A0A087YRE8_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087YRE8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 399 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	52.5	Low	63	Low	221 Å²	221	145.8 Å²	145.8	100%	1.089	69%	0.69	S	S	*	*				0	-29.2	0	-95.8	174.1	161.7	0	0	115.8	F3	M1-F3 PolarHBondContact O-N 3.49Å
2	R	52.2	Low	64.2	Low	215 Å²	215	141.7 Å²	141.7	81%	0.811	68%	0.675	S	S	*	*	H	α-helix	trans	-76.3	-15.6	-178.4	-75.2	-177.7	176.7	175.7	-1.4	116.6
3	F	51.3	Low	65	Low	174 Å²	174	135.2 Å²	135.2	76%	0.763	65%	0.654	S	S	*	*	H	α-helix	trans	-79.7	-39.6	-178.6	-156.5	-99.4	0	0	0	112.5	M1 Q5 R6 L7	M1-F3 PolarHBondContact O-N 3.49Å; F3-Q5 PolarHBondContact O-N 3.24Å; F3-R6 PolarHBondContact O-N 3.45Å; F3-L7 PolarHBondContact O-N 3.02Å
4	N	54.8	Low	66.1	Low	125 Å²	125	130.6 Å²	130.6	67%	0.668	64%	0.638	S	S	*	*	H	α-helix	trans	-67.2	-32.5	177.6	-92	2.8	0	0	0	113.5	F8	N4-F8 WeakPolarHBondContact O-CB 3.38Å; N4-F8 PolarHBondContact O-N 3.02Å
5	Q	58.3	Low	67.1	Low	143 Å²	143	125.7 Å²	125.7	67%	0.668	62%	0.621	S	S	*	*	H	α-helix	trans	-68.3	-35	176.8	-79.8	178.4	-27.5	0	0	112.6	F3 A9	F3-Q5 PolarHBondContact O-N 3.24Å; Q5-A9 VanDerWaalsContact O-CB 3.31Å; Q5-A9 WeakPolarHBondContact O-CB 3.33Å; Q5-A9 PolarHBondContact O-N 3.34Å
6	R	63.2	Low	68	Low	203 Å²	203	124.7 Å²	124.7	77%	0.766	62%	0.619	S	S	*	*	H	α-helix	trans	-72.3	-39.2	177.5	-71.2	-173.7	176.1	-170.1	-1.6	112	F3 M10	F3-R6 PolarHBondContact O-N 3.45Å; R6-M10 WeakPolarHBondContact O-CB 3.36Å; R6-M10 PolarHBondContact O-N 2.97Å
7	L	67.8	Low	68.6	Low	100 Å²	100	124.2 Å²	124.2	52%	0.524	62%	0.618	S	S	.	*	H	α-helix	trans	-66.4	-42.1	175.8	-166.4	70.3	0	0	0	111.3	F3 M10 V11	F3-L7 PolarHBondContact O-N 3.02Å; L7-M10 PolarHBondContact O-N 3.42Å; L7-V11 WeakPolarHBondContact O-CG2 3.38Å; L7-V11 PolarHBondContact O-N 3.46Å
8	F	69.9	Low	69.2	Low	153 Å²	153	122.7 Å²	122.7	67%	0.671	61%	0.611	S	S	*	*	H	α-helix	trans	-65.6	-42.2	177.6	-142.2	-92.3	0	0	0	112.1	N4 M10 V11 L12	N4-F8 WeakPolarHBondContact O-CB 3.38Å; N4-F8 PolarHBondContact O-N 3.02Å; F8-M10 VanDerWaalsContact C-N 3.32Å; F8-M10 PolarHBondContact O-N 2.95Å; F8-V11 PolarHBondContact O-N 3.29Å; F8-L12 HydrophobicContact CD1-CD1 4.12Å; F8-L12 HydrophobicContact CE1-CD1 4.01Å; F8-L12 WeakPolarHBondContact O-CB 3.31Å; F8-L12 PolarHBondContact O-N 2.98Å
9	A	71.5	Confident	69.6	Low	61 Å²	61	121.7 Å²	121.7	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-62.2	-39.8	174.5	0	0	0	0	0	112	Q5 L12 S13	Q5-A9 VanDerWaalsContact O-CB 3.31Å; Q5-A9 WeakPolarHBondContact O-CB 3.33Å; Q5-A9 PolarHBondContact O-N 3.34Å; A9-L12 PolarHBondContact O-N 3.27Å; A9-S13 WeakPolarHBondContact O-CB 3.47Å; A9-S13 PolarHBondContact O-N 3.43Å; A9-S13 PolarHBondContact O-OG 2.96Å; A9-S13 VanDerWaalsContact O-OG 3.12Å
10	M	74.1	Confident	70.2	Confident	123 Å²	123	122.4 Å²	122.4	61%	0.606	61%	0.607	S	S	*	*	H	α-helix	trans	-66.1	-45.3	177.9	-166	175.7	178.7	0	0	111.6	R6 L7 F8 L12 S13 V14	R6-M10 WeakPolarHBondContact O-CB 3.36Å; R6-M10 PolarHBondContact O-N 2.97Å; L7-M10 PolarHBondContact O-N 3.42Å; F8-M10 VanDerWaalsContact C-N 3.32Å; F8-M10 PolarHBondContact O-N 2.95Å; M10-L12 VanDerWaalsContact C-N 3.34Å; M10-L12 PolarHBondContact O-N 2.97Å; M10-S13 WeakPolarHBondContact CA-OG 3.35Å; M10-S13 PolarHBondContact O-N 3.42Å; M10-S13 PolarHBondContact O-OG 3.48Å; M10-V14 WeakPolarHBondContact O-CG2 3.5Å; M10-V14 PolarHBondContact O-N 2.72Å
11	V	77.6	Confident	70.5	Confident	86 Å²	86	124.8 Å²	124.8	52%	0.521	61%	0.61	S	S	.	*	H	α-helix	trans	-62.8	-40.2	176.2	174.5	0	0	0	0	111.3	L7 F8 V14 S15	L7-V11 WeakPolarHBondContact O-CG2 3.38Å; L7-V11 PolarHBondContact O-N 3.46Å; F8-V11 PolarHBondContact O-N 3.29Å; V11-V14 PolarHBondContact O-N 3.12Å; V11-S15 WeakPolarHBondContact O-CB 3.35Å; V11-S15 PolarHBondContact O-N 2.99Å; V11-S15 PolarHBondContact O-OG 3.49Å
12	L	77.3	Confident	71.3	Confident	96 Å²	96	119 Å²	119	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-42.7	176.8	-128.9	101.7	0	0	0	111.6	F8 A9 M10 S15 L16	F8-L12 HydrophobicContact CD1-CD1 4.12Å; F8-L12 HydrophobicContact CE1-CD1 4.01Å; F8-L12 WeakPolarHBondContact O-CB 3.31Å; F8-L12 PolarHBondContact O-N 2.98Å; A9-L12 PolarHBondContact O-N 3.27Å; M10-L12 VanDerWaalsContact C-N 3.34Å; M10-L12 PolarHBondContact O-N 2.97Å; L12-S15 PolarHBondContact O-N 3Å; L12-L16 HydrophobicContact CD2-CD1 4.39Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 WeakPolarHBondContact O-CG 3.44Å; L12-L16 PolarHBondContact O-N 3.5Å
13	S	75.2	Confident	72.1	Confident	58 Å²	58	112.4 Å²	112.4	41%	0.406	57%	0.567	S	S	.	*	H	α-helix	trans	-65.4	-40.3	178.7	56.9	0	0	0	0	113	A9 M10 L16 L17	A9-S13 WeakPolarHBondContact O-CB 3.47Å; A9-S13 PolarHBondContact O-N 3.43Å; A9-S13 PolarHBondContact O-OG 2.96Å; A9-S13 VanDerWaalsContact O-OG 3.12Å; M10-S13 WeakPolarHBondContact CA-OG 3.35Å; M10-S13 PolarHBondContact O-N 3.42Å; M10-S13 PolarHBondContact O-OG 3.48Å; S13-L16 PolarHBondContact O-N 2.99Å; S13-L17 WeakPolarHBondContact O-CB 3.45Å; S13-L17 WeakPolarHBondContact O-CD1 3.48Å; S13-L17 WeakPolarHBondContact O-CG 3.3Å; S13-L17 PolarHBondContact O-N 3.35Å
14	V	80.1	Confident	73	Confident	71 Å²	71	106.6 Å²	106.6	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-68	-40	175.8	173.5	0	0	0	0	110.6	M10 V11 L16 L17 I18	M10-V14 WeakPolarHBondContact O-CG2 3.5Å; M10-V14 PolarHBondContact O-N 2.72Å; V11-V14 PolarHBondContact O-N 3.12Å; V14-L16 PolarHBondContact O-N 3.41Å; V14-L17 PolarHBondContact O-N 2.96Å; V14-I18 HydrophobicContact CG1-CD1 3.91Å; V14-I18 VanDerWaalsContact O-CG1 3.3Å; V14-I18 WeakPolarHBondContact O-CG1 3.36Å; V14-I18 PolarHBondContact O-N 2.67Å
15	S	81.3	Confident	73.4	Confident	56 Å²	56	102.8 Å²	102.8	39%	0.392	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-41.6	177.8	-53.6	0	0	0	0	112	V11 L12 I18 L19	V11-S15 WeakPolarHBondContact O-CB 3.35Å; V11-S15 PolarHBondContact O-N 2.99Å; V11-S15 PolarHBondContact O-OG 3.49Å; L12-S15 PolarHBondContact O-N 3Å; S15-I18 PolarHBondContact O-N 3.3Å; S15-L19 PolarHBondContact O-N 2.94Å
16	L	80.6	Confident	73.3	Confident	110 Å²	110	101 Å²	101	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-66.3	-38.5	175.2	-80.4	162.5	0	0	0	112.3	L12 S13 V14 L19 F20	L12-L16 HydrophobicContact CD2-CD1 4.39Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 WeakPolarHBondContact O-CG 3.44Å; L12-L16 PolarHBondContact O-N 3.5Å; S13-L16 PolarHBondContact O-N 2.99Å; V14-L16 PolarHBondContact O-N 3.41Å; L16-L19 PolarHBondContact O-N 3.45Å; L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.39Å; L16-F20 PolarHBondContact O-N 2.92Å
17	L	79.4	Confident	72.9	Confident	117 Å²	117	97.7 Å²	97.7	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-64.5	-40.7	174.8	-82	161.5	0	0	0	112.1	S13 V14 F20 Y21	S13-L17 WeakPolarHBondContact O-CB 3.45Å; S13-L17 WeakPolarHBondContact O-CD1 3.48Å; S13-L17 WeakPolarHBondContact O-CG 3.3Å; S13-L17 PolarHBondContact O-N 3.35Å; V14-L17 PolarHBondContact O-N 2.96Å; L17-F20 PolarHBondContact O-N 2.96Å; L17-Y21 WeakPolarHBondContact O-CB 3.29Å; L17-Y21 PolarHBondContact O-N 2.89Å
18	I	79.4	Confident	71.9	Confident	96 Å²	96	99.8 Å²	99.8	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-45.8	176.1	-67.8	165.9	0	0	0	110.6	V14 S15 F20 Y21 L22	V14-I18 HydrophobicContact CG1-CD1 3.91Å; V14-I18 VanDerWaalsContact O-CG1 3.3Å; V14-I18 WeakPolarHBondContact O-CG1 3.36Å; V14-I18 PolarHBondContact O-N 2.67Å; S15-I18 PolarHBondContact O-N 3.3Å; I18-F20 VanDerWaalsContact C-N 3.35Å; I18-F20 PolarHBondContact O-N 3.16Å; I18-Y21 PolarHBondContact O-N 3.47Å; I18-L22 HydrophobicContact CG2-CD1 3.87Å; I18-L22 HydrophobicContact CG2-CG 4.39Å; I18-L22 WeakPolarHBondContact O-CB 3.3Å; I18-L22 VanDerWaalsContact O-CG 3.29Å; I18-L22 WeakPolarHBondContact O-CG 3.42Å; I18-L22 PolarHBondContact O-N 3.47Å
19	L	76.7	Confident	71.1	Confident	105 Å²	105	97.4 Å²	97.4	55%	0.55	52%	0.515	S	S	.	.	H	α-helix	trans	-59.3	-45.6	175.7	-90.2	154.7	0	0	0	111.6	S15 L16 Y21 L22 T23	S15-L19 PolarHBondContact O-N 2.94Å; L16-L19 PolarHBondContact O-N 3.45Å; L19-Y21 VanDerWaalsContact C-N 3.35Å; L19-Y21 PolarHBondContact O-N 2.91Å; L19-L22 PolarHBondContact O-N 3.25Å; L19-T23 WeakPolarHBondContact O-CG2 3.26Å; L19-T23 PolarHBondContact O-N 3.3Å; L19-T23 PolarHBondContact O-OG1 3.42Å
20	F	80.8	Confident	69.7	Low	135 Å²	135	99 Å²	99	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-40.9	176.6	-175	-101.7	0	0	0	112.2	L16 L17 I18 T23 V24	L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.39Å; L16-F20 PolarHBondContact O-N 2.92Å; L17-F20 PolarHBondContact O-N 2.96Å; I18-F20 VanDerWaalsContact C-N 3.35Å; I18-F20 PolarHBondContact O-N 3.16Å; F20-T23 WeakPolarHBondContact CA-OG1 3.43Å; F20-T23 PolarHBondContact O-N 3.46Å; F20-T23 PolarHBondContact O-OG1 2.97Å; F20-V24 HydrophobicContact CD1-CG2 4.23Å; F20-V24 HydrophobicContact CE1-CG2 3.88Å; F20-V24 HydrophobicContact CE2-CG2 4.22Å; F20-V24 HydrophobicContact CZ-CG2 3.87Å; F20-V24 WeakPolarHBondContact O-CB 3.45Å; F20-V24 VanDerWaalsContact O-CG2 3.26Å; F20-V24 WeakPolarHBondContact O-CG2 3.45Å; F20-V24 PolarHBondContact O-N 2.92Å
21	Y	76.8	Confident	68.4	Low	172 Å²	172	97.3 Å²	97.3	68%	0.675	51%	0.512	S	S	*	.	H	α-helix	trans	-67.7	-37.2	178.1	-154.1	-88.4	0	0	0	112.3	L17 I18 L19 S25	L17-Y21 WeakPolarHBondContact O-CB 3.29Å; L17-Y21 PolarHBondContact O-N 2.89Å; I18-Y21 PolarHBondContact O-N 3.47Å; L19-Y21 VanDerWaalsContact C-N 3.35Å; L19-Y21 PolarHBondContact O-N 2.91Å; Y21-S25 VanDerWaalsContact O-CB 3.28Å; Y21-S25 WeakPolarHBondContact O-CB 3.38Å; Y21-S25 PolarHBondContact O-N 2.89Å; Y21-S25 PolarHBondContact O-OG 3.43Å
22	L	68.8	Low	66.7	Low	101 Å²	101	97.2 Å²	97.2	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-67.9	-41.4	175	-72.5	170	0	0	0	111.7	I18 L19 S25 L26	I18-L22 HydrophobicContact CG2-CD1 3.87Å; I18-L22 HydrophobicContact CG2-CG 4.39Å; I18-L22 WeakPolarHBondContact O-CB 3.3Å; I18-L22 VanDerWaalsContact O-CG 3.29Å; I18-L22 WeakPolarHBondContact O-CG 3.42Å; I18-L22 PolarHBondContact O-N 3.47Å; L19-L22 PolarHBondContact O-N 3.25Å; L22-S25 PolarHBondContact O-N 2.92Å; L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 WeakPolarHBondContact O-CG 3.42Å; L22-L26 PolarHBondContact O-N 3.42Å
23	T	69.9	Low	64.9	Low	76 Å²	76	101.5 Å²	101.5	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-44	176.6	52	0	0	0	0	111.7	L19 F20 S25 L26 E27	L19-T23 WeakPolarHBondContact O-CG2 3.26Å; L19-T23 PolarHBondContact O-N 3.3Å; L19-T23 PolarHBondContact O-OG1 3.42Å; F20-T23 WeakPolarHBondContact CA-OG1 3.43Å; F20-T23 PolarHBondContact O-N 3.46Å; F20-T23 PolarHBondContact O-OG1 2.97Å; T23-S25 VanDerWaalsContact C-N 3.31Å; T23-S25 PolarHBondContact O-N 2.86Å; T23-L26 PolarHBondContact O-N 2.93Å; T23-E27 WeakPolarHBondContact O-CB 3.28Å; T23-E27 PolarHBondContact O-N 2.91Å
24	V	68.9	Low	63.3	Low	51 Å²	51	103.7 Å²	103.7	31%	0.309	53%	0.531	S	S	.	.	H	α-helix	trans	-65.4	-35.5	177.1	171.8	0	0	0	0	111.5	F20 K28	F20-V24 HydrophobicContact CD1-CG2 4.23Å; F20-V24 HydrophobicContact CE1-CG2 3.88Å; F20-V24 HydrophobicContact CE2-CG2 4.22Å; F20-V24 HydrophobicContact CZ-CG2 3.87Å; F20-V24 WeakPolarHBondContact O-CB 3.45Å; F20-V24 VanDerWaalsContact O-CG2 3.26Å; F20-V24 WeakPolarHBondContact O-CG2 3.45Å; F20-V24 PolarHBondContact O-N 2.92Å; V24-K28 PolarHBondContact O-N 3.32Å
