakPolarHBondContact O-CB 3.24Å; F155-Q159 PolarHBondContact O-N 3Å; R157-Q159 VanDerWaalsContact C-N 3.32Å; R157-Q159 PolarHBondContact O-N 3.31Å; Q159-I161 VanDerWaalsContact C-N 3.27Å; Q159-I161 PolarHBondContact O-N 2.92Å; Q159-R162 WeakPolarHBondContact O-CB 3.35Å; Q159-R162 PolarHBondContact O-N 2.98Å; Q159-R162 VanDerWaalsContact O-N 3.09Å; Q159-R162 VanDerWaalsContact OE1-NH1 3.08Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.34Å; Q159-E163 PolarHBondContact NE2-OE1 3Å; Q159-E163 WeakPolarHBondContact O-CG 3.05Å; Q159-E163 PolarHBondContact O-N 2.81Å; Q159-H205 PolarHBondContact OE1-CE1 2.99Å; Q159-H205 PolarHBondContact OE1-NE2 3.25Å
160	A	98.9	Very high	98.3	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-38.2	175.2	0	0	0	0	0	112.1	A156 R157 R158 E163 S164 P380 I384	A156-A160 WeakPolarHBondContact O-CB 3.28Å; A156-A160 PolarHBondContact O-N 3.37Å; R157-A160 PolarHBondContact O-N 2.61Å; R158-A160 PolarHBondContact O-N 2.96Å; A160-E163 PolarHBondContact O-N 3.39Å; A160-S164 VanDerWaalsContact O-CB 3.24Å; A160-S164 WeakPolarHBondContact O-CB 3.44Å; A160-S164 PolarHBondContact O-N 3.11Å; A160-S164 PolarHBondContact O-OG 3.43Å; A160-P380 HydrophobicContact CB-CB 3.62Å; A160-P380 WeakPolarHBondContact CB-O 3.32Å; A160-I384 HydrophobicContact CB-CD1 3.89Å; A160-I384 HydrophobicContact CB-CG1 3.97Å
161	I	98.9	Very high	97.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-43.1	174.2	-66	171.3	0	0	0	110.8	I148 R157 R158 Q159 E163 S164 W165 G166 F180 D246 M383	I148-I161 HydrophobicContact CG2-CD1 4.04Å; R157-I161 VanDerWaalsContact O-CG1 3.25Å; R157-I161 WeakPolarHBondContact O-CG1 3.45Å; R157-I161 PolarHBondContact O-N 3.14Å; R158-I161 WeakPolarHBondContact O-CB 3.43Å; R158-I161 PolarHBondContact O-N 3.17Å; R158-I161 VanDerWaalsContact O-N 3.17Å; Q159-I161 VanDerWaalsContact C-N 3.27Å; Q159-I161 PolarHBondContact O-N 2.92Å; I161-E163 VanDerWaalsContact C-N 3.29Å; I161-E163 PolarHBondContact O-N 3.16Å; I161-S164 PolarHBondContact O-N 3.44Å; I161-W165 HydrophobicContact CB-CZ2 4.14Å; I161-W165 HydrophobicContact CD1-CH2 3.93Å; I161-W165 HydrophobicContact CD1-CZ2 3.48Å; I161-W165 VanDerWaalsContact CD1-CZ2 3.48Å; I161-W165 HydrophobicContact CG1-CH2 4.1Å; I161-W165 HydrophobicContact CG1-CZ2 3.39Å; I161-W165 HydrophobicContact CG2-CD2 4.21Å; I161-W165 HydrophobicContact CG2-CE3 4.15Å; I161-W165 HydrophobicContact CG2-CH2 3.66Å; I161-W165 HydrophobicContact CG2-CZ2 3.74Å; I161-W165 HydrophobicContact CG2-CZ3 3.87Å; I161-G166 WeakPolarHBondContact O-CA 3.3Å; I161-G166 PolarHBondContact O-N 2.76Å; I161-F180 HydrophobicContact CB-CE1 4.32Å; I161-F180 HydrophobicContact CB-CZ 4.1Å; I161-F180 HydrophobicContact CD1-CE1 4.08Å; I161-F180 HydrophobicContact CG2-CE1 4.16Å; I161-F180 HydrophobicContact CG2-CZ 3.97Å; I161-D246 HydrophobicContact CD1-CB 3.95Å; I161-M383 HydrophobicContact CG1-SD 3.88Å
162	R	98.9	Very high	97.1	Very high	18 Å²	18	45.4 Å²	45.4	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-37.9	175.9	-59.6	-169	-177.2	94.8	5.7	112.8	R158 Q159 S164 Q167 F180 E201 D207	R158-R162 WeakPolarHBondContact O-CG 3.37Å; R158-R162 PolarHBondContact O-N 3.48Å; Q159-R162 WeakPolarHBondContact O-CB 3.35Å; Q159-R162 PolarHBondContact O-N 2.98Å; Q159-R162 VanDerWaalsContact O-N 3.09Å; Q159-R162 VanDerWaalsContact OE1-NH1 3.08Å; R162-S164 VanDerWaalsContact C-N 3.35Å; R162-Q167 WeakPolarHBondContact O-CG 3.39Å; R162-F180 HydrophobicContact CG-CE2 4.18Å; R162-F180 HydrophobicContact CG-CZ 4.42Å; R162-E201 IonicContact CZ-OE1 3.34Å; R162-E201 VanDerWaalsContact CZ-OE1 3.22Å; R162-E201 IonicContact NH1-OE1 3.27Å; R162-E201 PolarHBondContact NH1-OE1 3.41Å; R162-E201 IonicContact NH2-OE1 3.46Å; R162-E201 PolarHBondContact NH2-OE1 3.31Å; R162-D207 WeakPolarHBondContact CD-OD2 3.2Å; R162-D207 IonicContact CZ-OD1 3.67Å; R162-D207 IonicContact CZ-OD2 3.22Å; R162-D207 IonicContact NE-OD1 3.66Å; R162-D207 PolarHBondContact NE-OD1 3.15Å; R162-D207 IonicContact NE-OD2 3.31Å; R162-D207 PolarHBondContact NE-OD2 2.78Å; R162-D207 IonicContact NH2-OD1 3.68Å; R162-D207 PolarHBondContact NH2-OD1 3.49Å; R162-D207 IonicContact NH2-OD2 2.72Å
163	E	98.7	Very high	96.6	Very high	100 Å²	100	51.2 Å²	51.2	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-85.6	-8.6	-177.2	-69.1	175.4	-169.7	0	0	113.4	Q159 A160 I161	Q159-E163 WeakPolarHBondContact CG-OE1 3.34Å; Q159-E163 PolarHBondContact NE2-OE1 3Å; Q159-E163 WeakPolarHBondContact O-CG 3.05Å; Q159-E163 PolarHBondContact O-N 2.81Å; A160-E163 PolarHBondContact O-N 3.39Å; I161-E163 VanDerWaalsContact C-N 3.29Å; I161-E163 PolarHBondContact O-N 3.16Å
164	S	98.8	Very high	96.4	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-123.4	-176.3	68.5	0	0	0	0	112.3	A160 I161 R162 G166 Q167 W387	A160-S164 VanDerWaalsContact O-CB 3.24Å; A160-S164 WeakPolarHBondContact O-CB 3.44Å; A160-S164 PolarHBondContact O-N 3.11Å; A160-S164 PolarHBondContact O-OG 3.43Å; I161-S164 PolarHBondContact O-N 3.44Å; R162-S164 VanDerWaalsContact C-N 3.35Å; S164-G166 PolarHBondContact O-N 2.9Å; S164-G166 VanDerWaalsContact O-N 3.13Å; S164-Q167 WeakPolarHBondContact O-CG 2.94Å; S164-Q167 PolarHBondContact O-N 3.43Å; S164-Q167 PolarHBondContact O-OE1 3.38Å; S164-W387 VanDerWaalsContact CA-CD1 3.43Å; S164-W387 PolarHBondContact O-NE1 3.04Å
165	W	98.7	Very high	96.4	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.008	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.3	-171.1	57.8	-98.2	0	0	0	114.5	I148 I161 Q167 F242 V248 F249 V250 T252 W387	I148-W165 HydrophobicContact CD1-CH2 3.57Å; I148-W165 HydrophobicContact CD1-CZ3 3.75Å; I148-W165 HydrophobicContact CG1-CH2 4.01Å; I148-W165 HydrophobicContact CG1-CZ3 4.31Å; I161-W165 HydrophobicContact CB-CZ2 4.14Å; I161-W165 HydrophobicContact CD1-CH2 3.93Å; I161-W165 HydrophobicContact CD1-CZ2 3.48Å; I161-W165 VanDerWaalsContact CD1-CZ2 3.48Å; I161-W165 HydrophobicContact CG1-CH2 4.1Å; I161-W165 HydrophobicContact CG1-CZ2 3.39Å; I161-W165 HydrophobicContact CG2-CD2 4.21Å; I161-W165 HydrophobicContact CG2-CE3 4.15Å; I161-W165 HydrophobicContact CG2-CH2 3.66Å; I161-W165 HydrophobicContact CG2-CZ2 3.74Å; I161-W165 HydrophobicContact CG2-CZ3 3.87Å; W165-Q167 VanDerWaalsContact C-N 3.32Å; W165-F242 HydrophobicContact CZ3-CE1 4.31Å; W165-V248 HydrophobicContact CZ2-CG2 4.29Å; W165-V248 WeakPolarHBondContact CZ2-O 2.99Å; W165-V248 PolarHBondContact NE1-O 3.29Å; W165-V248 VanDerWaalsContact NE1-O 3.16Å; W165-F249 HydrophobicContact CB-CE2 4.43Å; W165-F249 AromaticContact CD1-CD2 3.77Å; W165-V250 HydrophobicContact CB-CB 4.29Å; W165-V250 WeakPolarHBondContact CB-O 3.06Å; W165-V250 HydrophobicContact CD2-CB 3.69Å; W165-V250 HydrophobicContact CD2-CG2 3.82Å; W165-V250 HydrophobicContact CE3-CB 3.58Å; W165-V250 HydrophobicContact CE3-CG1 4.44Å; W165-V250 HydrophobicContact CE3-CG2 3.62Å; W165-V250 HydrophobicContact CG-CB 4.04Å; W165-V250 HydrophobicContact CH2-CG2 3.84Å; W165-V250 HydrophobicContact CZ2-CG2 4Å; W165-V250 HydrophobicContact CZ3-CB 4.13Å; W165-V250 HydrophobicContact CZ3-CG2 3.65Å; W165-T252 WeakPolarHBondContact O-CB 3.38Å; W165-T252 PolarHBondContact O-OG1 3.45Å; W165-W387 HydrophobicContact CB-CD2 4.47Å; W165-W387 HydrophobicContact CB-CE3 3.82Å; W165-W387 HydrophobicContact CB-CZ3 3.9Å
166	G	98.6	Very high	96.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.1	-178.3	0	0	0	0	0	114.4	I161 S164 E168 R178	I161-G166 WeakPolarHBondContact O-CA 3.3Å; I161-G166 PolarHBondContact O-N 2.76Å; S164-G166 PolarHBondContact O-N 2.9Å; S164-G166 VanDerWaalsContact O-N 3.13Å; G166-E168 PolarHBondContact O-N 3.27Å; G166-R178 WeakPolarHBondContact O-CD 3.27Å; G166-R178 PolarHBondContact O-NH1 3.29Å
167	Q	98.1	Very high	96.4	Very high	89 Å²	89	44.7 Å²	44.7	42%	0.416	25%	0.246	S	C	.	.			trans	-47	131.3	-173.5	-78.5	173.9	-55.6	0	0	113.4	R162 S164 W165	R162-Q167 WeakPolarHBondContact O-CG 3.39Å; S164-Q167 WeakPolarHBondContact O-CG 2.94Å; S164-Q167 PolarHBondContact O-N 3.43Å; S164-Q167 PolarHBondContact O-OE1 3.38Å; W165-Q167 VanDerWaalsContact C-N 3.32Å
168	E	98.1	Very high	96.4	Very high	86 Å²	86	42 Å²	42	40%	0.402	24%	0.236	S	C	.	.			trans	-72	137.9	170	-60.7	-164.1	158.1	0	0	108.4	K137 G166 V176 R178	K137-E168 IonicContact NZ-OE1 3.63Å; K137-E168 PolarHBondContact NZ-OE1 2.9Å; K137-E168 IonicContact NZ-OE2 2.82Å; G166-E168 PolarHBondContact O-N 3.27Å; E168-V176 VanDerWaalsContact CA-O 3.3Å; E168-V176 WeakPolarHBondContact CA-O 3.48Å; E168-V176 WeakPolarHBondContact CB-O 3.43Å; E168-R178 HydrophobicContact CG-CB 4.11Å; E168-R178 PolarHBondContact OE1-N 2.9Å
169	S	95.9	Very high	96.4	Very high	44 Å²	44	42 Å²	42	31%	0.308	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	162.6	-174.4	61.8	0	0	0	0	111.6	T175 V176	S169-T175 CarbonylContact O-C 3.59Å; S169-T175 WeakPolarHBondContact O-CA 3.39Å; S169-V176 PolarHBondContact N-O 3.04Å; S169-V176 VanDerWaalsContact N-O 3.15Å; S169-V176 PolarHBondContact O-N 2.64Å
170	N	93.2	Very high	96.4	Very high	89 Å²	89	39.3 Å²	39.3	48%	0.476	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	64.2	176.4	-176.6	40.9	0	0	0	110.2	K140 Q174 T175	K140-N170 VanDerWaalsContact NZ-CG 3.34Å; K140-N170 PolarHBondContact NZ-ND2 3.36Å; K140-N170 PolarHBondContact NZ-OD1 2.93Å; N170-Q174 WeakPolarHBondContact CA-O 3.39Å; N170-T175 PolarHBondContact OD1-OG1 3.11Å
171	T	87.3	Confident	96.4	Very high	109 Å²	109	39.2 Å²	39.2	67%	0.669	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91	132.2	-179.2	-56.4	0	0	0	0	109.8	N173 Q174	T171-N173 PolarHBondContact O-N 3.16Å; T171-Q174 PolarHBondContact N-O 3.44Å; T171-Q174 WeakPolarHBondContact O-CB 3.44Å; T171-Q174 PolarHBondContact O-N 2.91Å
172	G	84.9	Confident	96.4	Very high	73 Å²	73	39.2 Å²	39.2	75%	0.753	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	28.2	178.5	0	0	0	0	0	114.2	Q174	G172-Q174 PolarHBondContact O-N 3.19Å
173	N	87.8	Confident	96.3	Very high	126 Å²	126	38.3 Å²	38.3	67%	0.674	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.6	-171.5	-160.4	35	0	0	0	114.8	K140 T171	K140-N173 PolarHBondContact NZ-OD1 3.44Å; T171-N173 PolarHBondContact O-N 3.16Å
174	Q	94.3	Very high	96.3	Very high	47 Å²	47	36.1 Å²	36.1	22%	0.22	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	108.6	170.8	-63.6	-172.9	-40.1	0	0	108.6	F143 N170 T171 G172 N260	F143-Q174 HydrophobicContact CB-CB 3.78Å; F143-Q174 HydrophobicContact CB-CG 4.27Å; F143-Q174 HydrophobicContact CD1-CB 4.03Å; F143-Q174 HydrophobicContact CD1-CG 4.27Å; F143-Q174 HydrophobicContact CD2-CG 4.16Å; F143-Q174 VanDerWaalsContact CE2-NE2 3.29Å; F143-Q174 HydrophobicContact CG-CB 3.86Å; F143-Q174 HydrophobicContact CG-CG 3.97Å; N170-Q174 WeakPolarHBondContact CA-O 3.39Å; T171-Q174 PolarHBondContact N-O 3.44Å; T171-Q174 WeakPolarHBondContact O-CB 3.44Å; T171-Q174 PolarHBondContact O-N 2.91Å; G172-Q174 PolarHBondContact O-N 3.19Å; Q174-N260 PolarHBondContact NE2-OD1 3.28Å; Q174-N260 PolarHBondContact OE1-ND2 3.23Å
175	T	98.1	Very high	96.2	Very high	14 Å²	14	37 Å²	37	9%	0.086	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125	-177.9	-58.4	0	0	0	0	110.3	K140 P142 F143 L144 S169 N170 V177	K140-T175 HydrophobicContact CD-CG2 4.34Å; K140-T175 VanDerWaalsContact CD-OG1 3.29Å; K140-T175 WeakPolarHBondContact CD-OG1 3.14Å; K140-T175 WeakPolarHBondContact CE-OG1 3.08Å; K140-T175 PolarHBondContact NZ-OG1 2.9Å; P142-T175 CarbonylContact C-O 3.4Å; P142-T175 WeakPolarHBondContact CA-O 3.48Å; F143-T175 PolarHBondContact N-O 3.24Å; L144-T175 PolarHBondContact N-O 2.9Å; S169-T175 CarbonylContact O-C 3.59Å; S169-T175 WeakPolarHBondContact O-CA 3.39Å; N170-T175 PolarHBondContact OD1-OG1 3.11Å; T175-V177 HydrophobicContact CG2-CG1 3.83Å
176	V	98.7	Very high	95.9	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.2	171.9	-175.4	0	0	0	0	107.9	L144 L146 E168 S169 L256	L144-V176 HydrophobicContact CB-CG1 4.39Å; L144-V176 HydrophobicContact CB-CG2 4.26Å; L144-V176 HydrophobicContact CD2-CG1 4.39Å; L144-V176 HydrophobicContact CG-CG1 4.47Å; L144-V176 WeakPolarHBondContact O-CA 3.22Å; L146-V176 HydrophobicContact CD1-CG1 3.81Å; L146-V176 HydrophobicContact CG-CG1 3.87Å; E168-V176 VanDerWaalsContact CA-O 3.3Å; E168-V176 WeakPolarHBondContact CA-O 3.48Å; E168-V176 WeakPolarHBondContact CB-O 3.43Å; S169-V176 PolarHBondContact N-O 3.04Å; S169-V176 VanDerWaalsContact N-O 3.15Å; S169-V176 PolarHBondContact O-N 2.64Å; V176-L256 HydrophobicContact CG2-CD1 4.29Å; V176-L256 HydrophobicContact CG2-CD2 4.03Å
177	V	98.8	Very high	95.6	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.055	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.6	178	-56.2	0	0	0	0	110.2	K137 P142 L144 L145 L146 T175	K137-V177 HydrophobicContact CD-CB 3.84Å; K137-V177 HydrophobicContact CD-CG2 4.31Å; K137-V177 HydrophobicContact CG-CB 4.35Å; K137-V177 HydrophobicContact CG-CG2 4.28Å; P142-V177 HydrophobicContact CB-CG1 4.35Å; P142-V177 HydrophobicContact CB-CG2 3.81Å; P142-V177 HydrophobicContact CG-CG1 4.19Å; P142-V177 HydrophobicContact CG-CG2 3.59Å; L144-V177 PolarHBondContact O-N 3.25Å; L145-V177 HydrophobicContact CB-CG2 4.49Å; L145-V177 HydrophobicContact CD1-CG2 3.68Å; L146-V177 PolarHBondContact N-O 3.18Å; T175-V177 HydrophobicContact CG2-CG1 3.83Å
178	R	98.8	Very high	95.4	Very high	15 Å²	15	45.5 Å²	45.5	6%	0.057	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.2	-174.8	-177	-178.5	61.6	-95.7	-8.2	111.8	K137 L146 G166 E168 F180 D207	K137-R178 WeakPolarHBondContact CE-O 3.49Å; L146-R178 HydrophobicContact CB-CB 4.34Å; L146-R178 HydrophobicContact CB-CG 4.33Å; L146-R178 CarbonylContact O-C 3.52Å; L146-R178 WeakPolarHBondContact O-CA 3.32Å; G166-R178 WeakPolarHBondContact O-CD 3.27Å; G166-R178 PolarHBondContact O-NH1 3.29Å; E168-R178 HydrophobicContact CG-CB 4.11Å; E168-R178 PolarHBondContact OE1-N 2.9Å; R178-F180 HydrophobicContact CG-CE2 4.44Å; R178-D207 IonicContact CZ-OD2 2.72Å; R178-D207 IonicContact NE-OD2 2.79Å; R178-D207 PolarHBondContact NE-OD2 2.75Å; R178-D207 VanDerWaalsContact NE-OD2 3.16Å; R178-D207 IonicContact NH2-OD2 3.74Å; R178-D207 PolarHBondContact NH2-OD2 2.88Å; R178-D207 WeakPolarHBondContact O-CB 3.27Å
179	V	98.9	Very high	95.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.3	167.3	-64.1	0	0	0	0	110.9	K137 L145 L146 A147 I148 L181 D207 L209 F227 W230	K137-V179 HydrophobicContact CD-CG1 4.27Å; K137-V179 HydrophobicContact CG-CG1 3.76Å; L145-V179 HydrophobicContact CD1-CG2 4.07Å; L146-V179 PolarHBondContact O-N 3.15Å; A147-V179 WeakPolarHBondContact CA-O 3.43Å; A147-V179 HydrophobicContact CB-CG2 4.09Å; I148-V179 PolarHBondContact N-O 3.35Å; V179-L181 HydrophobicContact CG2-CD2 4.06Å; V179-D207 CarbonylContact C-O 3.57Å; V179-D207 WeakPolarHBondContact CA-O 3.48Å; V179-L209 HydrophobicContact CB-CD1 3.92Å; V179-L209 HydrophobicContact CB-CG 4.09Å; V179-L209 HydrophobicContact CG1-CD1 4.05Å; V179-L209 HydrophobicContact CG1-CG 4.19Å; V179-L209 HydrophobicContact CG2-CD1 4Å; V179-F227 HydrophobicContact CG2-CE2 4.41Å; V179-W230 HydrophobicContact CG1-CH2 4.08Å; V179-W230 HydrophobicContact CG1-CZ2 4.47Å
180	F	98.9	Very high	95.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.8	168.3	-64.3	-77.6	0	0	0	110.2	I148 R158 I161 R162 R178 L182 D207 I208 L209	I148-F180 HydrophobicContact CB-CD1 3.66Å; I148-F180 HydrophobicContact CB-CE1 3.86Å; I148-F180 HydrophobicContact CG1-CD1 4.43Å; I148-F180 HydrophobicContact CG1-CE1 4.24Å; I148-F180 HydrophobicContact CG2-CD1 3.95Å; I148-F180 HydrophobicContact CG2-CE1 3.95Å; I148-F180 CarbonylContact O-C 3.22Å; I148-F180 VanDerWaalsContact O-CA 3.31Å; I148-F180 WeakPolarHBondContact O-CA 3.38Å; R158-F180 HydrophobicContact CB-CD1 4.32Å; R158-F180 HydrophobicContact CB-CD2 4.32Å; R158-F180 HydrophobicContact CB-CE1 3.92Å; R158-F180 HydrophobicContact CB-CE2 3.89Å; R158-F180 HydrophobicContact CB-CZ 3.69Å; R158-F180 HydrophobicContact CG-CD1 3.61Å; R158-F180 HydrophobicContact CG-CD2 4.14Å; R158-F180 HydrophobicContact CG-CE1 3.65Å; R158-F180 HydrophobicContact CG-CE2 4.15Å; R158-F180 HydrophobicContact CG-CG 3.87Å; R158-F180 HydrophobicContact CG-CZ 3.92Å; R158-F180 WeakPolarHBondContact O-CZ 3.46Å; I161-F180 HydrophobicContact CB-CE1 4.32Å; I161-F180 HydrophobicContact CB-CZ 4.1Å; I161-F180 HydrophobicContact CD1-CE1 4.08Å; I161-F180 HydrophobicContact CG2-CE1 4.16Å; I161-F180 HydrophobicContact CG2-CZ 3.97Å; R162-F180 HydrophobicContact CG-CE2 4.18Å; R162-F180 HydrophobicContact CG-CZ 4.42Å; R178-F180 HydrophobicContact CG-CE2 4.44Å; F180-L182 HydrophobicContact CB-CD1 3.67Å; F180-D207 PolarHBondContact N-O 3.02Å; F180-I208 HydrophobicContact CB-CD1 3.89Å; F180-I208 HydrophobicContact CD2-CD1 3.96Å; F180-I208 HydrophobicContact CG-CD1 4.31Å; F180-L209 PolarHBondContact O-N 3.48Å
181	L	98.9	Very high	95.2	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.2	-174	-49.3	178.7	0	0	0	110.7	A147 I148 K149 S150 V179 L209 W211 K223 F227	A147-L181 HydrophobicContact CB-CD1 4.27Å; I148-L181 PolarHBondContact O-N 3.12Å; K149-L181 HydrophobicContact CG-CD1 4.48Å; S150-L181 PolarHBondContact N-O 3.09Å; S150-L181 VanDerWaalsContact N-O 3.12Å; S150-L181 VanDerWaalsContact O-O 3.1Å; V179-L181 HydrophobicContact CG2-CD2 4.06Å; L181-L209 HydrophobicContact CD2-CD1 4.09Å; L181-W211 HydrophobicContact CB-CZ3 4.38Å; L181-W211 HydrophobicContact CD2-CH2 4.03Å; L181-W211 HydrophobicContact CD2-CZ3 4.08Å; L181-K223 HydrophobicContact CB-CD 3.9Å; L181-K223 HydrophobicContact CB-CG 4.06Å; L181-K223 WeakPolarHBondContact O-CE 3.05Å; L181-K223 PolarHBondContact O-NZ 2.99Å; L181-F227 HydrophobicContact CD1-CB 3.86Å; L181-F227 HydrophobicContact CD1-CD1 4.24Å; L181-F227 HydrophobicContact CD1-CD2 3.94Å; L181-F227 HydrophobicContact CD1-CG 3.72Å; L181-F227 HydrophobicContact CD2-CB 4.22Å; L181-F227 HydrophobicContact CD2-CD2 3.52Å; L181-F227 HydrophobicContact CD2-CE2 4.22Å; L181-F227 HydrophobicContact CD2-CG 4.07Å; L181-F227 HydrophobicContact CG-CD2 4.37Å
182	L	98.9	Very high	95.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.6	-175.8	-70	76.8	0	0	0	112	F180 L198 I208 L209 M210 W211	F180-L182 HydrophobicContact CB-CD1 3.67Å; L182-L198 HydrophobicContact CD2-CD1 3.61Å; L182-L198 HydrophobicContact CD2-CD2 3.76Å; L182-L198 HydrophobicContact CD2-CG 4.35Å; L182-I208 HydrophobicContact CD1-CD1 4.41Å; L182-I208 HydrophobicContact CD1-CG2 4.26Å; L182-L209 PolarHBondContact N-O 2.73Å; L182-M210 HydrophobicContact CB-CG 4.28Å; L182-M210 WeakPolarHBondContact O-CA 3.31Å; L182-W211 PolarHBondContact O-N 2.94Å
183	G	98.6	Very high	96.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-170.4	156.3	0	0	0	0	0	111.3	W211 Y213 D215	G183-W211 WeakPolarHBondContact CA-O 3.37Å; G183-Y213 PolarHBondContact N-OH 3.16Å; G183-D215 PolarHBondContact N-OD2 2.89Å
184	Q	98	Very high	96.5	Very high	54 Å²	54	44 Å²	44	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.6	173.9	-65.2	-73.1	8.6	0	0	111.2	P186 M210 N212 Y213 D215	Q184-P186 WeakPolarHBondContact O-CD 3.43Å; Q184-M210 HydrophobicContact CG-CE 4.35Å; Q184-N212 PolarHBondContact NE2-OD1 2.92Å; Q184-Y213 WeakPolarHBondContact CB-O 3.33Å; Q184-Y213 PolarHBondContact N-O 2.89Å; Q184-D215 WeakPolarHBondContact O-CB 3.48Å; Q184-D215 PolarHBondContact O-N 3.01Å
185	T	96.1	Very high	96.6	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.11	24%	0.244	C	C	.	.			trans	-112.7	81.5	167.8	50.5	0	0	0	0	107.8	L151 T152 H191	L151-T185 HydrophobicContact CD2-CG2 4.14Å; T152-T185 WeakPolarHBondContact CB-OG1 3.48Å; T152-T185 WeakPolarHBondContact OG1-CG2 3.41Å; T152-T185 PolarHBondContact OG1-OG1 3.03Å; T185-H191 WeakPolarHBondContact O-CB 3.47Å
186	P	93.1	Very high	96.6	Very high	26 Å²	26	49.8 Å²	49.8	17%	0.169	27%	0.272	C	S	.	.			trans	-83.7	160.2	-161.5	39.2	-41.3	0	0	0	111.9	Q184 E188 D189 R214	Q184-P186 WeakPolarHBondContact O-CD 3.43Å; P186-E188 VanDerWaalsContact CB-OE2 3.29Å; P186-E188 WeakPolarHBondContact CB-OE2 3.46Å; P186-E188 PolarHBondContact O-N 3.5Å; P186-D189 PolarHBondContact O-N 3.11Å; P186-D189 VanDerWaalsContact O-N 3.08Å; P186-R214 HydrophobicContact CG-CG 4.06Å
187	P	91.9	Very high	96.6	Very high	91 Å²	91	54.8 Å²	54.8	59%	0.591	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-60	-27.6	-177.5	-24.5	35	0	0	0	114.3	D189 N190	P187-D189 PolarHBondContact O-N 2.89Å; P187-D189 VanDerWaalsContact O-N 3.13Å; P187-N190 WeakPolarHBondContact O-CA 3.26Å; P187-N190 PolarHBondContact O-N 3.22Å
188	E	93.9	Very high	96.6	Very high	153 Å²	153	54.4 Å²	54.4	72%	0.715	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-59.5	-22.6	176.7	-64.6	75.2	-165.8	0	0	112.5	P186 N190	P186-E188 VanDerWaalsContact CB-OE2 3.29Å; P186-E188 WeakPolarHBondContact CB-OE2 3.46Å; P186-E188 PolarHBondContact O-N 3.5Å; E188-N190 VanDerWaalsContact C-N 3.35Å
189	D	93.4	Very high	96.5	Very high	38 Å²	38	59.6 Å²	59.6	20%	0.203	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-93.1	7.3	175.7	-69.7	-18.7	0	0	0	113.3	P186 P187 H191 R214	P186-D189 PolarHBondContact O-N 3.11Å; P186-D189 VanDerWaalsContact O-N 3.08Å; P187-D189 PolarHBondContact O-N 2.89Å; P187-D189 VanDerWaalsContact O-N 3.13Å; D189-H191 VanDerWaalsContact C-N 3.26Å; D189-H191 PolarHBondContact O-N 3.1Å; D189-R214 IonicContact OD1-CZ 3.76Å; D189-R214 IonicContact OD1-NE 3.83Å; D189-R214 PolarHBondContact OD1-NE 3.5Å; D189-R214 IonicContact OD1-NH2 3.75Å; D189-R214 PolarHBondContact OD1-NH2 2.81Å; D189-R214 WeakPolarHBondContact OD2-CG 3.41Å; D189-R214 IonicContact OD2-CZ 3.39Å; D189-R214 IonicContact OD2-NE 2.74Å; D189-R214 PolarHBondContact OD2-NE 2.91Å; D189-R214 IonicContact OD2-NH2 3.66Å
190	N	94.9	Very high	96.5	Very high	151 Å²	151	66.2 Å²	66.2	81%	0.807	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	28.2	-173.8	-45.4	-78.6	0	0	0	113.5	P187 E188	P187-N190 WeakPolarHBondContact O-CA 3.26Å; P187-N190 PolarHBondContact O-N 3.22Å; E188-N190 VanDerWaalsContact C-N 3.35Å
191	H	94.1	Very high	96.5	Very high	61 Å²	61	66.8 Å²	66.8	28%	0.282	35%	0.349	S	S	.	.			trans	-79.4	139.4	170.8	-77.4	-66.4	0	0	0	111	T185 D189	T185-H191 WeakPolarHBondContact O-CB 3.47Å; D189-H191 VanDerWaalsContact C-N 3.26Å; D189-H191 PolarHBondContact O-N 3.1Å