25	S	63.5	Low	61.3	Low	45 Å²	45	103.2 Å²	103.2	32%	0.315	54%	0.535	S	S	.	.	H	α-helix	trans	-70.1	-41.1	175.6	-64.9	0	0	0	0	112.4	Y21 L22 T23 E27 K28 I29	Y21-S25 VanDerWaalsContact O-CB 3.28Å; Y21-S25 WeakPolarHBondContact O-CB 3.38Å; Y21-S25 PolarHBondContact O-N 2.89Å; Y21-S25 PolarHBondContact O-OG 3.43Å; L22-S25 PolarHBondContact O-N 2.92Å; T23-S25 VanDerWaalsContact C-N 3.31Å; T23-S25 PolarHBondContact O-N 2.86Å; S25-E27 VanDerWaalsContact C-N 3.32Å; S25-K28 PolarHBondContact O-N 3.42Å; S25-I29 WeakPolarHBondContact O-CD1 3.35Å; S25-I29 WeakPolarHBondContact O-CG1 3.46Å; S25-I29 PolarHBondContact O-N 2.94Å
26	L	56.3	Low	59.1	Low	106 Å²	106	106.8 Å²	106.8	56%	0.555	55%	0.55	S	S	*	.	H	α-helix	trans	-62.4	-40.2	173.5	-83.7	160.6	0	0	0	111.6	L22 T23 I29 N30	L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 WeakPolarHBondContact O-CG 3.42Å; L22-L26 PolarHBondContact O-N 3.42Å; T23-L26 PolarHBondContact O-N 2.93Å; L26-I29 PolarHBondContact O-N 3Å; L26-N30 WeakPolarHBondContact O-CB 3.4Å; L26-N30 PolarHBondContact O-N 2.89Å
27	E	54.4	Low	56.9	Low	134 Å²	134	110.2 Å²	110.2	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-66.4	-44.8	178.1	-150.2	168.2	-157.5	0	0	111.1	T23 S25 I29 N30 T31	T23-E27 WeakPolarHBondContact O-CB 3.28Å; T23-E27 PolarHBondContact O-N 2.91Å; S25-E27 VanDerWaalsContact C-N 3.32Å; E27-I29 PolarHBondContact O-N 2.94Å; E27-N30 CarbonylContact O-C 3.6Å; E27-N30 PolarHBondContact O-N 3.38Å; E27-T31 PolarHBondContact O-N 3.2Å; E27-T31 PolarHBondContact O-OG1 2.92Å
28	K	47.3	Very low	54.5	Low	143 Å²	143	108.9 Å²	108.9	62%	0.622	56%	0.561	S	S	*	*	H	α-helix	trans	-60.4	-41.2	172.3	-86.1	-175.4	176.4	178.3	0	113	V24 S25 N30 T31 T32	V24-K28 PolarHBondContact O-N 3.32Å; S25-K28 PolarHBondContact O-N 3.42Å; K28-N30 VanDerWaalsContact C-N 3.32Å; K28-N30 PolarHBondContact O-N 2.81Å; K28-T31 PolarHBondContact O-N 2.93Å; K28-T32 WeakPolarHBondContact O-CB 3.22Å; K28-T32 PolarHBondContact O-N 3.14Å; K28-T32 PolarHBondContact O-OG1 2.74Å
29	I	52.3	Low	52.3	Low	104 Å²	104	113.5 Å²	113.5	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-63.3	-41.3	176.4	-69.3	163.6	0	0	0	110	S25 L26 E27 R33	S25-I29 WeakPolarHBondContact O-CD1 3.35Å; S25-I29 WeakPolarHBondContact O-CG1 3.46Å; S25-I29 PolarHBondContact O-N 2.94Å; L26-I29 PolarHBondContact O-N 3Å; E27-I29 PolarHBondContact O-N 2.94Å; I29-R33 WeakPolarHBondContact O-CB 3.33Å; I29-R33 PolarHBondContact O-N 3.37Å
30	N	43.5	Very low	50.2	Low	93 Å²	93	116.6 Å²	116.6	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-68.7	-40.6	175.7	-80.7	-14.4	0	0	0	112.6	L26 E27 K28 T32 R33 V34	L26-N30 WeakPolarHBondContact O-CB 3.4Å; L26-N30 PolarHBondContact O-N 2.89Å; E27-N30 CarbonylContact O-C 3.6Å; E27-N30 PolarHBondContact O-N 3.38Å; K28-N30 VanDerWaalsContact C-N 3.32Å; K28-N30 PolarHBondContact O-N 2.81Å; N30-T32 VanDerWaalsContact C-N 3.33Å; N30-T32 PolarHBondContact O-N 3.5Å; N30-R33 PolarHBondContact O-N 2.69Å; N30-V34 WeakPolarHBondContact O-CB 3.41Å; N30-V34 WeakPolarHBondContact O-CG2 3.4Å; N30-V34 PolarHBondContact O-N 3.31Å
31	T	45.3	Very low	47.7	Very low	89 Å²	89	115.9 Å²	115.9	55%	0.546	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-36.9	176.3	-8.9	0	0	0	0	111.6	E27 K28 V34 A35	E27-T31 PolarHBondContact O-N 3.2Å; E27-T31 PolarHBondContact O-OG1 2.92Å; K28-T31 PolarHBondContact O-N 2.93Å; T31-V34 PolarHBondContact O-N 3.27Å; T31-A35 VanDerWaalsContact O-CB 3.26Å; T31-A35 WeakPolarHBondContact O-CB 3.33Å; T31-A35 PolarHBondContact O-N 3.46Å
32	T	43	Very low	45.2	Very low	83 Å²	83	114.5 Å²	114.5	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-71.7	-34.1	176.7	-42.3	0	0	0	0	111.4	K28 N30 N36	K28-T32 WeakPolarHBondContact O-CB 3.22Å; K28-T32 PolarHBondContact O-N 3.14Å; K28-T32 PolarHBondContact O-OG1 2.74Å; N30-T32 VanDerWaalsContact C-N 3.33Å; N30-T32 PolarHBondContact O-N 3.5Å; T32-N36 WeakPolarHBondContact O-CB 3.47Å; T32-N36 PolarHBondContact O-N 2.65Å; T32-N36 VanDerWaalsContact O-N 3.15Å
33	R	39.8	Very low	43.3	Very low	186 Å²	186	115.4 Å²	115.4	70%	0.702	61%	0.609	S	S	*	*	H	α-helix	trans	-67.5	-41	172.2	-117.5	-178.5	177.9	-176.4	-0.8	112.4	I29 N30 F37	I29-R33 WeakPolarHBondContact O-CB 3.33Å; I29-R33 PolarHBondContact O-N 3.37Å; N30-R33 PolarHBondContact O-N 2.69Å; R33-F37 PolarHBondContact O-N 3.42Å
34	V	41.5	Very low	41.2	Very low	104 Å²	104	117.8 Å²	117.8	63%	0.63	62%	0.624	S	S	*	*	H	α-helix	trans	-72.3	-38.7	179.6	173.7	0	0	0	0	111.1	N30 T31 N36 F37	N30-V34 WeakPolarHBondContact O-CB 3.41Å; N30-V34 WeakPolarHBondContact O-CG2 3.4Å; N30-V34 PolarHBondContact O-N 3.31Å; T31-V34 PolarHBondContact O-N 3.27Å; V34-N36 PolarHBondContact O-N 3.08Å; V34-F37 PolarHBondContact O-N 3.18Å
35	A	37.8	Very low	39.5	Very low	61 Å²	61	121 Å²	121	50%	0.504	65%	0.648	S	S	.	*	H	α-helix	trans	-70.1	-27.8	176.4	0	0	0	0	0	113.6	T31 S38	T31-A35 VanDerWaalsContact O-CB 3.26Å; T31-A35 WeakPolarHBondContact O-CB 3.33Å; T31-A35 PolarHBondContact O-N 3.46Å; A35-S38 PolarHBondContact O-OG 3.05Å
36	N	34.8	Very low	37.8	Very low	132 Å²	132	122.5 Å²	122.5	71%	0.706	66%	0.659	S	S	*	*	H	α-helix	trans	-84.6	-11	173.4	-80.3	-15.9	0	0	0	113.7	T32 V34	T32-N36 WeakPolarHBondContact O-CB 3.47Å; T32-N36 PolarHBondContact O-N 2.65Å; T32-N36 VanDerWaalsContact O-N 3.15Å; V34-N36 PolarHBondContact O-N 3.08Å
37	F	34.1	Very low	36.7	Very low	182 Å²	182	123.5 Å²	123.5	80%	0.798	67%	0.672	S	S	*	*	H	α-helix	trans	-91.5	-9.7	176.1	-125.3	-96.9	0	0	0	113.7	R33 V34	R33-F37 PolarHBondContact O-N 3.42Å; V34-F37 PolarHBondContact O-N 3.18Å
38	S	29.7	Very low	35.6	Very low	89 Å²	89	123.8 Å²	123.8	62%	0.622	68%	0.677	S	S	*	*			trans	-94.9	6.7	-177.7	59.7	0	0	0	0	115	A35 Q40	A35-S38 PolarHBondContact O-OG 3.05Å; S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 3.08Å
39	K	32.2	Very low	35.1	Very low	193 Å²	193	121.3 Å²	121.3	84%	0.839	68%	0.677	S	S	*	*			trans	-91.7	72.6	161.8	-85.1	-177.1	176.6	177.8	0	109.3	V41	K39-V41 PolarHBondContact O-N 3.32Å; K39-V41 VanDerWaalsContact O-N 3.13Å
40	Q	33.1	Very low	34.7	Very low	169 Å²	169	118.9 Å²	118.9	79%	0.79	67%	0.669	S	S	*	*			trans	-60.5	109.6	161.8	-84.7	175.5	-39	0	0	108.3	S38 N42	S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 3.08Å; Q40-N42 PolarHBondContact O-N 3.47Å
41	V	28.6	Very low	35.1	Very low	121 Å²	121	122.8 Å²	122.8	73%	0.733	68%	0.683	S	S	*	*			trans	-63.5	111.9	153.1	176.4	0	0	0	0	105.1	K39 V43	K39-V41 PolarHBondContact O-N 3.32Å; K39-V41 VanDerWaalsContact O-N 3.13Å; V41-V43 HydrophobicContact CG1-CG2 3.89Å; V41-V43 PolarHBondContact O-N 3.47Å
42	N	24.8	Very low	35.8	Very low	143 Å²	143	119.6 Å²	119.6	77%	0.765	66%	0.663	S	S	*	*			trans	-61.7	84.8	164.3	-85	-14.8	0	0	0	107.8	Q40 T44	Q40-N42 PolarHBondContact O-N 3.47Å; N42-T44 VanDerWaalsContact C-N 3.26Å; N42-T44 PolarHBondContact O-N 2.84Å; N42-T44 VanDerWaalsContact O-N 3.1Å
43	V	28.8	Very low	36.8	Very low	120 Å²	120	121 Å²	121	73%	0.727	67%	0.673	S	S	*	*			trans	-74.3	94.1	159.8	-178.1	0	0	0	0	104.6	V41 S45	V41-V43 HydrophobicContact CG1-CG2 3.89Å; V41-V43 PolarHBondContact O-N 3.47Å; V43-S45 PolarHBondContact O-N 3.01Å
44	T	25.8	Very low	38.3	Very low	126 Å²	126	113.3 Å²	113.3	77%	0.773	65%	0.647	S	S	*	*			trans	-47.1	111.3	160.7	25.2	0	0	0	0	107.7	N42 S46	N42-T44 VanDerWaalsContact C-N 3.26Å; N42-T44 PolarHBondContact O-N 2.84Å; N42-T44 VanDerWaalsContact O-N 3.1Å; T44-S46 PolarHBondContact O-N 3.29Å
45	S	33.3	Very low	39.9	Very low	117 Å²	117	109.8 Å²	109.8	82%	0.818	63%	0.629	S	S	*	*			trans	-65.7	86.6	168.7	53.7	0	0	0	0	108	V43	V43-S45 PolarHBondContact O-N 3.01Å
46	S	26.8	Very low	41.4	Very low	78 Å²	78	107.9 Å²	107.9	55%	0.545	61%	0.612	S	S	.	*			trans	-67.9	129.9	161.8	174.5	0	0	0	0	108	T44 L48	T44-S46 PolarHBondContact O-N 3.29Å; S46-L48 PolarHBondContact O-N 3.45Å
47	P	33.5	Very low	43.3	Very low	126 Å²	126	107.6 Å²	107.6	82%	0.818	61%	0.606	S	S	*	*			trans	-74.9	77.4	167.6	32.6	-30.1	0	0	0	107.8	S49	P47-S49 PolarHBondContact O-N 3.46Å
48	L	31.7	Very low	45.2	Very low	141 Å²	141	102 Å²	102	74%	0.738	59%	0.585	S	S	*	*			trans	-76.1	87.8	161.6	-82.9	148.6	0	0	0	106.1	S46 P50	S46-L48 PolarHBondContact O-N 3.45Å; L48-P50 WeakPolarHBondContact O-CD 3.33Å
49	S	36.9	Very low	47.4	Very low	90 Å²	90	97.9 Å²	97.9	63%	0.629	56%	0.556	S	S	*	*			trans	-73.7	101.8	149.5	-160.4	0	0	0	0	104.5	P47 H51	P47-S49 PolarHBondContact O-N 3.46Å; S49-H51 PolarHBondContact O-N 2.97Å; S49-H51 VanDerWaalsContact O-N 3.12Å
50	P	43.3	Very low	49.5	Very low	54 Å²	54	91.4 Å²	91.4	35%	0.351	53%	0.526	S	S	.	.			trans	-60	123.1	169.5	25.8	-30.7	0	0	0	105.7	L48 I52	L48-P50 WeakPolarHBondContact O-CD 3.33Å; P50-I52 HydrophobicContact CB-CG1 4.06Å; P50-I52 HydrophobicContact CG-CD1 3.9Å; P50-I52 HydrophobicContact CG-CG1 3.88Å; P50-I52 PolarHBondContact O-N 3.19Å
51	H	52.8	Low	51.7	Low	174 Å²	174	90.1 Å²	90.1	81%	0.806	52%	0.518	S	S	*	.			trans	-59.7	87	160.4	-77	-72.9	0	0	0	106	S49 P53	S49-H51 PolarHBondContact O-N 2.97Å; S49-H51 VanDerWaalsContact O-N 3.12Å; H51-P53 WeakPolarHBondContact O-CD 3.45Å
52	I	59.6	Low	54	Low	22 Å²	22	86.8 Å²	86.8	11%	0.113	50%	0.496	C	S	.	.			trans	-74.5	110.3	174.2	-69.1	156.9	0	0	0	104.1	P50 V54 F323 V324 L345	P50-I52 HydrophobicContact CB-CG1 4.06Å; P50-I52 HydrophobicContact CG-CD1 3.9Å; P50-I52 HydrophobicContact CG-CG1 3.88Å; P50-I52 PolarHBondContact O-N 3.19Å; I52-V54 PolarHBondContact O-N 3.44Å; I52-F323 HydrophobicContact CB-CD1 4.28Å; I52-F323 HydrophobicContact CB-CE1 4.43Å; I52-F323 HydrophobicContact CD1-CB 3.76Å; I52-F323 HydrophobicContact CD1-CD1 3.43Å; I52-F323 VanDerWaalsContact CD1-CD1 3.43Å; I52-F323 HydrophobicContact CD1-CE1 4.17Å; I52-F323 HydrophobicContact CD1-CG 3.71Å; I52-F323 HydrophobicContact CG1-CD1 4.44Å; I52-V324 HydrophobicContact CG2-CG2 4.45Å; I52-L345 HydrophobicContact CG2-CD2 3.48Å; I52-L345 VanDerWaalsContact CG2-CD2 3.48Å
53	P	63.1	Low	56.6	Low	113 Å²	113	80.2 Å²	80.2	73%	0.734	46%	0.46	S	S	*	.			trans	-65.1	109.1	-180	26.2	-31	0	0	0	107.8	H51	H51-P53 WeakPolarHBondContact O-CD 3.45Å
54	V	72.3	Confident	59	Low	24 Å²	24	76.7 Å²	76.7	15%	0.145	44%	0.44	C	S	.	.			trans	-81.4	122.2	172.6	178.2	0	0	0	0	107.2	I52 S56 L59 I81 V324 A344	I52-V54 PolarHBondContact O-N 3.44Å; V54-S56 PolarHBondContact O-N 3.46Å; V54-L59 HydrophobicContact CG1-CD1 4.24Å; V54-I81 HydrophobicContact CB-CG2 4.25Å; V54-I81 HydrophobicContact CG2-CG2 4.07Å; V54-V324 HydrophobicContact CG2-CG2 4.35Å; V54-A344 CarbonylContact C-O 3.59Å; V54-A344 WeakPolarHBondContact CA-O 3.47Å; V54-A344 HydrophobicContact CG1-CB 4.21Å
55	A	75.1	Confident	61.1	Low	30 Å²	30	76.7 Å²	76.7	25%	0.248	43%	0.431	C	S	.	.			trans	-73.3	63	177.6	0	0	0	0	0	111.3	E57 D58 L59 A344	A55-E57 PolarHBondContact O-N 3.17Å; A55-D58 HydrophobicContact CB-CB 4.3Å; A55-D58 PolarHBondContact O-N 3.37Å; A55-L59 WeakPolarHBondContact O-CG 3.29Å; A55-L59 PolarHBondContact O-N 2.89Å; A55-A344 PolarHBondContact N-O 3.28Å
56	S	69.3	Low	62.7	Low	22 Å²	22	74.5 Å²	74.5	15%	0.154	41%	0.41	C	S	.	.	H	α-helix	trans	-63.9	-38.6	-170.4	63.7	0	0	0	0	113.5	V54 D58 L59 R60 E82	V54-S56 PolarHBondContact O-N 3.46Å; S56-D58 PolarHBondContact O-N 3.47Å; S56-L59 WeakPolarHBondContact O-CB 3.37Å; S56-L59 PolarHBondContact O-N 3.15Å; S56-R60 WeakPolarHBondContact O-CG 3.24Å; S56-R60 PolarHBondContact O-N 3.38Å; S56-E82 WeakPolarHBondContact CB-OE1 3.22Å; S56-E82 PolarHBondContact OG-OE1 3.17Å
57	E	73.6	Confident	65.2	Low	125 Å²	125	76.4 Å²	76.4	58%	0.584	42%	0.418	S	S	*	.	H	α-helix	trans	-65.7	-39.4	179.7	-159.6	-170.8	142.1	0	0	112.5	A55 L59 R60 K61	A55-E57 PolarHBondContact O-N 3.17Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 2.96Å; E57-R60 PolarHBondContact O-N 3.31Å; E57-K61 WeakPolarHBondContact O-CG 3.37Å; E57-K61 PolarHBondContact O-N 2.82Å; E57-K61 WeakPolarHBondContact OE1-CE 3.36Å; E57-K61 IonicContact OE1-NZ 2.92Å; E57-K61 PolarHBondContact OE1-NZ 3.36Å
58	D	75.6	Confident	68	Low	66 Å²	66	70.6 Å²	70.6	35%	0.353	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-36.7	175.5	-100.1	17.9	0	0	0	112	A55 S56 K343	A55-D58 HydrophobicContact CB-CB 4.3Å; A55-D58 PolarHBondContact O-N 3.37Å; S56-D58 PolarHBondContact O-N 3.47Å; D58-K343 IonicContact OD2-NZ 3.07Å; D58-K343 PolarHBondContact OD2-NZ 2.9Å
59	L	76	Confident	71	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-70	-44	176.9	-70.2	166.2	0	0	0	111.8	V54 A55 S56 E57 K61 I62 I63 F74 F328 K343 A344	V54-L59 HydrophobicContact CG1-CD1 4.24Å; A55-L59 WeakPolarHBondContact O-CG 3.29Å; A55-L59 PolarHBondContact O-N 2.89Å; S56-L59 WeakPolarHBondContact O-CB 3.37Å; S56-L59 PolarHBondContact O-N 3.15Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 2.96Å; L59-K61 PolarHBondContact O-N 3.31Å; L59-I62 PolarHBondContact O-N 3.01Å; L59-I62 VanDerWaalsContact O-N 3.12Å; L59-I63 PolarHBondContact O-N 2.74Å; L59-F74 HydrophobicContact CB-CE1 4.2Å; L59-F74 HydrophobicContact CB-CZ 3.91Å; L59-F74 HydrophobicContact CD1-CZ 4.08Å; L59-F74 HydrophobicContact CD2-CZ 4.14Å; L59-F74 HydrophobicContact CG-CZ 4.28Å; L59-F328 HydrophobicContact CD1-CE2 4.34Å; L59-F328 HydrophobicContact CD1-CZ 3.69Å; L59-K343 HydrophobicContact CD2-CB 4.13Å; L59-K343 HydrophobicContact CD2-CG 3.85Å; L59-A344 HydrophobicContact CD1-CB 3.64Å; L59-A344 HydrophobicContact CD2-CB 4.36Å; L59-A344 HydrophobicContact CG-CB 4.45Å
60	R	76.1	Confident	73.7	Confident	57 Å²	57	60.2 Å²	60.2	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-29.2	178	-71.8	173.9	-174	-82.8	3.7	112.4	S56 E57 Y75 V78 T79 E82	S56-R60 WeakPolarHBondContact O-CG 3.24Å; S56-R60 PolarHBondContact O-N 3.38Å; E57-R60 PolarHBondContact O-N 3.31Å; R60-Y75 HydrophobicContact CG-CE2 4.36Å; R60-Y75 PolarHBondContact NH1-OH 3.39Å; R60-Y75 VanDerWaalsContact NH1-OH 3.12Å; R60-V78 HydrophobicContact CG-CG1 4.36Å; R60-T79 PolarHBondContact NH2-OG1 2.61Å; R60-E82 IonicContact CZ-OE1 2.75Å; R60-E82 IonicContact CZ-OE2 3.24Å; R60-E82 IonicContact NE-OE1 2.79Å; R60-E82 PolarHBondContact NE-OE1 2.94Å; R60-E82 VanDerWaalsContact NE-OE1 3.13Å; R60-E82 IonicContact NE-OE2 3.44Å; R60-E82 VanDerWaalsContact NH2-CD 3.31Å; R60-E82 IonicContact NH2-OE1 3.52Å; R60-E82 PolarHBondContact NH2-OE1 3.1Å; R60-E82 IonicContact NH2-OE2 2.8Å; R60-E82 PolarHBondContact NH2-OE2 3.25Å
61	K	79.5	Confident	76.1	Confident	141 Å²	141	57.7 Å²	57.7	61%	0.613	30%	0.302	S	S	*	.	H	α-helix	trans	-71.7	-30.2	176.1	-74	168.5	-173.8	160.3	0	113.5	E57 L59	E57-K61 WeakPolarHBondContact O-CG 3.37Å; E57-K61 PolarHBondContact O-N 2.82Å; E57-K61 WeakPolarHBondContact OE1-CE 3.36Å; E57-K61 IonicContact OE1-NZ 2.92Å; E57-K61 PolarHBondContact OE1-NZ 3.36Å; L59-K61 PolarHBondContact O-N 3.31Å
62	I	76.9	Confident	78	Confident	52 Å²	52	53.4 Å²	53.4	27%	0.267	28%	0.279	S	S	.	.	H	α-helix	trans	-92.6	-43.4	-174.3	-64.7	170.7	0	0	0	111	L59 P64 K343	L59-I62 PolarHBondContact O-N 3.01Å; L59-I62 VanDerWaalsContact O-N 3.12Å; I62-P64 WeakPolarHBondContact O-CD 3.48Å; I62-K343 HydrophobicContact CD1-CD 4.41Å; I62-K343 VanDerWaalsContact CD1-CE 3.48Å; I62-K343 HydrophobicContact CD1-CG 4.32Å
63	I	79.3	Confident	79.4	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	29%	0.285	C	S	.	.	S	Bend	trans	-93.4	112.6	-178.1	-56.9	-177.6	0	0	0	108.1	L59 Q65 W70 N71 F74 Y298 L340	L59-I63 PolarHBondContact O-N 2.74Å; I63-Q65 PolarHBondContact O-N 2.94Å; I63-W70 HydrophobicContact CD1-CH2 4.08Å; I63-W70 HydrophobicContact CD1-CZ3 3.8Å; I63-W70 HydrophobicContact CG2-CZ3 4.3Å; I63-N71 WeakPolarHBondContact CG2-ND2 3.5Å; I63-F74 HydrophobicContact CB-CD1 4.2Å; I63-F74 HydrophobicContact CB-CE1 4.14Å; I63-F74 HydrophobicContact CD1-CD1 3.71Å; I63-F74 HydrophobicContact CD1-CD2 4.22Å; I63-F74 HydrophobicContact CD1-CE1 3.45Å; I63-F74 VanDerWaalsContact CD1-CE1 3.45Å; I63-F74 HydrophobicContact CD1-CE2 3.98Å; I63-F74 HydrophobicContact CD1-CG 4.08Å; I63-F74 HydrophobicContact CD1-CZ 3.59Å; I63-F74 HydrophobicContact CG1-CE1 4.23Å; I63-F74 HydrophobicContact CG2-CD1 4.05Å; I63-F74 HydrophobicContact CG2-CE1 4.49Å; I63-Y298 HydrophobicContact CG2-CE2 4.37Å; I63-L340 HydrophobicContact CD1-CD2 3.29Å; I63-L340 HydrophobicContact CG1-CD2 4.24Å
64	P	77.9	Confident	80.8	Confident	46 Å²	46	49.5 Å²	49.5	30%	0.299	25%	0.251	S	S	.	.			trans	-64.7	141.2	179.6	27.4	-32.2	0	0	0	109.4	I62 D66 N71 S299	I62-P64 WeakPolarHBondContact O-CD 3.48Å; P64-D66 HydrophobicContact CB-CB 4.08Å; P64-D66 HydrophobicContact CG-CB 4.27Å; P64-D66 PolarHBondContact O-N 3.39Å; P64-N71 PolarHBondContact O-ND2 2.83Å; P64-S299 WeakPolarHBondContact CG-O 2.9Å
65	Q	70.6	Confident	81.6	Confident	126 Å²	126	51.5 Å²	51.5	59%	0.589	26%	0.257	S	S	*	.			trans	-66	2.9	173.1	-169.7	177.1	-4.9	0	0	113	I63 Y75	I63-Q65 PolarHBondContact O-N 2.94Å; Q65-Y75 HydrophobicContact CB-CD2 3.98Å; Q65-Y75 HydrophobicContact CB-CE2 3.89Å; Q65-Y75 VanDerWaalsContact CD-CE2 3.48Å; Q65-Y75 HydrophobicContact CG-CD1 4.35Å; Q65-Y75 HydrophobicContact CG-CD2 3.7Å; Q65-Y75 HydrophobicContact CG-CE1 4.31Å; Q65-Y75 HydrophobicContact CG-CE2 3.62Å; Q65-Y75 HydrophobicContact CG-CG 4.04Å; Q65-Y75 PolarHBondContact OE1-OH 3Å
66	D	67.8	Low	82.1	Confident	71 Å²	71	53 Å²	53	38%	0.38	27%	0.265	S	S	.	.			trans	-40.6	162.9	-178.2	-166.5	17.3	0	0	0	115.1	P64 A68 S299	P64-D66 HydrophobicContact CB-CB 4.08Å; P64-D66 HydrophobicContact CG-CB 4.27Å; P64-D66 PolarHBondContact O-N 3.39Å; D66-A68 PolarHBondContact O-N 3.19Å; D66-S299 WeakPolarHBondContact OD2-CB 3.22Å; D66-S299 PolarHBondContact OD2-OG 2.88Å
67	V	78	Confident	82.9	Confident	118 Å²	118	52.2 Å²	52.2	72%	0.715	26%	0.26	S	S	*	.	S	Bend	trans	-68.7	3	-172.9	-148.5	0	0	0	0	113.9	R72	V67-R72 PolarHBondContact O-NH1 3.38Å
68	A	93.3	Very high	83.4	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.033	23%	0.233	C	C	.	.			trans	-71.9	144	177.9	0	0	0	0	0	111.7	D66 W70 N71 R72 L295 T296	D66-A68 PolarHBondContact O-N 3.19Å; A68-W70 PolarHBondContact O-N 2.75Å; A68-N71 HydrophobicContact CB-CB 4.34Å; A68-N71 VanDerWaalsContact CB-OD1 3.29Å; A68-N71 WeakPolarHBondContact CB-OD1 3.05Å; A68-N71 WeakPolarHBondContact O-CB 3.01Å; A68-N71 PolarHBondContact O-N 3.47Å; A68-R72 WeakPolarHBondContact O-CG 3.45Å; A68-R72 PolarHBondContact O-N 3.2Å; A68-R72 VanDerWaalsContact O-N 3.13Å; A68-L295 WeakPolarHBondContact CB-O 3.28Å; A68-T296 CarbonylContact C-O 3.43Å; A68-T296 WeakPolarHBondContact CA-O 3.33Å
69	Y	93.6	Very high	83.8	Confident	14 Å²	14	44.6 Å²	44.6	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-49.6	-169.7	173.1	-115.3	0	0	0	113.7	N71 R72 L73 L105 N108 V109 L123 M126 T296 F297	Y69-N71 VanDerWaalsContact C-N 3.34Å; Y69-N71 PolarHBondContact O-N 3.27Å; Y69-R72 PolarHBondContact O-N 3.02Å; Y69-L73 HydrophobicContact CD1-CD1 4.26Å; Y69-L73 HydrophobicContact CE1-CD1 3.69Å; Y69-L73 HydrophobicContact CE2-CD1 4.08Å; Y69-L73 HydrophobicContact CE2-CD2 4.38Å; Y69-L73 HydrophobicContact CE2-CG 4.22Å; Y69-L73 PolarHBondContact O-N 2.74Å; Y69-L73 VanDerWaalsContact O-N 3.16Å; Y69-L105 HydrophobicContact CE1-CD2 4.48Å; Y69-N108 HydrophobicContact CD2-CB 3.72Å; Y69-N108 HydrophobicContact CE2-CB 3.73Å; Y69-V109 HydrophobicContact CD1-CG2 3.8Å; Y69-V109 HydrophobicContact CD2-CG2 3.99Å; Y69-V109 HydrophobicContact CE1-CG2 4.43Å; Y69-V109 HydrophobicContact CG-CG2 3.53Å; Y69-L123 HydrophobicContact CD1-CD2 4.3Å; Y69-L123 HydrophobicContact CE1-CD2 4.11Å; Y69-M126 HydrophobicContact CE1-CE 3.68Å; Y69-T296 PolarHBondContact N-O 3.47Å; Y69-F297 HydrophobicContact CD1-CD2 4.28Å; Y69-F297 HydrophobicContact CD1-CE2 4.48Å; Y69-F297 PolarHBondContact N-O 2.91Å
70	W	94.4	Very high	84	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-38	-180	-169.8	96.1	0	0	0	111.6	I63 A68 R72 L73 F74 F297 Y298 P329 L330 F331 L340	I63-W70 HydrophobicContact CD1-CH2 4.08Å; I63-W70 HydrophobicContact CD1-CZ3 3.8Å; I63-W70 HydrophobicContact CG2-CZ3 4.3Å; A68-W70 PolarHBondContact O-N 2.75Å; W70-R72 VanDerWaalsContact C-N 3.33Å; W70-R72 PolarHBondContact O-N 3.48Å; W70-L73 PolarHBondContact O-N 3.02Å; W70-F74 HydrophobicContact CD2-CB 4.45Å; W70-F74 HydrophobicContact CE3-CB 3.85Å; W70-F74 HydrophobicContact CE3-CG 4.49Å; W70-F74 HydrophobicContact CH2-CB 3.8Å; W70-F74 AromaticContact CH2-CD2 3.4Å; W70-F74 HydrophobicContact CH2-CD2 3.4Å; W70-F74 HydrophobicContact CH2-CE2 4.16Å; W70-F74 AromaticContact CH2-CG 3.72Å; W70-F74 HydrophobicContact CH2-CG 3.72Å; W70-F74 HydrophobicContact CZ2-CB 4.42Å; W70-F74 HydrophobicContact CZ2-CD2 4.14Å; W70-F74 HydrophobicContact CZ3-CB 3.49Å; W70-F74 VanDerWaalsContact CZ3-CB 3.49Å; W70-F74 HydrophobicContact CZ3-CD1 4.42Å; W70-F74 AromaticContact CZ3-CD2 3.86Å; W70-F74 HydrophobicContact CZ3-CD2 3.86Å; W70-F74 AromaticContact CZ3-CG 3.66Å; W70-F74 HydrophobicContact CZ3-CG 3.66Å; W70-F74 WeakPolarHBondContact O-CB 3.48Å; W70-F74 PolarHBondContact O-N 3.49Å; W70-F297 HydrophobicContact CB-CD2 4.32Å; W70-F297 HydrophobicContact CB-CE1 4.15Å; W70-F297 HydrophobicContact CB-CE2 3.93Å; W70-F297 HydrophobicContact CB-CZ 3.86Å; W70-F297 WeakPolarHBondContact CB-O 3.48Å; W70-F297 AromaticContact CD1-CZ 3.58Å; W70-F297 HydrophobicContact CG-CE1 4.34Å; W70-F297 HydrophobicContact CG-CE2 4.37Å; W70-F297 AromaticContact CG-CZ 3.94Å; W70-F297 HydrophobicContact CG-CZ 3.94Å; W70-F297 PolarHBondContact N-O 3.16Å; W70-Y298 HydrophobicContact CD2-CD2 4.32Å; W70-Y298 AromaticContact CE3-CD2 3.62Å; W70-Y298 HydrophobicContact CE3-CD2 3.62Å; W70-Y298 AromaticContact CE3-CE2 3.89Å; W70-Y298 HydrophobicContact CE3-CE2 3.89Å; W70-Y298 HydrophobicContact CZ3-CD2 4.19Å; W70-Y298 AromaticContact CZ3-CE2 3.98Å; W70-Y298 HydrophobicContact CZ3-CE2 3.98Å; W70-P329 HydrophobicContact CD2-CG 4.32Å; W70-P329 HydrophobicContact CZ2-CG 3.9Å; W70-P329 PolarHBondContact NE1-O 3.49Å; W70-L330 PolarHBondContact NE1-O 3.44Å; W70-F331 AromaticContact CD2-CD2 3.81Å; W70-F331 HydrophobicContact CD2-CD2 3.81Å; W70-F331 HydrophobicContact CD2-CE2 4.25Å; W70-F331 AromaticContact CE2-CD2 3.56Å; W70-F331 HydrophobicContact CE3-CD2 4.4Å; W70-F331 HydrophobicContact CG-CD2 4.11Å; W70-F331 HydrophobicContact CG-CE2 4.45Å; W70-F331 HydrophobicContact CZ2-CB 4.26Å; W70-F331 AromaticContact CZ2-CD2 3.96Å; W70-F331 HydrophobicContact CZ2-CD2 3.96Å; W70-F331 AromaticContact NE1-CD2 3.67Å; W70-L340 HydrophobicContact CH2-CD1 3.55Å; W70-L340 HydrophobicContact CH2-CD2 4.43Å; W70-L340 HydrophobicContact CZ2-CD1 3.89Å; W70-L340 HydrophobicContact CZ3-CD1 4.48Å
71	N	93.8	Very high	84.1	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-44.7	175.8	-64.8	70	0	0	0	111.4	I63 P64 A68 Y69 F74 Y75 Y298 S299	I63-N71 WeakPolarHBondContact CG2-ND2 3.5Å; P64-N71 PolarHBondContact O-ND2 2.83Å; A68-N71 HydrophobicContact CB-CB 4.34Å; A68-N71 VanDerWaalsContact CB-OD1 3.29Å; A68-N71 WeakPolarHBondContact CB-OD1 3.05Å; A68-N71 WeakPolarHBondContact O-CB 3.01Å; A68-N71 PolarHBondContact O-N 3.47Å; Y69-N71 VanDerWaalsContact C-N 3.34Å; Y69-N71 PolarHBondContact O-N 3.27Å; N71-F74 PolarHBondContact O-N 2.92Å; N71-Y75 WeakPolarHBondContact O-CB 3.47Å; N71-Y75 PolarHBondContact O-N 2.9Å; N71-Y298 WeakPolarHBondContact OD1-CA 3.46Å; N71-Y298 WeakPolarHBondContact OD1-CD2 2.97Å; N71-S299 PolarHBondContact ND2-O 2.96Å; N71-S299 PolarHBondContact OD1-N 2.94Å