192	P	95.4	Very high	96.5	Very high	81 Å²	81	67.1 Å²	67.1	53%	0.526	35%	0.351	S	S	.	.			trans	-65.4	145.2	170.1	29.5	-34.4	0	0	0	109.8	L194	P192-L194 HydrophobicContact CB-CG 4.4Å; P192-L194 HydrophobicContact CG-CD1 3.89Å; P192-L194 HydrophobicContact CG-CG 4.17Å; P192-L194 PolarHBondContact O-N 3.49Å; P192-L194 VanDerWaalsContact O-N 3.15Å
193	D	96	Very high	96.5	Very high	125 Å²	125	72.3 Å²	72.3	67%	0.668	38%	0.379	S	S	*	.			trans	-71.3	111	173	-173	3.9	0	0	0	110	S195	D193-S195 VanDerWaalsContact OD1-CB 3.27Å; D193-S195 WeakPolarHBondContact OD1-CB 3.04Å; D193-S195 PolarHBondContact OD1-N 3.04Å; D193-S195 PolarHBondContact OD1-OG 3.25Å
194	L	97.4	Very high	96.5	Very high	38 Å²	38	79 Å²	79	20%	0.199	41%	0.408	C	S	.	.			trans	-124.1	17.8	178.5	-63	170.3	0	0	0	110.6	T152 P153 F155 P192 M197 L198	T152-L194 HydrophobicContact CG2-CB 3.9Å; P153-L194 HydrophobicContact CB-CD1 3.91Å; F155-L194 HydrophobicContact CE2-CB 4.24Å; F155-L194 HydrophobicContact CE2-CD1 4.16Å; F155-L194 HydrophobicContact CZ-CB 4.39Å; P192-L194 HydrophobicContact CB-CG 4.4Å; P192-L194 HydrophobicContact CG-CD1 3.89Å; P192-L194 HydrophobicContact CG-CG 4.17Å; P192-L194 PolarHBondContact O-N 3.49Å; P192-L194 VanDerWaalsContact O-N 3.15Å; L194-M197 HydrophobicContact CD2-SD 3.79Å; L194-M197 PolarHBondContact O-N 2.04Å; L194-L198 PolarHBondContact O-N 3.09Å
195	S	95.6	Very high	96.5	Very high	55 Å²	55	78.8 Å²	78.8	39%	0.385	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-44.7	-173.2	58.9	0	0	0	0	112.7	D193 M197 L198 K199	D193-S195 VanDerWaalsContact OD1-CB 3.27Å; D193-S195 WeakPolarHBondContact OD1-CB 3.04Å; D193-S195 PolarHBondContact OD1-N 3.04Å; D193-S195 PolarHBondContact OD1-OG 3.25Å; S195-M197 VanDerWaalsContact C-N 3.35Å; S195-M197 PolarHBondContact O-N 3.44Å; S195-L198 PolarHBondContact O-N 2.82Å; S195-K199 PolarHBondContact O-N 2.92Å
196	D	97.6	Very high	96.7	Very high	129 Å²	129	83.9 Å²	83.9	69%	0.69	43%	0.43	S	S	*	.	H	α-helix	trans	-63.4	-39.1	176	-75.7	-26.2	0	0	0	112.3	K199 F200	D196-K199 PolarHBondContact O-N 2.97Å; D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 PolarHBondContact O-N 3.12Å
197	M	98.4	Very high	96.9	Very high	106 Å²	106	82.7 Å²	82.7	52%	0.522	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-39.6	175.2	-70.3	-176.9	66.2	0	0	111.6	F155 L194 S195 F200 E201	F155-M197 HydrophobicContact CE1-CB 4.13Å; F155-M197 HydrophobicContact CE2-CB 4.43Å; F155-M197 HydrophobicContact CE2-CE 4.43Å; F155-M197 HydrophobicContact CZ-CB 3.68Å; L194-M197 HydrophobicContact CD2-SD 3.79Å; L194-M197 PolarHBondContact O-N 2.04Å; S195-M197 VanDerWaalsContact C-N 3.35Å; S195-M197 PolarHBondContact O-N 3.44Å; M197-F200 PolarHBondContact O-N 3.25Å; M197-E201 WeakPolarHBondContact O-CB 3.32Å; M197-E201 PolarHBondContact O-N 2.97Å
198	L	98.6	Very high	97.3	Very high	1 Å²	1	78.3 Å²	78.3	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-67	-39.3	176	-177.5	67.3	0	0	0	111.5	T152 F155 L182 L194 S195 E201 S202 I208 M210	T152-L198 HydrophobicContact CG2-CB 4.26Å; T152-L198 HydrophobicContact CG2-CD2 4.12Å; F155-L198 HydrophobicContact CZ-CB 4.45Å; L182-L198 HydrophobicContact CD2-CD1 3.61Å; L182-L198 HydrophobicContact CD2-CD2 3.76Å; L182-L198 HydrophobicContact CD2-CG 4.35Å; L194-L198 PolarHBondContact O-N 3.09Å; S195-L198 PolarHBondContact O-N 2.82Å; L198-E201 WeakPolarHBondContact O-CB 3.31Å; L198-E201 PolarHBondContact O-N 3.43Å; L198-S202 WeakPolarHBondContact O-CB 3.07Å; L198-S202 PolarHBondContact O-N 2.9Å; L198-I208 HydrophobicContact CD1-CD1 4.47Å; L198-I208 HydrophobicContact CD1-CG1 4.48Å; L198-I208 HydrophobicContact CD1-CG2 4.26Å; L198-M210 HydrophobicContact CD2-CE 3.88Å; L198-M210 HydrophobicContact CD2-CG 4.47Å; L198-M210 HydrophobicContact CD2-SD 3.52Å; L198-M210 VanDerWaalsContact CD2-SD 3.52Å
199	K	98.4	Very high	97.5	Very high	124 Å²	124	71 Å²	71	54%	0.539	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-47.1	174.5	-174.3	177	178.4	-178.3	0	111.2	S195 D196 E201 S202 D203	S195-K199 PolarHBondContact O-N 2.92Å; D196-K199 PolarHBondContact O-N 2.97Å; K199-E201 VanDerWaalsContact C-N 3.32Å; K199-E201 PolarHBondContact O-N 2.96Å; K199-S202 WeakPolarHBondContact O-CB 3.3Å; K199-S202 PolarHBondContact O-N 3.28Å; K199-S202 VanDerWaalsContact O-N 3.15Å; K199-D203 VanDerWaalsContact O-CG 3.32Å; K199-D203 PolarHBondContact O-N 2.99Å
200	F	98.8	Very high	97.8	Very high	140 Å²	140	69.8 Å²	69.8	61%	0.614	35%	0.353	S	S	*	.	H	α-helix	trans	-59.1	-41.9	174.3	176.6	-97.4	0	0	0	112.4	D196 M197 D203 K204	D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 PolarHBondContact O-N 3.12Å; M197-F200 PolarHBondContact O-N 3.25Å; F200-D203 PolarHBondContact O-N 3.14Å; F200-K204 HydrophobicContact CE1-CD 4.22Å; F200-K204 HydrophobicContact CZ-CD 4.43Å; F200-K204 VanDerWaalsContact O-CB 3.3Å; F200-K204 WeakPolarHBondContact O-CB 3.38Å; F200-K204 PolarHBondContact O-N 2.64Å
201	E	98.9	Very high	98	Very high	11 Å²	11	62.7 Å²	62.7	5%	0.051	32%	0.315	C	S	.	.	H	α-helix	trans	-60.4	-45	174.4	-175	-172.4	-173.1	0	0	111.6	F155 R158 R162 M197 L198 K199 K204 H205	F155-E201 HydrophobicContact CD1-CB 4.49Å; F155-E201 WeakPolarHBondContact CD1-OE2 2.96Å; F155-E201 HydrophobicContact CE1-CB 4.23Å; F155-E201 WeakPolarHBondContact CE1-OE2 3.16Å; R158-E201 IonicContact CZ-OE1 2.75Å; R158-E201 IonicContact CZ-OE2 3.26Å; R158-E201 VanDerWaalsContact CZ-OE2 3.27Å; R158-E201 VanDerWaalsContact NE-CD 3.34Å; R158-E201 IonicContact NE-OE1 3.16Å; R158-E201 PolarHBondContact NE-OE1 3.09Å; R158-E201 IonicContact NE-OE2 3.78Å; R158-E201 PolarHBondContact NE-OE2 3.06Å; R158-E201 IonicContact NH2-OE1 2.77Å; R158-E201 IonicContact NH2-OE2 2.86Å; R158-E201 PolarHBondContact NH2-OE2 2.92Å; R162-E201 IonicContact CZ-OE1 3.34Å; R162-E201 VanDerWaalsContact CZ-OE1 3.22Å; R162-E201 IonicContact NH1-OE1 3.27Å; R162-E201 PolarHBondContact NH1-OE1 3.41Å; R162-E201 IonicContact NH2-OE1 3.46Å; R162-E201 PolarHBondContact NH2-OE1 3.31Å; M197-E201 WeakPolarHBondContact O-CB 3.32Å; M197-E201 PolarHBondContact O-N 2.97Å; L198-E201 WeakPolarHBondContact O-CB 3.31Å; L198-E201 PolarHBondContact O-N 3.43Å; K199-E201 VanDerWaalsContact C-N 3.32Å; K199-E201 PolarHBondContact O-N 2.96Å; E201-K204 PolarHBondContact O-N 3.09Å; E201-H205 WeakPolarHBondContact O-CB 3.44Å; E201-H205 PolarHBondContact O-CD2 3.19Å; E201-H205 PolarHBondContact O-N 2.84Å
202	S	98.8	Very high	98.2	Very high	7 Å²	7	63.6 Å²	63.6	5%	0.049	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-48.2	176.3	175.8	0	0	0	0	111.9	I132 Q134 L198 K199 K204 H205 Q206	I132-S202 WeakPolarHBondContact CG2-OG 3.46Å; Q134-S202 PolarHBondContact NE2-OG 3.36Å; L198-S202 WeakPolarHBondContact O-CB 3.07Å; L198-S202 PolarHBondContact O-N 2.9Å; K199-S202 WeakPolarHBondContact O-CB 3.3Å; K199-S202 PolarHBondContact O-N 3.28Å; K199-S202 VanDerWaalsContact O-N 3.15Å; S202-K204 PolarHBondContact O-N 3.33Å; S202-H205 PolarHBondContact O-N 2.93Å; S202-Q206 VanDerWaalsContact O-CA 3.29Å; S202-Q206 WeakPolarHBondContact O-CA 3.44Å; S202-Q206 PolarHBondContact O-N 2.72Å
203	D	98.6	Very high	98.3	Very high	109 Å²	109	60 Å²	60	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-62.1	-35.6	179.8	-67.4	-17	0	0	0	111.3	K199 F200	K199-D203 VanDerWaalsContact O-CG 3.32Å; K199-D203 PolarHBondContact O-N 2.99Å; F200-D203 PolarHBondContact O-N 3.14Å
204	K	98.7	Very high	98.4	Very high	140 Å²	140	58.6 Å²	58.6	61%	0.609	28%	0.283	S	S	*	.	H	α-helix	trans	-76.2	-41.3	179.6	-178.6	173.2	179.5	172.6	0	113.8	F200 E201 S202	F200-K204 HydrophobicContact CE1-CD 4.22Å; F200-K204 HydrophobicContact CZ-CD 4.43Å; F200-K204 VanDerWaalsContact O-CB 3.3Å; F200-K204 WeakPolarHBondContact O-CB 3.38Å; F200-K204 PolarHBondContact O-N 2.64Å; E201-K204 PolarHBondContact O-N 3.09Å; S202-K204 PolarHBondContact O-N 3.33Å
205	H	98.7	Very high	98.4	Very high	51 Å²	51	57.2 Å²	57.2	24%	0.236	28%	0.276	C	S	.	.	H	α-helix	trans	-109.2	-15.2	-168.8	-66	-69.5	0	0	0	114.6	Q159 E201 S202 D207	Q159-H205 PolarHBondContact OE1-CE1 2.99Å; Q159-H205 PolarHBondContact OE1-NE2 3.25Å; E201-H205 WeakPolarHBondContact O-CB 3.44Å; E201-H205 PolarHBondContact O-CD2 3.19Å; E201-H205 PolarHBondContact O-N 2.84Å; S202-H205 PolarHBondContact O-N 2.93Å; H205-D207 WeakPolarHBondContact CB-OD1 3.38Å; H205-D207 PolarHBondContact O-N 2.84Å; H205-D207 VanDerWaalsContact O-N 3.16Å
206	Q	98.8	Very high	98.5	Very high	125 Å²	125	56.4 Å²	56.4	58%	0.584	27%	0.269	S	S	*	.	S	Bend	trans	50.2	39.5	176.8	-55.1	-172.8	-73.9	0	0	113.3	Q134 K137 S202	Q134-Q206 VanDerWaalsContact OE1-CA 3.27Å; Q134-Q206 PolarHBondContact OE1-O 2.88Å; K137-Q206 WeakPolarHBondContact CE-O 3.23Å; K137-Q206 PolarHBondContact NZ-O 2.92Å; S202-Q206 VanDerWaalsContact O-CA 3.29Å; S202-Q206 WeakPolarHBondContact O-CA 3.44Å; S202-Q206 PolarHBondContact O-N 2.72Å
207	D	98.8	Very high	98.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.248	C	C	.	.			trans	-137.4	18.6	-175.2	66.9	4.5	0	0	0	113.8	R162 R178 V179 F180 H205	R162-D207 WeakPolarHBondContact CD-OD2 3.2Å; R162-D207 IonicContact CZ-OD1 3.67Å; R162-D207 IonicContact CZ-OD2 3.22Å; R162-D207 IonicContact NE-OD1 3.66Å; R162-D207 PolarHBondContact NE-OD1 3.15Å; R162-D207 IonicContact NE-OD2 3.31Å; R162-D207 PolarHBondContact NE-OD2 2.78Å; R162-D207 IonicContact NH2-OD1 3.68Å; R162-D207 PolarHBondContact NH2-OD1 3.49Å; R162-D207 IonicContact NH2-OD2 2.72Å; R178-D207 IonicContact CZ-OD2 2.72Å; R178-D207 IonicContact NE-OD2 2.79Å; R178-D207 PolarHBondContact NE-OD2 2.75Å; R178-D207 VanDerWaalsContact NE-OD2 3.16Å; R178-D207 IonicContact NH2-OD2 3.74Å; R178-D207 PolarHBondContact NH2-OD2 2.88Å; R178-D207 WeakPolarHBondContact O-CB 3.27Å; V179-D207 CarbonylContact C-O 3.57Å; V179-D207 WeakPolarHBondContact CA-O 3.48Å; F180-D207 PolarHBondContact N-O 3.02Å; H205-D207 WeakPolarHBondContact CB-OD1 3.38Å; H205-D207 PolarHBondContact O-N 2.84Å; H205-D207 VanDerWaalsContact O-N 3.16Å
208	I	98.9	Very high	98.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.5	177.8	-57.8	-57.7	0	0	0	110.2	I132 Q134 F180 L182 L198 M210	I132-I208 HydrophobicContact CG2-CB 4.47Å; I132-I208 HydrophobicContact CG2-CG2 4.41Å; Q134-I208 WeakPolarHBondContact CG-O 3.44Å; Q134-I208 PolarHBondContact NE2-O 3.42Å; Q134-I208 VanDerWaalsContact NE2-O 3.09Å; F180-I208 HydrophobicContact CB-CD1 3.89Å; F180-I208 HydrophobicContact CD2-CD1 3.96Å; F180-I208 HydrophobicContact CG-CD1 4.31Å; L182-I208 HydrophobicContact CD1-CD1 4.41Å; L182-I208 HydrophobicContact CD1-CG2 4.26Å; L198-I208 HydrophobicContact CD1-CD1 4.47Å; L198-I208 HydrophobicContact CD1-CG1 4.48Å; L198-I208 HydrophobicContact CD1-CG2 4.26Å; I208-M210 HydrophobicContact CG2-CB 4.41Å
209	L	98.9	Very high	98.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.7	163.5	-59.8	178.5	0	0	0	108.8	L130 I132 Q134 V179 F180 L181 L182 W211 W230	L130-L209 HydrophobicContact CD1-CB 4.34Å; I132-L209 WeakPolarHBondContact O-CA 3.47Å; Q134-L209 HydrophobicContact CB-CD2 4.29Å; Q134-L209 HydrophobicContact CG-CD2 4.17Å; V179-L209 HydrophobicContact CB-CD1 3.92Å; V179-L209 HydrophobicContact CB-CG 4.09Å; V179-L209 HydrophobicContact CG1-CD1 4.05Å; V179-L209 HydrophobicContact CG1-CG 4.19Å; V179-L209 HydrophobicContact CG2-CD1 4Å; F180-L209 PolarHBondContact O-N 3.48Å; L181-L209 HydrophobicContact CD2-CD1 4.09Å; L182-L209 PolarHBondContact N-O 2.73Å; L209-W211 HydrophobicContact CB-CE3 4.43Å; L209-W211 HydrophobicContact CB-CH2 3.53Å; L209-W211 HydrophobicContact CB-CZ2 4.36Å; L209-W211 HydrophobicContact CB-CZ3 3.57Å; L209-W211 HydrophobicContact CD1-CH2 3.81Å; L209-W211 HydrophobicContact CD1-CZ2 4.49Å; L209-W211 HydrophobicContact CG-CH2 4.3Å; L209-W230 HydrophobicContact CD1-CD2 3.53Å; L209-W230 HydrophobicContact CD1-CE3 3.93Å; L209-W230 HydrophobicContact CD1-CG 3.88Å; L209-W230 HydrophobicContact CD1-CH2 4.38Å; L209-W230 HydrophobicContact CD1-CZ2 4.01Å; L209-W230 HydrophobicContact CD1-CZ3 4.34Å; L209-W230 HydrophobicContact CD2-CZ2 4.19Å
210	M	98.8	Very high	98.4	Very high	11 Å²	11	45.1 Å²	45.1	5%	0.054	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.7	-177	-168.3	-173.1	-172.2	0	0	111.3	L130 L131 I132 L182 Q184 L198 I208	L130-M210 WeakPolarHBondContact CD1-O 3.27Å; L131-M210 PolarHBondContact N-O 3.08Å; I132-M210 HydrophobicContact CB-CB 3.88Å; I132-M210 HydrophobicContact CD1-CB 4.08Å; I132-M210 HydrophobicContact CD1-SD 3.9Å; I132-M210 HydrophobicContact CG1-CB 4.04Å; I132-M210 HydrophobicContact CG1-SD 4.43Å; I132-M210 PolarHBondContact N-O 3.12Å; I132-M210 PolarHBondContact O-N 3.3Å; L182-M210 HydrophobicContact CB-CG 4.28Å; L182-M210 WeakPolarHBondContact O-CA 3.31Å; Q184-M210 HydrophobicContact CG-CE 4.35Å; L198-M210 HydrophobicContact CD2-CE 3.88Å; L198-M210 HydrophobicContact CD2-CG 4.47Å; L198-M210 HydrophobicContact CD2-SD 3.52Å; L198-M210 VanDerWaalsContact CD2-SD 3.52Å; I208-M210 HydrophobicContact CG2-CB 4.41Å
211	W	98.8	Very high	98.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	153	176.9	-68.3	-92.6	0	0	0	112.4	S129 L130 L181 L182 G183 L209 Y213 L226 W230	S129-W211 CarbonylContact O-C 2.96Å; S129-W211 VanDerWaalsContact O-CA 3.32Å; S129-W211 WeakPolarHBondContact O-CA 3.09Å; L130-W211 HydrophobicContact CD1-CD2 3.7Å; L130-W211 VanDerWaalsContact CD1-CE2 3.4Å; L130-W211 HydrophobicContact CD1-CE3 4.29Å; L130-W211 HydrophobicContact CD1-CG 4Å; L130-W211 HydrophobicContact CD1-CH2 4.36Å; L130-W211 HydrophobicContact CD1-CZ2 3.78Å; L181-W211 HydrophobicContact CB-CZ3 4.38Å; L181-W211 HydrophobicContact CD2-CH2 4.03Å; L181-W211 HydrophobicContact CD2-CZ3 4.08Å; L182-W211 PolarHBondContact O-N 2.94Å; G183-W211 WeakPolarHBondContact CA-O 3.37Å; L209-W211 HydrophobicContact CB-CE3 4.43Å; L209-W211 HydrophobicContact CB-CH2 3.53Å; L209-W211 HydrophobicContact CB-CZ2 4.36Å; L209-W211 HydrophobicContact CB-CZ3 3.57Å; L209-W211 HydrophobicContact CD1-CH2 3.81Å; L209-W211 HydrophobicContact CD1-CZ2 4.49Å; L209-W211 HydrophobicContact CG-CH2 4.3Å; W211-Y213 HydrophobicContact CB-CD1 3.66Å; W211-Y213 HydrophobicContact CB-CE1 3.97Å; W211-Y213 PolarHBondContact O-N 3.31Å; W211-L226 HydrophobicContact CB-CD1 3.86Å; W211-L226 HydrophobicContact CD2-CB 4.01Å; W211-L226 HydrophobicContact CD2-CD1 4.34Å; W211-L226 HydrophobicContact CG-CB 4.18Å; W211-L226 HydrophobicContact CG-CD1 3.81Å; W211-L226 HydrophobicContact CG-CG 4.41Å; W211-L226 HydrophobicContact CZ2-CB 4.28Å; W211-L226 WeakPolarHBondContact CZ2-O 3.25Å; W211-W230 HydrophobicContact CZ2-CB 3.94Å; W211-W230 HydrophobicContact CZ2-CG 4.44Å
212	N	98.4	Very high	98.4	Very high	81 Å²	81	38.1 Å²	38.1	43%	0.433	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	53.4	-178	-163.3	28.9	0	0	0	113.9	Y128 S129 L131 Q184	Y128-N212 WeakPolarHBondContact CD1-O 3.05Å; S129-N212 PolarHBondContact O-N 2.94Å; L131-N212 HydrophobicContact CD1-CB 3.72Å; L131-N212 HydrophobicContact CD2-CB 3.98Å; L131-N212 HydrophobicContact CG-CB 3.83Å; Q184-N212 PolarHBondContact NE2-OD1 2.92Å
213	Y	98.4	Very high	98.4	Very high	4 Å²	4	38 Å²	38	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.2	173.8	79.6	-83.3	0	0	0	110.2	G183 Q184 W211 D215 N219 L222 K223 L226	G183-Y213 PolarHBondContact N-OH 3.16Å; Q184-Y213 WeakPolarHBondContact CB-O 3.33Å; Q184-Y213 PolarHBondContact N-O 2.89Å; W211-Y213 HydrophobicContact CB-CD1 3.66Å; W211-Y213 HydrophobicContact CB-CE1 3.97Å; W211-Y213 PolarHBondContact O-N 3.31Å; Y213-D215 HydrophobicContact CE2-CB 4.29Å; Y213-D215 PolarHBondContact O-N 3.04Å; Y213-D215 VanDerWaalsContact OH-CG 3.28Å; Y213-D215 PolarHBondContact OH-OD1 2.04Å; Y213-N219 HydrophobicContact CD2-CB 3.96Å; Y213-N219 HydrophobicContact CE2-CB 3.8Å; Y213-L222 HydrophobicContact CD1-CD2 4.45Å; Y213-L222 HydrophobicContact CD2-CD2 3.66Å; Y213-L222 HydrophobicContact CD2-CG 4.43Å; Y213-L222 HydrophobicContact CE2-CD2 4.44Å; Y213-L222 HydrophobicContact CG-CD2 3.69Å; Y213-L222 HydrophobicContact CG-CG 4.43Å; Y213-K223 WeakPolarHBondContact OH-CB 3.34Å; Y213-K223 WeakPolarHBondContact OH-CE 3.4Å; Y213-L226 HydrophobicContact CD1-CD1 3.61Å; Y213-L226 HydrophobicContact CE1-CD1 3.92Å; Y213-L226 HydrophobicContact CG-CD1 4.38Å
214	R	98.3	Very high	98.4	Very high	97 Å²	97	32.9 Å²	32.9	37%	0.366	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	113.4	177.7	-173	-170.2	172.1	-156.6	3.4	110.8	D118 P186 D189 T216 N219	D118-R214 IonicContact OD2-CZ 3.97Å; D118-R214 IonicContact OD2-NH1 3.01Å; D118-R214 PolarHBondContact OD2-NH1 3.25Å; P186-R214 HydrophobicContact CG-CG 4.06Å; D189-R214 IonicContact OD1-CZ 3.76Å; D189-R214 IonicContact OD1-NE 3.83Å; D189-R214 PolarHBondContact OD1-NE 3.5Å; D189-R214 IonicContact OD1-NH2 3.75Å; D189-R214 PolarHBondContact OD1-NH2 2.81Å; D189-R214 WeakPolarHBondContact OD2-CG 3.41Å; D189-R214 IonicContact OD2-CZ 3.39Å; D189-R214 IonicContact OD2-NE 2.74Å; D189-R214 PolarHBondContact OD2-NE 2.91Å; D189-R214 IonicContact OD2-NH2 3.66Å; R214-T216 HydrophobicContact CG-CG2 3.86Å; R214-T216 PolarHBondContact O-N 2.72Å; R214-T216 VanDerWaalsContact O-N 3.09Å; R214-N219 PolarHBondContact O-ND2 3.23Å
215	D	98.1	Very high	98.4	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.043	13%	0.127	C	C	.	.			trans	-79.2	93.6	-174.3	-152.1	-5	0	0	0	111.5	L151 G183 Q184 Y213 K223	L151-D215 HydrophobicContact CD2-CB 3.9Å; G183-D215 PolarHBondContact N-OD2 2.89Å; Q184-D215 WeakPolarHBondContact O-CB 3.48Å; Q184-D215 PolarHBondContact O-N 3.01Å; Y213-D215 HydrophobicContact CE2-CB 4.29Å; Y213-D215 PolarHBondContact O-N 3.04Å; Y213-D215 VanDerWaalsContact OH-CG 3.28Å; Y213-D215 PolarHBondContact OH-OD1 2.04Å; D215-K223 VanDerWaalsContact CG-NZ 3.33Å; D215-K223 WeakPolarHBondContact OD1-CE 3.19Å; D215-K223 IonicContact OD1-NZ 2.99Å; D215-K223 PolarHBondContact OD1-NZ 3.03Å; D215-K223 VanDerWaalsContact OD1-NZ 3.12Å; D215-K223 WeakPolarHBondContact OD2-CE 3.49Å; D215-K223 IonicContact OD2-NZ 3.97Å; D215-K223 PolarHBondContact OD2-NZ 3.34Å
216	T	97.7	Very high	98.4	Very high	39 Å²	39	24.2 Å²	24.2	24%	0.239	12%	0.116	C	C	.	.			trans	-125.5	162.6	178.5	70.2	0	0	0	0	110.3	R214 F218 N219 L220	R214-T216 HydrophobicContact CG-CG2 3.86Å; R214-T216 PolarHBondContact O-N 2.72Å; R214-T216 VanDerWaalsContact O-N 3.09Å; T216-F218 VanDerWaalsContact C-N 3.25Å; T216-F218 PolarHBondContact O-N 3.12Å; T216-N219 PolarHBondContact O-N 2.86Å; T216-N219 PolarHBondContact OG1-ND2 3.37Å; T216-L220 PolarHBondContact O-N 2.88Å
217	F	96.3	Very high	98.4	Very high	57 Å²	57	18.2 Å²	18.2	25%	0.25	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-54	-39	178.3	-178.1	-97.9	0	0	0	113.1	N219 L220 Y289	F217-N219 VanDerWaalsContact C-N 3.31Å; F217-N219 PolarHBondContact O-N 2.63Å; F217-L220 HydrophobicContact CD2-CD1 3.7Å; F217-L220 HydrophobicContact CE2-CD1 3.83Å; F217-L220 WeakPolarHBondContact O-CB 3.45Å; F217-L220 WeakPolarHBondContact O-CG 3.35Å; F217-L220 PolarHBondContact O-N 3.26Å; F217-Y289 AromaticContact CE1-CD1 3.85Å; F217-Y289 HydrophobicContact CE1-CD1 3.85Å; F217-Y289 HydrophobicContact CE1-CE1 4.03Å; F217-Y289 HydrophobicContact CE2-CD1 4.33Å; F217-Y289 AromaticContact CE2-CE1 3.66Å; F217-Y289 HydrophobicContact CE2-CE1 3.66Å; F217-Y289 AromaticContact CZ-CD1 3.42Å; F217-Y289 HydrophobicContact CZ-CD1 3.42Å; F217-Y289 VanDerWaalsContact CZ-CD1 3.42Å; F217-Y289 AromaticContact CZ-CE1 3.18Å; F217-Y289 HydrophobicContact CZ-CE1 3.18Å
218	F	97.8	Very high	98.5	Very high	5 Å²	5	18.4 Å²	18.4	2%	0.022	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-77.9	-13.5	179.2	-81.4	12.4	0	0	0	114.3	R115 F116 F119 T216 P330	R115-F218 HydrophobicContact CB-CD2 4.01Å; R115-F218 HydrophobicContact CB-CE2 4.16Å; R115-F218 HydrophobicContact CG-CD2 4.06Å; R115-F218 HydrophobicContact CG-CE2 3.68Å; R115-F218 HydrophobicContact CG-CZ 4.11Å; R115-F218 WeakPolarHBondContact O-CD2 3.04Å; F116-F218 AromaticContact CD1-CE2 3.59Å; F116-F218 HydrophobicContact CD1-CE2 3.59Å; F116-F218 HydrophobicContact CD1-CZ 4.29Å; F116-F218 AromaticContact CD2-CE2 3.97Å; F116-F218 HydrophobicContact CD2-CE2 3.97Å; F116-F218 HydrophobicContact CD2-CZ 4.41Å; F116-F218 AromaticContact CE1-CE2 3.44Å; F116-F218 HydrophobicContact CE1-CE2 3.44Å; F116-F218 VanDerWaalsContact CE1-CE2 3.44Å; F116-F218 AromaticContact CE1-CZ 3.68Å; F116-F218 HydrophobicContact CE1-CZ 3.68Å; F116-F218 AromaticContact CE2-CE2 3.85Å; F116-F218 HydrophobicContact CE2-CE2 3.85Å; F116-F218 AromaticContact CE2-CZ 3.84Å; F116-F218 HydrophobicContact CE2-CZ 3.84Å; F116-F218 AromaticContact CG-CE2 3.84Å; F116-F218 HydrophobicContact CG-CE2 3.84Å; F116-F218 AromaticContact CZ-CE2 3.56Å; F116-F218 HydrophobicContact CZ-CE2 3.56Å; F116-F218 AromaticContact CZ-CZ 3.42Å; F116-F218 HydrophobicContact CZ-CZ 3.42Å; F116-F218 VanDerWaalsContact CZ-CZ 3.42Å; F119-F218 HydrophobicContact CB-CD2 4.1Å; F119-F218 HydrophobicContact CD2-CB 4.37Å; F119-F218 HydrophobicContact CG-CD2 4.46Å; T216-F218 VanDerWaalsContact C-N 3.25Å; T216-F218 PolarHBondContact O-N 3.12Å; F218-P330 HydrophobicContact CB-CB 4.38Å; F218-P330 HydrophobicContact CD1-CB 3.65Å; F218-P330 WeakPolarHBondContact CD1-O 3.12Å; F218-P330 HydrophobicContact CD2-CB 3.81Å; F218-P330 HydrophobicContact CD2-CG 4.35Å; F218-P330 HydrophobicContact CE1-CB 3.75Å; F218-P330 HydrophobicContact CE2-CB 3.88Å; F218-P330 HydrophobicContact CE2-CG 4.36Å; F218-P330 HydrophobicContact CG-CB 3.7Å; F218-P330 HydrophobicContact CZ-CB 3.86Å
219	N	98.6	Very high	98.4	Very high	36 Å²	36	21.5 Å²	21.5	19%	0.193	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-94.5	7.7	174	-72.1	-21.5	0	0	0	112.6	Y213 R214 T216 F217 S221 L222 K223	Y213-N219 HydrophobicContact CD2-CB 3.96Å; Y213-N219 HydrophobicContact CE2-CB 3.8Å; R214-N219 PolarHBondContact O-ND2 3.23Å; T216-N219 PolarHBondContact O-N 2.86Å; T216-N219 PolarHBondContact OG1-ND2 3.37Å; F217-N219 VanDerWaalsContact C-N 3.31Å; F217-N219 PolarHBondContact O-N 2.63Å; N219-S221 VanDerWaalsContact C-N 3.26Å; N219-S221 PolarHBondContact O-N 2.75Å; N219-L222 HydrophobicContact CB-CB 4.46Å; N219-L222 WeakPolarHBondContact O-CA 3.46Å; N219-L222 VanDerWaalsContact O-CB 3.29Å; N219-L222 WeakPolarHBondContact O-CB 2.75Å; N219-L222 PolarHBondContact O-N 3.49Å; N219-K223 PolarHBondContact O-N 3.11Å