72	R	91.4	Very high	83.9	Confident	84 Å²	84	43.7 Å²	43.7	32%	0.317	23%	0.227	S	C	.	.	H	α-helix	trans	-62.4	-45.3	176	-61.6	-166.4	-51.3	-90	8.3	112.2	V67 A68 Y69 W70 F74 Y75 S76 N108	V67-R72 PolarHBondContact O-NH1 3.38Å; A68-R72 WeakPolarHBondContact O-CG 3.45Å; A68-R72 PolarHBondContact O-N 3.2Å; A68-R72 VanDerWaalsContact O-N 3.13Å; Y69-R72 PolarHBondContact O-N 3.02Å; W70-R72 VanDerWaalsContact C-N 3.33Å; W70-R72 PolarHBondContact O-N 3.48Å; R72-F74 VanDerWaalsContact C-N 3.33Å; R72-F74 PolarHBondContact O-N 3.13Å; R72-Y75 PolarHBondContact O-N 3.36Å; R72-S76 WeakPolarHBondContact O-CB 3.5Å; R72-S76 PolarHBondContact O-N 2.92Å; R72-N108 PolarHBondContact NH2-O 2.78Å; R72-N108 PolarHBondContact NH2-OD1 2.94Å
73	L	90.9	Very high	83.9	Confident	48 Å²	48	47.6 Å²	47.6	25%	0.251	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-41.7	177.2	-68.1	-179	0	0	0	112.1	Y69 W70 A77 M126 P329	Y69-L73 HydrophobicContact CD1-CD1 4.26Å; Y69-L73 HydrophobicContact CE1-CD1 3.69Å; Y69-L73 HydrophobicContact CE2-CD1 4.08Å; Y69-L73 HydrophobicContact CE2-CD2 4.38Å; Y69-L73 HydrophobicContact CE2-CG 4.22Å; Y69-L73 PolarHBondContact O-N 2.74Å; Y69-L73 VanDerWaalsContact O-N 3.16Å; W70-L73 PolarHBondContact O-N 3.02Å; L73-A77 WeakPolarHBondContact O-CB 3.5Å; L73-A77 PolarHBondContact O-N 2.9Å; L73-M126 HydrophobicContact CD1-CE 3.51Å; L73-P329 HydrophobicContact CB-CB 4.16Å; L73-P329 HydrophobicContact CB-CG 3.95Å; L73-P329 HydrophobicContact CD1-CB 4.34Å
74	F	91.3	Very high	83.2	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-47.7	177.7	177.6	-95.5	0	0	0	111.5	L59 I63 W70 N71 R72 S76 A77 V78 F328 P329	L59-F74 HydrophobicContact CB-CE1 4.2Å; L59-F74 HydrophobicContact CB-CZ 3.91Å; L59-F74 HydrophobicContact CD1-CZ 4.08Å; L59-F74 HydrophobicContact CD2-CZ 4.14Å; L59-F74 HydrophobicContact CG-CZ 4.28Å; I63-F74 HydrophobicContact CB-CD1 4.2Å; I63-F74 HydrophobicContact CB-CE1 4.14Å; I63-F74 HydrophobicContact CD1-CD1 3.71Å; I63-F74 HydrophobicContact CD1-CD2 4.22Å; I63-F74 HydrophobicContact CD1-CE1 3.45Å; I63-F74 VanDerWaalsContact CD1-CE1 3.45Å; I63-F74 HydrophobicContact CD1-CE2 3.98Å; I63-F74 HydrophobicContact CD1-CG 4.08Å; I63-F74 HydrophobicContact CD1-CZ 3.59Å; I63-F74 HydrophobicContact CG1-CE1 4.23Å; I63-F74 HydrophobicContact CG2-CD1 4.05Å; I63-F74 HydrophobicContact CG2-CE1 4.49Å; W70-F74 HydrophobicContact CD2-CB 4.45Å; W70-F74 HydrophobicContact CE3-CB 3.85Å; W70-F74 HydrophobicContact CE3-CG 4.49Å; W70-F74 HydrophobicContact CH2-CB 3.8Å; W70-F74 AromaticContact CH2-CD2 3.4Å; W70-F74 HydrophobicContact CH2-CD2 3.4Å; W70-F74 HydrophobicContact CH2-CE2 4.16Å; W70-F74 AromaticContact CH2-CG 3.72Å; W70-F74 HydrophobicContact CH2-CG 3.72Å; W70-F74 HydrophobicContact CZ2-CB 4.42Å; W70-F74 HydrophobicContact CZ2-CD2 4.14Å; W70-F74 HydrophobicContact CZ3-CB 3.49Å; W70-F74 VanDerWaalsContact CZ3-CB 3.49Å; W70-F74 HydrophobicContact CZ3-CD1 4.42Å; W70-F74 AromaticContact CZ3-CD2 3.86Å; W70-F74 HydrophobicContact CZ3-CD2 3.86Å; W70-F74 AromaticContact CZ3-CG 3.66Å; W70-F74 HydrophobicContact CZ3-CG 3.66Å; W70-F74 WeakPolarHBondContact O-CB 3.48Å; W70-F74 PolarHBondContact O-N 3.49Å; N71-F74 PolarHBondContact O-N 2.92Å; R72-F74 VanDerWaalsContact C-N 3.33Å; R72-F74 PolarHBondContact O-N 3.13Å; F74-S76 VanDerWaalsContact C-N 3.33Å; F74-S76 PolarHBondContact O-N 2.92Å; F74-A77 WeakPolarHBondContact O-CB 3.48Å; F74-A77 PolarHBondContact O-N 3.22Å; F74-A77 VanDerWaalsContact O-N 3.1Å; F74-V78 HydrophobicContact CD1-CG2 4.13Å; F74-V78 HydrophobicContact CE1-CG2 3.61Å; F74-V78 HydrophobicContact CE2-CG2 4.04Å; F74-V78 HydrophobicContact CZ-CG2 3.57Å; F74-V78 WeakPolarHBondContact O-CG2 3.42Å; F74-V78 PolarHBondContact O-N 3.32Å; F74-F328 HydrophobicContact CD2-CD1 4.31Å; F74-F328 HydrophobicContact CD2-CG 4.31Å; F74-F328 AromaticContact CE2-CD1 3.94Å; F74-F328 HydrophobicContact CE2-CD1 3.94Å; F74-F328 AromaticContact CE2-CD2 3.95Å; F74-F328 HydrophobicContact CE2-CD2 3.95Å; F74-F328 AromaticContact CE2-CE1 3.9Å; F74-F328 HydrophobicContact CE2-CE1 3.9Å; F74-F328 AromaticContact CE2-CE2 3.88Å; F74-F328 HydrophobicContact CE2-CE2 3.88Å; F74-F328 AromaticContact CE2-CG 3.98Å; F74-F328 HydrophobicContact CE2-CG 3.98Å; F74-F328 AromaticContact CE2-CZ 3.87Å; F74-F328 HydrophobicContact CE2-CZ 3.87Å; F74-F328 HydrophobicContact CZ-CE1 4.5Å; F74-F328 HydrophobicContact CZ-CZ 4.31Å; F74-P329 HydrophobicContact CB-CG 4.26Å
75	Y	88.4	Confident	82.3	Confident	67 Å²	67	56 Å²	56	26%	0.263	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-41.8	179.3	-162.5	-85.7	0	0	0	111.8	R60 Q65 N71 R72 A77 V78 T79	R60-Y75 HydrophobicContact CG-CE2 4.36Å; R60-Y75 PolarHBondContact NH1-OH 3.39Å; R60-Y75 VanDerWaalsContact NH1-OH 3.12Å; Q65-Y75 HydrophobicContact CB-CD2 3.98Å; Q65-Y75 HydrophobicContact CB-CE2 3.89Å; Q65-Y75 VanDerWaalsContact CD-CE2 3.48Å; Q65-Y75 HydrophobicContact CG-CD1 4.35Å; Q65-Y75 HydrophobicContact CG-CD2 3.7Å; Q65-Y75 HydrophobicContact CG-CE1 4.31Å; Q65-Y75 HydrophobicContact CG-CE2 3.62Å; Q65-Y75 HydrophobicContact CG-CG 4.04Å; Q65-Y75 PolarHBondContact OE1-OH 3Å; N71-Y75 WeakPolarHBondContact O-CB 3.47Å; N71-Y75 PolarHBondContact O-N 2.9Å; R72-Y75 PolarHBondContact O-N 3.36Å; Y75-A77 VanDerWaalsContact C-N 3.34Å; Y75-A77 PolarHBondContact O-N 2.81Å; Y75-V78 PolarHBondContact O-N 2.94Å; Y75-T79 PolarHBondContact O-N 3.32Å; Y75-T79 PolarHBondContact O-OG1 2.89Å
76	S	87.4	Confident	81.5	Confident	61 Å²	61	55.7 Å²	55.7	43%	0.427	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-43.7	172.4	175.2	0	0	0	0	111.7	R72 F74 V78 T79 N80	R72-S76 WeakPolarHBondContact O-CB 3.5Å; R72-S76 PolarHBondContact O-N 2.92Å; F74-S76 VanDerWaalsContact C-N 3.33Å; F74-S76 PolarHBondContact O-N 2.92Å; S76-V78 PolarHBondContact O-N 3.46Å; S76-T79 PolarHBondContact O-N 3.3Å; S76-N80 PolarHBondContact O-N 3.15Å; S76-N80 PolarHBondContact O-ND2 3.28Å; S76-N80 PolarHBondContact O-OD1 3.46Å
77	A	86.2	Confident	80.5	Confident	6 Å²	6	54.6 Å²	54.6	5%	0.05	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-43.9	177.1	0	0	0	0	0	112.3	L73 F74 Y75 N80 I81 L327	L73-A77 WeakPolarHBondContact O-CB 3.5Å; L73-A77 PolarHBondContact O-N 2.9Å; F74-A77 WeakPolarHBondContact O-CB 3.48Å; F74-A77 PolarHBondContact O-N 3.22Å; F74-A77 VanDerWaalsContact O-N 3.1Å; Y75-A77 VanDerWaalsContact C-N 3.34Å; Y75-A77 PolarHBondContact O-N 2.81Å; A77-N80 PolarHBondContact O-N 2.9Å; A77-I81 WeakPolarHBondContact O-CD1 3.38Å; A77-I81 VanDerWaalsContact O-CG1 3.23Å; A77-I81 WeakPolarHBondContact O-CG1 3.39Å; A77-I81 PolarHBondContact O-N 3.41Å; A77-L327 WeakPolarHBondContact CB-O 3.41Å
78	V	83.8	Confident	79.1	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-43.2	178.7	175.5	0	0	0	0	111.7	R60 F74 Y75 S76 I81 E82 F328	R60-V78 HydrophobicContact CG-CG1 4.36Å; F74-V78 HydrophobicContact CD1-CG2 4.13Å; F74-V78 HydrophobicContact CE1-CG2 3.61Å; F74-V78 HydrophobicContact CE2-CG2 4.04Å; F74-V78 HydrophobicContact CZ-CG2 3.57Å; F74-V78 WeakPolarHBondContact O-CG2 3.42Å; F74-V78 PolarHBondContact O-N 3.32Å; Y75-V78 PolarHBondContact O-N 2.94Å; S76-V78 PolarHBondContact O-N 3.46Å; V78-I81 PolarHBondContact O-N 2.96Å; V78-E82 PolarHBondContact O-N 2.75Å; V78-F328 HydrophobicContact CG2-CE1 4.14Å
79	T	83.3	Confident	77.3	Confident	30 Å²	30	57.4 Å²	57.4	18%	0.184	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-44.3	176.4	-62.8	0	0	0	0	111.7	R60 Y75 S76 I81 E82 E83	R60-T79 PolarHBondContact NH2-OG1 2.61Å; Y75-T79 PolarHBondContact O-N 3.32Å; Y75-T79 PolarHBondContact O-OG1 2.89Å; S76-T79 PolarHBondContact O-N 3.3Å; T79-I81 VanDerWaalsContact C-N 3.28Å; T79-I81 PolarHBondContact O-N 3.33Å; T79-E82 PolarHBondContact O-N 2.78Å; T79-E82 VanDerWaalsContact O-N 3.09Å; T79-E83 HydrophobicContact CG2-CG 4.39Å; T79-E83 WeakPolarHBondContact CG2-OE1 3.31Å; T79-E83 PolarHBondContact O-N 3.31Å; T79-E83 VanDerWaalsContact O-N 3.09Å
80	N	81.4	Confident	75.3	Confident	40 Å²	40	66.4 Å²	66.4	21%	0.214	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-38.5	180	-63.1	-9.5	0	0	0	111.9	S76 A77 E82 E83 D85 P87	S76-N80 PolarHBondContact O-N 3.15Å; S76-N80 PolarHBondContact O-ND2 3.28Å; S76-N80 PolarHBondContact O-OD1 3.46Å; A77-N80 PolarHBondContact O-N 2.9Å; N80-E82 VanDerWaalsContact C-N 3.32Å; N80-E82 PolarHBondContact O-N 3.15Å; N80-E83 PolarHBondContact O-N 2.94Å; N80-D85 PolarHBondContact O-N 3.27Å; N80-P87 HydrophobicContact CB-CG 3.75Å
81	I	78.1	Confident	73.6	Confident	48 Å²	48	72.7 Å²	72.7	25%	0.246	36%	0.362	C	S	.	.	H	α-helix	trans	-61	-40.6	175.5	-63.5	162	0	0	0	111.6	V54 A77 V78 T79 D84 L327 F328	V54-I81 HydrophobicContact CB-CG2 4.25Å; V54-I81 HydrophobicContact CG2-CG2 4.07Å; A77-I81 WeakPolarHBondContact O-CD1 3.38Å; A77-I81 VanDerWaalsContact O-CG1 3.23Å; A77-I81 WeakPolarHBondContact O-CG1 3.39Å; A77-I81 PolarHBondContact O-N 3.41Å; V78-I81 PolarHBondContact O-N 2.96Å; T79-I81 VanDerWaalsContact C-N 3.28Å; T79-I81 PolarHBondContact O-N 3.33Å; I81-D84 PolarHBondContact O-N 3.3Å; I81-L327 HydrophobicContact CD1-CB 3.83Å; I81-L327 HydrophobicContact CD1-CD1 3.64Å; I81-L327 HydrophobicContact CD1-CG 4.26Å; I81-L327 HydrophobicContact CG1-CB 4.41Å; I81-L327 HydrophobicContact CG1-CD1 3.95Å; I81-F328 HydrophobicContact CD1-CE1 4.05Å
82	E	74.9	Confident	72	Confident	93 Å²	93	78.7 Å²	78.7	44%	0.435	39%	0.385	S	S	.	.	H	α-helix	trans	-70.9	-32.3	-178.8	-71	171.9	176.8	0	0	112.5	S56 R60 V78 T79 N80 D84	S56-E82 WeakPolarHBondContact CB-OE1 3.22Å; S56-E82 PolarHBondContact OG-OE1 3.17Å; R60-E82 IonicContact CZ-OE1 2.75Å; R60-E82 IonicContact CZ-OE2 3.24Å; R60-E82 IonicContact NE-OE1 2.79Å; R60-E82 PolarHBondContact NE-OE1 2.94Å; R60-E82 VanDerWaalsContact NE-OE1 3.13Å; R60-E82 IonicContact NE-OE2 3.44Å; R60-E82 VanDerWaalsContact NH2-CD 3.31Å; R60-E82 IonicContact NH2-OE1 3.52Å; R60-E82 PolarHBondContact NH2-OE1 3.1Å; R60-E82 IonicContact NH2-OE2 2.8Å; R60-E82 PolarHBondContact NH2-OE2 3.25Å; V78-E82 PolarHBondContact O-N 2.75Å; T79-E82 PolarHBondContact O-N 2.78Å; T79-E82 VanDerWaalsContact O-N 3.09Å; N80-E82 VanDerWaalsContact C-N 3.32Å; N80-E82 PolarHBondContact O-N 3.15Å; E82-D84 PolarHBondContact O-N 3.39Å
83	E	75.4	Confident	70.9	Confident	133 Å²	133	78.6 Å²	78.6	62%	0.621	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.6	-179.5	-68.7	178.9	177.2	0	0	113	T79 N80 D85	T79-E83 HydrophobicContact CG2-CG 4.39Å; T79-E83 WeakPolarHBondContact CG2-OE1 3.31Å; T79-E83 PolarHBondContact O-N 3.31Å; T79-E83 VanDerWaalsContact O-N 3.09Å; N80-E83 PolarHBondContact O-N 2.94Å; E83-D85 HydrophobicContact CB-CB 4.47Å; E83-D85 PolarHBondContact O-N 2.04Å
84	D	65.7	Low	70.3	Confident	128 Å²	128	78.3 Å²	78.3	68%	0.684	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	16.8	-169.1	-159.9	35.1	0	0	0	113	I81 E82 N86	I81-D84 PolarHBondContact O-N 3.3Å; E82-D84 PolarHBondContact O-N 3.39Å; D84-N86 PolarHBondContact O-N 2.93Å; D84-N86 VanDerWaalsContact O-N 3.08Å
85	D	59.8	Low	69.3	Low	98 Å²	98	83.4 Å²	83.4	52%	0.524	43%	0.427	S	S	.	.			trans	-68.6	110	160.4	-160.9	10.7	0	0	0	102.9	N80 E83 P87	N80-D85 PolarHBondContact O-N 3.27Å; E83-D85 HydrophobicContact CB-CB 4.47Å; E83-D85 PolarHBondContact O-N 2.04Å; D85-P87 VanDerWaalsContact C-N 3.34Å; D85-P87 WeakPolarHBondContact O-CD 3.44Å
86	N	52.3	Low	68.5	Low	120 Å²	120	81.7 Å²	81.7	64%	0.642	43%	0.427	S	S	*	.			trans	-85.7	85	169.8	-170.7	6.4	0	0	0	104.4	D84 S88	D84-N86 PolarHBondContact O-N 2.93Å; D84-N86 VanDerWaalsContact O-N 3.08Å; N86-S88 PolarHBondContact O-N 3.41Å