220	L	98.4	Very high	98.4	Very high	24 Å²	24	21.8 Å²	21.8	13%	0.126	10%	0.102	C	C	.	.	H	α-helix	trans	-65.4	-28.7	176.6	-69.6	176.3	0	0	0	112.8	K149 T216 F217 L222 K223 E224 D332	K149-L220 HydrophobicContact CD-CD2 4.4Å; T216-L220 PolarHBondContact O-N 2.88Å; F217-L220 HydrophobicContact CD2-CD1 3.7Å; F217-L220 HydrophobicContact CE2-CD1 3.83Å; F217-L220 WeakPolarHBondContact O-CB 3.45Å; F217-L220 WeakPolarHBondContact O-CG 3.35Å; F217-L220 PolarHBondContact O-N 3.26Å; L220-L222 VanDerWaalsContact C-N 3.31Å; L220-K223 HydrophobicContact CD2-CD 4.13Å; L220-K223 WeakPolarHBondContact O-CB 3.36Å; L220-K223 PolarHBondContact O-N 3.39Å; L220-E224 PolarHBondContact O-N 3.19Å; L220-D332 HydrophobicContact CB-CB 3.61Å
221	S	98.4	Very high	98.4	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-68.8	-32	170.9	58.2	0	0	0	0	111.9	N219 E224 V225 Y329	N219-S221 VanDerWaalsContact C-N 3.26Å; N219-S221 PolarHBondContact O-N 2.75Å; S221-E224 WeakPolarHBondContact O-CB 3.29Å; S221-E224 PolarHBondContact O-N 3.03Å; S221-V225 WeakPolarHBondContact O-CG2 3.5Å; S221-V225 PolarHBondContact O-N 3.31Å; S221-Y329 WeakPolarHBondContact CB-O 3.3Å; S221-Y329 PolarHBondContact OG-N 3.1Å; S221-Y329 PolarHBondContact OG-O 3.37Å
222	L	98.8	Very high	98.4	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.016	11%	0.113	C	C	.	.	H	α-helix	trans	-66.8	-43.1	170.5	173.5	65.2	0	0	0	110.9	R126 Y128 Y213 N219 L220 E224 V225 L226 L328	R126-L222 HydrophobicContact CB-CD1 3.65Å; Y128-L222 HydrophobicContact CD2-CD1 3.95Å; Y128-L222 HydrophobicContact CD2-CD2 3.55Å; Y128-L222 HydrophobicContact CD2-CG 4.26Å; Y128-L222 HydrophobicContact CE2-CD1 4.21Å; Y128-L222 HydrophobicContact CE2-CD2 3.35Å; Y128-L222 HydrophobicContact CE2-CG 4.39Å; Y213-L222 HydrophobicContact CD1-CD2 4.45Å; Y213-L222 HydrophobicContact CD2-CD2 3.66Å; Y213-L222 HydrophobicContact CD2-CG 4.43Å; Y213-L222 HydrophobicContact CE2-CD2 4.44Å; Y213-L222 HydrophobicContact CG-CD2 3.69Å; Y213-L222 HydrophobicContact CG-CG 4.43Å; N219-L222 HydrophobicContact CB-CB 4.46Å; N219-L222 WeakPolarHBondContact O-CA 3.46Å; N219-L222 VanDerWaalsContact O-CB 3.29Å; N219-L222 WeakPolarHBondContact O-CB 2.75Å; N219-L222 PolarHBondContact O-N 3.49Å; L220-L222 VanDerWaalsContact C-N 3.31Å; L222-E224 PolarHBondContact O-N 3.24Å; L222-V225 PolarHBondContact O-N 3.31Å; L222-L226 HydrophobicContact CD1-CD1 3.95Å; L222-L226 HydrophobicContact CD1-CG 3.96Å; L222-L226 HydrophobicContact CD2-CD1 4.47Å; L222-L226 HydrophobicContact CG-CD1 3.81Å; L222-L226 HydrophobicContact CG-CG 4.28Å; L222-L226 WeakPolarHBondContact O-CB 3.42Å; L222-L226 VanDerWaalsContact O-CG 3.27Å; L222-L226 WeakPolarHBondContact O-CG 3.3Å; L222-L226 PolarHBondContact O-N 3.35Å; L222-L328 HydrophobicContact CB-CD1 4.14Å; L222-L328 HydrophobicContact CD1-CD1 4.35Å
223	K	98.8	Very high	98.4	Very high	4 Å²	4	24 Å²	24	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-54.1	-42.8	171.8	-173.5	177.2	-72	-165.9	0	111.1	K149 S150 L181 Y213 D215 N219 L220 F227	K149-K223 HydrophobicContact CB-CD 4.33Å; K149-K223 HydrophobicContact CG-CD 3.93Å; S150-K223 PolarHBondContact O-NZ 3.29Å; L181-K223 HydrophobicContact CB-CD 3.9Å; L181-K223 HydrophobicContact CB-CG 4.06Å; L181-K223 WeakPolarHBondContact O-CE 3.05Å; L181-K223 PolarHBondContact O-NZ 2.99Å; Y213-K223 WeakPolarHBondContact OH-CB 3.34Å; Y213-K223 WeakPolarHBondContact OH-CE 3.4Å; D215-K223 VanDerWaalsContact CG-NZ 3.33Å; D215-K223 WeakPolarHBondContact OD1-CE 3.19Å; D215-K223 IonicContact OD1-NZ 2.99Å; D215-K223 PolarHBondContact OD1-NZ 3.03Å; D215-K223 VanDerWaalsContact OD1-NZ 3.12Å; D215-K223 WeakPolarHBondContact OD2-CE 3.49Å; D215-K223 IonicContact OD2-NZ 3.97Å; D215-K223 PolarHBondContact OD2-NZ 3.34Å; N219-K223 PolarHBondContact O-N 3.11Å; L220-K223 HydrophobicContact CD2-CD 4.13Å; L220-K223 WeakPolarHBondContact O-CB 3.36Å; L220-K223 PolarHBondContact O-N 3.39Å; K223-F227 VanDerWaalsContact O-CB 3.3Å; K223-F227 WeakPolarHBondContact O-CB 3.21Å; K223-F227 PolarHBondContact O-N 2.83Å
224	E	98.6	Very high	98.4	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-50.9	175.2	179.6	63.8	-175.7	0	0	112.4	L220 S221 L222 L226 F227 L228 K243 Y335	L220-E224 PolarHBondContact O-N 3.19Å; S221-E224 WeakPolarHBondContact O-CB 3.29Å; S221-E224 PolarHBondContact O-N 3.03Å; L222-E224 PolarHBondContact O-N 3.24Å; E224-L226 PolarHBondContact O-N 3.28Å; E224-F227 PolarHBondContact O-N 3.48Å; E224-L228 HydrophobicContact CG-CD1 4.01Å; E224-L228 HydrophobicContact CG-CG 4.48Å; E224-L228 WeakPolarHBondContact O-CB 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.31Å; E224-L228 PolarHBondContact O-N 2.98Å; E224-K243 WeakPolarHBondContact OE2-CD 3.48Å; E224-K243 WeakPolarHBondContact OE2-CE 3.39Å; E224-K243 IonicContact OE2-NZ 2.57Å; E224-K243 PolarHBondContact OE2-NZ 2.94Å; E224-Y335 HydrophobicContact CG-CD1 4.46Å
225	V	98.8	Very high	98.4	Very high	8 Å²	8	20.7 Å²	20.7	5%	0.048	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-43.9	-179.7	174.5	0	0	0	0	111.5	S221 L222 F227 L228 R229 T323 L328 Y335	S221-V225 WeakPolarHBondContact O-CG2 3.5Å; S221-V225 PolarHBondContact O-N 3.31Å; L222-V225 PolarHBondContact O-N 3.31Å; V225-F227 VanDerWaalsContact C-N 3.34Å; V225-F227 PolarHBondContact O-N 3Å; V225-L228 PolarHBondContact O-N 2.9Å; V225-R229 WeakPolarHBondContact O-CB 3.45Å; V225-R229 PolarHBondContact O-N 3.43Å; V225-T323 HydrophobicContact CG2-CG2 3.99Å; V225-L328 HydrophobicContact CG2-CD2 3.69Å; V225-Y335 HydrophobicContact CG2-CE1 3.62Å; V225-Y335 WeakPolarHBondContact CG2-OH 3.38Å
226	L	98.9	Very high	98.4	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-38.2	179.5	-68.7	171.4	0	0	0	112	R126 W211 Y213 L222 E224 R229 W230	R126-L226 WeakPolarHBondContact O-CD2 3.38Å; W211-L226 HydrophobicContact CB-CD1 3.86Å; W211-L226 HydrophobicContact CD2-CB 4.01Å; W211-L226 HydrophobicContact CD2-CD1 4.34Å; W211-L226 HydrophobicContact CG-CB 4.18Å; W211-L226 HydrophobicContact CG-CD1 3.81Å; W211-L226 HydrophobicContact CG-CG 4.41Å; W211-L226 HydrophobicContact CZ2-CB 4.28Å; W211-L226 WeakPolarHBondContact CZ2-O 3.25Å; Y213-L226 HydrophobicContact CD1-CD1 3.61Å; Y213-L226 HydrophobicContact CE1-CD1 3.92Å; Y213-L226 HydrophobicContact CG-CD1 4.38Å; L222-L226 HydrophobicContact CD1-CD1 3.95Å; L222-L226 HydrophobicContact CD1-CG 3.96Å; L222-L226 HydrophobicContact CD2-CD1 4.47Å; L222-L226 HydrophobicContact CG-CD1 3.81Å; L222-L226 HydrophobicContact CG-CG 4.28Å; L222-L226 WeakPolarHBondContact O-CB 3.42Å; L222-L226 VanDerWaalsContact O-CG 3.27Å; L222-L226 WeakPolarHBondContact O-CG 3.3Å; L222-L226 PolarHBondContact O-N 3.35Å; E224-L226 PolarHBondContact O-N 3.28Å; L226-R229 VanDerWaalsContact CD2-NH2 3.27Å; L226-R229 WeakPolarHBondContact O-CB 3.42Å; L226-W230 PolarHBondContact O-N 3.42Å
227	F	98.9	Very high	98.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.3	-48.6	173.5	166.8	-113.4	0	0	0	112.1	L145 A147 V179 L181 K223 E224 V225 R229 W230 V231 V241 Y311	L145-F227 HydrophobicContact CD2-CE2 4.08Å; L145-F227 HydrophobicContact CD2-CZ 4Å; A147-F227 HydrophobicContact CB-CD2 4.22Å; A147-F227 HydrophobicContact CB-CE1 3.9Å; A147-F227 HydrophobicContact CB-CE2 3.42Å; A147-F227 VanDerWaalsContact CB-CE2 3.42Å; A147-F227 HydrophobicContact CB-CZ 3.23Å; V179-F227 HydrophobicContact CG2-CE2 4.41Å; L181-F227 HydrophobicContact CD1-CB 3.86Å; L181-F227 HydrophobicContact CD1-CD1 4.24Å; L181-F227 HydrophobicContact CD1-CD2 3.94Å; L181-F227 HydrophobicContact CD1-CG 3.72Å; L181-F227 HydrophobicContact CD2-CB 4.22Å; L181-F227 HydrophobicContact CD2-CD2 3.52Å; L181-F227 HydrophobicContact CD2-CE2 4.22Å; L181-F227 HydrophobicContact CD2-CG 4.07Å; L181-F227 HydrophobicContact CG-CD2 4.37Å; K223-F227 VanDerWaalsContact O-CB 3.3Å; K223-F227 WeakPolarHBondContact O-CB 3.21Å; K223-F227 PolarHBondContact O-N 2.83Å; E224-F227 PolarHBondContact O-N 3.48Å; V225-F227 VanDerWaalsContact C-N 3.34Å; V225-F227 PolarHBondContact O-N 3Å; F227-R229 PolarHBondContact O-N 3.12Å; F227-W230 HydrophobicContact CE2-CE3 4.35Å; F227-W230 CarbonylContact O-C 3.46Å; F227-W230 WeakPolarHBondContact O-CA 3.41Å; F227-W230 WeakPolarHBondContact O-CB 3.36Å; F227-W230 PolarHBondContact O-N 3.3Å; F227-V231 HydrophobicContact CD2-CG2 4.14Å; F227-V231 HydrophobicContact CE1-CG2 4Å; F227-V231 HydrophobicContact CE2-CG2 3.51Å; F227-V231 HydrophobicContact CZ-CG2 3.43Å; F227-V231 VanDerWaalsContact CZ-CG2 3.43Å; F227-V231 PolarHBondContact O-N 2.81Å; F227-V241 HydrophobicContact CE1-CG1 4.1Å; F227-V241 HydrophobicContact CZ-CG1 3.84Å; F227-Y311 WeakPolarHBondContact CE1-OH 3.46Å
228	L	98.9	Very high	98.6	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-36.1	177.1	-73.8	174.9	0	0	0	111.8	E224 V225 V231 S232 A316 L319 Y320 T323	E224-L228 HydrophobicContact CG-CD1 4.01Å; E224-L228 HydrophobicContact CG-CG 4.48Å; E224-L228 WeakPolarHBondContact O-CB 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.31Å; E224-L228 PolarHBondContact O-N 2.98Å; V225-L228 PolarHBondContact O-N 2.9Å; L228-V231 PolarHBondContact O-N 3.35Å; L228-S232 PolarHBondContact O-N 2.96Å; L228-A316 HydrophobicContact CD2-CB 4.25Å; L228-L319 HydrophobicContact CD1-CB 3.96Å; L228-L319 HydrophobicContact CD2-CB 4.27Å; L228-Y320 HydrophobicContact CB-CD2 4.15Å; L228-Y320 HydrophobicContact CB-CG 4.44Å; L228-T323 HydrophobicContact CD1-CG2 3.97Å
229	R	98.8	Very high	98.6	Very high	66 Å²	66	27.2 Å²	27.2	25%	0.249	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-48.2	170.2	-177.5	175.4	69.5	174.5	3.6	111.5	Y128 V225 L226 F227 V231 S232 T233 Y320	Y128-R229 PolarHBondContact O-NH2 3.31Å; V225-R229 WeakPolarHBondContact O-CB 3.45Å; V225-R229 PolarHBondContact O-N 3.43Å; L226-R229 VanDerWaalsContact CD2-NH2 3.27Å; L226-R229 WeakPolarHBondContact O-CB 3.42Å; F227-R229 PolarHBondContact O-N 3.12Å; R229-V231 VanDerWaalsContact C-N 3.34Å; R229-V231 PolarHBondContact O-N 3.38Å; R229-S232 WeakPolarHBondContact O-CB 3.13Å; R229-S232 PolarHBondContact O-N 2.86Å; R229-S232 VanDerWaalsContact O-N 3.12Å; R229-T233 PolarHBondContact O-N 3.46Å; R229-T233 PolarHBondContact O-OG1 2.84Å; R229-Y320 VanDerWaalsContact CA-CE2 3.42Å; R229-Y320 HydrophobicContact CB-CD2 4.01Å; R229-Y320 HydrophobicContact CB-CE2 3.41Å; R229-Y320 VanDerWaalsContact CB-CE2 3.41Å; R229-Y320 HydrophobicContact CG-CE2 3.86Å; R229-Y320 WeakPolarHBondContact CG-OH 3.39Å
230	W	98.9	Very high	98.6	Very high	5 Å²	5	26 Å²	26	2%	0.019	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-39.3	178.3	-179.9	93.6	0	0	0	112.4	D133 K137 L145 V179 L209 W211 L226 F227 S232 T233 S234 C235	D133-W230 PolarHBondContact OD1-NE1 2.65Å; K137-W230 HydrophobicContact CB-CH2 4.19Å; K137-W230 HydrophobicContact CB-CZ2 4.19Å; K137-W230 HydrophobicContact CG-CH2 4.19Å; L145-W230 HydrophobicContact CD1-CZ3 4.44Å; L145-W230 HydrophobicContact CD2-CZ3 4.06Å; V179-W230 HydrophobicContact CG1-CH2 4.08Å; V179-W230 HydrophobicContact CG1-CZ2 4.47Å; L209-W230 HydrophobicContact CD1-CD2 3.53Å; L209-W230 HydrophobicContact CD1-CE3 3.93Å; L209-W230 HydrophobicContact CD1-CG 3.88Å; L209-W230 HydrophobicContact CD1-CH2 4.38Å; L209-W230 HydrophobicContact CD1-CZ2 4.01Å; L209-W230 HydrophobicContact CD1-CZ3 4.34Å; L209-W230 HydrophobicContact CD2-CZ2 4.19Å; W211-W230 HydrophobicContact CZ2-CB 3.94Å; W211-W230 HydrophobicContact CZ2-CG 4.44Å; L226-W230 PolarHBondContact O-N 3.42Å; F227-W230 HydrophobicContact CE2-CE3 4.35Å; F227-W230 CarbonylContact O-C 3.46Å; F227-W230 WeakPolarHBondContact O-CA 3.41Å; F227-W230 WeakPolarHBondContact O-CB 3.36Å; F227-W230 PolarHBondContact O-N 3.3Å; W230-S232 VanDerWaalsContact C-N 3.3Å; W230-S232 PolarHBondContact O-N 3.49Å; W230-T233 PolarHBondContact O-N 2.83Å; W230-T233 PolarHBondContact O-OG1 2.91Å; W230-S234 WeakPolarHBondContact O-CA 3.29Å; W230-S234 WeakPolarHBondContact O-CB 3.35Å; W230-S234 PolarHBondContact O-N 2.99Å; W230-C235 HydrophobicContact CE3-CB 4.25Å; W230-C235 HydrophobicContact CH2-CB 3.9Å; W230-C235 HydrophobicContact CZ3-CB 3.57Å
231	V	98.8	Very high	98.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-47	171.6	174.2	0	0	0	0	109.9	L145 F227 L228 R229 T233 C235 P236 A316	L145-V231 HydrophobicContact CD2-CG2 3.96Å; F227-V231 HydrophobicContact CD2-CG2 4.14Å; F227-V231 HydrophobicContact CE1-CG2 4Å; F227-V231 HydrophobicContact CE2-CG2 3.51Å; F227-V231 HydrophobicContact CZ-CG2 3.43Å; F227-V231 VanDerWaalsContact CZ-CG2 3.43Å; F227-V231 PolarHBondContact O-N 2.81Å; L228-V231 PolarHBondContact O-N 3.35Å; R229-V231 VanDerWaalsContact C-N 3.34Å; R229-V231 PolarHBondContact O-N 3.38Å; V231-T233 VanDerWaalsContact C-N 3.29Å; V231-T233 PolarHBondContact O-N 2.75Å; V231-C235 CarbonylContact O-C 3.57Å; V231-C235 WeakPolarHBondContact O-CA 3.33Å; V231-C235 PolarHBondContact O-N 3.31Å; V231-P236 VanDerWaalsContact O-CA 3.27Å; V231-P236 WeakPolarHBondContact O-CA 3.14Å; V231-A316 HydrophobicContact CG1-CB 4.06Å
232	S	98.6	Very high	98.7	Very high	44 Å²	44	24.8 Å²	24.8	31%	0.308	14%	0.136	S	C	.	.	H	α-helix	trans	-63.8	-29.3	179.5	-173.8	0	0	0	0	114.5	L228 R229 W230 Y320	L228-S232 PolarHBondContact O-N 2.96Å; R229-S232 WeakPolarHBondContact O-CB 3.13Å; R229-S232 PolarHBondContact O-N 2.86Å; R229-S232 VanDerWaalsContact O-N 3.12Å; W230-S232 VanDerWaalsContact C-N 3.3Å; W230-S232 PolarHBondContact O-N 3.49Å; S232-Y320 WeakPolarHBondContact OG-CD1 3.43Å
233	T	98.1	Very high	98.7	Very high	96 Å²	96	24.8 Å²	24.8	59%	0.589	14%	0.136	S	C	*	.	H	α-helix	trans	-97	-35.4	-176.8	56.1	0	0	0	0	113.7	R229 W230 V231	R229-T233 PolarHBondContact O-N 3.46Å; R229-T233 PolarHBondContact O-OG1 2.84Å; W230-T233 PolarHBondContact O-N 2.83Å; W230-T233 PolarHBondContact O-OG1 2.91Å; V231-T233 VanDerWaalsContact C-N 3.29Å; V231-T233 PolarHBondContact O-N 2.75Å
234	S	98.4	Very high	98.6	Very high	31 Å²	31	24.6 Å²	24.6	22%	0.217	14%	0.136	C	C	.	.	H	α-helix	trans	-121.8	-17.6	-165.6	-49.7	0	0	0	0	113.2	W230	W230-S234 WeakPolarHBondContact O-CA 3.29Å; W230-S234 WeakPolarHBondContact O-CB 3.35Å; W230-S234 PolarHBondContact O-N 2.99Å
235	C	98.6	Very high	98.6	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.014	15%	0.145	C	C	.	.			trans	-141.7	45.1	179.3	-158.7	0	0	0	0	114.1	C138 W230 V231 D237 T238	C138-C235 HydrophobicContact CB-CB 3.7Å; C138-C235 WeakPolarHBondContact CB-SG 3.32Å; C138-C235 WeakPolarHBondContact SG-CB 3.12Å; C138-C235 CovalentContact SG-SG 2.03Å; C138-C235 PolarHBondContact SG-SG 3.35Å; W230-C235 HydrophobicContact CE3-CB 4.25Å; W230-C235 HydrophobicContact CH2-CB 3.9Å; W230-C235 HydrophobicContact CZ3-CB 3.57Å; V231-C235 CarbonylContact O-C 3.57Å; V231-C235 WeakPolarHBondContact O-CA 3.33Å; V231-C235 PolarHBondContact O-N 3.31Å; C235-D237 VanDerWaalsContact C-N 3.25Å; C235-D237 PolarHBondContact O-N 2.88Å; C235-T238 PolarHBondContact O-N 2.94Å
236	P	98.3	Very high	98.6	Very high	46 Å²	46	26.2 Å²	26.2	30%	0.299	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.9	-167.5	28.2	-36.6	0	0	0	113.5	V231 L317	V231-P236 VanDerWaalsContact O-CA 3.27Å; V231-P236 WeakPolarHBondContact O-CA 3.14Å; P236-L317 HydrophobicContact CB-CD2 4.2Å
237	D	98.1	Very high	98.6	Very high	113 Å²	113	27.7 Å²	27.7	60%	0.604	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	5.2	-172.5	-64.7	-46.4	0	0	0	114	K141 C235 E239	K141-D237 HydrophobicContact CD-CB 4.33Å; K141-D237 WeakPolarHBondContact CE-O 3.34Å; K141-D237 HydrophobicContact CG-CB 3.97Å; K141-D237 VanDerWaalsContact CG-O 3.24Å; K141-D237 WeakPolarHBondContact CG-O 3.35Å; C235-D237 VanDerWaalsContact C-N 3.25Å; C235-D237 PolarHBondContact O-N 2.88Å; D237-E239 PolarHBondContact O-N 3.36Å
238	T	98.6	Very high	98.6	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.025	15%	0.152	C	C	.	.			trans	-56.9	137.2	174.4	-171.3	0	0	0	0	110.8	P142 L145 C235 F240 V241 G313	P142-T238 WeakPolarHBondContact O-CA 3.33Å; L145-T238 HydrophobicContact CB-CG2 4.3Å; L145-T238 HydrophobicContact CD2-CG2 4.4Å; C235-T238 PolarHBondContact O-N 2.94Å; T238-F240 PolarHBondContact OG1-O 3.03Å; T238-V241 HydrophobicContact CG2-CG2 3.7Å; T238-G313 WeakPolarHBondContact O-CA 3.27Å
239	E	98.5	Very high	98.6	Very high	82 Å²	82	27.6 Å²	27.6	38%	0.383	15%	0.151	S	C	.	.	S	Bend	trans	-74.1	-42.5	-177.9	-61.3	-163.4	170.2	0	0	111.8	K141 P142 F143 D237 S312 G313	K141-E239 IonicContact NZ-OE1 3.7Å; K141-E239 PolarHBondContact NZ-OE1 3.18Å; P142-E239 PolarHBondContact O-N 3.22Å; F143-E239 HydrophobicContact CD2-CB 4.25Å; F143-E239 HydrophobicContact CD2-CG 4.45Å; F143-E239 WeakPolarHBondContact CD2-OE2 2.86Å; F143-E239 VanDerWaalsContact CE2-OE2 3.29Å; F143-E239 WeakPolarHBondContact CE2-OE2 3.19Å; D237-E239 PolarHBondContact O-N 3.36Å; E239-S312 WeakPolarHBondContact O-CA 3.38Å; E239-G313 PolarHBondContact O-N 3.06Å
240	F	98.9	Very high	98.6	Very high	11 Å²	11	24.4 Å²	24.4	5%	0.048	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	157.9	178.4	-58.8	-77.9	0	0	0	111.7	F143 L144 L145 T238 L259 L262 A267 L270 Y311	F143-F240 HydrophobicContact CE1-CD2 4.35Å; F143-F240 HydrophobicContact CE2-CD2 4.1Å; F143-F240 AromaticContact CE2-CE2 3.85Å; F143-F240 HydrophobicContact CE2-CE2 3.85Å; F143-F240 HydrophobicContact CZ-CD2 4.01Å; F143-F240 AromaticContact CZ-CE2 3.84Å; F143-F240 HydrophobicContact CZ-CE2 3.84Å; F143-F240 PolarHBondContact O-N 3.48Å; L144-F240 HydrophobicContact CD1-CB 4.01Å; L145-F240 PolarHBondContact N-O 2.97Å; T238-F240 PolarHBondContact OG1-O 3.03Å; F240-L259 HydrophobicContact CB-CD1 3.87Å; F240-L259 HydrophobicContact CB-CD2 4.23Å; F240-L259 HydrophobicContact CD1-CD2 3.48Å; F240-L259 VanDerWaalsContact CD1-CD2 3.48Å; F240-L259 HydrophobicContact CD2-CB 4.26Å; F240-L259 HydrophobicContact CD2-CD1 3.75Å; F240-L259 HydrophobicContact CD2-CD2 3.85Å; F240-L259 HydrophobicContact CD2-CG 4.17Å; F240-L259 HydrophobicContact CE1-CD2 3.68Å; F240-L259 HydrophobicContact CE2-CB 4.14Å; F240-L259 HydrophobicContact CE2-CD1 4.46Å; F240-L259 HydrophobicContact CE2-CD2 4.03Å; F240-L259 HydrophobicContact CE2-CG 4.44Å; F240-L259 HydrophobicContact CG-CD1 3.81Å; F240-L259 HydrophobicContact CG-CD2 3.56Å; F240-L259 HydrophobicContact CG-CG 4.22Å; F240-L259 HydrophobicContact CZ-CD2 3.94Å; F240-L262 HydrophobicContact CE1-CD1 4.22Å; F240-L262 HydrophobicContact CZ-CD1 4.33Å; F240-A267 HydrophobicContact CE1-CB 4.15Å; F240-A267 HydrophobicContact CZ-CB 3.9Å; F240-L270 HydrophobicContact CD1-CD2 3.91Å; F240-L270 HydrophobicContact CE1-CD2 3.88Å; F240-Y311 CarbonylContact C-O 3.37Å; F240-Y311 WeakPolarHBondContact CA-O 3.24Å
241	V	98.9	Very high	98.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.9	175.7	-176.2	0	0	0	0	108	L145 F227 T238 Y311 A316	L145-V241 HydrophobicContact CB-CG2 4.35Å; L145-V241 HydrophobicContact CD2-CG1 4.45Å; L145-V241 HydrophobicContact CD2-CG2 4.3Å; L145-V241 WeakPolarHBondContact O-CA 3.48Å; F227-V241 HydrophobicContact CE1-CG1 4.1Å; F227-V241 HydrophobicContact CZ-CG1 3.84Å; T238-V241 HydrophobicContact CG2-CG2 3.7Å; V241-Y311 HydrophobicContact CB-CD2 4.08Å; V241-Y311 HydrophobicContact CB-CE1 4.11Å; V241-Y311 HydrophobicContact CB-CE2 3.64Å; V241-Y311 HydrophobicContact CG1-CE1 3.98Å; V241-Y311 HydrophobicContact CG1-CE2 3.98Å; V241-Y311 WeakPolarHBondContact CG1-OH 3.48Å; V241-Y311 HydrophobicContact CG2-CE2 4.06Å; V241-Y311 PolarHBondContact N-O 3.23Å; V241-Y311 PolarHBondContact O-N 3.44Å; V241-A316 HydrophobicContact CG2-CB 4.38Å
242	F	98.9	Very high	98.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.9	161.7	171.1	-95.1	0	0	0	107.8	L144 L145 L146 A147 I148 W165 V250 I255 L310 F353 L374	L144-F242 HydrophobicContact CD1-CB 4.09Å; L145-F242 PolarHBondContact O-N 2.87Å; L146-F242 HydrophobicContact CD2-CB 3.83Å; L146-F242 HydrophobicContact CD2-CD1 4Å; L146-F242 HydrophobicContact CD2-CG 4.24Å; A147-F242 PolarHBondContact N-O 2.95Å; I148-F242 HydrophobicContact CD1-CD1 4.02Å; I148-F242 HydrophobicContact CD1-CE1 3.81Å; W165-F242 HydrophobicContact CZ3-CE1 4.31Å; F242-V250 HydrophobicContact CE1-CG2 3.79Å; F242-V250 HydrophobicContact CE2-CG1 4.39Å; F242-V250 HydrophobicContact CE2-CG2 4.37Å; F242-V250 HydrophobicContact CZ-CG1 4.26Å; F242-V250 HydrophobicContact CZ-CG2 3.54Å; F242-I255 HydrophobicContact CD2-CD1 3.89Å; F242-I255 HydrophobicContact CE2-CD1 4.25Å; F242-I255 HydrophobicContact CG-CD1 4.45Å; F242-L310 HydrophobicContact CB-CD1 3.9Å; F242-F353 HydrophobicContact CE2-CE1 4.31Å; F242-L374 HydrophobicContact CE2-CD1 4.15Å; F242-L374 HydrophobicContact CZ-CD1 3.78Å
243	K	98.8	Very high	98.5	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.9	170.1	-178.8	-171.6	162	-156.1	0	108.9	A147 E224 G308 F309 Y311 D332	A147-K243 VanDerWaalsContact O-CA 3.3Å; A147-K243 WeakPolarHBondContact O-CA 3.21Å; E224-K243 WeakPolarHBondContact OE2-CD 3.48Å; E224-K243 WeakPolarHBondContact OE2-CE 3.39Å; E224-K243 IonicContact OE2-NZ 2.57Å; E224-K243 PolarHBondContact OE2-NZ 2.94Å; K243-G308 CarbonylContact O-C 3.58Å; K243-G308 WeakPolarHBondContact O-CA 3.36Å; K243-F309 HydrophobicContact CB-CD2 4.31Å; K243-F309 HydrophobicContact CB-CE2 3.97Å; K243-F309 HydrophobicContact CB-CZ 4.45Å; K243-F309 HydrophobicContact CD-CE2 3.85Å; K243-F309 HydrophobicContact CD-CZ 3.67Å; K243-F309 HydrophobicContact CG-CE2 4.42Å; K243-F309 HydrophobicContact CG-CZ 4.44Å; K243-F309 PolarHBondContact N-O 3.45Å; K243-F309 PolarHBondContact O-N 2.81Å; K243-Y311 HydrophobicContact CB-CE1 4.04Å; K243-D332 IonicContact NZ-OD2 3.6Å; K243-D332 PolarHBondContact NZ-OD2 3.37Å
244	G	98.1	Very high	98.5	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	173.4	180	0	0	0	0	0	114.4	A147 I148 K149 G307	A147-G244 PolarHBondContact O-N 3.15Å; A147-G244 VanDerWaalsContact O-N 3.11Å; I148-G244 CarbonylContact C-O 3.54Å; I148-G244 WeakPolarHBondContact CA-O 3.39Å; K149-G244 PolarHBondContact N-O 3.06Å; G244-G307 CarbonylContact C-O 3.56Å; G244-G307 WeakPolarHBondContact CA-O 3.3Å
245	D	98.6	Very high	98.5	Very high	36 Å²	36	22.6 Å²	22.6	19%	0.193	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	162.7	170.9	-65.9	-38.7	0	0	0	111	K149 D247 V248 G307	K149-D245 WeakPolarHBondContact CE-OD1 3.31Å; K149-D245 IonicContact NZ-OD1 3.27Å; K149-D245 PolarHBondContact NZ-OD1 2.86Å; K149-D245 IonicContact NZ-OD2 2.76Å; D245-D247 VanDerWaalsContact C-N 3.31Å; D245-D247 WeakPolarHBondContact CB-OD1 3.36Å; D245-D247 PolarHBondContact O-N 3.15Å; D245-V248 HydrophobicContact CB-CG1 4.3Å; D245-V248 WeakPolarHBondContact O-CG2 3.49Å; D245-G307 PolarHBondContact N-O 3.29Å; D245-G307 WeakPolarHBondContact OD2-CA 3.42Å