87	P	48.1	Very low	67.9	Low	49 Å²	49	79.2 Å²	79.2	32%	0.318	41%	0.409	S	S	.	.			trans	-64.3	102.2	163.5	32.1	-33.5	0	0	0	101.5	N80 D85 R89	N80-P87 HydrophobicContact CB-CG 3.75Å; D85-P87 VanDerWaalsContact C-N 3.34Å; D85-P87 WeakPolarHBondContact O-CD 3.44Å; P87-R89 PolarHBondContact O-N 2.89Å
88	S	48.3	Very low	67	Low	101 Å²	101	84.1 Å²	84.1	71%	0.706	43%	0.43	S	S	*	.			trans	-50.8	88.5	142.2	15.1	0	0	0	0	102.8	N86 R90	N86-S88 PolarHBondContact O-N 3.41Å; S88-R90 VanDerWaalsContact C-N 3.31Å; S88-R90 PolarHBondContact O-N 3.07Å
89	R	54.2	Low	65.9	Low	79 Å²	79	91.8 Å²	91.8	30%	0.298	47%	0.465	S	S	.	.			trans	-46.4	112.5	168.3	-90	-170	176.1	174.9	2.9	101.3	P87 E91 L327 F328 P329	P87-R89 PolarHBondContact O-N 2.89Å; R89-E91 VanDerWaalsContact C-N 3.27Å; R89-E91 PolarHBondContact O-N 3.32Å; R89-L327 PolarHBondContact NH2-O 3.45Å; R89-F328 VanDerWaalsContact NH1-C 3.33Å; R89-F328 PolarHBondContact NH1-O 3.17Å; R89-F328 VanDerWaalsContact NH1-O 3.1Å; R89-P329 VanDerWaalsContact NH2-CD 3.33Å; R89-P329 VanDerWaalsContact NH2-N 3.17Å
90	R	53.1	Low	64.9	Low	203 Å²	203	92.8 Å²	92.8	77%	0.766	47%	0.468	S	S	*	.			trans	-49.1	103.8	-171.7	-76.9	179.7	-179.3	175	0.2	105.5	S88 Y92	S88-R90 VanDerWaalsContact C-N 3.31Å; S88-R90 PolarHBondContact O-N 3.07Å; R90-Y92 HydrophobicContact CB-CD2 4.4Å; R90-Y92 HydrophobicContact CB-CE2 3.96Å; R90-Y92 WeakPolarHBondContact O-CD2 3.43Å; R90-Y92 PolarHBondContact O-N 2.91Å
91	E	57	Low	64.2	Low	133 Å²	133	95.6 Å²	95.6	62%	0.621	48%	0.483	S	S	*	.			trans	-73.8	92.6	178.7	-87.6	-167.1	-161.1	0	0	102.8	R89 S130	R89-E91 VanDerWaalsContact C-N 3.27Å; R89-E91 PolarHBondContact O-N 3.32Å; E91-S130 PolarHBondContact OE2-OG 3.04Å
92	Y	60.4	Low	64.1	Low	127 Å²	127	96.2 Å²	96.2	50%	0.498	49%	0.485	S	S	.	.			trans	-58.6	134.8	173.9	-69.5	-84.8	0	0	0	106.7	R90 W94	R90-Y92 HydrophobicContact CB-CD2 4.4Å; R90-Y92 HydrophobicContact CB-CE2 3.96Å; R90-Y92 WeakPolarHBondContact O-CD2 3.43Å; R90-Y92 PolarHBondContact O-N 2.91Å; Y92-W94 PolarHBondContact O-N 3.46Å
93	P	69.8	Low	64.3	Low	82 Å²	82	96.2 Å²	96.2	53%	0.532	49%	0.485	S	S	.	.			trans	-46.5	137.1	173.1	-26.3	32.9	0	0	0	109.3	S95 A96 C97	P93-S95 PolarHBondContact O-N 3.33Å; P93-A96 HydrophobicContact CB-CB 4.38Å; P93-A96 CarbonylContact O-C 3.59Å; P93-A96 WeakPolarHBondContact O-CA 3.26Å; P93-A96 PolarHBondContact O-N 3Å; P93-C97 PolarHBondContact O-N 3.31Å
94	W	78.6	Confident	64.7	Low	41 Å²	41	93.2 Å²	93.2	16%	0.155	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-34.4	-178.9	176.3	-109.7	0	0	0	112.9	Y92 A96 C97 C128 P131 P132 D214 F215	Y92-W94 PolarHBondContact O-N 3.46Å; W94-A96 VanDerWaalsContact C-N 3.29Å; W94-A96 PolarHBondContact O-N 3.49Å; W94-C97 PolarHBondContact O-SG 3.39Å; W94-C128 HydrophobicContact CE3-CB 4.05Å; W94-C128 HydrophobicContact CH2-CB 4.23Å; W94-C128 HydrophobicContact CZ3-CB 3.54Å; W94-P131 HydrophobicContact CD2-CB 3.98Å; W94-P131 VanDerWaalsContact CE3-CA 3.45Å; W94-P131 HydrophobicContact CE3-CB 3.82Å; W94-P131 HydrophobicContact CH2-CB 3.8Å; W94-P131 HydrophobicContact CH2-CG 4.48Å; W94-P131 HydrophobicContact CZ2-CB 3.98Å; W94-P131 HydrophobicContact CZ3-CB 3.67Å; W94-P131 HydrophobicContact CZ3-CG 4.14Å; W94-P132 HydrophobicContact CG-CG 4.29Å; W94-D214 VanDerWaalsContact CE2-O 3.23Å; W94-D214 WeakPolarHBondContact CZ2-O 3.32Å; W94-D214 PolarHBondContact NE1-O 3.43Å; W94-D214 PolarHBondContact NE1-OD2 3.13Å; W94-F215 HydrophobicContact CH2-CB 3.82Å; W94-F215 HydrophobicContact CZ2-CB 4.22Å
95	S	70.2	Confident	65.7	Low	111 Å²	111	87.1 Å²	87.1	78%	0.776	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.5	175.9	51.9	0	0	0	0	114.8	P93	P93-S95 PolarHBondContact O-N 3.33Å
96	A	70.2	Confident	66.9	Low	32 Å²	32	86.8 Å²	86.8	26%	0.264	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-9.7	-174.8	0	0	0	0	0	113.6	P93 W94 K98 E99	P93-A96 HydrophobicContact CB-CB 4.38Å; P93-A96 CarbonylContact O-C 3.59Å; P93-A96 WeakPolarHBondContact O-CA 3.26Å; P93-A96 PolarHBondContact O-N 3Å; W94-A96 VanDerWaalsContact C-N 3.29Å; W94-A96 PolarHBondContact O-N 3.49Å; A96-K98 VanDerWaalsContact C-N 3.27Å; A96-K98 PolarHBondContact O-N 3.36Å; A96-E99 WeakPolarHBondContact O-CB 3.24Å; A96-E99 PolarHBondContact O-N 3.1Å
97	C	75.4	Confident	68.6	Low	8 Å²	8	87.4 Å²	87.4	5%	0.054	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.8	-172.8	70.7	0	0	0	0	113.7	P93 W94 E99 C128	P93-C97 PolarHBondContact O-N 3.31Å; W94-C97 PolarHBondContact O-SG 3.39Å; C97-E99 PolarHBondContact O-N 2.93Å; C97-C128 HydrophobicContact CB-CB 3.9Å; C97-C128 WeakPolarHBondContact CB-SG 3.39Å; C97-C128 PolarHBondContact O-SG 2.75Å; C97-C128 VanDerWaalsContact SG-CA 3.52Å; C97-C128 WeakPolarHBondContact SG-CB 3.45Å; C97-C128 CovalentContact SG-SG 2.03Å; C97-C128 PolarHBondContact SG-SG 2.93Å
98	K	66.5	Low	70.5	Confident	109 Å²	109	88 Å²	88	47%	0.474	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-0.1	179	-66.3	-174.6	-177.7	174.3	0	112.8	A96 E100 C128	A96-K98 VanDerWaalsContact C-N 3.27Å; A96-K98 PolarHBondContact O-N 3.36Å; K98-E100 PolarHBondContact O-N 2.94Å; K98-C128 WeakPolarHBondContact CG-SG 3.37Å; K98-C128 PolarHBondContact N-SG 2.89Å
99	E	61	Low	72.5	Confident	162 Å²	162	83.2 Å²	83.2	76%	0.757	40%	0.403	S	S	*	.			trans	-87	42.1	177.9	-60	-175	172.9	0	0	111.9	A96 C97 N101	A96-E99 WeakPolarHBondContact O-CB 3.24Å; A96-E99 PolarHBondContact O-N 3.1Å; C97-E99 PolarHBondContact O-N 2.93Å; E99-N101 PolarHBondContact O-N 3.06Å
100	E	63.2	Low	74.1	Confident	51 Å²	51	87 Å²	87	24%	0.238	42%	0.424	C	S	.	.			trans	-70.2	118.9	160.8	-85.3	-168.4	172.1	0	0	108.8	K98 Q102 N127	K98-E100 PolarHBondContact O-N 2.94Å; E100-Q102 PolarHBondContact O-N 3.3Å; E100-Q102 VanDerWaalsContact O-N 3.1Å; E100-N127 PolarHBondContact OE1-ND2 2.81Å
101	N	66.6	Low	76	Confident	99 Å²	99	79.3 Å²	79.3	53%	0.529	40%	0.398	S	S	.	.			trans	-58.5	119.8	173.9	-177.1	-8.1	0	0	0	108.1	E99 E103 V104 L105	E99-N101 PolarHBondContact O-N 3.06Å; N101-E103 PolarHBondContact O-N 3.06Å; N101-E103 WeakPolarHBondContact OD1-CB 3.45Å; N101-E103 WeakPolarHBondContact OD1-CG 3Å; N101-E103 PolarHBondContact OD1-N 2.7Å; N101-V104 HydrophobicContact CB-CG2 4.12Å; N101-V104 WeakPolarHBondContact O-CA 3.39Å; N101-V104 WeakPolarHBondContact O-CB 3.31Å; N101-V104 PolarHBondContact O-N 3.15Å; N101-L105 PolarHBondContact O-N 3.27Å
102	Q	74.8	Confident	77.7	Confident	62 Å²	62	73 Å²	73	29%	0.29	37%	0.369	S	S	.	.	H	α-helix	trans	-50.9	-28.5	177.7	-177.3	166.4	-16.9	0	0	112.1	E100 L105 R106 F112	E100-Q102 PolarHBondContact O-N 3.3Å; E100-Q102 VanDerWaalsContact O-N 3.1Å; Q102-L105 PolarHBondContact O-N 3.02Å; Q102-R106 WeakPolarHBondContact O-CG 3.4Å; Q102-R106 PolarHBondContact O-N 3.16Å; Q102-F112 HydrophobicContact CG-CE1 4.17Å
103	E	80.2	Confident	79.3	Confident	93 Å²	93	71 Å²	71	44%	0.435	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-39	173	-61.5	-55.9	125.9	0	0	113	N101 L105 R106 I107	N101-E103 PolarHBondContact O-N 3.06Å; N101-E103 WeakPolarHBondContact OD1-CB 3.45Å; N101-E103 WeakPolarHBondContact OD1-CG 3Å; N101-E103 PolarHBondContact OD1-N 2.7Å; E103-L105 VanDerWaalsContact C-N 3.34Å; E103-L105 PolarHBondContact O-N 2.84Å; E103-R106 PolarHBondContact O-N 2.96Å; E103-R106 IonicContact OE1-NH1 2.69Å; E103-R106 PolarHBondContact OE1-NH1 3.45Å; E103-I107 WeakPolarHBondContact O-CB 3.48Å; E103-I107 WeakPolarHBondContact O-CD1 3.28Å; E103-I107 WeakPolarHBondContact O-CG1 3.2Å; E103-I107 PolarHBondContact O-N 2.88Å
104	V	83.3	Confident	80.4	Confident	70 Å²	70	70.3 Å²	70.3	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-40.8	176.1	176.1	0	0	0	0	110.8	N101 I107 N108	N101-V104 HydrophobicContact CB-CG2 4.12Å; N101-V104 WeakPolarHBondContact O-CA 3.39Å; N101-V104 WeakPolarHBondContact O-CB 3.31Å; N101-V104 PolarHBondContact O-N 3.15Å; V104-I107 PolarHBondContact O-N 2.68Å; V104-N108 PolarHBondContact O-N 3.08Å; V104-N108 PolarHBondContact O-ND2 2.85Å
105	L	86.4	Confident	81.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-65.5	-44.2	175.1	-74.3	174.1	0	0	0	111.2	Y69 N101 Q102 E103 I107 N108 V109 F112 L123 K124	Y69-L105 HydrophobicContact CE1-CD2 4.48Å; N101-L105 PolarHBondContact O-N 3.27Å; Q102-L105 PolarHBondContact O-N 3.02Å; E103-L105 VanDerWaalsContact C-N 3.34Å; E103-L105 PolarHBondContact O-N 2.84Å; L105-I107 VanDerWaalsContact C-N 3.33Å; L105-I107 PolarHBondContact O-N 3.46Å; L105-N108 CarbonylContact O-C 3.23Å; L105-N108 PolarHBondContact O-N 2.76Å; L105-N108 VanDerWaalsContact O-N 3.14Å; L105-V109 WeakPolarHBondContact O-CA 2.98Å; L105-V109 WeakPolarHBondContact O-CB 3.31Å; L105-V109 PolarHBondContact O-N 2.75Å; L105-F112 HydrophobicContact CB-CD2 4.43Å; L105-F112 HydrophobicContact CB-CE2 4.5Å; L105-F112 HydrophobicContact CD1-CE2 4.09Å; L105-F112 HydrophobicContact CD1-CZ 4.21Å; L105-L123 HydrophobicContact CD1-CB 4.45Å; L105-K124 HydrophobicContact CD1-CG 3.87Å
106	R	86.3	Confident	82.3	Confident	90 Å²	90	65 Å²	65	34%	0.34	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-37.4	176.5	-75.7	171.9	167.9	167.6	-2.5	113.4	Q102 E103 N108 V109 F112 D113	Q102-R106 WeakPolarHBondContact O-CG 3.4Å; Q102-R106 PolarHBondContact O-N 3.16Å; E103-R106 PolarHBondContact O-N 2.96Å; E103-R106 IonicContact OE1-NH1 2.69Å; E103-R106 PolarHBondContact OE1-NH1 3.45Å; R106-N108 VanDerWaalsContact C-N 3.31Å; R106-N108 PolarHBondContact O-N 3.43Å; R106-V109 CarbonylContact O-C 3.58Å; R106-F112 HydrophobicContact CG-CD1 4.34Å; R106-D113 IonicContact CZ-OD1 3.44Å; R106-D113 IonicContact CZ-OD2 3.51Å; R106-D113 IonicContact NE-OD1 3.13Å; R106-D113 PolarHBondContact NE-OD1 2.75Å; R106-D113 IonicContact NE-OD2 2.7Å; R106-D113 PolarHBondContact NE-OD2 2.69Å; R106-D113 IonicContact NH2-OD1 3.65Å; R106-D113 PolarHBondContact NH2-OD1 3.19Å; R106-D113 IonicContact NH2-OD2 3.7Å; R106-D113 PolarHBondContact NH2-OD2 3.14Å
107	I	86.7	Confident	83.4	Confident	134 Å²	134	68.3 Å²	68.3	69%	0.687	35%	0.35	S	S	*	.	H	α-helix	trans	-64.2	-39.3	175	-70.4	162.9	0	0	0	110.8	E103 V104 L105	E103-I107 WeakPolarHBondContact O-CB 3.48Å; E103-I107 WeakPolarHBondContact O-CD1 3.28Å; E103-I107 WeakPolarHBondContact O-CG1 3.2Å; E103-I107 PolarHBondContact O-N 2.88Å; V104-I107 PolarHBondContact O-N 2.68Å; L105-I107 VanDerWaalsContact C-N 3.33Å; L105-I107 PolarHBondContact O-N 3.46Å
108	N	88	Confident	84.3	Confident	61 Å²	61	72 Å²	72	33%	0.326	37%	0.369	S	S	.	.	H	α-helix	trans	-90.9	-21.1	-174.4	-78.8	-76.1	0	0	0	114.4	Y69 R72 V104 L105 R106	Y69-N108 HydrophobicContact CD2-CB 3.72Å; Y69-N108 HydrophobicContact CE2-CB 3.73Å; R72-N108 PolarHBondContact NH2-O 2.78Å; R72-N108 PolarHBondContact NH2-OD1 2.94Å; V104-N108 PolarHBondContact O-N 3.08Å; V104-N108 PolarHBondContact O-ND2 2.85Å; L105-N108 CarbonylContact O-C 3.23Å; L105-N108 PolarHBondContact O-N 2.76Å; L105-N108 VanDerWaalsContact O-N 3.14Å; R106-N108 VanDerWaalsContact C-N 3.31Å; R106-N108 PolarHBondContact O-N 3.43Å
109	V	91.2	Very high	85.6	Confident	1 Å²	1	67 Å²	67	1%	0.006	35%	0.347	C	S	.	.			trans	-134.9	88.3	-177.6	-172.5	0	0	0	0	107.5	Y69 L105 R106 D111 F112 Y115	Y69-V109 HydrophobicContact CD1-CG2 3.8Å; Y69-V109 HydrophobicContact CD2-CG2 3.99Å; Y69-V109 HydrophobicContact CE1-CG2 4.43Å; Y69-V109 HydrophobicContact CG-CG2 3.53Å; L105-V109 WeakPolarHBondContact O-CA 2.98Å; L105-V109 WeakPolarHBondContact O-CB 3.31Å; L105-V109 PolarHBondContact O-N 2.75Å; R106-V109 CarbonylContact O-C 3.58Å; V109-D111 PolarHBondContact O-N 2.6Å; V109-D111 VanDerWaalsContact O-N 3.15Å; V109-F112 HydrophobicContact CB-CB 4.16Å; V109-F112 HydrophobicContact CG1-CB 4.09Å; V109-F112 VanDerWaalsContact O-CB 3.24Å; V109-F112 WeakPolarHBondContact O-CB 3.45Å; V109-F112 PolarHBondContact O-N 3.47Å; V109-F112 VanDerWaalsContact O-N 3.07Å; V109-Y115 HydrophobicContact CG1-CE2 3.67Å; V109-Y115 WeakPolarHBondContact CG1-OH 3.32Å
110	H	87.9	Confident	87.1	Confident	158 Å²	158	61.1 Å²	61.1	73%	0.731	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.7	-169.7	59.2	-90.8	0	0	0	114.5	T296	H110-T296 WeakPolarHBondContact CE1-CG2 3.12Å
111	D	92.7	Very high	88.5	Confident	42 Å²	42	63.3 Å²	63.3	23%	0.225	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	19.4	179.1	67.1	-27.5	0	0	0	112.8	V109 D113 S114 Y115 T296	V109-D111 PolarHBondContact O-N 2.6Å; V109-D111 VanDerWaalsContact O-N 3.15Å; D111-D113 VanDerWaalsContact C-N 3.29Å; D111-D113 PolarHBondContact O-N 3.28Å; D111-S114 WeakPolarHBondContact O-CB 3.44Å; D111-S114 PolarHBondContact O-N 2.83Å; D111-S114 PolarHBondContact O-OG 3.29Å; D111-Y115 WeakPolarHBondContact OD1-CE1 3.27Å; D111-Y115 PolarHBondContact OD1-OH 3.15Å; D111-Y115 WeakPolarHBondContact OD2-CE1 3.38Å; D111-T296 WeakPolarHBondContact OD1-CB 3.34Å; D111-T296 PolarHBondContact OD1-OG1 3.26Å; D111-T296 PolarHBondContact OD2-OG1 2.75Å
112	F	92.8	Very high	89.8	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-49.4	-45.7	-178.5	175.1	-101.6	0	0	0	113.6	Q102 L105 R106 V109 S114 Y115 Q120 L123 K124	Q102-F112 HydrophobicContact CG-CE1 4.17Å; L105-F112 HydrophobicContact CB-CD2 4.43Å; L105-F112 HydrophobicContact CB-CE2 4.5Å; L105-F112 HydrophobicContact CD1-CE2 4.09Å; L105-F112 HydrophobicContact CD1-CZ 4.21Å; R106-F112 HydrophobicContact CG-CD1 4.34Å; V109-F112 HydrophobicContact CB-CB 4.16Å; V109-F112 HydrophobicContact CG1-CB 4.09Å; V109-F112 VanDerWaalsContact O-CB 3.24Å; V109-F112 WeakPolarHBondContact O-CB 3.45Å; V109-F112 PolarHBondContact O-N 3.47Å; V109-F112 VanDerWaalsContact O-N 3.07Å; F112-S114 PolarHBondContact O-N 2.87Å; F112-Y115 HydrophobicContact CD2-CD2 4.41Å; F112-Y115 WeakPolarHBondContact O-CB 3.42Å; F112-Y115 PolarHBondContact O-N 3.35Å; F112-Y115 VanDerWaalsContact O-N 3.11Å; F112-Q120 HydrophobicContact CE1-CB 4.4Å; F112-Q120 HydrophobicContact CE1-CG 4.34Å; F112-Q120 HydrophobicContact CE2-CB 4.06Å; F112-Q120 HydrophobicContact CE2-CG 4.21Å; F112-Q120 HydrophobicContact CZ-CB 3.72Å; F112-Q120 HydrophobicContact CZ-CG 4.02Å; F112-L123 HydrophobicContact CD2-CD1 3.79Å; F112-L123 HydrophobicContact CE2-CB 3.95Å; F112-L123 HydrophobicContact CE2-CD1 3.85Å; F112-K124 HydrophobicContact CZ-CG 4.28Å
113	D	92.6	Very high	90.6	Very high	84 Å²	84	56 Å²	56	45%	0.449	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.3	-177.6	-63.9	-56.6	0	0	0	112.7	R106 D111	R106-D113 IonicContact CZ-OD1 3.44Å; R106-D113 IonicContact CZ-OD2 3.51Å; R106-D113 IonicContact NE-OD1 3.13Å; R106-D113 PolarHBondContact NE-OD1 2.75Å; R106-D113 IonicContact NE-OD2 2.7Å; R106-D113 PolarHBondContact NE-OD2 2.69Å; R106-D113 IonicContact NH2-OD1 3.65Å; R106-D113 PolarHBondContact NH2-OD1 3.19Å; R106-D113 IonicContact NH2-OD2 3.7Å; R106-D113 PolarHBondContact NH2-OD2 3.14Å; D111-D113 VanDerWaalsContact C-N 3.29Å; D111-D113 PolarHBondContact O-N 3.28Å
114	S	93.4	Very high	91	Very high	68 Å²	68	55 Å²	55	48%	0.476	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-85.6	-11.5	174.9	80.6	0	0	0	0	113.8	D111 F112	D111-S114 WeakPolarHBondContact O-CB 3.44Å; D111-S114 PolarHBondContact O-N 2.83Å; D111-S114 PolarHBondContact O-OG 3.29Å; F112-S114 PolarHBondContact O-N 2.87Å
115	Y	94.7	Very high	91.3	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.02	28%	0.282	C	S	.	.	S	Bend	trans	-71.2	153.6	-178.5	-69.3	-2.7	0	0	0	111.8	V109 D111 F112 F119 Q120 L123 P294 T296 F297	V109-Y115 HydrophobicContact CG1-CE2 3.67Å; V109-Y115 WeakPolarHBondContact CG1-OH 3.32Å; D111-Y115 WeakPolarHBondContact OD1-CE1 3.27Å; D111-Y115 PolarHBondContact OD1-OH 3.15Å; D111-Y115 WeakPolarHBondContact OD2-CE1 3.38Å; F112-Y115 HydrophobicContact CD2-CD2 4.41Å; F112-Y115 WeakPolarHBondContact O-CB 3.42Å; F112-Y115 PolarHBondContact O-N 3.35Å; F112-Y115 VanDerWaalsContact O-N 3.11Å; Y115-F119 AromaticContact CD2-CD1 3.64Å; Y115-F119 HydrophobicContact CD2-CD1 3.64Å; Y115-F119 HydrophobicContact CD2-CE1 4.21Å; Y115-F119 HydrophobicContact CD2-CG 4.47Å; Y115-F119 HydrophobicContact CE2-CD1 4.06Å; Y115-F119 HydrophobicContact CE2-CE1 4.15Å; Y115-F119 HydrophobicContact CG-CD1 4.44Å; Y115-Q120 PolarHBondContact O-NE2 3.07Å; Y115-L123 HydrophobicContact CD2-CD1 3.82Å; Y115-L123 HydrophobicContact CE2-CD1 3.64Å; Y115-P294 HydrophobicContact CD1-CB 3.98Å; Y115-P294 HydrophobicContact CD1-CG 3.7Å; Y115-P294 HydrophobicContact CD2-CG 4.05Å; Y115-P294 HydrophobicContact CE1-CB 3.23Å; Y115-P294 HydrophobicContact CE1-CG 3.41Å; Y115-P294 VanDerWaalsContact CE1-CG 3.41Å; Y115-P294 HydrophobicContact CE2-CB 4.18Å; Y115-P294 HydrophobicContact CE2-CG 3.79Å; Y115-P294 HydrophobicContact CG-CG 4Å; Y115-P294 VanDerWaalsContact CZ-CG 3.45Å; Y115-P294 WeakPolarHBondContact OH-CB 3.3Å; Y115-T296 PolarHBondContact OH-OG1 3.24Å; Y115-F297 HydrophobicContact CE2-CB 4.41Å; Y115-F297 PolarHBondContact OH-N 3.37Å; Y115-F297 VanDerWaalsContact OH-N 3.17Å
116	P	95.4	Very high	91.5	Very high	36 Å²	36	52.6 Å²	52.6	23%	0.234	28%	0.283	C	S	.	.			trans	-54.6	143.1	170.1	-26	35.2	0	0	0	111.8	L118 F119 Q120 Y292	P116-L118 PolarHBondContact O-N 3.48Å; P116-L118 VanDerWaalsContact O-N 3.12Å; P116-F119 WeakPolarHBondContact O-CA 3.13Å; P116-F119 WeakPolarHBondContact O-CB 3.03Å; P116-F119 PolarHBondContact O-N 3.47Å; P116-Q120 PolarHBondContact O-N 3.1Å; P116-Q120 VanDerWaalsContact O-N 3.1Å; P116-Y292 HydrophobicContact CG-CD1 3.86Å; P116-Y292 HydrophobicContact CG-CE1 3.96Å
117	P	93.3	Very high	91.5	Very high	101 Å²	101	50.9 Å²	50.9	66%	0.656	28%	0.28	S	S	*	.	H	α-helix	trans	-53	-39	-176.2	-30	35.4	0	0	0	114.2	F119 Q120 T121	P117-F119 VanDerWaalsContact C-N 3.29Å; P117-F119 PolarHBondContact O-N 3.25Å; P117-Q120 PolarHBondContact O-N 3.12Å; P117-T121 PolarHBondContact O-N 3.4Å; P117-T121 PolarHBondContact O-OG1 3.39Å
118	L	92.5	Very high	91.6	Very high	85 Å²	85	44.6 Å²	44.6	45%	0.445	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-39.1	177	-172.8	63.3	0	0	0	112.3	P116 T121 Y122 L220	P116-L118 PolarHBondContact O-N 3.48Å; P116-L118 VanDerWaalsContact O-N 3.12Å; L118-T121 PolarHBondContact O-N 3.43Å; L118-Y122 PolarHBondContact O-N 2.85Å; L118-L220 HydrophobicContact CB-CD1 4.47Å; L118-L220 HydrophobicContact CD2-CD1 4.23Å; L118-L220 HydrophobicContact CD2-CG 4.11Å; L118-L220 HydrophobicContact CG-CD1 3.82Å; L118-L220 HydrophobicContact CG-CG 4.12Å
119	F	94.9	Very high	91.7	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.022	24%	0.238	C	C	.	.	H	α-helix	trans	-73.2	-37.4	179.3	-152.7	-75.1	0	0	0	111.7	Y115 P116 P117 T121 Y122 L123 L220 I293 P294 F297 P332	Y115-F119 AromaticContact CD2-CD1 3.64Å; Y115-F119 HydrophobicContact CD2-CD1 3.64Å; Y115-F119 HydrophobicContact CD2-CE1 4.21Å; Y115-F119 HydrophobicContact CD2-CG 4.47Å; Y115-F119 HydrophobicContact CE2-CD1 4.06Å; Y115-F119 HydrophobicContact CE2-CE1 4.15Å; Y115-F119 HydrophobicContact CG-CD1 4.44Å; P116-F119 WeakPolarHBondContact O-CA 3.13Å; P116-F119 WeakPolarHBondContact O-CB 3.03Å; P116-F119 PolarHBondContact O-N 3.47Å; P117-F119 VanDerWaalsContact C-N 3.29Å; P117-F119 PolarHBondContact O-N 3.25Å; F119-T121 VanDerWaalsContact C-N 3.33Å; F119-Y122 HydrophobicContact CE1-CD1 4.48Å; F119-Y122 WeakPolarHBondContact O-CB 3.34Å; F119-Y122 PolarHBondContact O-N 2.75Å; F119-L123 HydrophobicContact CD1-CD1 3.99Å; F119-L123 HydrophobicContact CD1-CG 4.07Å; F119-L123 HydrophobicContact CE1-CD1 4.02Å; F119-L123 HydrophobicContact CE1-CD2 4.43Å; F119-L123 HydrophobicContact CE1-CG 4.02Å; F119-L123 PolarHBondContact O-N 3.24Å; F119-L220 HydrophobicContact CB-CD1 4.26Å; F119-L220 HydrophobicContact CD2-CD1 3.95Å; F119-L220 HydrophobicContact CG-CD1 4.33Å; F119-I293 HydrophobicContact CE2-CD1 4.04Å; F119-P294 HydrophobicContact CD1-CG 4.34Å; F119-P294 HydrophobicContact CE1-CG 4.13Å; F119-P294 HydrophobicContact CE2-CG 4.47Å; F119-P294 HydrophobicContact CZ-CG 4.2Å; F119-F297 HydrophobicContact CE1-CB 4.17Å; F119-F297 HydrophobicContact CE1-CD1 4.18Å; F119-F297 AromaticContact CE1-CD2 3.83Å; F119-F297 HydrophobicContact CE1-CD2 3.83Å; F119-F297 HydrophobicContact CE1-CE2 4.25Å; F119-F297 AromaticContact CE1-CG 3.77Å; F119-F297 HydrophobicContact CE1-CG 3.77Å; F119-F297 HydrophobicContact CZ-CB 4.28Å; F119-F297 AromaticContact CZ-CD1 3.63Å; F119-F297 HydrophobicContact CZ-CD1 3.63Å; F119-F297 HydrophobicContact CZ-CD2 4.09Å; F119-F297 AromaticContact CZ-CE1 3.9Å; F119-F297 HydrophobicContact CZ-CE1 3.9Å; F119-F297 HydrophobicContact CZ-CE2 4.34Å; F119-F297 AromaticContact CZ-CG 3.71Å; F119-F297 HydrophobicContact CZ-CG 3.71Å; F119-F297 HydrophobicContact CZ-CZ 4.25Å; F119-P332 HydrophobicContact CE2-CB 4.35Å; F119-P332 HydrophobicContact CE2-CG 3.99Å; F119-P332 HydrophobicContact CZ-CG 4.01Å
120	Q	93.1	Very high	91.6	Very high	37 Å²	37	45.1 Å²	45.1	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-45.3	172.1	-63.1	-176.9	31.6	0	0	111	F112 Y115 P116 P117 L123 K124	F112-Q120 HydrophobicContact CE1-CB 4.4Å; F112-Q120 HydrophobicContact CE1-CG 4.34Å; F112-Q120 HydrophobicContact CE2-CB 4.06Å; F112-Q120 HydrophobicContact CE2-CG 4.21Å; F112-Q120 HydrophobicContact CZ-CB 3.72Å; F112-Q120 HydrophobicContact CZ-CG 4.02Å; Y115-Q120 PolarHBondContact O-NE2 3.07Å; P116-Q120 PolarHBondContact O-N 3.1Å; P116-Q120 VanDerWaalsContact O-N 3.1Å; P117-Q120 PolarHBondContact O-N 3.12Å; Q120-L123 PolarHBondContact O-N 3.47Å; Q120-K124 WeakPolarHBondContact O-CG 3.44Å; Q120-K124 PolarHBondContact O-N 3.22Å; Q120-K124 VanDerWaalsContact O-N 3.11Å
121	T	91.4	Very high	91.9	Very high	98 Å²	98	38 Å²	38	60%	0.601	22%	0.22	S	C	*	.	H	α-helix	trans	-62.3	-42.2	176	-62.2	0	0	0	0	111.9	P117 L118 F119 K124 G125	P117-T121 PolarHBondContact O-N 3.4Å; P117-T121 PolarHBondContact O-OG1 3.39Å; L118-T121 PolarHBondContact O-N 3.43Å; F119-T121 VanDerWaalsContact C-N 3.33Å; T121-K124 PolarHBondContact O-N 2.92Å; T121-G125 PolarHBondContact O-N 3.32Å
122	Y	93.2	Very high	92	Very high	5 Å²	5	38.9 Å²	38.9	2%	0.02	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-49.5	174.3	167.8	-96.9	0	0	0	111.5	L118 F119 K124 G125 M126 L220 F297 L330 F331 P332	L118-Y122 PolarHBondContact O-N 2.85Å; F119-Y122 HydrophobicContact CE1-CD1 4.48Å; F119-Y122 WeakPolarHBondContact O-CB 3.34Å; F119-Y122 PolarHBondContact O-N 2.75Å; Y122-K124 PolarHBondContact O-N 3.36Å; Y122-G125 CarbonylContact O-C 3.59Å; Y122-G125 PolarHBondContact O-N 3.42Å; Y122-G125 VanDerWaalsContact O-N 3.09Å; Y122-M126 HydrophobicContact CE1-CB 4.39Å; Y122-M126 HydrophobicContact CE1-CG 4.03Å; Y122-M126 HydrophobicContact CE1-SD 3.82Å; Y122-M126 WeakPolarHBondContact O-CA 3.36Å; Y122-M126 PolarHBondContact O-N 3.44Å; Y122-L220 HydrophobicContact CD2-CB 3.66Å; Y122-L220 VanDerWaalsContact CD2-O 3.31Å; Y122-L220 WeakPolarHBondContact CD2-O 3.47Å; Y122-L220 HydrophobicContact CE2-CB 4.41Å; Y122-L220 WeakPolarHBondContact CE2-O 3.38Å; Y122-L220 HydrophobicContact CG-CB 3.93Å; Y122-L220 HydrophobicContact CG-CD1 4.23Å; Y122-F297 HydrophobicContact CE1-CE2 4.38Å; Y122-F297 HydrophobicContact CE1-CZ 4.19Å; Y122-L330 PolarHBondContact OH-O 2.8Å; Y122-F331 VanDerWaalsContact OH-C 3.25Å; Y122-F331 WeakPolarHBondContact OH-CA 3.43Å; Y122-F331 PolarHBondContact OH-N 3.19Å; Y122-P332 HydrophobicContact CD1-CB 4.2Å; Y122-P332 HydrophobicContact CD2-CB 4.45Å; Y122-P332 HydrophobicContact CE1-CB 3.86Å; Y122-P332 HydrophobicContact CE1-CG 4.12Å; Y122-P332 HydrophobicContact CE2-CB 4.09Å; Y122-P332 HydrophobicContact CG-CB 4.5Å; Y122-P332 WeakPolarHBondContact OH-CD 3.45Å