246	D	98.7	Very high	98.5	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.037	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	6.7	-178.8	67.3	8.9	0	0	0	114.8	I148 K149 S150 H154 R157 I161 M383	I148-D246 HydrophobicContact CG2-CB 3.89Å; K149-D246 WeakPolarHBondContact O-CB 3.39Å; K149-D246 PolarHBondContact O-N 2.88Å; S150-D246 VanDerWaalsContact CA-OD2 3.31Å; S150-D246 WeakPolarHBondContact CA-OD2 3.49Å; S150-D246 VanDerWaalsContact CB-OD2 3.29Å; S150-D246 WeakPolarHBondContact CB-OD2 3.27Å; S150-D246 PolarHBondContact OG-OD2 2.91Å; H154-D246 WeakPolarHBondContact CB-OD2 3.4Å; H154-D246 IonicContact CE1-OD1 2.68Å; H154-D246 IonicContact CE1-OD2 2.76Å; H154-D246 IonicContact CG-OD2 3.99Å; H154-D246 IonicContact ND1-OD1 3.06Å; H154-D246 PolarHBondContact ND1-OD1 3.47Å; H154-D246 IonicContact ND1-OD2 3.17Å; H154-D246 PolarHBondContact ND1-OD2 3.25Å; R157-D246 HydrophobicContact CB-CB 4.17Å; R157-D246 WeakPolarHBondContact CB-O 3.27Å; R157-D246 VanDerWaalsContact CD-CG 3.46Å; R157-D246 WeakPolarHBondContact CD-OD1 3.3Å; R157-D246 IonicContact CZ-OD1 3.78Å; R157-D246 IonicContact NE-OD1 2.64Å; R157-D246 IonicContact NH1-OD1 2.64Å; R157-D246 PolarHBondContact NH1-OD1 2.93Å; I161-D246 HydrophobicContact CD1-CB 3.95Å; D246-M383 WeakPolarHBondContact O-CE 3.41Å
247	D	98.5	Very high	98.4	Very high	33 Å²	33	26.7 Å²	26.7	18%	0.176	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	24.6	175.9	51.4	17.2	0	0	0	113.5	R157 D245 H376 S377 R378	R157-D247 IonicContact CZ-OD2 3.74Å; R157-D247 IonicContact NH1-OD2 2.83Å; R157-D247 PolarHBondContact NH1-OD2 3.12Å; R157-D247 IonicContact NH2-OD2 2.86Å; D245-D247 VanDerWaalsContact C-N 3.31Å; D245-D247 WeakPolarHBondContact CB-OD1 3.36Å; D245-D247 PolarHBondContact O-N 3.15Å; D247-H376 IonicContact OD1-CD2 3.53Å; D247-H376 IonicContact OD1-NE2 3.64Å; D247-S377 CarbonylContact O-C 3.55Å; D247-S377 WeakPolarHBondContact O-CA 3.24Å; D247-S377 VanDerWaalsContact O-CB 3.31Å; D247-S377 WeakPolarHBondContact O-CB 3.38Å; D247-R378 PolarHBondContact O-N 3.17Å
248	V	98.6	Very high	98.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	150.9	173.3	-54.9	0	0	0	0	111.2	W165 D245 V250 L374 V375 H376 M383	W165-V248 HydrophobicContact CZ2-CG2 4.29Å; W165-V248 WeakPolarHBondContact CZ2-O 2.99Å; W165-V248 PolarHBondContact NE1-O 3.29Å; W165-V248 VanDerWaalsContact NE1-O 3.16Å; D245-V248 HydrophobicContact CB-CG1 4.3Å; D245-V248 WeakPolarHBondContact O-CG2 3.49Å; V248-V250 HydrophobicContact CG2-CG2 3.87Å; V248-L374 HydrophobicContact CB-CD1 3.67Å; V248-L374 HydrophobicContact CB-CG 4.01Å; V248-L374 HydrophobicContact CG1-CD1 3.99Å; V248-L374 HydrophobicContact CG1-CG 4.42Å; V248-L374 HydrophobicContact CG2-CD1 3.46Å; V248-L374 VanDerWaalsContact CG2-CD1 3.46Å; V248-L374 HydrophobicContact CG2-CG 4.26Å; V248-V375 WeakPolarHBondContact CA-O 3.35Å; V248-H376 HydrophobicContact CG1-CB 3.92Å; V248-M383 WeakPolarHBondContact O-CE 3.34Å
249	F	98.8	Very high	98.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134.8	162.6	174.3	-91.2	0	0	0	109.3	W165 N251 Y369 L372 L374 V375 R378 M383 I386 W387 L390	W165-F249 HydrophobicContact CB-CE2 4.43Å; W165-F249 AromaticContact CD1-CD2 3.77Å; F249-N251 HydrophobicContact CE1-CB 4.27Å; F249-Y369 HydrophobicContact CD1-CD1 4.09Å; F249-Y369 HydrophobicContact CE1-CD1 4.29Å; F249-L372 HydrophobicContact CD1-CD1 4.43Å; F249-L374 CarbonylContact O-C 3.58Å; F249-L374 VanDerWaalsContact O-CA 3.24Å; F249-L374 WeakPolarHBondContact O-CA 3.45Å; F249-V375 HydrophobicContact CB-CG1 3.9Å; F249-V375 HydrophobicContact CD1-CG1 4.23Å; F249-V375 PolarHBondContact N-O 2.98Å; F249-V375 PolarHBondContact O-N 3.14Å; F249-R378 HydrophobicContact CB-CB 4.22Å; F249-R378 HydrophobicContact CB-CG 3.79Å; F249-M383 HydrophobicContact CD2-CB 4.44Å; F249-I386 HydrophobicContact CD1-CG2 3.97Å; F249-I386 HydrophobicContact CD2-CB 4.03Å; F249-I386 HydrophobicContact CD2-CD1 4.46Å; F249-I386 HydrophobicContact CD2-CG2 3.92Å; F249-I386 HydrophobicContact CE1-CG2 3.6Å; F249-I386 HydrophobicContact CE2-CB 3.87Å; F249-I386 HydrophobicContact CE2-CG2 3.54Å; F249-I386 HydrophobicContact CG-CD1 4.35Å; F249-I386 HydrophobicContact CG-CG2 4.13Å; F249-I386 HydrophobicContact CZ-CB 4.24Å; F249-I386 HydrophobicContact CZ-CG2 3.39Å; F249-W387 HydrophobicContact CE2-CB 4.14Å; F249-W387 HydrophobicContact CE2-CE3 4.2Å; F249-W387 HydrophobicContact CZ-CE3 4.13Å; F249-L390 HydrophobicContact CE1-CD1 3.86Å; F249-L390 HydrophobicContact CZ-CD1 3.57Å
250	V	98.8	Very high	98.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.5	179	-173.2	0	0	0	0	109.3	W165 F242 V248 T252 I255 M373 L374	W165-V250 HydrophobicContact CB-CB 4.29Å; W165-V250 WeakPolarHBondContact CB-O 3.06Å; W165-V250 HydrophobicContact CD2-CB 3.69Å; W165-V250 HydrophobicContact CD2-CG2 3.82Å; W165-V250 HydrophobicContact CE3-CB 3.58Å; W165-V250 HydrophobicContact CE3-CG1 4.44Å; W165-V250 HydrophobicContact CE3-CG2 3.62Å; W165-V250 HydrophobicContact CG-CB 4.04Å; W165-V250 HydrophobicContact CH2-CG2 3.84Å; W165-V250 HydrophobicContact CZ2-CG2 4Å; W165-V250 HydrophobicContact CZ3-CB 4.13Å; W165-V250 HydrophobicContact CZ3-CG2 3.65Å; F242-V250 HydrophobicContact CE1-CG2 3.79Å; F242-V250 HydrophobicContact CE2-CG1 4.39Å; F242-V250 HydrophobicContact CE2-CG2 4.37Å; F242-V250 HydrophobicContact CZ-CG1 4.26Å; F242-V250 HydrophobicContact CZ-CG2 3.54Å; V248-V250 HydrophobicContact CG2-CG2 3.87Å; V250-T252 PolarHBondContact O-N 3.1Å; V250-I255 HydrophobicContact CG1-CD1 3.33Å; V250-I255 HydrophobicContact CG1-CG1 4.36Å; V250-M373 WeakPolarHBondContact CA-O 3.35Å; V250-L374 HydrophobicContact CG2-CD1 4.21Å
251	N	98.6	Very high	98.3	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	14%	0.144	C	C	.	.			trans	-87.3	83.1	167.6	-173.1	-18	0	0	0	108.9	F249 H253 H254 I255 Y369 V370 L372 M373 L390	F249-N251 HydrophobicContact CE1-CB 4.27Å; N251-H253 PolarHBondContact O-N 2.8Å; N251-H253 PolarHBondContact OD1-N 3.01Å; N251-H254 HydrophobicContact CB-CB 4.06Å; N251-H254 PolarHBondContact O-N 2.83Å; N251-H254 PolarHBondContact OD1-N 3.21Å; N251-I255 PolarHBondContact O-N 3.17Å; N251-Y369 PolarHBondContact ND2-O 3.46Å; N251-V370 PolarHBondContact ND2-O 3.25Å; N251-L372 HydrophobicContact CB-CD1 4.33Å; N251-L372 WeakPolarHBondContact CB-O 3.49Å; N251-M373 PolarHBondContact N-O 2.9Å; N251-L390 HydrophobicContact CB-CD1 4.46Å
252	T	98.5	Very high	98.2	Very high	7 Å²	7	28.1 Å²	28.1	4%	0.043	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-31.2	-176.9	-52.5	0	0	0	0	112.2	L144 W165 V250 I255 L256	L144-T252 HydrophobicContact CD2-CG2 4.33Å; W165-T252 WeakPolarHBondContact O-CB 3.38Å; W165-T252 PolarHBondContact O-OG1 3.45Å; V250-T252 PolarHBondContact O-N 3.1Å; T252-I255 PolarHBondContact O-N 2.95Å; T252-L256 HydrophobicContact CG2-CD1 4.48Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.5Å; T252-L256 PolarHBondContact O-N 3.38Å
253	H	97.4	Very high	98.2	Very high	81 Å²	81	31.2 Å²	31.2	38%	0.375	17%	0.172	S	C	.	.	H	α-helix	trans	-62.7	-44.2	173.4	-63.1	-42.1	0	0	0	112	N251 L256 N257 W387	N251-H253 PolarHBondContact O-N 2.8Å; N251-H253 PolarHBondContact OD1-N 3.01Å; H253-L256 PolarHBondContact O-N 2.99Å; H253-N257 VanDerWaalsContact O-CG 3.31Å; H253-N257 PolarHBondContact O-N 3.37Å; H253-N257 PolarHBondContact O-ND2 2.87Å; H253-W387 AromaticContact CD2-CH2 3.71Å; H253-W387 AromaticContact CE1-CH2 3.78Å; H253-W387 AromaticContact NE2-CH2 3.37Å; H253-W387 WeakPolarHBondContact NE2-CH2 3.5Å; H253-W387 AromaticContact NE2-CZ2 3.66Å
254	H	98.2	Very high	98	Very high	45 Å²	45	40.6 Å²	40.6	21%	0.208	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-41.3	175.5	-165.3	162.7	0	0	0	111.2	N251 L256 N257 Y258 V370 D371 L372	N251-H254 HydrophobicContact CB-CB 4.06Å; N251-H254 PolarHBondContact O-N 2.83Å; N251-H254 PolarHBondContact OD1-N 3.21Å; H254-L256 VanDerWaalsContact C-N 3.33Å; H254-L256 PolarHBondContact O-N 3.19Å; H254-N257 PolarHBondContact O-N 2.98Å; H254-Y258 WeakPolarHBondContact O-CB 3.46Å; H254-Y258 PolarHBondContact O-N 2.92Å; H254-V370 PolarHBondContact ND1-O 3.5Å; H254-D371 VanDerWaalsContact CE1-CA 3.46Å; H254-D371 WeakPolarHBondContact CE1-CA 3.43Å; H254-D371 PolarHBondContact CE1-O 2.84Å; H254-D371 VanDerWaalsContact ND1-C 3.31Å; H254-D371 WeakPolarHBondContact ND1-CA 3.25Å; H254-L372 PolarHBondContact ND1-O 3.36Å
255	I	98.5	Very high	97.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55.2	-49	174	-72.5	-178.4	0	0	0	111.1	L144 F242 V250 N251 T252 N257 Y258 L259 L310 M373	L144-I255 HydrophobicContact CD2-CG2 3.89Å; F242-I255 HydrophobicContact CD2-CD1 3.89Å; F242-I255 HydrophobicContact CE2-CD1 4.25Å; F242-I255 HydrophobicContact CG-CD1 4.45Å; V250-I255 HydrophobicContact CG1-CD1 3.33Å; V250-I255 HydrophobicContact CG1-CG1 4.36Å; N251-I255 PolarHBondContact O-N 3.17Å; T252-I255 PolarHBondContact O-N 2.95Å; I255-N257 PolarHBondContact O-N 3.45Å; I255-Y258 PolarHBondContact O-N 3.11Å; I255-L259 HydrophobicContact CG2-CD1 3.84Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 VanDerWaalsContact O-CG 3.31Å; I255-L259 WeakPolarHBondContact O-CG 3.46Å; I255-L259 PolarHBondContact O-N 3.18Å; I255-L310 HydrophobicContact CG2-CD1 4.03Å; I255-L310 HydrophobicContact CG2-CD2 3.96Å; I255-M373 HydrophobicContact CB-SD 4.42Å; I255-M373 HydrophobicContact CG1-SD 3.61Å
256	L	98.1	Very high	97.6	Very high	23 Å²	23	47 Å²	47	12%	0.12	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-43.3	179.7	-68.5	171.3	0	0	0	111.9	F143 L144 V176 T252 H253 H254 Y258 L259 N260	F143-L256 HydrophobicContact CD1-CD2 3.72Å; F143-L256 HydrophobicContact CE1-CD2 3.85Å; L144-L256 HydrophobicContact CB-CD2 4.4Å; L144-L256 HydrophobicContact CD2-CD2 4.09Å; V176-L256 HydrophobicContact CG2-CD1 4.29Å; V176-L256 HydrophobicContact CG2-CD2 4.03Å; T252-L256 HydrophobicContact CG2-CD1 4.48Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.5Å; T252-L256 PolarHBondContact O-N 3.38Å; H253-L256 PolarHBondContact O-N 2.99Å; H254-L256 VanDerWaalsContact C-N 3.33Å; H254-L256 PolarHBondContact O-N 3.19Å; L256-Y258 VanDerWaalsContact C-N 3.34Å; L256-Y258 PolarHBondContact O-N 3.01Å; L256-L259 PolarHBondContact O-N 3.46Å; L256-N260 WeakPolarHBondContact O-CB 3.47Å; L256-N260 PolarHBondContact O-N 3.23Å; L256-N260 PolarHBondContact O-ND2 3.19Å
257	N	97.2	Very high	97.5	Very high	111 Å²	111	47.7 Å²	47.7	59%	0.594	26%	0.258	S	S	*	.	H	α-helix	trans	-61.5	-42.3	176.2	-70.6	-16.7	0	0	0	112	H253 H254 I255 N260 S261	H253-N257 VanDerWaalsContact O-CG 3.31Å; H253-N257 PolarHBondContact O-N 3.37Å; H253-N257 PolarHBondContact O-ND2 2.87Å; H254-N257 PolarHBondContact O-N 2.98Å; I255-N257 PolarHBondContact O-N 3.45Å; N257-N260 PolarHBondContact O-N 2.8Å; N257-S261 PolarHBondContact O-N 3.37Å; N257-S261 VanDerWaalsContact O-N 3.16Å
258	Y	98.4	Very high	97.4	Very high	34 Å²	34	51.8 Å²	51.8	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-47.8	176.9	172.3	-93.4	0	0	0	111.8	H254 I255 L256 N260 S261 L262 L270 I272 L310 H350 M373	H254-Y258 WeakPolarHBondContact O-CB 3.46Å; H254-Y258 PolarHBondContact O-N 2.92Å; I255-Y258 PolarHBondContact O-N 3.11Å; L256-Y258 VanDerWaalsContact C-N 3.34Å; L256-Y258 PolarHBondContact O-N 3.01Å; Y258-N260 VanDerWaalsContact C-N 3.28Å; Y258-N260 PolarHBondContact O-N 3.31Å; Y258-S261 WeakPolarHBondContact O-CB 3.37Å; Y258-S261 PolarHBondContact O-N 3.22Å; Y258-S261 PolarHBondContact O-OG 3.15Å; Y258-L262 HydrophobicContact CE1-CD1 4.11Å; Y258-L262 HydrophobicContact CE1-CD2 3.96Å; Y258-L262 HydrophobicContact CE1-CG 4.31Å; Y258-L262 HydrophobicContact CE2-CD2 4.41Å; Y258-L270 HydrophobicContact CE1-CD1 4.34Å; Y258-I272 HydrophobicContact CD1-CD1 4.14Å; Y258-I272 HydrophobicContact CE1-CD1 3.4Å; Y258-I272 VanDerWaalsContact CE1-CD1 3.4Å; Y258-L310 HydrophobicContact CD1-CD2 4.19Å; Y258-L310 HydrophobicContact CE1-CD2 4.45Å; Y258-H350 AromaticContact CE2-CD2 3.88Å; Y258-H350 AromaticContact CE2-NE2 3.8Å; Y258-M373 HydrophobicContact CD1-CE 4.18Å; Y258-M373 HydrophobicContact CD2-CE 3.78Å; Y258-M373 HydrophobicContact CG-CE 3.5Å
259	L	98.2	Very high	97.3	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-59	-41.2	178.4	-70	175.3	0	0	0	111.8	F143 L144 F240 I255 L256 S261 L262 L270 L310	F143-L259 HydrophobicContact CE1-CB 3.9Å; F143-L259 HydrophobicContact CE1-CD1 3.99Å; F143-L259 HydrophobicContact CZ-CB 3.84Å; L144-L259 HydrophobicContact CD1-CD1 4.2Å; F240-L259 HydrophobicContact CB-CD1 3.87Å; F240-L259 HydrophobicContact CB-CD2 4.23Å; F240-L259 HydrophobicContact CD1-CD2 3.48Å; F240-L259 VanDerWaalsContact CD1-CD2 3.48Å; F240-L259 HydrophobicContact CD2-CB 4.26Å; F240-L259 HydrophobicContact CD2-CD1 3.75Å; F240-L259 HydrophobicContact CD2-CD2 3.85Å; F240-L259 HydrophobicContact CD2-CG 4.17Å; F240-L259 HydrophobicContact CE1-CD2 3.68Å; F240-L259 HydrophobicContact CE2-CB 4.14Å; F240-L259 HydrophobicContact CE2-CD1 4.46Å; F240-L259 HydrophobicContact CE2-CD2 4.03Å; F240-L259 HydrophobicContact CE2-CG 4.44Å; F240-L259 HydrophobicContact CG-CD1 3.81Å; F240-L259 HydrophobicContact CG-CD2 3.56Å; F240-L259 HydrophobicContact CG-CG 4.22Å; F240-L259 HydrophobicContact CZ-CD2 3.94Å; I255-L259 HydrophobicContact CG2-CD1 3.84Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 VanDerWaalsContact O-CG 3.31Å; I255-L259 WeakPolarHBondContact O-CG 3.46Å; I255-L259 PolarHBondContact O-N 3.18Å; L256-L259 PolarHBondContact O-N 3.46Å; L259-S261 PolarHBondContact O-N 2.9Å; L259-L262 HydrophobicContact CD2-CD1 3.96Å; L259-L262 WeakPolarHBondContact O-CB 3.03Å; L259-L262 PolarHBondContact O-N 3.49Å; L259-L270 HydrophobicContact CD2-CD2 3.73Å; L259-L310 HydrophobicContact CD1-CD1 4.35Å; L259-L310 HydrophobicContact CD1-CD2 4.43Å; L259-L310 HydrophobicContact CD2-CD1 4.49Å; L259-L310 HydrophobicContact CD2-CD2 3.67Å; L259-L310 HydrophobicContact CD2-CG 4.23Å; L259-L310 HydrophobicContact CG-CD2 4.06Å
260	N	97.1	Very high	97.2	Very high	84 Å²	84	55 Å²	55	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-22.1	175.9	-78.4	-44.4	0	0	0	114.2	Q174 L256 N257 Y258 L262	Q174-N260 PolarHBondContact NE2-OD1 3.28Å; Q174-N260 PolarHBondContact OE1-ND2 3.23Å; L256-N260 WeakPolarHBondContact O-CB 3.47Å; L256-N260 PolarHBondContact O-N 3.23Å; L256-N260 PolarHBondContact O-ND2 3.19Å; N257-N260 PolarHBondContact O-N 2.8Å; Y258-N260 VanDerWaalsContact C-N 3.28Å; Y258-N260 PolarHBondContact O-N 3.31Å; N260-L262 VanDerWaalsContact C-N 3.33Å
261	S	97.4	Very high	97.2	Very high	88 Å²	88	55.5 Å²	55.5	62%	0.615	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.2	177.2	78.5	0	0	0	0	113.7	N257 Y258 L259	N257-S261 PolarHBondContact O-N 3.37Å; N257-S261 VanDerWaalsContact O-N 3.16Å; Y258-S261 WeakPolarHBondContact O-CB 3.37Å; Y258-S261 PolarHBondContact O-N 3.22Å; Y258-S261 PolarHBondContact O-OG 3.15Å; L259-S261 PolarHBondContact O-N 2.9Å
262	L	97.7	Very high	97.3	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.152	29%	0.293	C	S	.	.			trans	-74.1	141	-175.4	-63.4	177.2	0	0	0	112.3	F240 Y258 L259 N260 K266 A267 L270	F240-L262 HydrophobicContact CE1-CD1 4.22Å; F240-L262 HydrophobicContact CZ-CD1 4.33Å; Y258-L262 HydrophobicContact CE1-CD1 4.11Å; Y258-L262 HydrophobicContact CE1-CD2 3.96Å; Y258-L262 HydrophobicContact CE1-CG 4.31Å; Y258-L262 HydrophobicContact CE2-CD2 4.41Å; L259-L262 HydrophobicContact CD2-CD1 3.96Å; L259-L262 WeakPolarHBondContact O-CB 3.03Å; L259-L262 PolarHBondContact O-N 3.49Å; N260-L262 VanDerWaalsContact C-N 3.33Å; L262-K266 HydrophobicContact CD2-CD 3.88Å; L262-K266 HydrophobicContact CD2-CG 4.23Å; L262-A267 HydrophobicContact CB-CB 4.34Å; L262-L270 HydrophobicContact CD1-CD1 4.02Å; L262-L270 HydrophobicContact CD1-CD2 3.68Å; L262-L270 HydrophobicContact CD1-CG 4.36Å
263	S	97.4	Very high	97.3	Very high	64 Å²	64	55.1 Å²	55.1	45%	0.448	29%	0.291	S	S	.	.			trans	-69.1	151.7	164.1	70.2	0	0	0	0	110.6	S265 K266 A267	S263-S265 PolarHBondContact O-N 3.39Å; S263-S265 VanDerWaalsContact O-N 3.16Å; S263-S265 PolarHBondContact OG-OG 3.06Å; S263-K266 PolarHBondContact O-N 3.2Å; S263-K266 VanDerWaalsContact O-N 3.13Å; S263-K266 WeakPolarHBondContact OG-CB 3.49Å; S263-K266 PolarHBondContact OG-N 3.39Å; S263-A267 WeakPolarHBondContact O-CB 3.42Å; S263-A267 PolarHBondContact O-N 3.33Å
264	K	94.3	Very high	97.3	Very high	199 Å²	199	52.1 Å²	52.1	87%	0.865	28%	0.278	S	S	*	.	H	α-helix	trans	-54.9	-35.3	177.6	-68.8	-174.1	177.2	-177.2	0	113.3	K268	K264-K268 PolarHBondContact O-N 2.9Å
265	S	94.3	Very high	97.3	Very high	99 Å²	99	50.5 Å²	50.5	69%	0.692	27%	0.271	S	S	*	.	H	α-helix	trans	-69.4	-44.9	178.3	54.6	0	0	0	0	112.1	S263 A267 K268	S263-S265 PolarHBondContact O-N 3.39Å; S263-S265 VanDerWaalsContact O-N 3.16Å; S263-S265 PolarHBondContact OG-OG 3.06Å; S265-A267 VanDerWaalsContact C-N 3.35Å; S265-K268 PolarHBondContact O-N 3.49Å
266	K	94.9	Very high	97.2	Very high	74 Å²	74	53.3 Å²	53.3	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-68.7	-35.3	177.9	-169.4	172.9	177.7	81.5	0	111.8	L262 S263 K268 L270 E348	L262-K266 HydrophobicContact CD2-CD 3.88Å; L262-K266 HydrophobicContact CD2-CG 4.23Å; S263-K266 PolarHBondContact O-N 3.2Å; S263-K266 VanDerWaalsContact O-N 3.13Å; S263-K266 WeakPolarHBondContact OG-CB 3.49Å; S263-K266 PolarHBondContact OG-N 3.39Å; K266-K268 VanDerWaalsContact C-N 3.31Å; K266-K268 PolarHBondContact O-N 3.35Å; K266-L270 PolarHBondContact O-N 3.43Å; K266-E348 VanDerWaalsContact NZ-CD 3.28Å; K266-E348 IonicContact NZ-OE1 3.41Å; K266-E348 PolarHBondContact NZ-OE1 3.42Å; K266-E348 VanDerWaalsContact NZ-OE1 3.09Å; K266-E348 IonicContact NZ-OE2 3.33Å; K266-E348 PolarHBondContact NZ-OE2 3.17Å
267	A	96.6	Very high	97.1	Very high	21 Å²	21	56.7 Å²	56.7	17%	0.174	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-34.1	178.2	0	0	0	0	0	113.3	F240 L262 S263 S265 D269 S312	F240-A267 HydrophobicContact CE1-CB 4.15Å; F240-A267 HydrophobicContact CZ-CB 3.9Å; L262-A267 HydrophobicContact CB-CB 4.34Å; S263-A267 WeakPolarHBondContact O-CB 3.42Å; S263-A267 PolarHBondContact O-N 3.33Å; S265-A267 VanDerWaalsContact C-N 3.35Å; A267-D269 PolarHBondContact O-N 3.37Å; A267-S312 WeakPolarHBondContact O-CB 3.34Å
268	K	95.8	Very high	96.9	Very high	118 Å²	118	58.4 Å²	58.4	51%	0.513	31%	0.31	S	S	.	.	H	α-helix	trans	-61.7	-42.5	-171.9	-172.6	177.2	179.5	-178.9	0	113.7	K264 S265 K266 S312 H314	K264-K268 PolarHBondContact O-N 2.9Å; S265-K268 PolarHBondContact O-N 3.49Å; K266-K268 VanDerWaalsContact C-N 3.31Å; K266-K268 PolarHBondContact O-N 3.35Å; K268-S312 PolarHBondContact O-OG 2.79Å; K268-H314 WeakPolarHBondContact CE-CE1 3.33Å; K268-H314 WeakPolarHBondContact CE-NE2 3.37Å; K268-H314 PolarHBondContact O-ND1 3.4Å; K268-H314 VanDerWaalsContact O-ND1 3.12Å
269	D	96.2	Very high	96.8	Very high	62 Å²	62	57.7 Å²	57.7	33%	0.332	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	29.2	-177.4	-65.5	-24.9	0	0	0	111.5	A267 F271 H314 R318	A267-D269 PolarHBondContact O-N 3.37Å; D269-F271 PolarHBondContact O-N 3.36Å; D269-H314 IonicContact OD1-CE1 2.74Å; D269-H314 IonicContact OD1-ND1 3.55Å; D269-H314 PolarHBondContact OD1-ND1 2.94Å; D269-R318 IonicContact OD1-CZ 2.78Å; D269-R318 IonicContact OD1-NH1 3.37Å; D269-R318 PolarHBondContact OD1-NH1 3.38Å; D269-R318 IonicContact OD2-NH1 3.27Å; D269-R318 PolarHBondContact OD2-NH1 3.47Å
270	L	98.7	Very high	96.7	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	32%	0.321	C	S	.	.			trans	-56.9	128.5	177.7	-178.7	74.9	0	0	0	110.1	F240 Y258 L259 L262 K266 I272 L310 Y311 S312 L315	F240-L270 HydrophobicContact CD1-CD2 3.91Å; F240-L270 HydrophobicContact CE1-CD2 3.88Å; Y258-L270 HydrophobicContact CE1-CD1 4.34Å; L259-L270 HydrophobicContact CD2-CD2 3.73Å; L262-L270 HydrophobicContact CD1-CD1 4.02Å; L262-L270 HydrophobicContact CD1-CD2 3.68Å; L262-L270 HydrophobicContact CD1-CG 4.36Å; K266-L270 PolarHBondContact O-N 3.43Å; L270-I272 HydrophobicContact CD1-CG2 3.75Å; L270-I272 HydrophobicContact CG-CG2 4.5Å; L270-L310 HydrophobicContact CD2-CD2 4.46Å; L270-L310 HydrophobicContact CD2-CG 4.38Å; L270-Y311 CarbonylContact O-C 3.59Å; L270-Y311 WeakPolarHBondContact O-CA 3.44Å; L270-Y311 WeakPolarHBondContact O-CB 3.42Å; L270-S312 PolarHBondContact O-N 2.77Å; L270-S312 VanDerWaalsContact O-N 3.07Å; L270-L315 WeakPolarHBondContact O-CD2 3.3Å
271	F	98.8	Very high	96.7	Very high	12 Å²	12	55.2 Å²	55.2	5%	0.053	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	112.5	161.8	-162.6	-66.9	0	0	0	108.7	D269 A304 F309 L310 Y311 L315 L319 T336 L340 P347 E348	D269-F271 PolarHBondContact O-N 3.36Å; F271-A304 HydrophobicContact CE1-CB 3.89Å; F271-F309 HydrophobicContact CE1-CB 4.14Å; F271-F309 HydrophobicContact CE1-CD2 4.06Å; F271-F309 HydrophobicContact CE1-CG 4.13Å; F271-F309 HydrophobicContact CE2-CD2 4.18Å; F271-F309 HydrophobicContact CE2-CE2 4.29Å; F271-F309 HydrophobicContact CZ-CB 4.46Å; F271-F309 AromaticContact CZ-CD2 3.52Å; F271-F309 HydrophobicContact CZ-CD2 3.52Å; F271-F309 AromaticContact CZ-CE2 3.76Å; F271-F309 HydrophobicContact CZ-CE2 3.76Å; F271-F309 AromaticContact CZ-CG 4Å; F271-F309 HydrophobicContact CZ-CG 4Å; F271-F309 HydrophobicContact CZ-CZ 4.42Å; F271-L310 WeakPolarHBondContact CA-O 3.29Å; F271-Y311 HydrophobicContact CD2-CD1 4.43Å; F271-Y311 HydrophobicContact CD2-CG 4.14Å; F271-Y311 HydrophobicContact CE2-CD1 4.19Å; F271-Y311 HydrophobicContact CE2-CG 4.27Å; F271-L315 HydrophobicContact CB-CD2 3.73Å; F271-L315 HydrophobicContact CD2-CD2 3.81Å; F271-L315 HydrophobicContact CG-CD2 4.27Å; F271-L319 HydrophobicContact CD2-CD1 4.43Å; F271-L319 HydrophobicContact CE2-CD1 4.18Å; F271-T336 HydrophobicContact CE2-CG2 3.86Å; F271-T336 HydrophobicContact CZ-CG2 3.74Å; F271-L340 HydrophobicContact CB-CD2 4.49Å; F271-L340 HydrophobicContact CD1-CD1 3.9Å; F271-L340 HydrophobicContact CD2-CD1 3.78Å; F271-L340 HydrophobicContact CD2-CD2 3.75Å; F271-L340 HydrophobicContact CD2-CG 4.26Å; F271-L340 HydrophobicContact CE1-CD1 3.88Å; F271-L340 HydrophobicContact CE2-CD1 3.76Å; F271-L340 HydrophobicContact CE2-CD2 4.22Å; F271-L340 HydrophobicContact CE2-CG 4.31Å; F271-L340 HydrophobicContact CG-CD1 3.84Å; F271-L340 HydrophobicContact CG-CD2 4.19Å; F271-L340 HydrophobicContact CZ-CD1 3.81Å; F271-P347 HydrophobicContact CD1-CB 3.47Å; F271-P347 VanDerWaalsContact CD1-CB 3.47Å; F271-P347 HydrophobicContact CE1-CB 3.98Å; F271-P347 HydrophobicContact CG-CB 4.27Å; F271-E348 PolarHBondContact O-N 3.2Å
272	I	98.8	Very high	96.7	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.3	-178.7	65	165.7	0	0	0	112.5	Y258 L270 F309 L310 E348 H350 F353	Y258-I272 HydrophobicContact CD1-CD1 4.14Å; Y258-I272 HydrophobicContact CE1-CD1 3.4Å; Y258-I272 VanDerWaalsContact CE1-CD1 3.4Å; L270-I272 HydrophobicContact CD1-CG2 3.75Å; L270-I272 HydrophobicContact CG-CG2 4.5Å; I272-F309 WeakPolarHBondContact O-CA 3.31Å; I272-F309 VanDerWaalsContact O-CB 3.27Å; I272-F309 WeakPolarHBondContact O-CB 3.19Å; I272-L310 HydrophobicContact CD1-CB 4.4Å; I272-L310 HydrophobicContact CD1-CD2 4.11Å; I272-L310 HydrophobicContact CG1-CB 3.87Å; I272-L310 HydrophobicContact CG1-CD2 4.39Å; I272-L310 PolarHBondContact N-O 3.2Å; I272-L310 PolarHBondContact O-N 2.98Å; I272-E348 VanDerWaalsContact CA-O 3.26Å; I272-E348 WeakPolarHBondContact CA-O 3.39Å; I272-E348 HydrophobicContact CG2-CB 4.04Å; I272-H350 HydrophobicContact CB-CB 4.2Å; I272-H350 HydrophobicContact CD1-CB 4.08Å; I272-F353 HydrophobicContact CD1-CE2 3.92Å; I272-F353 HydrophobicContact CG1-CE2 4.09Å; I272-F353 HydrophobicContact CG1-CZ 4.4Å
273	G	98.6	Very high	96.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178	-156.5	172.6	0	0	0	0	0	112.2	V275 E348 K349 H350	G273-V275 PolarHBondContact O-N 3.13Å; G273-E348 PolarHBondContact N-O 3.08Å; G273-K349 WeakPolarHBondContact O-CA 3.38Å; G273-H350 PolarHBondContact O-N 3.21Å
274	D	98.1	Very high	96.6	Very high	18 Å²	18	58.6 Å²	58.6	10%	0.096	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	85.4	167	-166.6	-21.5	0	0	0	110.1	A304 G305 K349 F353 T355	D274-A304 WeakPolarHBondContact O-CA 3.49Å; D274-G305 PolarHBondContact O-N 3.45Å; D274-K349 IonicContact OD1-NZ 2.68Å; D274-K349 PolarHBondContact OD1-NZ 2.78Å; D274-K349 IonicContact OD2-NZ 2.75Å; D274-K349 PolarHBondContact OD2-NZ 2.91Å; D274-F353 HydrophobicContact CB-CB 4.07Å; D274-T355 HydrophobicContact CB-CG2 3.46Å; D274-T355 VanDerWaalsContact CB-CG2 3.46Å; D274-T355 PolarHBondContact OD2-OG1 3.21Å
275	V	98.1	Very high	96.7	Very high	11 Å²	11	56.6 Å²	56.6	7%	0.067	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.6	-175.4	-177.6	0	0	0	0	111.9	G273 P302 Y303 A304 P347 E348 K349	G273-V275 PolarHBondContact O-N 3.13Å; V275-P302 HydrophobicContact CG1-CB 4.25Å; V275-Y303 WeakPolarHBondContact CA-O 3.46Å; V275-A304 HydrophobicContact CG2-CB 4.05Å; V275-P347 HydrophobicContact CG1-CB 4.49Å; V275-P347 HydrophobicContact CG1-CG 3.9Å; V275-P347 HydrophobicContact CG2-CB 3.78Å; V275-P347 HydrophobicContact CG2-CG 4.08Å; V275-E348 VanDerWaalsContact CG2-C 3.46Å; V275-E348 WeakPolarHBondContact CG2-O 3.19Å; V275-K349 HydrophobicContact CB-CB 4.09Å
276	I	95.9	Very high	96.8	Very high	60 Å²	60	61 Å²	61	31%	0.308	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.2	176	-52.2	173.2	0	0	0	108.6	A279 P302 Y303	I276-A279 HydrophobicContact CG2-CB 3.86Å; I276-P302 WeakPolarHBondContact O-CA 3.44Å; I276-Y303 HydrophobicContact CB-CE1 4.43Å; I276-Y303 HydrophobicContact CD1-CE2 4.28Å; I276-Y303 PolarHBondContact N-O 3.38Å; I276-Y303 PolarHBondContact O-N 3.06Å
277	H	96.3	Very high	96.8	Very high	94 Å²	94	61.1 Å²	61.1	44%	0.435	30%	0.303	S	S	.	.			trans	-107	157.1	173.8	-68.9	-100.8	0	0	0	110.6	A279	H277-A279 PolarHBondContact O-N 2.81Å; H277-A279 VanDerWaalsContact O-N 3.09Å
278	N	94.4	Very high	96.7	Very high	147 Å²	147	66 Å²	66	79%	0.786	32%	0.32	S	S	*	.	S	Bend	trans	56.4	26	174.7	-51.6	-36.7	0	0	0	114
279	A	95.3	Very high	96.7	Very high	18 Å²	18	64.7 Å²	64.7	15%	0.149	31%	0.313	C	S	.	.			trans	-77.2	159.5	175.2	0	0	0	0	0	111.1	I276 H277 Y300 Y303	I276-A279 HydrophobicContact CG2-CB 3.86Å; H277-A279 PolarHBondContact O-N 2.81Å; H277-A279 VanDerWaalsContact O-N 3.09Å; A279-Y300 HydrophobicContact CB-CD2 4.27Å; A279-Y300 PolarHBondContact O-N 3.1Å; A279-Y303 HydrophobicContact CB-CE1 3.93Å
280	G	96	Very high	96.7	Very high	25 Å²	25	62.3 Å²	62.3	26%	0.258	30%	0.299	S	S	.	.			trans	-141.1	167.5	172.9	0	0	0	0	0	111.7	H282	G280-H282 PolarHBondContact O-N 3.43Å
281	P	97.1	Very high	96.7	Very high	14 Å²	14	62.1 Å²	62.1	9%	0.091	30%	0.298	C	S	.	.			trans	-58	131.8	174.1	24.8	-36.2	0	0	0	111.7	R283 I291 Y296 G298 Y300	P281-R283 PolarHBondContact O-N 3.44Å; P281-I291 HydrophobicContact CB-CB 3.9Å; P281-I291 HydrophobicContact CB-CG1 4.46Å; P281-I291 HydrophobicContact CB-CG2 4.32Å; P281-Y296 HydrophobicContact CB-CD1 4.38Å; P281-Y296 HydrophobicContact CG-CD1 4Å; P281-Y296 HydrophobicContact CG-CE1 4.42Å; P281-G298 VanDerWaalsContact CD-O 3.26Å; P281-G298 WeakPolarHBondContact CD-O 3.38Å; P281-Y300 WeakPolarHBondContact CA-OH 3.24Å; P281-Y300 HydrophobicContact CB-CE1 4.25Å
282	H	97.3	Very high	96.7	Very high	92 Å²	92	61.7 Å²	61.7	43%	0.426	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-69.3	130	171.5	-66	166	0	0	0	110.2	G280 L287 Y290 I291	G280-H282 PolarHBondContact O-N 3.43Å; H282-L287 HydrophobicContact CB-CB 4.49Å; H282-L287 HydrophobicContact CB-CD1 3.84Å; H282-Y290 CarbonylContact O-C 3.57Å; H282-Y290 WeakPolarHBondContact O-CA 3.35Å; H282-Y290 WeakPolarHBondContact O-CD2 3.49Å; H282-I291 PolarHBondContact O-N 3.45Å
283	R	97.1	Very high	96.6	Very high	79 Å²	79	66.5 Å²	66.5	30%	0.298	32%	0.319	S	S	.	.			trans	-104.2	-9.9	-175.6	-54.9	-49.6	-165.3	175.1	5.5	114.7	P281 K285 Y290 I291 P292 E293 Y296	P281-R283 PolarHBondContact O-N 3.44Å; R283-K285 PolarHBondContact O-N 3.2Å; R283-Y290 WeakPolarHBondContact O-CD2 3.33Å; R283-Y290 VanDerWaalsContact O-CE2 3.23Å; R283-Y290 WeakPolarHBondContact O-CE2 3.28Å; R283-I291 VanDerWaalsContact CD-O 3.31Å; R283-I291 WeakPolarHBondContact CD-O 3.31Å; R283-I291 PolarHBondContact NH1-O 3.17Å; R283-P292 PolarHBondContact NH1-O 3.09Å; R283-E293 WeakPolarHBondContact CB-OE1 3.45Å; R283-E293 WeakPolarHBondContact CD-OE1 3.38Å; R283-E293 WeakPolarHBondContact CG-OE1 3.48Å; R283-E293 IonicContact NE-OE1 3.53Å; R283-Y296 PolarHBondContact NH1-O 2.8Å; R283-Y296 PolarHBondContact NH2-O 2.83Å
284	D	97.3	Very high	96.5	Very high	80 Å²	80	68.7 Å²	68.7	43%	0.428	33%	0.333	S	S	.	.			trans	-74.3	117.9	171.4	-179.3	-2.1	0	0	0	110.1	K286 L287 Y290	D284-K286 PolarHBondContact O-N 3.29Å; D284-K286 VanDerWaalsContact O-N 3.08Å; D284-K286 WeakPolarHBondContact OD1-CB 3.4Å; D284-K286 PolarHBondContact OD1-N 2.96Å; D284-L287 HydrophobicContact CB-CD1 3.86Å; D284-L287 HydrophobicContact CB-CG 3.96Å; D284-L287 WeakPolarHBondContact O-CB 3.02Å; D284-L287 PolarHBondContact O-N 3.08Å; D284-Y290 WeakPolarHBondContact O-CB 3.15Å; D284-Y290 WeakPolarHBondContact O-CD2 3.49Å
285	K	96.1	Very high	96.4	Very high	158 Å²	158	67.9 Å²	67.9	69%	0.687	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.1	179.4	-66.9	-177.8	179.4	-178.1	0	113.7	R283 Y290	R283-K285 PolarHBondContact O-N 3.2Å; K285-Y290 HydrophobicContact CB-CE1 4.43Å; K285-Y290 HydrophobicContact CG-CD1 4.37Å; K285-Y290 HydrophobicContact CG-CD2 4.37Å; K285-Y290 HydrophobicContact CG-CE1 3.85Å; K285-Y290 HydrophobicContact CG-CE2 3.87Å
286	K	95.6	Very high	96.4	Very high	191 Å²	191	68 Å²	68	83%	0.83	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-17.1	179.6	-61.5	178.3	-178.5	178.1	0	113.2	D284	D284-K286 PolarHBondContact O-N 3.29Å; D284-K286 VanDerWaalsContact O-N 3.08Å; D284-K286 WeakPolarHBondContact OD1-CB 3.4Å; D284-K286 PolarHBondContact OD1-N 2.96Å
287	L	95.4	Very high	96.4	Very high	76 Å²	76	66.8 Å²	66.8	40%	0.398	32%	0.324	S	S	.	.	S	Bend	trans	-79.6	143	-176.6	-65	175.7	0	0	0	111.7	H282 D284 Y289 Y290	H282-L287 HydrophobicContact CB-CB 4.49Å; H282-L287 HydrophobicContact CB-CD1 3.84Å; D284-L287 HydrophobicContact CB-CD1 3.86Å; D284-L287 HydrophobicContact CB-CG 3.96Å; D284-L287 WeakPolarHBondContact O-CB 3.02Å; D284-L287 PolarHBondContact O-N 3.08Å; L287-Y289 PolarHBondContact O-N 3.24Å; L287-Y290 VanDerWaalsContact O-CB 3.28Å; L287-Y290 WeakPolarHBondContact O-CB 3.44Å; L287-Y290 PolarHBondContact O-N 2.91Å
288	K	93.4	Very high	96.3	Very high	123 Å²	123	64.7 Å²	64.7	54%	0.535	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-44.9	176.1	-179.5	-177.7	176	-168.8	0	111.9
289	Y	95.6	Very high	96.4	Very high	92 Å²	92	63.4 Å²	63.4	36%	0.361	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	25.3	-177.8	-51.9	-73.4	0	0	0	113.3	F217 L287 I291 I331	F217-Y289 AromaticContact CE1-CD1 3.85Å; F217-Y289 HydrophobicContact CE1-CD1 3.85Å; F217-Y289 HydrophobicContact CE1-CE1 4.03Å; F217-Y289 HydrophobicContact CE2-CD1 4.33Å; F217-Y289 AromaticContact CE2-CE1 3.66Å; F217-Y289 HydrophobicContact CE2-CE1 3.66Å; F217-Y289 AromaticContact CZ-CD1 3.42Å; F217-Y289 HydrophobicContact CZ-CD1 3.42Å; F217-Y289 VanDerWaalsContact CZ-CD1 3.42Å; F217-Y289 AromaticContact CZ-CE1 3.18Å; F217-Y289 HydrophobicContact CZ-CE1 3.18Å; L287-Y289 PolarHBondContact O-N 3.24Å; Y289-I291 PolarHBondContact O-N 2.83Å; Y289-I331 HydrophobicContact CD1-CD1 4.41Å
290	Y	98.1	Very high	96.6	Very high	12 Å²	12	63.3 Å²	63.3	5%	0.047	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-52.9	135.1	172.1	168.9	-121.6	0	0	0	110.8	F116 H282 R283 D284 K285 L287 P292	F116-Y290 AromaticContact CE2-CD1 4Å; F116-Y290 HydrophobicContact CE2-CD1 4Å; F116-Y290 HydrophobicContact CE2-CE1 4.21Å; F116-Y290 HydrophobicContact CZ-CD1 4.33Å; F116-Y290 VanDerWaalsContact CZ-O 3.31Å; F116-Y290 WeakPolarHBondContact CZ-O 3.44Å; H282-Y290 CarbonylContact O-C 3.57Å; H282-Y290 WeakPolarHBondContact O-CA 3.35Å; H282-Y290 WeakPolarHBondContact O-CD2 3.49Å; R283-Y290 WeakPolarHBondContact O-CD2 3.33Å; R283-Y290 VanDerWaalsContact O-CE2 3.23Å; R283-Y290 WeakPolarHBondContact O-CE2 3.28Å; D284-Y290 WeakPolarHBondContact O-CB 3.15Å; D284-Y290 WeakPolarHBondContact O-CD2 3.49Å; K285-Y290 HydrophobicContact CB-CE1 4.43Å; K285-Y290 HydrophobicContact CG-CD1 4.37Å; K285-Y290 HydrophobicContact CG-CD2 4.37Å; K285-Y290 HydrophobicContact CG-CE1 3.85Å; K285-Y290 HydrophobicContact CG-CE2 3.87Å; L287-Y290 VanDerWaalsContact O-CB 3.28Å; L287-Y290 WeakPolarHBondContact O-CB 3.44Å; L287-Y290 PolarHBondContact O-N 2.91Å; Y290-P292 HydrophobicContact CE1-CG 3.69Å
291	I	98.3	Very high	96.6	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.306	C	S	.	.			trans	-133.7	122.1	170.1	-58.7	-67.5	0	0	0	109.1	F116 P281 H282 R283 Y289 V295 P330 I331	F116-I291 HydrophobicContact CE1-CD1 4Å; F116-I291 HydrophobicContact CZ-CD1 4.16Å; P281-I291 HydrophobicContact CB-CB 3.9Å; P281-I291 HydrophobicContact CB-CG1 4.46Å; P281-I291 HydrophobicContact CB-CG2 4.32Å; H282-I291 PolarHBondContact O-N 3.45Å; R283-I291 VanDerWaalsContact CD-O 3.31Å; R283-I291 WeakPolarHBondContact CD-O 3.31Å; R283-I291 PolarHBondContact NH1-O 3.17Å; Y289-I291 PolarHBondContact O-N 2.83Å; I291-V295 HydrophobicContact CG2-CB 4.4Å; I291-V295 HydrophobicContact CG2-CG1 4.42Å; I291-P330 HydrophobicContact CD1-CB 3.91Å; I291-P330 HydrophobicContact CD1-CG 4.07Å; I291-I331 HydrophobicContact CD1-CD1 4.29Å; I291-I331 HydrophobicContact CD1-CG1 4.39Å; I291-I331 HydrophobicContact CG1-CD1 4.15Å
292	P	97.5	Very high	96.7	Very high	3 Å²	3	63.3 Å²	63.3	2%	0.019	31%	0.312	C	S	.	.			trans	-62.8	146.5	174.7	-17.5	25.4	0	0	0	112.9	L112 F116 R283 Y290 V294 V295 Y296	L112-P292 HydrophobicContact CD2-CB 4.21Å; L112-P292 HydrophobicContact CD2-CG 3.85Å; F116-P292 HydrophobicContact CD1-CG 4.37Å; F116-P292 HydrophobicContact CD2-CG 4.41Å; F116-P292 HydrophobicContact CE1-CG 4.12Å; F116-P292 HydrophobicContact CE2-CG 4.13Å; F116-P292 HydrophobicContact CZ-CG 3.99Å; R283-P292 PolarHBondContact NH1-O 3.09Å; Y290-P292 HydrophobicContact CE1-CG 3.69Å; P292-V294 HydrophobicContact CB-CG2 3.85Å; P292-V294 PolarHBondContact O-N 3.39Å; P292-V295 HydrophobicContact CB-CB 4.38Å; P292-V295 HydrophobicContact CB-CG2 4.01Å; P292-V295 HydrophobicContact CG-CB 4.47Å; P292-V295 HydrophobicContact CG-CG2 3.89Å; P292-V295 PolarHBondContact O-N 3.01Å; P292-Y296 PolarHBondContact O-N 3.44Å; P292-Y296 VanDerWaalsContact O-N 3.13Å
293	E	96.6	Very high	96.8	Very high	103 Å²	103	60.5 Å²	60.5	48%	0.481	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-37.9	175.2	-67.7	75	-168.9	0	0	111.5	A57 R283 V295 Y296	A57-E293 WeakPolarHBondContact CB-O 3.12Å; R283-E293 WeakPolarHBondContact CB-OE1 3.45Å; R283-E293 WeakPolarHBondContact CD-OE1 3.38Å; R283-E293 WeakPolarHBondContact CG-OE1 3.48Å; R283-E293 IonicContact NE-OE1 3.53Å; E293-V295 PolarHBondContact O-N 2.74Å; E293-Y296 CarbonylContact O-C 3.54Å
294	V	96.5	Very high	96.8	Very high	47 Å²	47	56.9 Å²	56.9	29%	0.285	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.4	177.9	-60.3	0	0	0	0	113.3	A57 Y58 V106 T107 L112 P292	A57-V294 WeakPolarHBondContact CA-O 3.38Å; Y58-V294 PolarHBondContact N-O 3.23Å; V106-V294 HydrophobicContact CG1-CG2 4.49Å; T107-V294 HydrophobicContact CG2-CG1 4.46Å; L112-V294 HydrophobicContact CD2-CG2 4.17Å; P292-V294 HydrophobicContact CB-CG2 3.85Å; P292-V294 PolarHBondContact O-N 3.39Å
295	V	97.6	Very high	96.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-48.8	178.4	175.2	0	0	0	0	110.7	W59 L112 F116 L120 I291 P292 E293	W59-V295 WeakPolarHBondContact CB-O 3.44Å; W59-V295 PolarHBondContact N-O 3.14Å; L112-V295 HydrophobicContact CD1-CG2 4.39Å; F116-V295 HydrophobicContact CD1-CG1 4.34Å; F116-V295 HydrophobicContact CD1-CG2 3.98Å; F116-V295 HydrophobicContact CE1-CG1 4.41Å; F116-V295 HydrophobicContact CE1-CG2 4.41Å; L120-V295 HydrophobicContact CD1-CG2 4.49Å; I291-V295 HydrophobicContact CG2-CB 4.4Å; I291-V295 HydrophobicContact CG2-CG1 4.42Å; P292-V295 HydrophobicContact CB-CB 4.38Å; P292-V295 HydrophobicContact CB-CG2 4.01Å; P292-V295 HydrophobicContact CG-CB 4.47Å; P292-V295 HydrophobicContact CG-CG2 3.89Å; P292-V295 PolarHBondContact O-N 3.01Å; E293-V295 PolarHBondContact O-N 2.74Å
296	Y	97.8	Very high	95.8	Very high	15 Å²	15	47.3 Å²	47.3	6%	0.059	25%	0.25	C	C	.	.			trans	-140.3	135.2	178.2	-176.8	-92.4	0	0	0	112.2	W59 N60 P281 R283 P292 E293 L299 Y300 Y329 M338	W59-Y296 HydrophobicContact CD2-CD2 4.05Å; W59-Y296 HydrophobicContact CD2-CE2 4.38Å; W59-Y296 AromaticContact CE3-CD2 3.56Å; W59-Y296 HydrophobicContact CE3-CD2 3.56Å; W59-Y296 AromaticContact CE3-CE2 3.58Å; W59-Y296 HydrophobicContact CE3-CE2 3.58Å; W59-Y296 HydrophobicContact CG-CD2 4.45Å; W59-Y296 HydrophobicContact CZ3-CD2 4.17Å; W59-Y296 AromaticContact CZ3-CE2 3.69Å; W59-Y296 HydrophobicContact CZ3-CE2 3.69Å; N60-Y296 WeakPolarHBondContact OD1-CA 3.19Å; P281-Y296 HydrophobicContact CB-CD1 4.38Å; P281-Y296 HydrophobicContact CG-CD1 4Å; P281-Y296 HydrophobicContact CG-CE1 4.42Å; R283-Y296 PolarHBondContact NH1-O 2.8Å; R283-Y296 PolarHBondContact NH2-O 2.83Å; P292-Y296 PolarHBondContact O-N 3.44Å; P292-Y296 VanDerWaalsContact O-N 3.13Å; E293-Y296 CarbonylContact O-C 3.54Å; Y296-L299 PolarHBondContact OH-O 2.95Å; Y296-Y300 HydrophobicContact CD1-CD1 4.48Å; Y296-Y300 AromaticContact CD1-CE1 3.91Å; Y296-Y300 HydrophobicContact CD1-CE1 3.91Å; Y296-Y300 AromaticContact CE1-CD1 3.73Å; Y296-Y300 HydrophobicContact CE1-CD1 3.73Å; Y296-Y300 AromaticContact CE1-CE1 3.6Å; Y296-Y300 HydrophobicContact CE1-CE1 3.6Å; Y296-Y329 HydrophobicContact CD2-CD2 4.35Å; Y296-Y329 AromaticContact CD2-CE2 3.51Å; Y296-Y329 HydrophobicContact CD2-CE2 3.51Å; Y296-Y329 HydrophobicContact CE2-CE2 4.15Å; Y296-Y329 AromaticContact CG-CE2 3.77Å; Y296-Y329 HydrophobicContact CG-CE2 3.77Å; Y296-M338 HydrophobicContact CE2-CE 3.81Å
297	S	95.6	Very high	95.6	Very high	34 Å²	34	38.2 Å²	38.2	24%	0.238	21%	0.21	C	C	.	.			trans	-118.8	152.8	176	60.7	0	0	0	0	111.6	N60	N60-S297 VanDerWaalsContact CG-OG 3.32Å; N60-S297 PolarHBondContact ND2-O 2.98Å; N60-S297 PolarHBondContact OD1-N 2.97Å; N60-S297 PolarHBondContact OD1-OG 3.39Å
298	G	94.4	Very high	95.6	Very high	50 Å²	50	34.8 Å²	34.8	52%	0.515	19%	0.194	S	C	.	.	S	Bend	trans	92.6	-169.3	-179.9	0	0	0	0	0	113.7	P281	P281-G298 VanDerWaalsContact CD-O 3.26Å; P281-G298 WeakPolarHBondContact CD-O 3.38Å
299	L	96.4	Very high	95.9	Very high	120 Å²	120	29 Å²	29	63%	0.628	17%	0.168	S	C	*	.	P	Polyproline II helix	trans	-94.8	164	-179.7	-61.2	178.4	0	0	0	111.1	Y296	Y296-L299 PolarHBondContact OH-O 2.95Å
300	Y	98.1	Very high	96.1	Very high	16 Å²	16	24.7 Å²	24.7	6%	0.063	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-83.8	145.9	170.3	-65.8	-29.9	0	0	0	111.3	A279 P281 Y296 Y303 Y329 V334	A279-Y300 HydrophobicContact CB-CD2 4.27Å; A279-Y300 PolarHBondContact O-N 3.1Å; P281-Y300 WeakPolarHBondContact CA-OH 3.24Å; P281-Y300 HydrophobicContact CB-CE1 4.25Å; Y296-Y300 HydrophobicContact CD1-CD1 4.48Å; Y296-Y300 AromaticContact CD1-CE1 3.91Å; Y296-Y300 HydrophobicContact CD1-CE1 3.91Å; Y296-Y300 AromaticContact CE1-CD1 3.73Å; Y296-Y300 HydrophobicContact CE1-CD1 3.73Å; Y296-Y300 AromaticContact CE1-CE1 3.6Å; Y296-Y300 HydrophobicContact CE1-CE1 3.6Å; Y300-Y303 HydrophobicContact CD2-CE1 4.11Å; Y300-Y329 AromaticContact CE1-CE1 3.85Å; Y300-Y329 HydrophobicContact CE1-CE1 3.85Å; Y300-Y329 AromaticContact CE1-CZ 3.71Å; Y300-Y329 WeakPolarHBondContact CE1-OH 3.24Å; Y300-Y329 AromaticContact CZ-CE1 3.98Å; Y300-Y329 PolarHBondContact OH-OH 3.34Å; Y300-V334 HydrophobicContact CD1-CG1 3.53Å; Y300-V334 HydrophobicContact CD2-CG1 4.22Å; Y300-V334 HydrophobicContact CD2-CG2 3.91Å; Y300-V334 HydrophobicContact CE1-CG1 3.84Å; Y300-V334 HydrophobicContact CE2-CG1 4.47Å; Y300-V334 HydrophobicContact CE2-CG2 3.9Å; Y300-V334 HydrophobicContact CG-CG1 3.73Å; Y300-V334 HydrophobicContact CG-CG2 4.26Å
301	P	98	Very high	96.1	Very high	6 Å²	6	24.1 Å²	24.1	4%	0.039	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-64.1	163.5	165.9	30.9	-35.1	0	0	0	109.9	Y303 M338 Q341	P301-Y303 WeakPolarHBondContact O-CD1 3.37Å; P301-Y303 PolarHBondContact O-N 3.46Å; P301-M338 HydrophobicContact CG-CB 4.46Å; P301-M338 HydrophobicContact CG-CG 3.89Å; P301-Q341 HydrophobicContact CB-CB 4Å; P301-Q341 HydrophobicContact CB-CG 4.37Å
302	P	98.4	Very high	96.1	Very high	33 Å²	33	24.2 Å²	24.2	21%	0.214	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-56.3	131.6	168.5	-22.9	34.3	0	0	0	110.9	V275 I276 V346 P347	V275-P302 HydrophobicContact CG1-CB 4.25Å; I276-P302 WeakPolarHBondContact O-CA 3.44Å; P302-V346 HydrophobicContact CB-CG1 4.09Å; P302-V346 HydrophobicContact CG-CG1 4.19Å; P302-P347 HydrophobicContact CB-CG 4.35Å
303	Y	98.4	Very high	96.2	Very high	33 Å²	33	24 Å²	24	13%	0.129	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.3	-179.7	69.9	-85.8	0	0	0	110.5	V275 I276 A279 Y300 P301 D333 V334	V275-Y303 WeakPolarHBondContact CA-O 3.46Å; I276-Y303 HydrophobicContact CB-CE1 4.43Å; I276-Y303 HydrophobicContact CD1-CE2 4.28Å; I276-Y303 PolarHBondContact N-O 3.38Å; I276-Y303 PolarHBondContact O-N 3.06Å; A279-Y303 HydrophobicContact CB-CE1 3.93Å; Y300-Y303 HydrophobicContact CD2-CE1 4.11Å; P301-Y303 WeakPolarHBondContact O-CD1 3.37Å; P301-Y303 PolarHBondContact O-N 3.46Å; Y303-D333 WeakPolarHBondContact CB-O 3.13Å; Y303-D333 HydrophobicContact CD2-CB 3.83Å; Y303-D333 HydrophobicContact CE2-CB 4.18Å; Y303-V334 HydrophobicContact CD1-CG2 4.19Å; Y303-V334 HydrophobicContact CD2-CG2 4.32Å; Y303-V334 HydrophobicContact CE1-CG2 3.98Å; Y303-V334 HydrophobicContact CE2-CG2 4.11Å; Y303-V334 HydrophobicContact CG-CG2 4.36Å
304	A	97.9	Very high	96.3	Very high	2 Å²	2	22.9 Å²	22.9	2%	0.017	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.5	167.5	0	0	0	0	0	109.1	F271 D274 V275 F309 D333	F271-A304 HydrophobicContact CE1-CB 3.89Å; D274-A304 WeakPolarHBondContact O-CA 3.49Å; V275-A304 HydrophobicContact CG2-CB 4.05Å; A304-F309 HydrophobicContact CB-CB 3.96Å; A304-F309 HydrophobicContact CB-CD1 4.21Å; A304-F309 HydrophobicContact CB-CG 4.35Å; A304-D333 WeakPolarHBondContact O-CB 3.34Å
305	G	90.5	Very high	96.4	Very high	4 Å²	4	20.7 Å²	20.7	4%	0.041	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	-172.5	175.8	0	0	0	0	0	113.7	D274 D333 T355	D274-G305 PolarHBondContact O-N 3.45Å; G305-D333 WeakPolarHBondContact CA-OD2 3.35Å; G305-T355 WeakPolarHBondContact O-CG2 3.02Å
306	G	81.2	Confident	96.4	Very high	33 Å²	33	20.7 Å²	20.7	34%	0.34	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	87.2	16.2	166.4	0	0	0	0	0	116.9	D333 T355	G306-D333 PolarHBondContact N-OD2 3.19Å; G306-T355 WeakPolarHBondContact O-CB 3.44Å; G306-T355 VanDerWaalsContact O-CG2 3.31Å; G306-T355 WeakPolarHBondContact O-CG2 3.37Å
307	G	90.9	Very high	96.5	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.5	-27	170	0	0	0	0	0	114.8	G244 D245	G244-G307 CarbonylContact C-O 3.56Å; G244-G307 WeakPolarHBondContact CA-O 3.3Å; D245-G307 PolarHBondContact N-O 3.29Å; D245-G307 WeakPolarHBondContact OD2-CA 3.42Å
308	G	97.3	Very high	96.6	Very high	4 Å²	4	24.4 Å²	24.4	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169	166.1	174.4	0	0	0	0	0	114.6	K243 F353	K243-G308 CarbonylContact O-C 3.58Å; K243-G308 WeakPolarHBondContact O-CA 3.36Å; G308-F353 VanDerWaalsContact O-CD1 3.24Å; G308-F353 WeakPolarHBondContact O-CD1 3.45Å; G308-F353 WeakPolarHBondContact O-CE1 3.41Å