123	L	92.4	Very high	92.2	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-44.5	-178.9	-80.5	178.8	0	0	0	113	Y69 L105 F112 Y115 F119 Q120 G125 M126 F297	Y69-L123 HydrophobicContact CD1-CD2 4.3Å; Y69-L123 HydrophobicContact CE1-CD2 4.11Å; L105-L123 HydrophobicContact CD1-CB 4.45Å; F112-L123 HydrophobicContact CD2-CD1 3.79Å; F112-L123 HydrophobicContact CE2-CB 3.95Å; F112-L123 HydrophobicContact CE2-CD1 3.85Å; Y115-L123 HydrophobicContact CD2-CD1 3.82Å; Y115-L123 HydrophobicContact CE2-CD1 3.64Å; F119-L123 HydrophobicContact CD1-CD1 3.99Å; F119-L123 HydrophobicContact CD1-CG 4.07Å; F119-L123 HydrophobicContact CE1-CD1 4.02Å; F119-L123 HydrophobicContact CE1-CD2 4.43Å; F119-L123 HydrophobicContact CE1-CG 4.02Å; F119-L123 PolarHBondContact O-N 3.24Å; Q120-L123 PolarHBondContact O-N 3.47Å; L123-G125 PolarHBondContact O-N 2.82Å; L123-G125 VanDerWaalsContact O-N 3.16Å; L123-M126 HydrophobicContact CD2-CE 4.41Å; L123-M126 HydrophobicContact CD2-SD 4.13Å; L123-M126 WeakPolarHBondContact O-CB 3.24Å; L123-M126 PolarHBondContact O-N 2.79Å; L123-M126 VanDerWaalsContact O-N 3.16Å; L123-F297 HydrophobicContact CD2-CD2 3.73Å; L123-F297 HydrophobicContact CD2-CE2 3.55Å
124	K	89.8	Confident	92.4	Very high	72 Å²	72	42.2 Å²	42.2	31%	0.313	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-27.3	176.2	-69.8	175.9	-178.8	-172.5	0	113.3	L105 F112 Q120 T121 Y122	L105-K124 HydrophobicContact CD1-CG 3.87Å; F112-K124 HydrophobicContact CZ-CG 4.28Å; Q120-K124 WeakPolarHBondContact O-CG 3.44Å; Q120-K124 PolarHBondContact O-N 3.22Å; Q120-K124 VanDerWaalsContact O-N 3.11Å; T121-K124 PolarHBondContact O-N 2.92Å; Y122-K124 PolarHBondContact O-N 3.36Å
125	G	88.9	Confident	92.6	Very high	19 Å²	19	40.1 Å²	40.1	20%	0.196	23%	0.228	C	C	.	.	H	α-helix	trans	-106.1	1.1	179.7	0	0	0	0	0	114.6	T121 Y122 L123 N127 C128	T121-G125 PolarHBondContact O-N 3.32Å; Y122-G125 CarbonylContact O-C 3.59Å; Y122-G125 PolarHBondContact O-N 3.42Å; Y122-G125 VanDerWaalsContact O-N 3.09Å; L123-G125 PolarHBondContact O-N 2.82Å; L123-G125 VanDerWaalsContact O-N 3.16Å; G125-N127 PolarHBondContact O-N 3.15Å; G125-N127 VanDerWaalsContact O-N 3.14Å; G125-C128 VanDerWaalsContact O-CB 3.22Å; G125-C128 WeakPolarHBondContact O-CB 3.21Å; G125-C128 PolarHBondContact O-N 3.25Å
126	M	90	Very high	92.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.3	-168.3	-173.4	-179.7	67.8	0	0	112.7	Y69 L73 Y122 L123 F297 L330	Y69-M126 HydrophobicContact CE1-CE 3.68Å; L73-M126 HydrophobicContact CD1-CE 3.51Å; Y122-M126 HydrophobicContact CE1-CB 4.39Å; Y122-M126 HydrophobicContact CE1-CG 4.03Å; Y122-M126 HydrophobicContact CE1-SD 3.82Å; Y122-M126 WeakPolarHBondContact O-CA 3.36Å; Y122-M126 PolarHBondContact O-N 3.44Å; L123-M126 HydrophobicContact CD2-CE 4.41Å; L123-M126 HydrophobicContact CD2-SD 4.13Å; L123-M126 WeakPolarHBondContact O-CB 3.24Å; L123-M126 PolarHBondContact O-N 2.79Å; L123-M126 VanDerWaalsContact O-N 3.16Å; M126-F297 HydrophobicContact SD-CE2 4.12Å; M126-F297 HydrophobicContact SD-CZ 4.45Å; M126-L330 HydrophobicContact CG-CB 4.07Å
127	N	86.7	Confident	92.9	Very high	54 Å²	54	42.5 Å²	42.5	29%	0.289	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-3.1	177.9	-70.7	-33.5	0	0	0	113.7	E100 G125 R129	E100-N127 PolarHBondContact OE1-ND2 2.81Å; G125-N127 PolarHBondContact O-N 3.15Å; G125-N127 VanDerWaalsContact O-N 3.14Å; N127-R129 PolarHBondContact O-N 3.44Å
128	C	89	Confident	93	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.02	23%	0.225	C	C	.	.			trans	-81.7	95.6	172.9	-73.4	0	0	0	0	111.5	W94 C97 K98 G125	W94-C128 HydrophobicContact CE3-CB 4.05Å; W94-C128 HydrophobicContact CH2-CB 4.23Å; W94-C128 HydrophobicContact CZ3-CB 3.54Å; C97-C128 HydrophobicContact CB-CB 3.9Å; C97-C128 WeakPolarHBondContact CB-SG 3.39Å; C97-C128 PolarHBondContact O-SG 2.75Å; C97-C128 VanDerWaalsContact SG-CA 3.52Å; C97-C128 WeakPolarHBondContact SG-CB 3.45Å; C97-C128 CovalentContact SG-SG 2.03Å; C97-C128 PolarHBondContact SG-SG 2.93Å; K98-C128 WeakPolarHBondContact CG-SG 3.37Å; K98-C128 PolarHBondContact N-SG 2.89Å; G125-C128 VanDerWaalsContact O-CB 3.22Å; G125-C128 WeakPolarHBondContact O-CB 3.21Å; G125-C128 PolarHBondContact O-N 3.25Å
129	R	89.1	Confident	93.1	Very high	30 Å²	30	42.6 Å²	42.6	11%	0.113	23%	0.234	C	C	.	.			trans	-115.9	1.5	-170.3	-58.2	-173.6	72.6	178.9	15.6	115.9	N127 P131 D227 M228 S325 K326 F328 L330 Y337	N127-R129 PolarHBondContact O-N 3.44Å; R129-P131 WeakPolarHBondContact O-CD 3.45Å; R129-D227 IonicContact CZ-OD2 2.73Å; R129-D227 IonicContact NE-OD2 2.78Å; R129-D227 IonicContact NH2-OD2 2.93Å; R129-D227 PolarHBondContact NH2-OD2 3.03Å; R129-M228 WeakPolarHBondContact O-CE 3.38Å; R129-S325 PolarHBondContact NH1-O 2.92Å; R129-S325 PolarHBondContact NH2-O 2.82Å; R129-K326 PolarHBondContact NH1-O 3.39Å; R129-F328 PolarHBondContact NH1-O 2.82Å; R129-F328 PolarHBondContact NH2-O 3.29Å; R129-L330 HydrophobicContact CG-CD1 4.16Å; R129-L330 HydrophobicContact CG-CG 4.47Å; R129-Y337 PolarHBondContact NH2-OH 3.35Å
130	S	90.6	Very high	93.2	Very high	42 Å²	42	43.4 Å²	43.4	29%	0.294	24%	0.237	S	C	.	.			trans	-123.2	53.6	-175.6	-54.2	0	0	0	0	112.6	E91	E91-S130 PolarHBondContact OE2-OG 3.04Å
131	P	93.4	Very high	93.2	Very high	8 Å²	8	42.2 Å²	42.2	5%	0.052	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-61.6	138.5	176.3	26.8	-33.7	0	0	0	111.3	W94 R129 W213 F215 L224 M228	W94-P131 HydrophobicContact CD2-CB 3.98Å; W94-P131 VanDerWaalsContact CE3-CA 3.45Å; W94-P131 HydrophobicContact CE3-CB 3.82Å; W94-P131 HydrophobicContact CH2-CB 3.8Å; W94-P131 HydrophobicContact CH2-CG 4.48Å; W94-P131 HydrophobicContact CZ2-CB 3.98Å; W94-P131 HydrophobicContact CZ3-CB 3.67Å; W94-P131 HydrophobicContact CZ3-CG 4.14Å; R129-P131 WeakPolarHBondContact O-CD 3.45Å; P131-W213 HydrophobicContact CB-CB 4.32Å; P131-W213 HydrophobicContact CG-CB 4.21Å; P131-F215 HydrophobicContact CB-CB 4.32Å; P131-F215 HydrophobicContact CB-CD1 4.32Å; P131-F215 HydrophobicContact CG-CD1 3.92Å; P131-L224 HydrophobicContact CG-CD1 4.41Å; P131-L224 HydrophobicContact CG-CD2 4.47Å; P131-M228 HydrophobicContact CG-CG 3.82Å; P131-M228 HydrophobicContact CG-SD 3.62Å
132	P	94.6	Very high	93	Very high	61 Å²	61	42.2 Å²	42.2	40%	0.396	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-57.3	147.4	171.2	-25.2	32.5	0	0	0	112	W94 W213 D214	W94-P132 HydrophobicContact CG-CG 4.29Å; P132-W213 WeakPolarHBondContact O-CA 3.31Å; P132-D214 HydrophobicContact CB-CB 4.5Å; P132-D214 PolarHBondContact O-N 3.35Å
133	I	96.6	Very high	92.6	Very high	71 Å²	71	46.4 Å²	46.4	36%	0.364	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.8	168.8	-165.6	161.4	0	0	0	109.4	I135 N136 W213	I133-I135 WeakPolarHBondContact CG1-O 3.4Å; I133-N136 HydrophobicContact CD1-CB 3.49Å; I133-N136 VanDerWaalsContact CD1-CB 3.49Å; I133-N136 HydrophobicContact CG1-CB 4.02Å; I133-W213 HydrophobicContact CD1-CZ2 4.15Å
134	L	96.8	Very high	92.8	Very high	84 Å²	84	50.8 Å²	50.8	44%	0.44	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-43.3	178.2	-62.1	179.1	0	0	0	111.3	N188 Q212 D214	L134-N188 HydrophobicContact CD1-CB 4.41Å; L134-Q212 HydrophobicContact CB-CB 4.29Å; L134-Q212 HydrophobicContact CB-CG 4.31Å; L134-Q212 HydrophobicContact CD1-CG 4.27Å; L134-Q212 PolarHBondContact N-O 3.17Å; L134-D214 HydrophobicContact CD1-CB 3.9Å; L134-D214 HydrophobicContact CD2-CB 3.96Å; L134-D214 HydrophobicContact CG-CB 3.88Å
135	I	98.2	Very high	93.2	Very high	25 Å²	25	47.4 Å²	47.4	13%	0.128	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.3	178	-55.1	179	0	0	0	108.1	I133 L200 A204 I210 L211 Q212	I133-I135 WeakPolarHBondContact CG1-O 3.4Å; I135-L200 HydrophobicContact CD1-CD2 4.26Å; I135-L200 HydrophobicContact CD1-CG 4.3Å; I135-A204 HydrophobicContact CD1-CB 4.1Å; I135-A204 HydrophobicContact CG2-CB 3.7Å; I135-I210 HydrophobicContact CB-CG2 4.45Å; I135-I210 HydrophobicContact CD1-CG2 4.21Å; I135-I210 HydrophobicContact CG2-CB 4.46Å; I135-I210 HydrophobicContact CG2-CG2 4.13Å; I135-I210 WeakPolarHBondContact CG2-O 3.36Å; I135-L211 WeakPolarHBondContact O-CA 3.07Å; I135-Q212 HydrophobicContact CB-CB 3.85Å; I135-Q212 HydrophobicContact CD1-CB 4.2Å; I135-Q212 VanDerWaalsContact CD1-OE1 3.28Å; I135-Q212 HydrophobicContact CG1-CB 4Å; I135-Q212 PolarHBondContact N-O 2.82Å; I135-Q212 PolarHBondContact O-N 3.37Å
136	N	98	Very high	93.6	Very high	55 Å²	55	46.9 Å²	46.9	29%	0.294	25%	0.25	S	S	.	.			trans	-130.9	153.2	-177.9	-165	5.7	0	0	0	111.7	I133 W232	I133-N136 HydrophobicContact CD1-CB 3.49Å; I133-N136 VanDerWaalsContact CD1-CB 3.49Å; I133-N136 HydrophobicContact CG1-CB 4.02Å; N136-W232 PolarHBondContact OD1-NE1 2.8Å
137	Q	97.6	Very high	94	Very high	35 Å²	35	46.8 Å²	46.8	16%	0.164	25%	0.25	C	C	.	.			trans	-128.8	62.4	176	-53.7	-59.4	-21.9	0	0	111.2	M139 K140 G208 I210 L211 W232	Q137-M139 PolarHBondContact O-N 3.46Å; Q137-K140 HydrophobicContact CB-CB 4.23Å; Q137-K140 WeakPolarHBondContact O-CB 3.33Å; Q137-K140 PolarHBondContact O-N 2.63Å; Q137-G208 VanDerWaalsContact CD-C 3.43Å; Q137-G208 WeakPolarHBondContact CG-O 3.47Å; Q137-I210 VanDerWaalsContact CG-O 3.26Å; Q137-I210 WeakPolarHBondContact CG-O 3.45Å; Q137-I210 PolarHBondContact NE2-O 3.25Å; Q137-L211 HydrophobicContact CB-CD2 3.97Å; Q137-L211 HydrophobicContact CG-CD2 3.97Å; Q137-W232 HydrophobicContact CB-CZ2 4.49Å; Q137-W232 WeakPolarHBondContact O-CZ2 3.07Å
138	P	96.4	Very high	94.6	Very high	61 Å²	61	44.2 Å²	44.2	40%	0.396	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.6	-169.2	26.2	-35.8	0	0	0	114	H236	P138-H236 WeakPolarHBondContact CA-ND1 3.38Å
139	M	95.1	Very high	95.1	Very high	128 Å²	128	44.1 Å²	44.1	63%	0.631	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	5.8	-176.6	-60.2	-53.4	-76.9	0	0	113.9	Q137 C141 N142	Q137-M139 PolarHBondContact O-N 3.46Å; M139-C141 VanDerWaalsContact C-N 3.33Å; M139-C141 PolarHBondContact O-N 3.39Å; M139-N142 WeakPolarHBondContact CA-OD1 3.4Å; M139-N142 VanDerWaalsContact CE-ND2 3.28Å; M139-N142 WeakPolarHBondContact CE-ND2 2.82Å; M139-N142 WeakPolarHBondContact CE-OD1 3.49Å; M139-N142 PolarHBondContact O-ND2 2.88Å; M139-N142 VanDerWaalsContact O-ND2 3.12Å; M139-N142 PolarHBondContact O-OD1 3.25Å; M139-N142 VanDerWaalsContact O-OD1 3.1Å; M139-N142 PolarHBondContact SD-OD1 3.13Å
140	K	95.6	Very high	95.5	Very high	21 Å²	21	42.7 Å²	42.7	9%	0.091	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-38.5	-173.9	-172.3	63.8	165.4	-172.2	0	113	Q137 D171 R181 S182 V183 W232	Q137-K140 HydrophobicContact CB-CB 4.23Å; Q137-K140 WeakPolarHBondContact O-CB 3.33Å; Q137-K140 PolarHBondContact O-N 2.63Å; K140-D171 WeakPolarHBondContact CE-OD2 3.42Å; K140-D171 IonicContact NZ-OD1 2.7Å; K140-D171 PolarHBondContact NZ-OD1 3.35Å; K140-D171 IonicContact NZ-OD2 2.81Å; K140-D171 PolarHBondContact NZ-OD2 2.7Å; K140-R181 PolarHBondContact O-NE 3.43Å; K140-S182 WeakPolarHBondContact CE-O 3.38Å; K140-S182 PolarHBondContact NZ-O 2.87Å; K140-V183 HydrophobicContact CD-CG1 4.34Å; K140-V183 HydrophobicContact CG-CG1 3.74Å; K140-W232 HydrophobicContact CB-CH2 4.11Å; K140-W232 HydrophobicContact CB-CZ2 4.36Å