309	F	98.7	Very high	96.8	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.009	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.4	179.7	43.1	-98.9	0	0	0	110.9	K243 F271 I272 A304 Y311 D333 T336	K243-F309 HydrophobicContact CB-CD2 4.31Å; K243-F309 HydrophobicContact CB-CE2 3.97Å; K243-F309 HydrophobicContact CB-CZ 4.45Å; K243-F309 HydrophobicContact CD-CE2 3.85Å; K243-F309 HydrophobicContact CD-CZ 3.67Å; K243-F309 HydrophobicContact CG-CE2 4.42Å; K243-F309 HydrophobicContact CG-CZ 4.44Å; K243-F309 PolarHBondContact N-O 3.45Å; K243-F309 PolarHBondContact O-N 2.81Å; F271-F309 HydrophobicContact CE1-CB 4.14Å; F271-F309 HydrophobicContact CE1-CD2 4.06Å; F271-F309 HydrophobicContact CE1-CG 4.13Å; F271-F309 HydrophobicContact CE2-CD2 4.18Å; F271-F309 HydrophobicContact CE2-CE2 4.29Å; F271-F309 HydrophobicContact CZ-CB 4.46Å; F271-F309 AromaticContact CZ-CD2 3.52Å; F271-F309 HydrophobicContact CZ-CD2 3.52Å; F271-F309 AromaticContact CZ-CE2 3.76Å; F271-F309 HydrophobicContact CZ-CE2 3.76Å; F271-F309 AromaticContact CZ-CG 4Å; F271-F309 HydrophobicContact CZ-CG 4Å; F271-F309 HydrophobicContact CZ-CZ 4.42Å; I272-F309 WeakPolarHBondContact O-CA 3.31Å; I272-F309 VanDerWaalsContact O-CB 3.27Å; I272-F309 WeakPolarHBondContact O-CB 3.19Å; A304-F309 HydrophobicContact CB-CB 3.96Å; A304-F309 HydrophobicContact CB-CD1 4.21Å; A304-F309 HydrophobicContact CB-CG 4.35Å; F309-Y311 AromaticContact CD2-CD1 3.77Å; F309-Y311 HydrophobicContact CD2-CD1 3.77Å; F309-Y311 AromaticContact CD2-CE1 3.73Å; F309-Y311 HydrophobicContact CD2-CE1 3.73Å; F309-Y311 HydrophobicContact CE2-CD1 4.18Å; F309-Y311 AromaticContact CE2-CE1 3.73Å; F309-Y311 HydrophobicContact CE2-CE1 3.73Å; F309-D333 WeakPolarHBondContact CE1-OD1 3.47Å; F309-T336 HydrophobicContact CE2-CG2 4.35Å; F309-T336 HydrophobicContact CZ-CG2 4.25Å
310	L	98.9	Very high	97	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132	-174.1	-178.9	72.7	0	0	0	110.1	L144 F242 I255 Y258 L259 L270 F271 I272 F353	L144-L310 HydrophobicContact CD1-CD1 3.95Å; F242-L310 HydrophobicContact CB-CD1 3.9Å; I255-L310 HydrophobicContact CG2-CD1 4.03Å; I255-L310 HydrophobicContact CG2-CD2 3.96Å; Y258-L310 HydrophobicContact CD1-CD2 4.19Å; Y258-L310 HydrophobicContact CE1-CD2 4.45Å; L259-L310 HydrophobicContact CD1-CD1 4.35Å; L259-L310 HydrophobicContact CD1-CD2 4.43Å; L259-L310 HydrophobicContact CD2-CD1 4.49Å; L259-L310 HydrophobicContact CD2-CD2 3.67Å; L259-L310 HydrophobicContact CD2-CG 4.23Å; L259-L310 HydrophobicContact CG-CD2 4.06Å; L270-L310 HydrophobicContact CD2-CD2 4.46Å; L270-L310 HydrophobicContact CD2-CG 4.38Å; F271-L310 WeakPolarHBondContact CA-O 3.29Å; I272-L310 HydrophobicContact CD1-CB 4.4Å; I272-L310 HydrophobicContact CD1-CD2 4.11Å; I272-L310 HydrophobicContact CG1-CB 3.87Å; I272-L310 HydrophobicContact CG1-CD2 4.39Å; I272-L310 PolarHBondContact N-O 3.2Å; I272-L310 PolarHBondContact O-N 2.98Å; L310-F353 HydrophobicContact CB-CZ 4.04Å
311	Y	98.9	Very high	96.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	169.5	-177.7	56.3	-82.1	0	0	0	112.3	F227 F240 V241 K243 L270 F271 F309 A316	F227-Y311 WeakPolarHBondContact CE1-OH 3.46Å; F240-Y311 CarbonylContact C-O 3.37Å; F240-Y311 WeakPolarHBondContact CA-O 3.24Å; V241-Y311 HydrophobicContact CB-CD2 4.08Å; V241-Y311 HydrophobicContact CB-CE1 4.11Å; V241-Y311 HydrophobicContact CB-CE2 3.64Å; V241-Y311 HydrophobicContact CG1-CE1 3.98Å; V241-Y311 HydrophobicContact CG1-CE2 3.98Å; V241-Y311 WeakPolarHBondContact CG1-OH 3.48Å; V241-Y311 HydrophobicContact CG2-CE2 4.06Å; V241-Y311 PolarHBondContact N-O 3.23Å; V241-Y311 PolarHBondContact O-N 3.44Å; K243-Y311 HydrophobicContact CB-CE1 4.04Å; L270-Y311 CarbonylContact O-C 3.59Å; L270-Y311 WeakPolarHBondContact O-CA 3.44Å; L270-Y311 WeakPolarHBondContact O-CB 3.42Å; F271-Y311 HydrophobicContact CD2-CD1 4.43Å; F271-Y311 HydrophobicContact CD2-CG 4.14Å; F271-Y311 HydrophobicContact CE2-CD1 4.19Å; F271-Y311 HydrophobicContact CE2-CG 4.27Å; F309-Y311 AromaticContact CD2-CD1 3.77Å; F309-Y311 HydrophobicContact CD2-CD1 3.77Å; F309-Y311 AromaticContact CD2-CE1 3.73Å; F309-Y311 HydrophobicContact CD2-CE1 3.73Å; F309-Y311 HydrophobicContact CE2-CD1 4.18Å; F309-Y311 AromaticContact CE2-CE1 3.73Å; F309-Y311 HydrophobicContact CE2-CE1 3.73Å; Y311-A316 HydrophobicContact CD2-CB 4.17Å; Y311-A316 HydrophobicContact CE2-CB 3.65Å
312	S	98.9	Very high	97	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	148.7	178.2	75.4	0	0	0	0	112.2	E239 A267 K268 L270 H314 L315 A316	E239-S312 WeakPolarHBondContact O-CA 3.38Å; A267-S312 WeakPolarHBondContact O-CB 3.34Å; K268-S312 PolarHBondContact O-OG 2.79Å; L270-S312 PolarHBondContact O-N 2.77Å; L270-S312 VanDerWaalsContact O-N 3.07Å; S312-H314 VanDerWaalsContact C-N 3.26Å; S312-H314 PolarHBondContact O-N 2.69Å; S312-L315 PolarHBondContact O-N 2.79Å; S312-L315 VanDerWaalsContact O-N 3.16Å; S312-L315 VanDerWaalsContact OG-CB 3.23Å; S312-L315 WeakPolarHBondContact OG-CB 3.36Å; S312-L315 PolarHBondContact OG-N 3.26Å; S312-A316 PolarHBondContact O-N 2.86Å
313	G	98.8	Very high	97	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-33.3	172.8	0	0	0	0	0	112.5	T238 E239 L315 A316 L317	T238-G313 WeakPolarHBondContact O-CA 3.27Å; E239-G313 PolarHBondContact O-N 3.06Å; G313-L315 VanDerWaalsContact C-N 3.32Å; G313-L315 PolarHBondContact O-N 3.02Å; G313-A316 WeakPolarHBondContact O-CA 3.43Å; G313-A316 WeakPolarHBondContact O-CB 3.48Å; G313-A316 PolarHBondContact O-N 2.72Å; G313-L317 PolarHBondContact O-N 2.86Å; G313-L317 VanDerWaalsContact O-N 3.14Å
314	H	98.6	Very high	96.9	Very high	79 Å²	79	24.8 Å²	24.8	37%	0.366	13%	0.125	S	C	.	.	H	α-helix	trans	-58.1	-43.2	171.5	172.7	-93.2	0	0	0	112.1	K268 D269 S312 A316 L317 R318	K268-H314 WeakPolarHBondContact CE-CE1 3.33Å; K268-H314 WeakPolarHBondContact CE-NE2 3.37Å; K268-H314 PolarHBondContact O-ND1 3.4Å; K268-H314 VanDerWaalsContact O-ND1 3.12Å; D269-H314 IonicContact OD1-CE1 2.74Å; D269-H314 IonicContact OD1-ND1 3.55Å; D269-H314 PolarHBondContact OD1-ND1 2.94Å; S312-H314 VanDerWaalsContact C-N 3.26Å; S312-H314 PolarHBondContact O-N 2.69Å; H314-A316 VanDerWaalsContact C-N 3.34Å; H314-L317 PolarHBondContact O-N 2.88Å; H314-R318 PolarHBondContact O-N 3.01Å
315	L	98.8	Very high	96.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-69.2	-33.3	174.5	-178.6	58.5	0	0	0	111.7	L270 F271 S312 G313 L317 R318 L319 L340 L343 L345	L270-L315 WeakPolarHBondContact O-CD2 3.3Å; F271-L315 HydrophobicContact CB-CD2 3.73Å; F271-L315 HydrophobicContact CD2-CD2 3.81Å; F271-L315 HydrophobicContact CG-CD2 4.27Å; S312-L315 PolarHBondContact O-N 2.79Å; S312-L315 VanDerWaalsContact O-N 3.16Å; S312-L315 VanDerWaalsContact OG-CB 3.23Å; S312-L315 WeakPolarHBondContact OG-CB 3.36Å; S312-L315 PolarHBondContact OG-N 3.26Å; G313-L315 VanDerWaalsContact C-N 3.32Å; G313-L315 PolarHBondContact O-N 3.02Å; L315-L317 VanDerWaalsContact C-N 3.3Å; L315-L317 PolarHBondContact O-N 3.27Å; L315-R318 HydrophobicContact CD1-CB 4.31Å; L315-R318 PolarHBondContact O-N 3.17Å; L315-R318 VanDerWaalsContact O-N 3.16Å; L315-L319 HydrophobicContact CD1-CG 4.33Å; L315-L319 HydrophobicContact CG-CD1 4.12Å; L315-L319 HydrophobicContact CG-CG 4.24Å; L315-L319 WeakPolarHBondContact O-CB 3.37Å; L315-L319 WeakPolarHBondContact O-CG 3.32Å; L315-L319 PolarHBondContact O-N 3.48Å; L315-L340 HydrophobicContact CD1-CD2 4.43Å; L315-L340 HydrophobicContact CD2-CD2 4.08Å; L315-L343 HydrophobicContact CD1-CD1 4.03Å; L315-L345 HydrophobicContact CD1-CD1 3.46Å; L315-L345 VanDerWaalsContact CD1-CD1 3.46Å; L315-L345 HydrophobicContact CD2-CD1 4.41Å
316	A	98.8	Very high	97.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-55.8	-43.6	174.2	0	0	0	0	0	112.1	L228 V231 V241 Y311 S312 G313 H314 L319 Y320	L228-A316 HydrophobicContact CD2-CB 4.25Å; V231-A316 HydrophobicContact CG1-CB 4.06Å; V241-A316 HydrophobicContact CG2-CB 4.38Å; Y311-A316 HydrophobicContact CD2-CB 4.17Å; Y311-A316 HydrophobicContact CE2-CB 3.65Å; S312-A316 PolarHBondContact O-N 2.86Å; G313-A316 WeakPolarHBondContact O-CA 3.43Å; G313-A316 WeakPolarHBondContact O-CB 3.48Å; G313-A316 PolarHBondContact O-N 2.72Å; H314-A316 VanDerWaalsContact C-N 3.34Å; A316-L319 WeakPolarHBondContact O-CB 3.36Å; A316-L319 PolarHBondContact O-N 3.42Å; A316-Y320 PolarHBondContact O-N 2.99Å
317	L	98.8	Very high	98	Very high	57 Å²	57	25.1 Å²	25.1	30%	0.298	12%	0.117	S	C	.	.	H	α-helix	trans	-64.9	-40.7	176.7	-61.1	-178.9	0	0	0	112.4	P236 G313 H314 L315 L319 Y320 H321	P236-L317 HydrophobicContact CB-CD2 4.2Å; G313-L317 PolarHBondContact O-N 2.86Å; G313-L317 VanDerWaalsContact O-N 3.14Å; H314-L317 PolarHBondContact O-N 2.88Å; L315-L317 VanDerWaalsContact C-N 3.3Å; L315-L317 PolarHBondContact O-N 3.27Å; L317-L319 VanDerWaalsContact C-N 3.35Å; L317-Y320 PolarHBondContact O-N 3.39Å; L317-H321 PolarHBondContact O-N 3.4Å
318	R	98.8	Very high	98.4	Very high	71 Å²	71	25.4 Å²	25.4	27%	0.268	12%	0.118	S	C	.	.	H	α-helix	trans	-65.1	-39.9	175.1	-66.5	174.2	60.8	-171.5	-0.1	111.6	D269 H314 L315 H321 I322 L343	D269-R318 IonicContact OD1-CZ 2.78Å; D269-R318 IonicContact OD1-NH1 3.37Å; D269-R318 PolarHBondContact OD1-NH1 3.38Å; D269-R318 IonicContact OD2-NH1 3.27Å; D269-R318 PolarHBondContact OD2-NH1 3.47Å; H314-R318 PolarHBondContact O-N 3.01Å; L315-R318 HydrophobicContact CD1-CB 4.31Å; L315-R318 PolarHBondContact O-N 3.17Å; L315-R318 VanDerWaalsContact O-N 3.16Å; R318-H321 PolarHBondContact O-N 3.04Å; R318-I322 PolarHBondContact O-N 3.26Å; R318-I322 VanDerWaalsContact O-N 3.12Å; R318-L343 HydrophobicContact CB-CD1 4.01Å; R318-L343 HydrophobicContact CB-CD2 4.37Å
319	L	98.8	Very high	98.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-62	-50.1	174.8	-75.9	169.7	0	0	0	110.1	L228 F271 L315 A316 L317 H321 I322 T323 C339 L340 L343	L228-L319 HydrophobicContact CD1-CB 3.96Å; L228-L319 HydrophobicContact CD2-CB 4.27Å; F271-L319 HydrophobicContact CD2-CD1 4.43Å; F271-L319 HydrophobicContact CE2-CD1 4.18Å; L315-L319 HydrophobicContact CD1-CG 4.33Å; L315-L319 HydrophobicContact CG-CD1 4.12Å; L315-L319 HydrophobicContact CG-CG 4.24Å; L315-L319 WeakPolarHBondContact O-CB 3.37Å; L315-L319 WeakPolarHBondContact O-CG 3.32Å; L315-L319 PolarHBondContact O-N 3.48Å; A316-L319 WeakPolarHBondContact O-CB 3.36Å; A316-L319 PolarHBondContact O-N 3.42Å; L317-L319 VanDerWaalsContact C-N 3.35Å; L319-H321 VanDerWaalsContact C-N 3.3Å; L319-H321 PolarHBondContact O-N 3.29Å; L319-I322 WeakPolarHBondContact O-CG2 3.45Å; L319-I322 PolarHBondContact O-N 2.85Å; L319-I322 VanDerWaalsContact O-N 3.09Å; L319-T323 WeakPolarHBondContact O-CG2 3.23Å; L319-T323 PolarHBondContact O-N 2.61Å; L319-T323 VanDerWaalsContact O-N 3.12Å; L319-C339 HydrophobicContact CD2-CB 3.73Å; L319-L340 HydrophobicContact CD2-CD2 3.96Å; L319-L340 HydrophobicContact CD2-CG 4.17Å; L319-L343 HydrophobicContact CD2-CD1 3.95Å; L319-L343 HydrophobicContact CG-CD1 4.3Å
320	Y	98.7	Very high	98.4	Very high	62 Å²	62	25.1 Å²	25.1	24%	0.243	12%	0.116	C	C	.	.	H	α-helix	trans	-52.6	-50	176.3	177.5	-125.7	0	0	0	111.5	L228 R229 S232 A316 L317 I322 T323	L228-Y320 HydrophobicContact CB-CD2 4.15Å; L228-Y320 HydrophobicContact CB-CG 4.44Å; R229-Y320 VanDerWaalsContact CA-CE2 3.42Å; R229-Y320 HydrophobicContact CB-CD2 4.01Å; R229-Y320 HydrophobicContact CB-CE2 3.41Å; R229-Y320 VanDerWaalsContact CB-CE2 3.41Å; R229-Y320 HydrophobicContact CG-CE2 3.86Å; R229-Y320 WeakPolarHBondContact CG-OH 3.39Å; S232-Y320 WeakPolarHBondContact OG-CD1 3.43Å; A316-Y320 PolarHBondContact O-N 2.99Å; L317-Y320 PolarHBondContact O-N 3.39Å; Y320-I322 VanDerWaalsContact C-N 3.28Å; Y320-I322 PolarHBondContact O-N 3.24Å; Y320-T323 WeakPolarHBondContact O-CB 3.42Å; Y320-T323 PolarHBondContact O-N 3.45Å; Y320-T323 VanDerWaalsContact O-N 3.11Å; Y320-T323 PolarHBondContact O-OG1 2.99Å
321	H	98	Very high	98.4	Very high	133 Å²	133	25.7 Å²	25.7	62%	0.616	12%	0.119	S	C	*	.	H	α-helix	trans	-59.8	-35.8	-179.7	-174.7	67.1	0	0	0	113.4	L317 R318 L319	L317-H321 PolarHBondContact O-N 3.4Å; R318-H321 PolarHBondContact O-N 3.04Å; L319-H321 VanDerWaalsContact C-N 3.3Å; L319-H321 PolarHBondContact O-N 3.29Å
322	I	98.2	Very high	98.3	Very high	12 Å²	12	25.9 Å²	25.9	6%	0.062	12%	0.12	C	C	.	.	H	α-helix	trans	-81.4	-14.1	-179.8	-146.9	66.7	0	0	0	113.3	R318 L319 Y320 D324 Q325 C339 K342 L343	R318-I322 PolarHBondContact O-N 3.26Å; R318-I322 VanDerWaalsContact O-N 3.12Å; L319-I322 WeakPolarHBondContact O-CG2 3.45Å; L319-I322 PolarHBondContact O-N 2.85Å; L319-I322 VanDerWaalsContact O-N 3.09Å; Y320-I322 VanDerWaalsContact C-N 3.28Å; Y320-I322 PolarHBondContact O-N 3.24Å; I322-D324 VanDerWaalsContact C-N 3.26Å; I322-D324 PolarHBondContact O-N 3.46Å; I322-Q325 HydrophobicContact CD1-CB 4.2Å; I322-Q325 HydrophobicContact CD1-CG 4.28Å; I322-Q325 HydrophobicContact CG1-CB 4.38Å; I322-Q325 WeakPolarHBondContact O-CA 3.39Å; I322-Q325 WeakPolarHBondContact O-CB 3.3Å; I322-Q325 PolarHBondContact O-N 2.97Å; I322-C339 HydrophobicContact CG2-CB 3.63Å; I322-K342 HydrophobicContact CD1-CD 3.93Å; I322-K342 HydrophobicContact CD1-CG 3.9Å; I322-K342 HydrophobicContact CG1-CB 4.03Å; I322-K342 HydrophobicContact CG1-CD 3.64Å; I322-K342 HydrophobicContact CG1-CG 3.64Å; I322-L343 HydrophobicContact CB-CD2 4.01Å; I322-L343 HydrophobicContact CB-CG 4.24Å; I322-L343 HydrophobicContact CD1-CD2 4.24Å; I322-L343 HydrophobicContact CG1-CD2 4.12Å; I322-L343 HydrophobicContact CG1-CG 4.34Å; I322-L343 HydrophobicContact CG2-CD1 4.27Å; I322-L343 HydrophobicContact CG2-CD2 4.38Å; I322-L343 HydrophobicContact CG2-CG 4.06Å
323	T	98.3	Very high	98.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-34.4	-179.5	63.6	0	0	0	0	112.8	R126 V225 L228 L319 Y320 Q325 V326 Y335	R126-T323 PolarHBondContact NH1-O 3.36Å; V225-T323 HydrophobicContact CG2-CG2 3.99Å; L228-T323 HydrophobicContact CD1-CG2 3.97Å; L319-T323 WeakPolarHBondContact O-CG2 3.23Å; L319-T323 PolarHBondContact O-N 2.61Å; L319-T323 VanDerWaalsContact O-N 3.12Å; Y320-T323 WeakPolarHBondContact O-CB 3.42Å; Y320-T323 PolarHBondContact O-N 3.45Å; Y320-T323 VanDerWaalsContact O-N 3.11Å; Y320-T323 PolarHBondContact O-OG1 2.99Å; T323-Q325 PolarHBondContact O-N 3.34Å; T323-V326 PolarHBondContact O-N 3.03Å; T323-V326 VanDerWaalsContact O-N 3.15Å; T323-Y335 WeakPolarHBondContact CA-OH 3.44Å; T323-Y335 VanDerWaalsContact CB-OH 3.27Å; T323-Y335 WeakPolarHBondContact CB-OH 3.48Å; T323-Y335 HydrophobicContact CG2-CE1 4.33Å; T323-Y335 PolarHBondContact O-OH 3.43Å
324	D	96.5	Very high	98.2	Very high	57 Å²	57	26.8 Å²	26.8	31%	0.305	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.3	174.6	-77	-5.6	0	0	0	112.8	H92 L93 I322	H92-D324 PolarHBondContact NE2-O 3.32Å; L93-D324 HydrophobicContact CD1-CB 4.25Å; L93-D324 HydrophobicContact CD2-CB 4.26Å; L93-D324 WeakPolarHBondContact CD2-OD1 3.13Å; I322-D324 VanDerWaalsContact C-N 3.26Å; I322-D324 PolarHBondContact O-N 3.46Å
325	Q	97.1	Very high	98.2	Very high	41 Å²	41	23 Å²	23	19%	0.192	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	5.7	179.4	-56.3	-170.5	30.2	0	0	113.8	Q63 L66 Y70 I322 T323 K342	Q63-Q325 PolarHBondContact NE2-O 3.1Å; L66-Q325 VanDerWaalsContact CD2-CA 3.5Å; L66-Q325 HydrophobicContact CD2-CB 4.37Å; L66-Q325 WeakPolarHBondContact CD2-O 3.43Å; Y70-Q325 HydrophobicContact CD1-CG 3.79Å; Y70-Q325 HydrophobicContact CD2-CG 4.45Å; Y70-Q325 HydrophobicContact CE1-CG 4.15Å; Y70-Q325 HydrophobicContact CG-CG 3.94Å; I322-Q325 HydrophobicContact CD1-CB 4.2Å; I322-Q325 HydrophobicContact CD1-CG 4.28Å; I322-Q325 HydrophobicContact CG1-CB 4.38Å; I322-Q325 WeakPolarHBondContact O-CA 3.39Å; I322-Q325 WeakPolarHBondContact O-CB 3.3Å; I322-Q325 PolarHBondContact O-N 2.97Å; T323-Q325 PolarHBondContact O-N 3.34Å; Q325-K342 HydrophobicContact CB-CD 3.77Å; Q325-K342 VanDerWaalsContact O-CE 3.25Å; Q325-K342 WeakPolarHBondContact O-CE 3.5Å; Q325-K342 PolarHBondContact O-NZ 3.31Å
326	V	98.1	Very high	98.2	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.018	11%	0.108	C	C	.	.	S	Bend	trans	-134.7	125.5	179	-171.6	0	0	0	0	109.4	W59 R126 T323 Y335 M338 K342	W59-V326 HydrophobicContact CZ2-CG1 4.3Å; R126-V326 PolarHBondContact NH2-O 3.48Å; T323-V326 PolarHBondContact O-N 3.03Å; T323-V326 VanDerWaalsContact O-N 3.15Å; V326-Y335 HydrophobicContact CB-CE2 4.01Å; V326-Y335 HydrophobicContact CG1-CD2 4.11Å; V326-Y335 HydrophobicContact CG1-CE2 3.7Å; V326-M338 HydrophobicContact CG1-CB 4.06Å; V326-M338 HydrophobicContact CG1-SD 4.48Å; V326-K342 HydrophobicContact CG2-CB 4.47Å; V326-K342 HydrophobicContact CG2-CD 3.8Å
327	H	98.2	Very high	98.2	Very high	3 Å²	3	23.2 Å²	23.2	1%	0.014	11%	0.109	C	C	.	.			trans	-64.6	141.8	171.2	-82	-67.6	0	0	0	110.3	W59 E62 L66 L123 Y335	W59-H327 HydrophobicContact CZ2-CB 4.43Å; W59-H327 PolarHBondContact NE1-O 3.12Å; E62-H327 PolarHBondContact O-NE2 3.45Å; L66-H327 WeakPolarHBondContact CD1-NE2 3.49Å; L123-H327 HydrophobicContact CD1-CB 4.49Å; H327-Y335 WeakPolarHBondContact O-CD2 3.36Å; H327-Y335 VanDerWaalsContact O-CE2 3.3Å; H327-Y335 WeakPolarHBondContact O-CE2 3.23Å
328	L	98.6	Very high	98.2	Very high	7 Å²	7	21 Å²	21	4%	0.037	10%	0.097	C	C	.	.			trans	-50.5	151.6	172.8	-63.2	175.3	0	0	0	110.2	W59 F119 L123 R126 L222 V225 Y335	W59-L328 PolarHBondContact NE1-O 3.28Å; F119-L328 HydrophobicContact CE2-CB 4.39Å; F119-L328 WeakPolarHBondContact CZ-O 3.44Å; L123-L328 HydrophobicContact CD1-CB 3.98Å; R126-L328 HydrophobicContact CB-CD1 4.49Å; L222-L328 HydrophobicContact CB-CD1 4.14Å; L222-L328 HydrophobicContact CD1-CD1 4.35Å; V225-L328 HydrophobicContact CG2-CD2 3.69Å; L328-Y335 HydrophobicContact CD2-CE2 4.35Å
329	Y	98.6	Very high	98.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.085	C	C	.	.			trans	-131.1	146.6	179.7	-167.4	-106.7	0	0	0	110	W59 S221 Y296 Y300 I331 V334 M338	W59-Y329 HydrophobicContact CD2-CD2 4.24Å; W59-Y329 HydrophobicContact CG-CD2 4.27Å; W59-Y329 AromaticContact NE1-CD2 3.81Å; S221-Y329 WeakPolarHBondContact CB-O 3.3Å; S221-Y329 PolarHBondContact OG-N 3.1Å; S221-Y329 PolarHBondContact OG-O 3.37Å; Y296-Y329 HydrophobicContact CD2-CD2 4.35Å; Y296-Y329 AromaticContact CD2-CE2 3.51Å; Y296-Y329 HydrophobicContact CD2-CE2 3.51Å; Y296-Y329 HydrophobicContact CE2-CE2 4.15Å; Y296-Y329 AromaticContact CG-CE2 3.77Å; Y296-Y329 HydrophobicContact CG-CE2 3.77Å; Y300-Y329 AromaticContact CE1-CE1 3.85Å; Y300-Y329 HydrophobicContact CE1-CE1 3.85Å; Y300-Y329 AromaticContact CE1-CZ 3.71Å; Y300-Y329 WeakPolarHBondContact CE1-OH 3.24Å; Y300-Y329 AromaticContact CZ-CE1 3.98Å; Y300-Y329 PolarHBondContact OH-OH 3.34Å; Y329-I331 HydrophobicContact CD1-CB 4.07Å; Y329-I331 HydrophobicContact CD1-CG1 4.48Å; Y329-I331 HydrophobicContact CE1-CB 4.11Å; Y329-I331 HydrophobicContact CE1-CD1 4.26Å; Y329-I331 HydrophobicContact CE1-CG1 4.13Å; Y329-I331 PolarHBondContact O-N 3.41Å; Y329-V334 HydrophobicContact CD1-CB 3.95Å; Y329-V334 HydrophobicContact CD1-CG1 3.97Å; Y329-V334 HydrophobicContact CE1-CB 4.09Å; Y329-V334 HydrophobicContact CE1-CG1 3.9Å; Y329-M338 HydrophobicContact CD1-CE 3.88Å; Y329-M338 HydrophobicContact CD2-CE 3.61Å; Y329-M338 HydrophobicContact CE1-CE 4.17Å; Y329-M338 HydrophobicContact CE2-CE 3.92Å; Y329-M338 HydrophobicContact CG-CE 3.61Å; Y329-M338 HydrophobicContact CG-SD 4.36Å
330	P	98.3	Very high	98.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	-64	-10.6	-175.1	-25.9	37	0	0	0	115.8	F119 F218 I291	F119-P330 HydrophobicContact CD1-CG 3.94Å; F119-P330 HydrophobicContact CD2-CG 4.12Å; F119-P330 HydrophobicContact CE1-CG 3.68Å; F119-P330 HydrophobicContact CE2-CB 4.48Å; F119-P330 HydrophobicContact CE2-CG 3.87Å; F119-P330 HydrophobicContact CG-CG 4.16Å; F119-P330 VanDerWaalsContact CZ-CD 3.41Å; F119-P330 HydrophobicContact CZ-CG 3.64Å; F218-P330 HydrophobicContact CB-CB 4.38Å; F218-P330 HydrophobicContact CD1-CB 3.65Å; F218-P330 WeakPolarHBondContact CD1-O 3.12Å; F218-P330 HydrophobicContact CD2-CB 3.81Å; F218-P330 HydrophobicContact CD2-CG 4.35Å; F218-P330 HydrophobicContact CE1-CB 3.75Å; F218-P330 HydrophobicContact CE2-CB 3.88Å; F218-P330 HydrophobicContact CE2-CG 4.36Å; F218-P330 HydrophobicContact CG-CB 3.7Å; F218-P330 HydrophobicContact CZ-CB 3.86Å; I291-P330 HydrophobicContact CD1-CB 3.91Å; I291-P330 HydrophobicContact CD1-CG 4.07Å
331	I	98.1	Very high	98.2	Very high	11 Å²	11	20.5 Å²	20.5	6%	0.056	10%	0.1	C	C	.	.	S	Bend	trans	-123.3	116.1	179.2	-50.4	176.5	0	0	0	107.5	Y289 I291 Y329 V334 Y335	Y289-I331 HydrophobicContact CD1-CD1 4.41Å; I291-I331 HydrophobicContact CD1-CD1 4.29Å; I291-I331 HydrophobicContact CD1-CG1 4.39Å; I291-I331 HydrophobicContact CG1-CD1 4.15Å; Y329-I331 HydrophobicContact CD1-CB 4.07Å; Y329-I331 HydrophobicContact CD1-CG1 4.48Å; Y329-I331 HydrophobicContact CE1-CB 4.11Å; Y329-I331 HydrophobicContact CE1-CD1 4.26Å; Y329-I331 HydrophobicContact CE1-CG1 4.13Å; Y329-I331 PolarHBondContact O-N 3.41Å; I331-V334 HydrophobicContact CB-CB 4.19Å; I331-V334 HydrophobicContact CB-CG2 3.98Å; I331-V334 HydrophobicContact CD1-CG2 4.46Å; I331-V334 HydrophobicContact CG2-CB 4.35Å; I331-V334 HydrophobicContact CG2-CG2 3.78Å; I331-V334 PolarHBondContact O-N 3.27Å; I331-Y335 PolarHBondContact O-N 2.57Å
332	D	97.6	Very high	98.2	Very high	5 Å²	5	17.2 Å²	17.2	3%	0.027	8%	0.084	C	C	.	.	H	α-helix	trans	-66	-41.9	-172	63.1	-36.2	0	0	0	113.7	K149 L220 K243 V334 Y335 T336	K149-D332 IonicContact NZ-OD2 3.12Å; K149-D332 PolarHBondContact NZ-OD2 2.91Å; L220-D332 HydrophobicContact CB-CB 3.61Å; K243-D332 IonicContact NZ-OD2 3.6Å; K243-D332 PolarHBondContact NZ-OD2 3.37Å; D332-V334 VanDerWaalsContact C-N 3.31Å; D332-V334 PolarHBondContact O-N 2.92Å; D332-Y335 WeakPolarHBondContact O-CB 3.48Å; D332-Y335 PolarHBondContact O-N 3.31Å; D332-T336 PolarHBondContact O-N 3.33Å; D332-T336 PolarHBondContact O-OG1 3.05Å
333	D	97.4	Very high	98.2	Very high	20 Å²	20	18.4 Å²	18.4	11%	0.107	9%	0.09	C	C	.	.	H	α-helix	trans	-62.7	-41.5	178.5	-67.1	-16.2	0	0	0	110.9	Y303 A304 G305 G306 F309 T336 G337	Y303-D333 WeakPolarHBondContact CB-O 3.13Å; Y303-D333 HydrophobicContact CD2-CB 3.83Å; Y303-D333 HydrophobicContact CE2-CB 4.18Å; A304-D333 WeakPolarHBondContact O-CB 3.34Å; G305-D333 WeakPolarHBondContact CA-OD2 3.35Å; G306-D333 PolarHBondContact N-OD2 3.19Å; F309-D333 WeakPolarHBondContact CE1-OD1 3.47Å; D333-T336 PolarHBondContact O-N 2.76Å; D333-G337 PolarHBondContact O-N 3.33Å
334	V	98.5	Very high	98.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-42.6	175.4	-177.3	0	0	0	0	110.7	Y300 Y303 Y329 I331 D332 T336 G337 M338	Y300-V334 HydrophobicContact CD1-CG1 3.53Å; Y300-V334 HydrophobicContact CD2-CG1 4.22Å; Y300-V334 HydrophobicContact CD2-CG2 3.91Å; Y300-V334 HydrophobicContact CE1-CG1 3.84Å; Y300-V334 HydrophobicContact CE2-CG1 4.47Å; Y300-V334 HydrophobicContact CE2-CG2 3.9Å; Y300-V334 HydrophobicContact CG-CG1 3.73Å; Y300-V334 HydrophobicContact CG-CG2 4.26Å; Y303-V334 HydrophobicContact CD1-CG2 4.19Å; Y303-V334 HydrophobicContact CD2-CG2 4.32Å; Y303-V334 HydrophobicContact CE1-CG2 3.98Å; Y303-V334 HydrophobicContact CE2-CG2 4.11Å; Y303-V334 HydrophobicContact CG-CG2 4.36Å; Y329-V334 HydrophobicContact CD1-CB 3.95Å; Y329-V334 HydrophobicContact CD1-CG1 3.97Å; Y329-V334 HydrophobicContact CE1-CB 4.09Å; Y329-V334 HydrophobicContact CE1-CG1 3.9Å; I331-V334 HydrophobicContact CB-CB 4.19Å; I331-V334 HydrophobicContact CB-CG2 3.98Å; I331-V334 HydrophobicContact CD1-CG2 4.46Å; I331-V334 HydrophobicContact CG2-CB 4.35Å; I331-V334 HydrophobicContact CG2-CG2 3.78Å; I331-V334 PolarHBondContact O-N 3.27Å; D332-V334 VanDerWaalsContact C-N 3.31Å; D332-V334 PolarHBondContact O-N 2.92Å; V334-T336 VanDerWaalsContact C-N 3.27Å; V334-T336 PolarHBondContact O-N 3.17Å; V334-G337 CarbonylContact O-C 3.41Å; V334-G337 WeakPolarHBondContact O-CA 3.39Å; V334-G337 PolarHBondContact O-N 3.15Å; V334-G337 VanDerWaalsContact O-N 3.11Å; V334-M338 HydrophobicContact CG1-CE 3.69Å; V334-M338 WeakPolarHBondContact O-CG 2.99Å; V334-M338 PolarHBondContact O-N 3.33Å
335	Y	98.8	Very high	98.2	Very high	1 Å²	1	20.9 Å²	20.9	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-55.9	-43.6	175	176.7	-101.4	0	0	0	111.7	E224 V225 T323 V326 H327 L328 I331 D332 G337 M338 C339	E224-Y335 HydrophobicContact CG-CD1 4.46Å; V225-Y335 HydrophobicContact CG2-CE1 3.62Å; V225-Y335 WeakPolarHBondContact CG2-OH 3.38Å; T323-Y335 WeakPolarHBondContact CA-OH 3.44Å; T323-Y335 VanDerWaalsContact CB-OH 3.27Å; T323-Y335 WeakPolarHBondContact CB-OH 3.48Å; T323-Y335 HydrophobicContact CG2-CE1 4.33Å; T323-Y335 PolarHBondContact O-OH 3.43Å; V326-Y335 HydrophobicContact CB-CE2 4.01Å; V326-Y335 HydrophobicContact CG1-CD2 4.11Å; V326-Y335 HydrophobicContact CG1-CE2 3.7Å; H327-Y335 WeakPolarHBondContact O-CD2 3.36Å; H327-Y335 VanDerWaalsContact O-CE2 3.3Å; H327-Y335 WeakPolarHBondContact O-CE2 3.23Å; L328-Y335 HydrophobicContact CD2-CE2 4.35Å; I331-Y335 PolarHBondContact O-N 2.57Å; D332-Y335 WeakPolarHBondContact O-CB 3.48Å; D332-Y335 PolarHBondContact O-N 3.31Å; Y335-G337 VanDerWaalsContact C-N 3.34Å; Y335-G337 PolarHBondContact O-N 3.31Å; Y335-M338 WeakPolarHBondContact O-CB 3.44Å; Y335-M338 PolarHBondContact O-N 3.24Å; Y335-C339 PolarHBondContact O-N 3.1Å; Y335-C339 PolarHBondContact O-SG 2.89Å
336	T	98.7	Very high	98.3	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-42.6	176.9	-50.7	0	0	0	0	110.8	F271 F309 D332 D333 V334 M338 C339 L340	F271-T336 HydrophobicContact CE2-CG2 3.86Å; F271-T336 HydrophobicContact CZ-CG2 3.74Å; F309-T336 HydrophobicContact CE2-CG2 4.35Å; F309-T336 HydrophobicContact CZ-CG2 4.25Å; D332-T336 PolarHBondContact O-N 3.33Å; D332-T336 PolarHBondContact O-OG1 3.05Å; D333-T336 PolarHBondContact O-N 2.76Å; V334-T336 VanDerWaalsContact C-N 3.27Å; V334-T336 PolarHBondContact O-N 3.17Å; T336-M338 PolarHBondContact O-N 2.87Å; T336-C339 WeakPolarHBondContact O-CB 3.21Å; T336-C339 PolarHBondContact O-N 2.61Å; T336-L340 WeakPolarHBondContact O-CG 3.35Å; T336-L340 PolarHBondContact O-N 3.16Å
337	G	98.6	Very high	98.3	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-39.1	172.1	0	0	0	0	0	113.9	D333 V334 Y335 C339 L340 Q341	D333-G337 PolarHBondContact O-N 3.33Å; V334-G337 CarbonylContact O-C 3.41Å; V334-G337 WeakPolarHBondContact O-CA 3.39Å; V334-G337 PolarHBondContact O-N 3.15Å; V334-G337 VanDerWaalsContact O-N 3.11Å; Y335-G337 VanDerWaalsContact C-N 3.34Å; Y335-G337 PolarHBondContact O-N 3.31Å; G337-C339 VanDerWaalsContact C-N 3.34Å; G337-L340 PolarHBondContact O-N 3.23Å; G337-Q341 WeakPolarHBondContact O-CB 3.35Å; G337-Q341 PolarHBondContact O-N 3.44Å
338	M	98.8	Very high	98.3	Very high	10 Å²	10	27.9 Å²	27.9	5%	0.049	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-39.4	174.1	-64.5	177.6	-172.8	0	0	111.7	W59 Y296 P301 V326 Y329 V334 Y335 T336 Q341 K342	W59-M338 HydrophobicContact CH2-CE 3.98Å; W59-M338 HydrophobicContact CH2-SD 3.33Å; W59-M338 WeakPolarHBondContact CH2-SD 3.43Å; W59-M338 HydrophobicContact CZ2-CE 4.11Å; W59-M338 HydrophobicContact CZ2-SD 3.37Å; W59-M338 WeakPolarHBondContact CZ2-SD 3.42Å; W59-M338 HydrophobicContact CZ3-CE 4.4Å; W59-M338 HydrophobicContact CZ3-SD 4.27Å; Y296-M338 HydrophobicContact CE2-CE 3.81Å; P301-M338 HydrophobicContact CG-CB 4.46Å; P301-M338 HydrophobicContact CG-CG 3.89Å; V326-M338 HydrophobicContact CG1-CB 4.06Å; V326-M338 HydrophobicContact CG1-SD 4.48Å; Y329-M338 HydrophobicContact CD1-CE 3.88Å; Y329-M338 HydrophobicContact CD2-CE 3.61Å; Y329-M338 HydrophobicContact CE1-CE 4.17Å; Y329-M338 HydrophobicContact CE2-CE 3.92Å; Y329-M338 HydrophobicContact CG-CE 3.61Å; Y329-M338 HydrophobicContact CG-SD 4.36Å; V334-M338 HydrophobicContact CG1-CE 3.69Å; V334-M338 WeakPolarHBondContact O-CG 2.99Å; V334-M338 PolarHBondContact O-N 3.33Å; Y335-M338 WeakPolarHBondContact O-CB 3.44Å; Y335-M338 PolarHBondContact O-N 3.24Å; T336-M338 PolarHBondContact O-N 2.87Å; M338-Q341 PolarHBondContact O-N 3.47Å; M338-K342 PolarHBondContact O-N 3.13Å
339	C	98.8	Very high	98.3	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-45.3	175.3	-65	0	0	0	0	111.6	L319 I322 Y335 T336 G337 Q341 K342 L343	L319-C339 HydrophobicContact CD2-CB 3.73Å; I322-C339 HydrophobicContact CG2-CB 3.63Å; Y335-C339 PolarHBondContact O-N 3.1Å; Y335-C339 PolarHBondContact O-SG 2.89Å; T336-C339 WeakPolarHBondContact O-CB 3.21Å; T336-C339 PolarHBondContact O-N 2.61Å; G337-C339 VanDerWaalsContact C-N 3.34Å; C339-Q341 PolarHBondContact O-N 2.81Å; C339-K342 PolarHBondContact O-N 2.73Å; C339-L343 WeakPolarHBondContact O-CG 3.48Å; C339-L343 PolarHBondContact O-N 2.96Å
340	L	98.8	Very high	98.3	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-45.9	175.1	-71.4	170.6	0	0	0	112	F271 L315 L319 T336 G337 K342 L343 G344 L345 P347	F271-L340 HydrophobicContact CB-CD2 4.49Å; F271-L340 HydrophobicContact CD1-CD1 3.9Å; F271-L340 HydrophobicContact CD2-CD1 3.78Å; F271-L340 HydrophobicContact CD2-CD2 3.75Å; F271-L340 HydrophobicContact CD2-CG 4.26Å; F271-L340 HydrophobicContact CE1-CD1 3.88Å; F271-L340 HydrophobicContact CE2-CD1 3.76Å; F271-L340 HydrophobicContact CE2-CD2 4.22Å; F271-L340 HydrophobicContact CE2-CG 4.31Å; F271-L340 HydrophobicContact CG-CD1 3.84Å; F271-L340 HydrophobicContact CG-CD2 4.19Å; F271-L340 HydrophobicContact CZ-CD1 3.81Å; L315-L340 HydrophobicContact CD1-CD2 4.43Å; L315-L340 HydrophobicContact CD2-CD2 4.08Å; L319-L340 HydrophobicContact CD2-CD2 3.96Å; L319-L340 HydrophobicContact CD2-CG 4.17Å; T336-L340 WeakPolarHBondContact O-CG 3.35Å; T336-L340 PolarHBondContact O-N 3.16Å; G337-L340 PolarHBondContact O-N 3.23Å; L340-K342 VanDerWaalsContact C-N 3.28Å; L340-K342 PolarHBondContact O-N 2.86Å; L340-L343 CarbonylContact O-C 3.58Å; L340-L343 WeakPolarHBondContact O-CA 3.35Å; L340-L343 WeakPolarHBondContact O-CB 3.11Å; L340-L343 PolarHBondContact O-N 2.98Å; L340-G344 PolarHBondContact O-N 2.92Å; L340-L345 CarbonylContact C-O 3.56Å; L340-L345 HydrophobicContact CD2-CB 4.29Å; L340-L345 HydrophobicContact CD2-CD1 4.39Å; L340-L345 PolarHBondContact O-N 2.93Å; L340-P347 HydrophobicContact CD1-CB 3.9Å; L340-P347 HydrophobicContact CD1-CG 3.98Å
341	Q	98.5	Very high	98.2	Very high	119 Å²	119	43.3 Å²	43.3	56%	0.556	23%	0.225	S	C	*	.	H	α-helix	trans	-58.4	-42.3	176.5	-176.7	-176.7	49.1	0	0	111.3	P301 G337 M338 C339 L343 G344	P301-Q341 HydrophobicContact CB-CB 4Å; P301-Q341 HydrophobicContact CB-CG 4.37Å; G337-Q341 WeakPolarHBondContact O-CB 3.35Å; G337-Q341 PolarHBondContact O-N 3.44Å; M338-Q341 PolarHBondContact O-N 3.47Å; C339-Q341 PolarHBondContact O-N 2.81Å; Q341-L343 VanDerWaalsContact C-N 3.27Å; Q341-L343 PolarHBondContact O-N 3.3Å; Q341-G344 WeakPolarHBondContact O-CA 3.47Å; Q341-G344 PolarHBondContact O-N 3.31Å
342	K	97.6	Very high	98.2	Very high	65 Å²	65	43 Å²	43	28%	0.283	23%	0.226	S	C	.	.	H	α-helix	trans	-66.7	-29	177.6	-174.2	168.6	-91.1	-130	0	112.7	N67 I322 Q325 V326 M338 C339 L340 G344	N67-K342 PolarHBondContact OD1-NZ 3.01Å; I322-K342 HydrophobicContact CD1-CD 3.93Å; I322-K342 HydrophobicContact CD1-CG 3.9Å; I322-K342 HydrophobicContact CG1-CB 4.03Å; I322-K342 HydrophobicContact CG1-CD 3.64Å; I322-K342 HydrophobicContact CG1-CG 3.64Å; Q325-K342 HydrophobicContact CB-CD 3.77Å; Q325-K342 VanDerWaalsContact O-CE 3.25Å; Q325-K342 WeakPolarHBondContact O-CE 3.5Å; Q325-K342 PolarHBondContact O-NZ 3.31Å; V326-K342 HydrophobicContact CG2-CB 4.47Å; V326-K342 HydrophobicContact CG2-CD 3.8Å; M338-K342 PolarHBondContact O-N 3.13Å; C339-K342 PolarHBondContact O-N 2.73Å; L340-K342 VanDerWaalsContact C-N 3.28Å; L340-K342 PolarHBondContact O-N 2.86Å; K342-G344 PolarHBondContact O-N 3.28Å
343	L	97.8	Very high	98.2	Very high	36 Å²	36	42.9 Å²	42.9	19%	0.188	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-2.9	170	-68.1	174.2	0	0	0	113.7	L315 R318 L319 I322 C339 L340 Q341 L345	L315-L343 HydrophobicContact CD1-CD1 4.03Å; R318-L343 HydrophobicContact CB-CD1 4.01Å; R318-L343 HydrophobicContact CB-CD2 4.37Å; L319-L343 HydrophobicContact CD2-CD1 3.95Å; L319-L343 HydrophobicContact CG-CD1 4.3Å; I322-L343 HydrophobicContact CB-CD2 4.01Å; I322-L343 HydrophobicContact CB-CG 4.24Å; I322-L343 HydrophobicContact CD1-CD2 4.24Å; I322-L343 HydrophobicContact CG1-CD2 4.12Å; I322-L343 HydrophobicContact CG1-CG 4.34Å; I322-L343 HydrophobicContact CG2-CD1 4.27Å; I322-L343 HydrophobicContact CG2-CD2 4.38Å; I322-L343 HydrophobicContact CG2-CG 4.06Å; C339-L343 WeakPolarHBondContact O-CG 3.48Å; C339-L343 PolarHBondContact O-N 2.96Å; L340-L343 CarbonylContact O-C 3.58Å; L340-L343 WeakPolarHBondContact O-CA 3.35Å; L340-L343 WeakPolarHBondContact O-CB 3.11Å; L340-L343 PolarHBondContact O-N 2.98Å; Q341-L343 VanDerWaalsContact C-N 3.27Å; Q341-L343 PolarHBondContact O-N 3.3Å; L343-L345 VanDerWaalsContact C-N 3.3Å; L343-L345 HydrophobicContact CB-CD1 4.17Å; L343-L345 HydrophobicContact CB-CG 4.19Å; L343-L345 HydrophobicContact CD1-CD1 4.49Å
344	G	98	Very high	98.2	Very high	68 Å²	68	46.5 Å²	46.5	70%	0.701	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	21.3	-175.2	0	0	0	0	0	113.6	L340 Q341 K342	L340-G344 PolarHBondContact O-N 2.92Å; Q341-G344 WeakPolarHBondContact O-CA 3.47Å; Q341-G344 PolarHBondContact O-N 3.31Å; K342-G344 PolarHBondContact O-N 3.28Å
345	L	98.1	Very high	98	Very high	41 Å²	41	46.9 Å²	46.9	22%	0.215	24%	0.239	C	C	.	.			trans	-107.1	151.1	-178.7	-62	175.6	0	0	0	111.1	L315 L340 L343	L315-L345 HydrophobicContact CD1-CD1 3.46Å; L315-L345 VanDerWaalsContact CD1-CD1 3.46Å; L315-L345 HydrophobicContact CD2-CD1 4.41Å; L340-L345 CarbonylContact C-O 3.56Å; L340-L345 HydrophobicContact CD2-CB 4.29Å; L340-L345 HydrophobicContact CD2-CD1 4.39Å; L340-L345 PolarHBondContact O-N 2.93Å; L343-L345 VanDerWaalsContact C-N 3.3Å; L343-L345 HydrophobicContact CB-CD1 4.17Å; L343-L345 HydrophobicContact CB-CG 4.19Å; L343-L345 HydrophobicContact CD1-CD1 4.49Å
346	V	98.2	Very high	97.8	Very high	93 Å²	93	55.4 Å²	55.4	56%	0.564	28%	0.277	S	S	*	.			trans	-121.4	123.9	172.9	-179	0	0	0	0	107.5	P302	P302-V346 HydrophobicContact CB-CG1 4.09Å; P302-V346 HydrophobicContact CG-CG1 4.19Å
347	P	98.3	Very high	97.6	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.019	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-64.5	145.5	176.7	28	-34.3	0	0	0	110.7	F271 V275 P302 L340	F271-P347 HydrophobicContact CD1-CB 3.47Å; F271-P347 VanDerWaalsContact CD1-CB 3.47Å; F271-P347 HydrophobicContact CE1-CB 3.98Å; F271-P347 HydrophobicContact CG-CB 4.27Å; V275-P347 HydrophobicContact CG1-CB 4.49Å; V275-P347 HydrophobicContact CG1-CG 3.9Å; V275-P347 HydrophobicContact CG2-CB 3.78Å; V275-P347 HydrophobicContact CG2-CG 4.08Å; P302-P347 HydrophobicContact CB-CG 4.35Å; L340-P347 HydrophobicContact CD1-CB 3.9Å; L340-P347 HydrophobicContact CD1-CG 3.98Å
348	E	98.4	Very high	97.4	Very high	99 Å²	99	57.4 Å²	57.4	46%	0.463	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.9	-178.4	-72.8	-178.1	-155.9	0	0	111.9	K266 F271 I272 G273 V275 H350	K266-E348 VanDerWaalsContact NZ-CD 3.28Å; K266-E348 IonicContact NZ-OE1 3.41Å; K266-E348 PolarHBondContact NZ-OE1 3.42Å; K266-E348 VanDerWaalsContact NZ-OE1 3.09Å; K266-E348 IonicContact NZ-OE2 3.33Å; K266-E348 PolarHBondContact NZ-OE2 3.17Å; F271-E348 PolarHBondContact O-N 3.2Å; I272-E348 VanDerWaalsContact CA-O 3.26Å; I272-E348 WeakPolarHBondContact CA-O 3.39Å; I272-E348 HydrophobicContact CG2-CB 4.04Å; G273-E348 PolarHBondContact N-O 3.08Å; V275-E348 VanDerWaalsContact CG2-C 3.46Å; V275-E348 WeakPolarHBondContact CG2-O 3.19Å; E348-H350 PolarHBondContact O-N 3.49Å
349	K	98.2	Very high	97.1	Very high	102 Å²	102	61.9 Å²	61.9	44%	0.443	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	128	174.6	175.7	63.8	175	176.4	0	110.4	G273 D274 V275	G273-K349 WeakPolarHBondContact O-CA 3.38Å; D274-K349 IonicContact OD1-NZ 2.68Å; D274-K349 PolarHBondContact OD1-NZ 2.78Å; D274-K349 IonicContact OD2-NZ 2.75Å; D274-K349 PolarHBondContact OD2-NZ 2.91Å; V275-K349 HydrophobicContact CB-CB 4.09Å
350	H	98.2	Very high	96.8	Very high	43 Å²	43	68.1 Å²	68.1	20%	0.199	34%	0.336	C	S	.	.			trans	-118.8	124.8	169.2	-170.8	-78.8	0	0	0	110.7	Y258 I272 G273 E348 G352 F353	Y258-H350 AromaticContact CE2-CD2 3.88Å; Y258-H350 AromaticContact CE2-NE2 3.8Å; I272-H350 HydrophobicContact CB-CB 4.2Å; I272-H350 HydrophobicContact CD1-CB 4.08Å; G273-H350 PolarHBondContact O-N 3.21Å; E348-H350 PolarHBondContact O-N 3.49Å; H350-G352 PolarHBondContact ND1-N 3.17Å; H350-G352 PolarHBondContact O-N 3.24Å; H350-F353 HydrophobicContact CB-CD2 3.88Å; H350-F353 HydrophobicContact CB-CE2 4.14Å; H350-F353 PolarHBondContact O-N 2.75Å
351	K	97	Very high	96.6	Very high	185 Å²	185	75.6 Å²	75.6	80%	0.804	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.1	-173.6	-66.5	-172.9	179.7	-179.4	0	114	F353 R354	K351-F353 PolarHBondContact O-N 2.68Å; K351-R354 WeakPolarHBondContact O-CD 3.41Å
352	G	97.6	Very high	96.3	Very high	6 Å²	6	72.3 Å²	72.3	6%	0.062	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.1	176.1	0	0	0	0	0	114.5	H350 R354 M373 L374	H350-G352 PolarHBondContact ND1-N 3.17Å; H350-G352 PolarHBondContact O-N 3.24Å; G352-R354 PolarHBondContact O-N 2.97Å; G352-M373 PolarHBondContact O-N 3.08Å; G352-L374 PolarHBondContact O-N 2.72Å; G352-L374 VanDerWaalsContact O-N 3.15Å
353	F	98.4	Very high	96.1	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.009	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	101.9	172.6	-71.7	-102	0	0	0	109.2	F242 I272 D274 G308 L310 H350 K351 M373 L374	F242-F353 HydrophobicContact CE2-CE1 4.31Å; I272-F353 HydrophobicContact CD1-CE2 3.92Å; I272-F353 HydrophobicContact CG1-CE2 4.09Å; I272-F353 HydrophobicContact CG1-CZ 4.4Å; D274-F353 HydrophobicContact CB-CB 4.07Å; G308-F353 VanDerWaalsContact O-CD1 3.24Å; G308-F353 WeakPolarHBondContact O-CD1 3.45Å; G308-F353 WeakPolarHBondContact O-CE1 3.41Å; L310-F353 HydrophobicContact CB-CZ 4.04Å; H350-F353 HydrophobicContact CB-CD2 3.88Å; H350-F353 HydrophobicContact CB-CE2 4.14Å; H350-F353 PolarHBondContact O-N 2.75Å; K351-F353 PolarHBondContact O-N 2.68Å; F353-M373 HydrophobicContact CD2-CB 3.95Å; F353-M373 HydrophobicContact CD2-CG 4.11Å; F353-M373 HydrophobicContact CE2-CB 3.82Å; F353-M373 HydrophobicContact CE2-CG 3.82Å; F353-M373 HydrophobicContact CG-CB 4.4Å; F353-M373 HydrophobicContact CZ-CB 4.15Å; F353-M373 HydrophobicContact CZ-CG 4.48Å; F353-L374 HydrophobicContact CD1-CB 4.17Å; F353-L374 HydrophobicContact CD1-CD2 4.34Å
354	R	97.3	Very high	96	Very high	95 Å²	95	77.2 Å²	77.2	36%	0.358	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	74	-175.3	-57.9	-60.9	-62.5	-101.2	0.3	110.5	K351 G352 F356 D357 I358 L372 L374 V375 H376	K351-R354 WeakPolarHBondContact O-CD 3.41Å; G352-R354 PolarHBondContact O-N 2.97Å; R354-F356 VanDerWaalsContact C-N 3.31Å; R354-F356 PolarHBondContact O-N 3.03Å; R354-D357 PolarHBondContact O-N 3.31Å; R354-I358 HydrophobicContact CB-CG2 4.26Å; R354-I358 HydrophobicContact CG-CG2 4.15Å; R354-L372 HydrophobicContact CG-CB 4.19Å; R354-L372 HydrophobicContact CG-CD2 4.46Å; R354-L374 WeakPolarHBondContact CB-O 3.31Å; R354-L374 PolarHBondContact N-O 2.87Å; R354-V375 HydrophobicContact CB-CB 4.21Å; R354-V375 HydrophobicContact CB-CG2 4.13Å; R354-V375 WeakPolarHBondContact O-CA 3.39Å; R354-H376 PolarHBondContact O-N 3.26Å
355	T	94.8	Very high	95.8	Very high	8 Å²	8	77.6 Å²	77.6	5%	0.049	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-18.4	-173	64.6	0	0	0	0	114	D274 G305 G306 L374 H376	D274-T355 HydrophobicContact CB-CG2 3.46Å; D274-T355 VanDerWaalsContact CB-CG2 3.46Å; D274-T355 PolarHBondContact OD2-OG1 3.21Å; G305-T355 WeakPolarHBondContact O-CG2 3.02Å; G306-T355 WeakPolarHBondContact O-CB 3.44Å; G306-T355 VanDerWaalsContact O-CG2 3.31Å; G306-T355 WeakPolarHBondContact O-CG2 3.37Å; T355-L374 HydrophobicContact CG2-CD2 4.23Å; T355-H376 PolarHBondContact O-ND1 3.31Å
356	F	93.8	Very high	95.8	Very high	180 Å²	180	76.3 Å²	76.3	79%	0.789	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	35.5	174	-63.3	-87.2	0	0	0	112	R354	R354-F356 VanDerWaalsContact C-N 3.31Å; R354-F356 PolarHBondContact O-N 3.03Å
357	D	94.4	Very high	95.7	Very high	33 Å²	33	73.7 Å²	73.7	18%	0.176	35%	0.347	C	S	.	.			trans	59.9	-177.2	-176.8	-146.3	-21.7	0	0	0	114.1	R354 K363 V375 H376 R378	R354-D357 PolarHBondContact O-N 3.31Å; D357-K363 VanDerWaalsContact CG-CE 3.4Å; D357-K363 WeakPolarHBondContact OD1-CE 3.43Å; D357-K363 WeakPolarHBondContact OD2-CE 3.48Å; D357-K363 IonicContact OD2-NZ 3.56Å; D357-K363 PolarHBondContact OD2-NZ 3.09Å; D357-V375 WeakPolarHBondContact OD1-CG2 3.17Å; D357-H376 WeakPolarHBondContact CA-O 3.39Å; D357-H376 PolarHBondContact N-O 2.66Å; D357-R378 VanDerWaalsContact CG-NH1 3.32Å; D357-R378 IonicContact OD1-CZ 3.89Å; D357-R378 VanDerWaalsContact OD1-CZ 3.31Å; D357-R378 IonicContact OD1-NH1 3.49Å; D357-R378 PolarHBondContact OD1-NH1 3.12Å; D357-R378 IonicContact OD1-NH2 2.75Å; D357-R378 PolarHBondContact OD1-NH2 2.72Å; D357-R378 IonicContact OD2-NH1 3.45Å; D357-R378 PolarHBondContact OD2-NH1 2.95Å
358	I	93.6	Very high	95.7	Very high	14 Å²	14	75 Å²	75	7%	0.072	36%	0.356	C	S	.	.			trans	-103.7	162.8	167.2	60.9	176.4	0	0	0	110.3	R354 E360 N362 K363 Y369 L372 V375	R354-I358 HydrophobicContact CB-CG2 4.26Å; R354-I358 HydrophobicContact CG-CG2 4.15Å; I358-E360 PolarHBondContact O-N 3.36Å; I358-N362 HydrophobicContact CD1-CB 4.38Å; I358-K363 HydrophobicContact CD1-CG 4.36Å; I358-K363 HydrophobicContact CG1-CG 3.89Å; I358-Y369 HydrophobicContact CD1-CD2 4.48Å; I358-Y369 HydrophobicContact CD1-CE1 4.28Å; I358-Y369 HydrophobicContact CD1-CE2 3.83Å; I358-L372 HydrophobicContact CG2-CD2 4.18Å; I358-V375 HydrophobicContact CG2-CG2 4.27Å
359	E	94.1	Very high	95.6	Very high	104 Å²	104	70.6 Å²	70.6	49%	0.486	34%	0.336	S	S	.	.			trans	-56	139	177.9	-67.8	174	-137.6	0	0	111.1	K361 N362 K363	E359-K361 VanDerWaalsContact C-N 3.28Å; E359-K361 HydrophobicContact CB-CG 4.29Å; E359-K361 PolarHBondContact O-N 3.43Å; E359-K361 WeakPolarHBondContact OE2-CE 2.88Å; E359-K361 IonicContact OE2-NZ 2.95Å; E359-K361 PolarHBondContact OE2-NZ 3.34Å; E359-N362 WeakPolarHBondContact O-CA 2.85Å; E359-N362 WeakPolarHBondContact O-CB 3.16Å; E359-N362 PolarHBondContact O-N 2.97Å; E359-K363 PolarHBondContact O-N 3.12Å
360	E	92.4	Very high	95.6	Very high	133 Å²	133	67.8 Å²	67.8	62%	0.621	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-53.7	-43.1	-173.3	-167.9	61.5	-147.7	0	0	112.8	I358 N362 K363	I358-E360 PolarHBondContact O-N 3.36Å; E360-N362 PolarHBondContact O-N 3.43Å; E360-N362 VanDerWaalsContact O-N 3.09Å; E360-K363 WeakPolarHBondContact O-CB 3.13Å; E360-K363 PolarHBondContact O-N 3.39Å; E360-K363 VanDerWaalsContact O-N 3.12Å; E360-K363 WeakPolarHBondContact OE2-CD 3.46Å; E360-K363 WeakPolarHBondContact OE2-CE 3.45Å; E360-K363 IonicContact OE2-NZ 3.44Å; E360-K363 PolarHBondContact OE2-NZ 2.84Å
361	K	93.1	Very high	95.4	Very high	158 Å²	158	71.7 Å²	71.7	69%	0.687	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-59.7	-21.5	176.9	64.2	176.2	-175.3	-153.5	0	114.2	E359	E359-K361 VanDerWaalsContact C-N 3.28Å; E359-K361 HydrophobicContact CB-CG 4.29Å; E359-K361 PolarHBondContact O-N 3.43Å; E359-K361 WeakPolarHBondContact OE2-CE 2.88Å; E359-K361 IonicContact OE2-NZ 2.95Å; E359-K361 PolarHBondContact OE2-NZ 3.34Å
362	N	93.9	Very high	95.4	Very high	51 Å²	51	63.1 Å²	63.1	27%	0.273	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-98.1	-10.6	-177.1	-68.9	-15.1	0	0	0	112.4	I358 E359 E360 N364 N365 S368	I358-N362 HydrophobicContact CD1-CB 4.38Å; E359-N362 WeakPolarHBondContact O-CA 2.85Å; E359-N362 WeakPolarHBondContact O-CB 3.16Å; E359-N362 PolarHBondContact O-N 2.97Å; E360-N362 PolarHBondContact O-N 3.43Å; E360-N362 VanDerWaalsContact O-N 3.09Å; N362-N364 VanDerWaalsContact C-N 3.28Å; N362-N364 PolarHBondContact O-N 3.18Å; N362-N365 PolarHBondContact O-N 2.79Å; N362-N365 VanDerWaalsContact O-N 3.1Å; N362-S368 WeakPolarHBondContact CB-OG 3.22Å; N362-S368 PolarHBondContact O-OG 3.49Å
363	K	93.5	Very high	95.5	Very high	52 Å²	52	62.9 Å²	62.9	23%	0.226	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.9	-174.6	-75.8	-174.4	177.8	174.9	0	114.7	D357 I358 E359 E360 Y369	D357-K363 VanDerWaalsContact CG-CE 3.4Å; D357-K363 WeakPolarHBondContact OD1-CE 3.43Å; D357-K363 WeakPolarHBondContact OD2-CE 3.48Å; D357-K363 IonicContact OD2-NZ 3.56Å; D357-K363 PolarHBondContact OD2-NZ 3.09Å; I358-K363 HydrophobicContact CD1-CG 4.36Å; I358-K363 HydrophobicContact CG1-CG 3.89Å; E359-K363 PolarHBondContact O-N 3.12Å; E360-K363 WeakPolarHBondContact O-CB 3.13Å; E360-K363 PolarHBondContact O-N 3.39Å; E360-K363 VanDerWaalsContact O-N 3.12Å; E360-K363 WeakPolarHBondContact OE2-CD 3.46Å; E360-K363 WeakPolarHBondContact OE2-CE 3.45Å; E360-K363 IonicContact OE2-NZ 3.44Å; E360-K363 PolarHBondContact OE2-NZ 2.84Å; K363-Y369 VanDerWaalsContact O-CE2 3.24Å; K363-Y369 WeakPolarHBondContact O-CE2 3.31Å; K363-Y369 PolarHBondContact O-OH 2.95Å
364	N	93.7	Very high	95.5	Very high	152 Å²	152	62.8 Å²	62.8	81%	0.813	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-3	-179.9	-60.5	-24.9	0	0	0	112.7	N362	N362-N364 VanDerWaalsContact C-N 3.28Å; N362-N364 PolarHBondContact O-N 3.18Å
365	N	95.5	Very high	95.5	Very high	75 Å²	75	58.2 Å²	58.2	40%	0.401	29%	0.292	S	S	.	.			trans	-97.1	108.6	177.6	-178.5	-8	0	0	0	109.9	N362 C367 S368	N362-N365 PolarHBondContact O-N 2.79Å; N362-N365 VanDerWaalsContact O-N 3.1Å; N365-C367 PolarHBondContact O-N 2.72Å; N365-C367 VanDerWaalsContact O-N 3.14Å; N365-C367 WeakPolarHBondContact OD1-CB 3.47Å; N365-C367 PolarHBondContact OD1-N 2.86Å; N365-S368 VanDerWaalsContact O-CB 3.27Å; N365-S368 WeakPolarHBondContact O-CB 3.28Å; N365-S368 PolarHBondContact O-N 3.27Å; N365-S368 PolarHBondContact O-OG 2.88Å
366	I	97.1	Very high	95.6	Very high	14 Å²	14	60.7 Å²	60.7	7%	0.072	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.9	-179.2	-170.1	60.1	0	0	0	113.4	S368 Y369 I386 Q389 L390 A393	I366-S368 PolarHBondContact O-N 2.85Å; I366-S368 VanDerWaalsContact O-N 3.15Å; I366-Y369 HydrophobicContact CD1-CD2 4.41Å; I366-Y369 WeakPolarHBondContact O-CB 3.39Å; I366-Y369 PolarHBondContact O-N 2.75Å; I366-I386 HydrophobicContact CD1-CG2 4.11Å; I366-Q389 HydrophobicContact CB-CB 4.33Å; I366-Q389 HydrophobicContact CD1-CB 3.68Å; I366-Q389 HydrophobicContact CG1-CB 3.78Å; I366-L390 HydrophobicContact CD1-CB 4.26Å; I366-L390 HydrophobicContact CD1-CG 4.12Å; I366-A393 HydrophobicContact CG1-CB 4.11Å
367	C	96.8	Very high	95.8	Very high	38 Å²	38	54.9 Å²	54.9	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-61.9	-25.7	177.6	-53.9	0	0	0	0	112.3	N365 Y369 V370 C397	N365-C367 PolarHBondContact O-N 2.72Å; N365-C367 VanDerWaalsContact O-N 3.14Å; N365-C367 WeakPolarHBondContact OD1-CB 3.47Å; N365-C367 PolarHBondContact OD1-N 2.86Å; C367-Y369 PolarHBondContact O-N 3.09Å; C367-V370 PolarHBondContact O-N 3.45Å; C367-C397 WeakPolarHBondContact CA-SG 3.31Å; C367-C397 HydrophobicContact CB-CB 3.77Å; C367-C397 WeakPolarHBondContact CB-SG 3.4Å; C367-C397 VanDerWaalsContact SG-CA 3.59Å; C367-C397 WeakPolarHBondContact SG-CB 3.4Å; C367-C397 CovalentContact SG-SG 2.04Å; C367-C397 PolarHBondContact SG-SG 2.92Å
368	S	96.9	Very high	96	Very high	32 Å²	32	54 Å²	54	22%	0.224	28%	0.279	C	S	.	.	H	α-helix	trans	-67.8	-18.3	174.9	-54.5	0	0	0	0	113	N362 N365 I366 L372	N362-S368 WeakPolarHBondContact CB-OG 3.22Å; N362-S368 PolarHBondContact O-OG 3.49Å; N365-S368 VanDerWaalsContact O-CB 3.27Å; N365-S368 WeakPolarHBondContact O-CB 3.28Å; N365-S368 PolarHBondContact O-N 3.27Å; N365-S368 PolarHBondContact O-OG 2.88Å; I366-S368 PolarHBondContact O-N 2.85Å; I366-S368 VanDerWaalsContact O-N 3.15Å; S368-L372 WeakPolarHBondContact O-CD2 3.39Å
369	Y	97.9	Very high	96.2	Very high	6 Å²	6	59.8 Å²	59.8	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-96	-12.9	179.4	-62.8	-99	0	0	0	113.2	F249 N251 I358 K363 I366 C367 L372 V375 R378 I386	F249-Y369 HydrophobicContact CD1-CD1 4.09Å; F249-Y369 HydrophobicContact CE1-CD1 4.29Å; N251-Y369 PolarHBondContact ND2-O 3.46Å; I358-Y369 HydrophobicContact CD1-CD2 4.48Å; I358-Y369 HydrophobicContact CD1-CE1 4.28Å; I358-Y369 HydrophobicContact CD1-CE2 3.83Å; K363-Y369 VanDerWaalsContact O-CE2 3.24Å; K363-Y369 WeakPolarHBondContact O-CE2 3.31Å; K363-Y369 PolarHBondContact O-OH 2.95Å; I366-Y369 HydrophobicContact CD1-CD2 4.41Å; I366-Y369 WeakPolarHBondContact O-CB 3.39Å; I366-Y369 PolarHBondContact O-N 2.75Å; C367-Y369 PolarHBondContact O-N 3.09Å; Y369-L372 HydrophobicContact CD1-CD2 4.07Å; Y369-L372 HydrophobicContact CG-CD2 4.41Å; Y369-V375 HydrophobicContact CD1-CG1 4.16Å; Y369-V375 HydrophobicContact CE1-CG1 3.85Å; Y369-R378 PolarHBondContact OH-NE 3.17Å; Y369-R378 PolarHBondContact OH-NH2 2.93Å; Y369-I386 HydrophobicContact CD1-CD1 4.17Å; Y369-I386 HydrophobicContact CD1-CG1 4.49Å; Y369-I386 HydrophobicContact CD1-CG2 3.63Å; Y369-I386 HydrophobicContact CD2-CG2 4.49Å; Y369-I386 HydrophobicContact CE1-CD1 3.51Å; Y369-I386 HydrophobicContact CE1-CG1 4.1Å; Y369-I386 HydrophobicContact CE1-CG2 4.1Å; Y369-I386 HydrophobicContact CG-CG2 3.85Å
370	V	97.5	Very high	96.4	Very high	43 Å²	43	55.9 Å²	55.9	26%	0.261	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-45.2	-179.6	175.8	0	0	0	0	110.6	N251 H254 C367 L390 A393 C397	N251-V370 PolarHBondContact ND2-O 3.25Å; H254-V370 PolarHBondContact ND1-O 3.5Å; C367-V370 PolarHBondContact O-N 3.45Å; V370-L390 HydrophobicContact CG2-CD2 4.4Å; V370-A393 HydrophobicContact CG2-CB 3.89Å; V370-C397 HydrophobicContact CG2-CB 4.43Å
371	D	94.6	Very high	96.7	Very high	125 Å²	125	55.5 Å²	55.5	67%	0.668	29%	0.285	S	S	*	.	S	Bend	trans	-95.9	4.5	-172.2	-67.7	-27.1	0	0	0	115.1	H254	H254-D371 VanDerWaalsContact CE1-CA 3.46Å; H254-D371 WeakPolarHBondContact CE1-CA 3.43Å; H254-D371 PolarHBondContact CE1-O 2.84Å; H254-D371 VanDerWaalsContact ND1-C 3.31Å; H254-D371 WeakPolarHBondContact ND1-CA 3.25Å
372	L	97.1	Very high	97	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	27%	0.269	C	S	.	.			trans	-94.7	157.3	172.9	61.8	77.8	0	0	0	111.7	F249 N251 H254 R354 I358 S368 Y369 V375	F249-L372 HydrophobicContact CD1-CD1 4.43Å; N251-L372 HydrophobicContact CB-CD1 4.33Å; N251-L372 WeakPolarHBondContact CB-O 3.49Å; H254-L372 PolarHBondContact ND1-O 3.36Å; R354-L372 HydrophobicContact CG-CB 4.19Å; R354-L372 HydrophobicContact CG-CD2 4.46Å; I358-L372 HydrophobicContact CG2-CD2 4.18Å; S368-L372 WeakPolarHBondContact O-CD2 3.39Å; Y369-L372 HydrophobicContact CD1-CD2 4.07Å; Y369-L372 HydrophobicContact CG-CD2 4.41Å; L372-V375 HydrophobicContact CD2-CB 4.12Å; L372-V375 HydrophobicContact CD2-CG1 4.35Å
373	M	98.3	Very high	97.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-87.4	-47.6	170.4	-66.8	-69.1	174.2	0	0	110.2	V250 N251 I255 Y258 G352 F353	V250-M373 WeakPolarHBondContact CA-O 3.35Å; N251-M373 PolarHBondContact N-O 2.9Å; I255-M373 HydrophobicContact CB-SD 4.42Å; I255-M373 HydrophobicContact CG1-SD 3.61Å; Y258-M373 HydrophobicContact CD1-CE 4.18Å; Y258-M373 HydrophobicContact CD2-CE 3.78Å; Y258-M373 HydrophobicContact CG-CE 3.5Å; G352-M373 PolarHBondContact O-N 3.08Å; F353-M373 HydrophobicContact CD2-CB 3.95Å; F353-M373 HydrophobicContact CD2-CG 4.11Å; F353-M373 HydrophobicContact CE2-CB 3.82Å; F353-M373 HydrophobicContact CE2-CG 3.82Å; F353-M373 HydrophobicContact CG-CB 4.4Å; F353-M373 HydrophobicContact CZ-CB 4.15Å; F353-M373 HydrophobicContact CZ-CG 4.48Å
374	L	98.4	Very high	97.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	148.2	-174.3	162.3	147.6	0	0	0	110.1	F242 V248 F249 V250 G352 F353 R354 T355	F242-L374 HydrophobicContact CE2-CD1 4.15Å; F242-L374 HydrophobicContact CZ-CD1 3.78Å; V248-L374 HydrophobicContact CB-CD1 3.67Å; V248-L374 HydrophobicContact CB-CG 4.01Å; V248-L374 HydrophobicContact CG1-CD1 3.99Å; V248-L374 HydrophobicContact CG1-CG 4.42Å; V248-L374 HydrophobicContact CG2-CD1 3.46Å; V248-L374 VanDerWaalsContact CG2-CD1 3.46Å; V248-L374 HydrophobicContact CG2-CG 4.26Å; F249-L374 CarbonylContact O-C 3.58Å; F249-L374 VanDerWaalsContact O-CA 3.24Å; F249-L374 WeakPolarHBondContact O-CA 3.45Å; V250-L374 HydrophobicContact CG2-CD1 4.21Å; G352-L374 PolarHBondContact O-N 2.72Å; G352-L374 VanDerWaalsContact O-N 3.15Å; F353-L374 HydrophobicContact CD1-CB 4.17Å; F353-L374 HydrophobicContact CD1-CD2 4.34Å; R354-L374 WeakPolarHBondContact CB-O 3.31Å; R354-L374 PolarHBondContact N-O 2.87Å; T355-L374 HydrophobicContact CG2-CD2 4.23Å
375	V	98.4	Very high	97.7	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.3	167.8	63.4	0	0	0	0	111.4	V248 F249 R354 D357 I358 Y369 L372 R378	V248-V375 WeakPolarHBondContact CA-O 3.35Å; F249-V375 HydrophobicContact CB-CG1 3.9Å; F249-V375 HydrophobicContact CD1-CG1 4.23Å; F249-V375 PolarHBondContact N-O 2.98Å; F249-V375 PolarHBondContact O-N 3.14Å; R354-V375 HydrophobicContact CB-CB 4.21Å; R354-V375 HydrophobicContact CB-CG2 4.13Å; R354-V375 WeakPolarHBondContact O-CA 3.39Å; D357-V375 WeakPolarHBondContact OD1-CG2 3.17Å; I358-V375 HydrophobicContact CG2-CG2 4.27Å; Y369-V375 HydrophobicContact CD1-CG1 4.16Å; Y369-V375 HydrophobicContact CE1-CG1 3.85Å; L372-V375 HydrophobicContact CD2-CB 4.12Å; L372-V375 HydrophobicContact CD2-CG1 4.35Å; V375-R378 HydrophobicContact CG1-CG 4.33Å
376	H	97.3	Very high	97.8	Very high	59 Å²	59	43 Å²	43	27%	0.273	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.4	175.4	170.4	-87.1	0	0	0	109.9	D247 V248 R354 T355 D357	D247-H376 IonicContact OD1-CD2 3.53Å; D247-H376 IonicContact OD1-NE2 3.64Å; V248-H376 HydrophobicContact CG1-CB 3.92Å; R354-H376 PolarHBondContact O-N 3.26Å; T355-H376 PolarHBondContact O-ND1 3.31Å; D357-H376 WeakPolarHBondContact CA-O 3.39Å; D357-H376 PolarHBondContact N-O 2.66Å
377	S	97.1	Very high	97.9	Very high	59 Å²	59	43.2 Å²	43.2	41%	0.413	23%	0.225	S	C	.	.			cis	-108.7	158.4	-9.4	56.4	0	0	0	0	110.8	D247	D247-S377 CarbonylContact O-C 3.55Å; D247-S377 WeakPolarHBondContact O-CA 3.24Å; D247-S377 VanDerWaalsContact O-CB 3.31Å; D247-S377 WeakPolarHBondContact O-CB 3.38Å
378	R	98.3	Very high	98	Very high	15 Å²	15	44.8 Å²	44.8	6%	0.057	24%	0.236	C	C	.	.			trans	-133.4	141.8	172.8	-66.9	-63.7	-179.7	-87.4	2.2	110.6	D247 F249 D357 Y369 V375 E382 M383 I386	D247-R378 PolarHBondContact O-N 3.17Å; F249-R378 HydrophobicContact CB-CB 4.22Å; F249-R378 HydrophobicContact CB-CG 3.79Å; D357-R378 VanDerWaalsContact CG-NH1 3.32Å; D357-R378 IonicContact OD1-CZ 3.89Å; D357-R378 VanDerWaalsContact OD1-CZ 3.31Å; D357-R378 IonicContact OD1-NH1 3.49Å; D357-R378 PolarHBondContact OD1-NH1 3.12Å; D357-R378 IonicContact OD1-NH2 2.75Å; D357-R378 PolarHBondContact OD1-NH2 2.72Å; D357-R378 IonicContact OD2-NH1 3.45Å; D357-R378 PolarHBondContact OD2-NH1 2.95Å; Y369-R378 PolarHBondContact OH-NE 3.17Å; Y369-R378 PolarHBondContact OH-NH2 2.93Å; V375-R378 HydrophobicContact CG1-CG 4.33Å; R378-E382 VanDerWaalsContact CA-OE2 3.28Å; R378-E382 WeakPolarHBondContact CA-OE2 3.45Å; R378-E382 HydrophobicContact CB-CB 4.18Å; R378-E382 WeakPolarHBondContact CD-OE2 3.11Å; R378-M383 HydrophobicContact CB-CE 4.42Å; R378-M383 HydrophobicContact CB-CG 3.9Å; R378-M383 WeakPolarHBondContact O-CE 3.44Å; R378-I386 HydrophobicContact CG-CD1 3.98Å
379	K	98.6	Very high	98	Very high	134 Å²	134	47.6 Å²	47.6	58%	0.583	25%	0.246	S	C	*	.			trans	-75.2	161.2	172.3	-66.3	176.5	-174.8	169.6	0	110.7	Q381 E382 M383	K379-Q381 VanDerWaalsContact C-N 3.34Å; K379-Q381 PolarHBondContact O-N 3.08Å; K379-E382 HydrophobicContact CB-CG 4.14Å; K379-E382 PolarHBondContact N-OE2 3.28Å; K379-E382 WeakPolarHBondContact O-CB 3.2Å; K379-E382 PolarHBondContact O-N 2.86Å; K379-M383 WeakPolarHBondContact O-CG 3.47Å; K379-M383 PolarHBondContact O-N 3.23Å
380	P	98.8	Very high	98	Very high	22 Å²	22	48.1 Å²	48.1	14%	0.143	25%	0.249	C	C	.	.	H	α-helix	trans	-48.9	-49.3	177.6	-30.9	37.4	0	0	0	114.2	A156 R157 A160 E382 M383 I384	A156-P380 HydrophobicContact CB-CG 4.19Å; R157-P380 HydrophobicContact CG-CG 4.09Å; A160-P380 HydrophobicContact CB-CB 3.62Å; A160-P380 WeakPolarHBondContact CB-O 3.32Å; P380-E382 PolarHBondContact O-N 2.68Å; P380-M383 PolarHBondContact O-N 3.14Å; P380-I384 PolarHBondContact O-N 3.16Å
381	Q	98.7	Very high	98	Very high	126 Å²	126	50.4 Å²	50.4	59%	0.589	26%	0.257	S	S	*	.	H	α-helix	trans	-63.9	-42.1	178.8	-70.4	76.5	12.1	0	0	112.1	K379 M383 I384 D385	K379-Q381 VanDerWaalsContact C-N 3.34Å; K379-Q381 PolarHBondContact O-N 3.08Å; Q381-M383 VanDerWaalsContact C-N 3.3Å; Q381-M383 PolarHBondContact O-N 3.02Å; Q381-I384 PolarHBondContact O-N 3.36Å; Q381-D385 WeakPolarHBondContact O-CB 3.43Å; Q381-D385 VanDerWaalsContact O-CG 3.23Å; Q381-D385 PolarHBondContact O-N 2.88Å
382	E	98.6	Very high	98	Very high	73 Å²	73	46.6 Å²	46.6	34%	0.341	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-38.6	178.3	-63.2	167.8	173.5	0	0	111.3	R378 K379 P380 D385 I386	R378-E382 VanDerWaalsContact CA-OE2 3.28Å; R378-E382 WeakPolarHBondContact CA-OE2 3.45Å; R378-E382 HydrophobicContact CB-CB 4.18Å; R378-E382 WeakPolarHBondContact CD-OE2 3.11Å; K379-E382 HydrophobicContact CB-CG 4.14Å; K379-E382 PolarHBondContact N-OE2 3.28Å; K379-E382 WeakPolarHBondContact O-CB 3.2Å; K379-E382 PolarHBondContact O-N 2.86Å; P380-E382 PolarHBondContact O-N 2.68Å; E382-D385 PolarHBondContact O-N 3.45Å; E382-I386 WeakPolarHBondContact O-CB 3.44Å; E382-I386 VanDerWaalsContact O-CD1 3.29Å; E382-I386 WeakPolarHBondContact O-CD1 3.33Å; E382-I386 WeakPolarHBondContact O-CG1 3.26Å; E382-I386 PolarHBondContact O-N 3.04Å
383	M	98.8	Very high	97.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-46	176	-64.5	179.9	-171.5	0	0	111.9	I161 D246 V248 F249 R378 K379 P380 Q381 W387	I161-M383 HydrophobicContact CG1-SD 3.88Å; D246-M383 WeakPolarHBondContact O-CE 3.41Å; V248-M383 WeakPolarHBondContact O-CE 3.34Å; F249-M383 HydrophobicContact CD2-CB 4.44Å; R378-M383 HydrophobicContact CB-CE 4.42Å; R378-M383 HydrophobicContact CB-CG 3.9Å; R378-M383 WeakPolarHBondContact O-CE 3.44Å; K379-M383 WeakPolarHBondContact O-CG 3.47Å; K379-M383 PolarHBondContact O-N 3.23Å; P380-M383 PolarHBondContact O-N 3.14Å; Q381-M383 VanDerWaalsContact C-N 3.3Å; Q381-M383 PolarHBondContact O-N 3.02Å; M383-W387 VanDerWaalsContact O-CB 3.28Å; M383-W387 WeakPolarHBondContact O-CB 3.49Å; M383-W387 PolarHBondContact O-N 2.94Å
384	I	98.8	Very high	97.7	Very high	49 Å²	49	53.4 Å²	53.4	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-44.5	178.5	-65.5	169.1	0	0	0	110.4	A160 P380 Q381 W387 S388	A160-I384 HydrophobicContact CB-CD1 3.89Å; A160-I384 HydrophobicContact CB-CG1 3.97Å; P380-I384 PolarHBondContact O-N 3.16Å; Q381-I384 PolarHBondContact O-N 3.36Å; I384-W387 PolarHBondContact O-N 3.14Å; I384-S388 WeakPolarHBondContact O-CB 3.44Å; I384-S388 PolarHBondContact O-N 2.99Å; I384-S388 PolarHBondContact O-OG 3.19Å
385	D	98.5	Very high	97.5	Very high	91 Å²	91	59.7 Å²	59.7	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-45.8	-179.1	-72.2	-15.7	0	0	0	111.8	Q381 E382 Q389	Q381-D385 WeakPolarHBondContact O-CB 3.43Å; Q381-D385 VanDerWaalsContact O-CG 3.23Å; Q381-D385 PolarHBondContact O-N 2.88Å; E382-D385 PolarHBondContact O-N 3.45Å; D385-Q389 WeakPolarHBondContact O-CG 3.23Å; D385-Q389 PolarHBondContact O-N 3.13Å; D385-Q389 VanDerWaalsContact O-N 3.12Å; D385-Q389 PolarHBondContact O-NE2 3.28Å
386	I	98.5	Very high	97.2	Very high	13 Å²	13	67 Å²	67	7%	0.067	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-48	176.8	-66.3	160.7	0	0	0	109.4	F249 I366 Y369 R378 E382 S388 Q389 L390	F249-I386 HydrophobicContact CD1-CG2 3.97Å; F249-I386 HydrophobicContact CD2-CB 4.03Å; F249-I386 HydrophobicContact CD2-CD1 4.46Å; F249-I386 HydrophobicContact CD2-CG2 3.92Å; F249-I386 HydrophobicContact CE1-CG2 3.6Å; F249-I386 HydrophobicContact CE2-CB 3.87Å; F249-I386 HydrophobicContact CE2-CG2 3.54Å; F249-I386 HydrophobicContact CG-CD1 4.35Å; F249-I386 HydrophobicContact CG-CG2 4.13Å; F249-I386 HydrophobicContact CZ-CB 4.24Å; F249-I386 HydrophobicContact CZ-CG2 3.39Å; I366-I386 HydrophobicContact CD1-CG2 4.11Å; Y369-I386 HydrophobicContact CD1-CD1 4.17Å; Y369-I386 HydrophobicContact CD1-CG1 4.49Å; Y369-I386 HydrophobicContact CD1-CG2 3.63Å; Y369-I386 HydrophobicContact CD2-CG2 4.49Å; Y369-I386 HydrophobicContact CE1-CD1 3.51Å; Y369-I386 HydrophobicContact CE1-CG1 4.1Å; Y369-I386 HydrophobicContact CE1-CG2 4.1Å; Y369-I386 HydrophobicContact CG-CG2 3.85Å; R378-I386 HydrophobicContact CG-CD1 3.98Å; E382-I386 WeakPolarHBondContact O-CB 3.44Å; E382-I386 VanDerWaalsContact O-CD1 3.29Å; E382-I386 WeakPolarHBondContact O-CD1 3.33Å; E382-I386 WeakPolarHBondContact O-CG1 3.26Å; E382-I386 PolarHBondContact O-N 3.04Å; I386-S388 PolarHBondContact O-N 2.81Å; I386-Q389 PolarHBondContact O-N 3.33Å; I386-L390 HydrophobicContact CG2-CD1 4.48Å; I386-L390 WeakPolarHBondContact O-CB 3.38Å; I386-L390 PolarHBondContact O-N 3.36Å
387	W	98.4	Very high	97	Very high	18 Å²	18	69.2 Å²	69.2	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-45.1	-179.4	-174.6	-109.7	0	0	0	112.6	S164 W165 F249 H253 M383 I384 Q389 L390 Q391	S164-W387 VanDerWaalsContact CA-CD1 3.43Å; S164-W387 PolarHBondContact O-NE1 3.04Å; W165-W387 HydrophobicContact CB-CD2 4.47Å; W165-W387 HydrophobicContact CB-CE3 3.82Å; W165-W387 HydrophobicContact CB-CZ3 3.9Å; F249-W387 HydrophobicContact CE2-CB 4.14Å; F249-W387 HydrophobicContact CE2-CE3 4.2Å; F249-W387 HydrophobicContact CZ-CE3 4.13Å; H253-W387 AromaticContact CD2-CH2 3.71Å; H253-W387 AromaticContact CE1-CH2 3.78Å; H253-W387 AromaticContact NE2-CH2 3.37Å; H253-W387 WeakPolarHBondContact NE2-CH2 3.5Å; H253-W387 AromaticContact NE2-CZ2 3.66Å; M383-W387 VanDerWaalsContact O-CB 3.28Å; M383-W387 WeakPolarHBondContact O-CB 3.49Å; M383-W387 PolarHBondContact O-N 2.94Å; I384-W387 PolarHBondContact O-N 3.14Å; W387-Q389 VanDerWaalsContact C-N 3.33Å; W387-Q389 PolarHBondContact O-N 2.75Å; W387-L390 WeakPolarHBondContact O-CB 3.28Å; W387-L390 PolarHBondContact O-N 2.67Å; W387-L390 VanDerWaalsContact O-N 3.16Å; W387-Q391 VanDerWaalsContact CE2-NE2 3.26Å; W387-Q391 WeakPolarHBondContact O-CG 3.12Å; W387-Q391 PolarHBondContact O-N 3.46Å; W387-Q391 PolarHBondContact O-NE2 3.47Å
388	S	98.1	Very high	97	Very high	70 Å²	70	69.8 Å²	69.8	49%	0.49	36%	0.355	S	S	.	.	H	α-helix	trans	-60.4	-42.8	178.9	-60.5	0	0	0	0	111.6	I384 I386	I384-S388 WeakPolarHBondContact O-CB 3.44Å; I384-S388 PolarHBondContact O-N 2.99Å; I384-S388 PolarHBondContact O-OG 3.19Å; I386-S388 PolarHBondContact O-N 2.81Å
389	Q	97.9	Very high	96.9	Very high	91 Å²	91	72.6 Å²	72.6	43%	0.425	37%	0.371	S	S	.	.	H	α-helix	trans	-68.2	-38	175.8	-70.6	179.5	69.8	0	0	112	I366 D385 I386 W387 Q391 S392 A393	I366-Q389 HydrophobicContact CB-CB 4.33Å; I366-Q389 HydrophobicContact CD1-CB 3.68Å; I366-Q389 HydrophobicContact CG1-CB 3.78Å; D385-Q389 WeakPolarHBondContact O-CG 3.23Å; D385-Q389 PolarHBondContact O-N 3.13Å; D385-Q389 VanDerWaalsContact O-N 3.12Å; D385-Q389 PolarHBondContact O-NE2 3.28Å; I386-Q389 PolarHBondContact O-N 3.33Å; W387-Q389 VanDerWaalsContact C-N 3.33Å; W387-Q389 PolarHBondContact O-N 2.75Å; Q389-Q391 PolarHBondContact O-N 3.38Å; Q389-S392 PolarHBondContact O-N 3.11Å; Q389-S392 VanDerWaalsContact O-N 3.1Å; Q389-S392 PolarHBondContact O-OG 3.16Å; Q389-A393 PolarHBondContact O-N 3.43Å
390	L	97.4	Very high	96.8	Very high	18 Å²	18	69.2 Å²	69.2	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-59.6	-33.7	-179.5	-126.5	163.2	0	0	0	112.5	F249 N251 I366 V370 I386 W387 S392 A393	F249-L390 HydrophobicContact CE1-CD1 3.86Å; F249-L390 HydrophobicContact CZ-CD1 3.57Å; N251-L390 HydrophobicContact CB-CD1 4.46Å; I366-L390 HydrophobicContact CD1-CB 4.26Å; I366-L390 HydrophobicContact CD1-CG 4.12Å; V370-L390 HydrophobicContact CG2-CD2 4.4Å; I386-L390 HydrophobicContact CG2-CD1 4.48Å; I386-L390 WeakPolarHBondContact O-CB 3.38Å; I386-L390 PolarHBondContact O-N 3.36Å; W387-L390 WeakPolarHBondContact O-CB 3.28Å; W387-L390 PolarHBondContact O-N 2.67Å; W387-L390 VanDerWaalsContact O-N 3.16Å; L390-S392 PolarHBondContact O-N 3.06Å; L390-S392 VanDerWaalsContact O-N 3.1Å; L390-A393 HydrophobicContact CD2-CB 4.43Å; L390-A393 WeakPolarHBondContact O-CB 3.5Å; L390-A393 PolarHBondContact O-N 2.72Å; L390-A393 VanDerWaalsContact O-N 3.09Å
391	Q	96.8	Very high	96.7	Very high	91 Å²	91	72 Å²	72	43%	0.425	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.9	177.5	-57.1	-47.9	-59	0	0	113.3	W387 Q389 H394	W387-Q391 VanDerWaalsContact CE2-NE2 3.26Å; W387-Q391 WeakPolarHBondContact O-CG 3.12Å; W387-Q391 PolarHBondContact O-N 3.46Å; W387-Q391 PolarHBondContact O-NE2 3.47Å; Q389-Q391 PolarHBondContact O-N 3.38Å; Q391-H394 PolarHBondContact O-CE1 3.13Å; Q391-H394 PolarHBondContact O-ND1 2.95Å
392	S	96.1	Very high	96.6	Very high	45 Å²	45	68.6 Å²	68.6	32%	0.315	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	8.2	179.8	65.9	0	0	0	0	113.6	Q389 L390 H394 L395	Q389-S392 PolarHBondContact O-N 3.11Å; Q389-S392 VanDerWaalsContact O-N 3.1Å; Q389-S392 PolarHBondContact O-OG 3.16Å; L390-S392 PolarHBondContact O-N 3.06Å; L390-S392 VanDerWaalsContact O-N 3.1Å; S392-H394 PolarHBondContact O-N 3.06Å; S392-L395 WeakPolarHBondContact O-CB 3.19Å; S392-L395 PolarHBondContact O-N 3.49Å; S392-L395 VanDerWaalsContact O-N 3.09Å
393	A	94.8	Very high	96.4	Very high	4 Å²	4	68.3 Å²	68.3	3%	0.033	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-63.8	-28.7	-175.3	0	0	0	0	0	113.3	I366 V370 Q389 L390 L395 K396 C397	I366-A393 HydrophobicContact CG1-CB 4.11Å; V370-A393 HydrophobicContact CG2-CB 3.89Å; Q389-A393 PolarHBondContact O-N 3.43Å; L390-A393 HydrophobicContact CD2-CB 4.43Å; L390-A393 WeakPolarHBondContact O-CB 3.5Å; L390-A393 PolarHBondContact O-N 2.72Å; L390-A393 VanDerWaalsContact O-N 3.09Å; A393-L395 PolarHBondContact O-N 3.35Å; A393-L395 VanDerWaalsContact O-N 3.08Å; A393-K396 PolarHBondContact O-N 2.9Å; A393-C397 PolarHBondContact O-N 3.18Å; A393-C397 VanDerWaalsContact O-N 3.11Å; A393-C397 PolarHBondContact O-SG 3.08Å
394	H	93.4	Very high	96.3	Very high	144 Å²	144	73.2 Å²	73.2	67%	0.667	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-60.3	-16.7	174.9	67.7	-86.2	0	0	0	114	Q391 S392 K396	Q391-H394 PolarHBondContact O-CE1 3.13Å; Q391-H394 PolarHBondContact O-ND1 2.95Å; S392-H394 PolarHBondContact O-N 3.06Å; H394-K396 VanDerWaalsContact C-N 3.32Å
395	L	94.2	Very high	96.1	Very high	132 Å²	132	75.1 Å²	75.1	69%	0.691	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-82.9	-10.2	174.1	-56.6	176.5	0	0	0	112.8	S392 A393	S392-L395 WeakPolarHBondContact O-CB 3.19Å; S392-L395 PolarHBondContact O-N 3.49Å; S392-L395 VanDerWaalsContact O-N 3.09Å; A393-L395 PolarHBondContact O-N 3.35Å; A393-L395 VanDerWaalsContact O-N 3.08Å
396	K	92.3	Very high	95.9	Very high	152 Å²	152	73.8 Å²	73.8	66%	0.661	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-16	-168.2	-61.7	-179	-176.8	175	0	115.4	A393 H394	A393-K396 PolarHBondContact O-N 2.9Å; H394-K396 VanDerWaalsContact C-N 3.32Å
397	C	92.8	Very high	95.6	Very high	107 Å²	107	79.3 Å²	79.3	72%	0.723	42%	0.417	S	S	*	.			trans	-123.2	0	-164.3	-56.7	0	0	0	0	116	C367 V370 A393	C367-C397 WeakPolarHBondContact CA-SG 3.31Å; C367-C397 HydrophobicContact CB-CB 3.77Å; C367-C397 WeakPolarHBondContact CB-SG 3.4Å; C367-C397 VanDerWaalsContact SG-CA 3.59Å; C367-C397 WeakPolarHBondContact SG-CB 3.4Å; C367-C397 CovalentContact SG-SG 2.04Å; C367-C397 PolarHBondContact SG-SG 2.92Å; V370-C397 HydrophobicContact CG2-CB 4.43Å; A393-C397 PolarHBondContact O-N 3.18Å; A393-C397 VanDerWaalsContact O-N 3.11Å; A393-C397 PolarHBondContact O-SG 3.08Å

Retrieved 397 of 397 residues in 229 ms (Link to these results)

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