141	C	94.4	Very high	95.9	Very high	13 Å²	13	40.7 Å²	40.7	9%	0.088	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	43.2	-178.5	-59.5	0	0	0	0	113.2	M139 N143 H236 C237	M139-C141 VanDerWaalsContact C-N 3.33Å; M139-C141 PolarHBondContact O-N 3.39Å; C141-N143 PolarHBondContact O-N 2.85Å; C141-H236 WeakPolarHBondContact CB-O 3.33Å; C141-C237 HydrophobicContact CB-CB 3.55Å; C141-C237 WeakPolarHBondContact CB-SG 3.23Å; C141-C237 WeakPolarHBondContact SG-CB 3.37Å; C141-C237 CovalentContact SG-SG 2.03Å; C141-C237 PolarHBondContact SG-SG 3.11Å
142	N	85.7	Confident	96.2	Very high	97 Å²	97	40.9 Å²	40.9	52%	0.519	22%	0.216	S	C	.	.	S	Bend	trans	-57	-15.1	178.5	-71.8	-16.4	0	0	0	115.6	M139	M139-N142 WeakPolarHBondContact CA-OD1 3.4Å; M139-N142 VanDerWaalsContact CE-ND2 3.28Å; M139-N142 WeakPolarHBondContact CE-ND2 2.82Å; M139-N142 WeakPolarHBondContact CE-OD1 3.49Å; M139-N142 PolarHBondContact O-ND2 2.88Å; M139-N142 VanDerWaalsContact O-ND2 3.12Å; M139-N142 PolarHBondContact O-OD1 3.25Å; M139-N142 VanDerWaalsContact O-OD1 3.1Å; M139-N142 PolarHBondContact SD-OD1 3.13Å
143	N	85.9	Confident	96.3	Very high	93 Å²	93	38 Å²	38	50%	0.497	20%	0.198	S	C	.	.	S	Bend	trans	-133.7	168.1	179.4	-64.5	-42.7	0	0	0	109.4	C141 T145	C141-N143 PolarHBondContact O-N 2.85Å; N143-T145 PolarHBondContact O-N 3.27Å; N143-T145 VanDerWaalsContact O-N 3.11Å; N143-T145 PolarHBondContact O-OG1 2.99Å; N143-T145 VanDerWaalsContact O-OG1 3.13Å
144	H	95.7	Very high	96.3	Very high	94 Å²	94	36.6 Å²	36.6	44%	0.435	19%	0.194	S	C	.	.			trans	-46.6	121.7	169.7	-179.6	-95.5	0	0	0	111	R179 L239 S241	H144-R179 WeakPolarHBondContact O-CD 3.33Å; H144-R179 PolarHBondContact O-NH1 2.98Å; H144-L239 PolarHBondContact CD2-O 3.29Å; H144-L239 VanDerWaalsContact CD2-O 3.22Å; H144-S241 PolarHBondContact CE1-OG 3.48Å; H144-S241 PolarHBondContact NE2-OG 2.54Å
145	T	98	Very high	96.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.7	-177.8	-66.1	0	0	0	0	106.9	N143 L147 L148 R181 L239 V240 S241	N143-T145 PolarHBondContact O-N 3.27Å; N143-T145 VanDerWaalsContact O-N 3.11Å; N143-T145 PolarHBondContact O-OG1 2.99Å; N143-T145 VanDerWaalsContact O-OG1 3.13Å; T145-L147 WeakPolarHBondContact CG2-O 3.39Å; T145-L148 HydrophobicContact CG2-CB 4.31Å; T145-R181 HydrophobicContact CG2-CB 3.98Å; T145-R181 HydrophobicContact CG2-CG 3.88Å; T145-L239 PolarHBondContact N-O 3.26Å; T145-V240 HydrophobicContact CG2-CG2 4.29Å; T145-V240 CarbonylContact O-C 3.52Å; T145-V240 VanDerWaalsContact O-CA 3.24Å; T145-V240 WeakPolarHBondContact O-CA 3.27Å; T145-S241 PolarHBondContact O-N 3.09Å
146	F	98.6	Very high	96.2	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-46.6	-179.1	174.4	-104.7	0	0	0	111	R178 R179 S241 F242 I258 L261 E262	F146-R178 HydrophobicContact CB-CB 4.13Å; F146-R178 HydrophobicContact CD1-CB 3.73Å; F146-R178 HydrophobicContact CD1-CG 3.94Å; F146-R178 HydrophobicContact CD2-CG 4.47Å; F146-R178 HydrophobicContact CE1-CB 4.33Å; F146-R178 HydrophobicContact CE1-CG 4.14Å; F146-R178 HydrophobicContact CG-CB 3.98Å; F146-R178 HydrophobicContact CG-CG 4.09Å; F146-R178 HydrophobicContact CZ-CG 4.47Å; F146-R179 WeakPolarHBondContact CB-O 3.43Å; F146-R179 PolarHBondContact N-O 3.46Å; F146-S241 VanDerWaalsContact O-CB 3.32Å; F146-S241 WeakPolarHBondContact O-CB 3.47Å; F146-F242 HydrophobicContact CD2-CD2 4.37Å; F146-F242 HydrophobicContact CD2-CE2 4.47Å; F146-F242 AromaticContact CE2-CD2 3.94Å; F146-F242 HydrophobicContact CE2-CD2 3.94Å; F146-F242 AromaticContact CE2-CE2 3.74Å; F146-F242 HydrophobicContact CE2-CE2 3.74Å; F146-F242 HydrophobicContact CZ-CD2 4.04Å; F146-F242 AromaticContact CZ-CE2 3.98Å; F146-F242 HydrophobicContact CZ-CE2 3.98Å; F146-F242 PolarHBondContact O-N 2.84Å; F146-I258 HydrophobicContact CE1-CB 4.45Å; F146-I258 HydrophobicContact CE1-CG1 4.27Å; F146-I258 HydrophobicContact CE1-CG2 4.02Å; F146-L261 HydrophobicContact CE1-CB 4.27Å; F146-L261 HydrophobicContact CE1-CD1 4.37Å; F146-L261 HydrophobicContact CZ-CB 3.84Å; F146-E262 HydrophobicContact CZ-CG 3.93Å
147	L	98.8	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.6	178.8	177.9	62.5	0	0	0	109.9	T145 F149 R179 V180 R181 F242 F244 L257 L261	T145-L147 WeakPolarHBondContact CG2-O 3.39Å; L147-F149 HydrophobicContact CD2-CD2 4.38Å; L147-F149 HydrophobicContact CD2-CE1 4.17Å; L147-F149 HydrophobicContact CD2-CE2 3.74Å; L147-F149 HydrophobicContact CD2-CZ 3.6Å; L147-F149 HydrophobicContact CG-CE2 4.35Å; L147-F149 HydrophobicContact CG-CZ 4.47Å; L147-R179 PolarHBondContact N-O 2.71Å; L147-V180 HydrophobicContact CB-CG2 4.3Å; L147-V180 WeakPolarHBondContact O-CA 3.33Å; L147-R181 PolarHBondContact O-N 3.16Å; L147-F242 WeakPolarHBondContact CA-O 3.46Å; L147-F242 HydrophobicContact CD1-CB 4.04Å; L147-F244 HydrophobicContact CD1-CB 4Å; L147-L257 HydrophobicContact CD2-CD2 3.97Å; L147-L261 HydrophobicContact CD1-CD1 4.13Å
148	L	98.8	Very high	96.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	114.7	167.6	178.7	63.4	0	0	0	108.9	T145 A150 R181 V183 F229 W232 T233 C237 V240 F242 V243 F244	T145-L148 HydrophobicContact CG2-CB 4.31Å; L148-A150 PolarHBondContact O-N 2.85Å; L148-R181 CarbonylContact C-O 3.56Å; L148-R181 WeakPolarHBondContact CA-O 3.25Å; L148-R181 HydrophobicContact CD1-CB 3.96Å; L148-V183 HydrophobicContact CD1-CG1 4.42Å; L148-V183 HydrophobicContact CD1-CG2 4.18Å; L148-F229 HydrophobicContact CD2-CE2 4.27Å; L148-F229 HydrophobicContact CD2-CZ 3.91Å; L148-W232 HydrophobicContact CD2-CZ3 4.22Å; L148-T233 HydrophobicContact CD2-CG2 4.29Å; L148-C237 HydrophobicContact CD2-CB 4.36Å; L148-V240 HydrophobicContact CB-CG2 3.71Å; L148-F242 PolarHBondContact N-O 3.14Å; L148-V243 HydrophobicContact CB-CG2 4.4Å; L148-V243 CarbonylContact O-C 3.54Å; L148-V243 WeakPolarHBondContact O-CA 3.33Å; L148-F244 PolarHBondContact O-N 2.99Å
149	F	98.8	Very high	96.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	111.1	164.5	-75	-69.9	0	0	0	109.1	L147 I151 W168 V180 R181 S182 V183 F244 V252 T254 L257	L147-F149 HydrophobicContact CD2-CD2 4.38Å; L147-F149 HydrophobicContact CD2-CE1 4.17Å; L147-F149 HydrophobicContact CD2-CE2 3.74Å; L147-F149 HydrophobicContact CD2-CZ 3.6Å; L147-F149 HydrophobicContact CG-CE2 4.35Å; L147-F149 HydrophobicContact CG-CZ 4.47Å; F149-I151 HydrophobicContact CB-CD1 3.99Å; F149-I151 HydrophobicContact CB-CG1 4.26Å; F149-W168 HydrophobicContact CD1-CE3 4.23Å; F149-W168 AromaticContact CD1-CZ3 3.9Å; F149-W168 HydrophobicContact CD1-CZ3 3.9Å; F149-W168 HydrophobicContact CE1-CE3 4.17Å; F149-W168 HydrophobicContact CE1-CZ3 4.22Å; F149-W168 HydrophobicContact CG-CZ3 4.43Å; F149-V180 HydrophobicContact CD2-CG1 3.54Å; F149-V180 HydrophobicContact CE2-CG1 3.59Å; F149-R181 PolarHBondContact N-O 2.75Å; F149-S182 CarbonylContact O-C 3.57Å; F149-S182 VanDerWaalsContact O-CA 3.31Å; F149-S182 WeakPolarHBondContact O-CA 3.31Å; F149-V183 PolarHBondContact O-N 3.2Å; F149-F244 HydrophobicContact CD1-CB 3.73Å; F149-F244 AromaticContact CD1-CD1 3.4Å; F149-F244 HydrophobicContact CD1-CD1 3.4Å; F149-F244 HydrophobicContact CD1-CE1 4.11Å; F149-F244 AromaticContact CD1-CG 3.66Å; F149-F244 HydrophobicContact CD1-CG 3.66Å; F149-F244 HydrophobicContact CE1-CB 3.96Å; F149-F244 AromaticContact CE1-CD1 3.87Å; F149-F244 HydrophobicContact CE1-CD1 3.87Å; F149-F244 HydrophobicContact CE1-CD2 4.29Å; F149-F244 HydrophobicContact CE1-CE1 4.42Å; F149-F244 AromaticContact CE1-CG 3.77Å; F149-F244 HydrophobicContact CE1-CG 3.77Å; F149-V252 HydrophobicContact CE1-CG1 4.03Å; F149-V252 HydrophobicContact CZ-CG1 4.19Å; F149-T254 HydrophobicContact CE2-CG2 3.8Å; F149-T254 HydrophobicContact CZ-CG2 3.87Å; F149-L257 HydrophobicContact CE1-CD2 4.08Å; F149-L257 HydrophobicContact CZ-CD2 4.21Å
150	A	98.5	Very high	96.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	110.1	169.3	0	0	0	0	0	108.1	L148 F185 F229 V243 F244 S245 G246	L148-A150 PolarHBondContact O-N 2.85Å; A150-F185 VanDerWaalsContact C-CE1 3.45Å; A150-F185 HydrophobicContact CB-CD1 4.3Å; A150-F185 HydrophobicContact CB-CE1 3.74Å; A150-F229 HydrophobicContact CB-CD1 4.13Å; A150-F229 HydrophobicContact CB-CD2 4.21Å; A150-F229 HydrophobicContact CB-CE1 3.45Å; A150-F229 VanDerWaalsContact CB-CE1 3.45Å; A150-F229 HydrophobicContact CB-CE2 3.54Å; A150-F229 HydrophobicContact CB-CG 4.48Å; A150-F229 HydrophobicContact CB-CZ 3.12Å; A150-V243 HydrophobicContact CB-CG1 4.11Å; A150-F244 WeakPolarHBondContact CA-O 3.47Å; A150-F244 WeakPolarHBondContact CB-O 3.26Å; A150-F244 PolarHBondContact N-O 3.07Å; A150-S245 VanDerWaalsContact O-CA 3.32Å; A150-S245 WeakPolarHBondContact O-CA 3.35Å; A150-G246 PolarHBondContact O-N 3.3Å
151	I	98.7	Very high	96.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.4	-172	-56.4	140.6	0	0	0	109.5	F149 S153 V164 W168 V183 F184 F185 G246 D248	F149-I151 HydrophobicContact CB-CD1 3.99Å; F149-I151 HydrophobicContact CB-CG1 4.26Å; I151-S153 PolarHBondContact O-N 3.34Å; I151-V164 HydrophobicContact CD1-CG1 3.72Å; I151-W168 HydrophobicContact CD1-CH2 4.26Å; I151-W168 HydrophobicContact CD1-CZ3 4.17Å; I151-W168 HydrophobicContact CG1-CH2 3.87Å; I151-W168 HydrophobicContact CG1-CZ3 4.03Å; I151-W168 HydrophobicContact CG2-CH2 4.39Å; I151-V183 PolarHBondContact N-O 3.46Å; I151-F184 HydrophobicContact CB-CD1 3.6Å; I151-F184 HydrophobicContact CB-CE1 3.88Å; I151-F184 HydrophobicContact CD1-CD1 4.05Å; I151-F184 HydrophobicContact CD1-CE1 3.64Å; I151-F184 HydrophobicContact CD1-CZ 3.98Å; I151-F184 HydrophobicContact CG1-CD1 4.44Å; I151-F184 HydrophobicContact CG1-CE1 4.31Å; I151-F184 HydrophobicContact CG2-CD1 3.59Å; I151-F184 HydrophobicContact CG2-CE1 3.68Å; I151-F184 VanDerWaalsContact O-CA 3.31Å; I151-F184 WeakPolarHBondContact O-CA 3.47Å; I151-F185 VanDerWaalsContact C-CE1 3.44Å; I151-F185 VanDerWaalsContact O-CD1 3.28Å; I151-F185 WeakPolarHBondContact O-CD1 3.48Å; I151-F185 PolarHBondContact O-N 3.34Å; I151-G246 CarbonylContact C-O 3.59Å; I151-G246 WeakPolarHBondContact CA-O 3.39Å; I151-D248 HydrophobicContact CG2-CB 3.88Å
152	K	98.4	Very high	96.8	Very high	12 Å²	12	37.2 Å²	37.2	5%	0.052	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	118.5	172.4	-71.5	178.9	-83.6	164.7	0	108.1	F185 L222 K225 G246 D247 D248 D334	K152-F185 HydrophobicContact CB-CZ 4.35Å; K152-F185 HydrophobicContact CD-CZ 4.35Å; K152-F185 HydrophobicContact CG-CE1 3.88Å; K152-F185 HydrophobicContact CG-CE2 3.8Å; K152-F185 HydrophobicContact CG-CZ 3.3Å; K152-L222 HydrophobicContact CD-CD2 4.28Å; K152-K225 HydrophobicContact CG-CD 4.3Å; K152-G246 PolarHBondContact N-O 3.19Å; K152-D247 WeakPolarHBondContact CE-OD1 3.36Å; K152-D247 IonicContact NZ-OD1 3.33Å; K152-D247 PolarHBondContact NZ-OD1 3.32Å; K152-D248 PolarHBondContact O-N 3.32Å; K152-D334 IonicContact NZ-OD2 3.47Å; K152-D334 PolarHBondContact NZ-OD2 3.45Å
153	S	97.9	Very high	97.5	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.014	17%	0.169	C	C	.	.			trans	-135.2	171.4	177.5	-166	0	0	0	0	110.7	I151 R161 F185 K225 D248	I151-S153 PolarHBondContact O-N 3.34Å; S153-R161 WeakPolarHBondContact OG-CG 3.44Å; S153-R161 PolarHBondContact OG-NH1 2.72Å; S153-R161 VanDerWaalsContact OG-NH1 3.16Å; S153-F185 PolarHBondContact N-O 2.9Å; S153-K225 PolarHBondContact O-NZ 3.29Å; S153-D248 WeakPolarHBondContact CA-OD2 3.33Å; S153-D248 VanDerWaalsContact CB-OD2 3.29Å; S153-D248 WeakPolarHBondContact CB-OD2 3.3Å; S153-D248 PolarHBondContact OG-OD2 2.95Å
154	S	96.7	Very high	98.1	Very high	40 Å²	40	28.3 Å²	28.3	28%	0.28	15%	0.145	S	C	.	.			trans	-119.5	150.5	174	-61.1	0	0	0	0	110.4	A156 N157 R161 L186	S154-A156 PolarHBondContact O-N 2.96Å; S154-N157 WeakPolarHBondContact O-CB 3.28Å; S154-N157 PolarHBondContact O-N 3.14Å; S154-R161 PolarHBondContact O-NH1 3.21Å; S154-L186 WeakPolarHBondContact O-CD2 3.44Å
155	P	96.5	Very high	98.2	Very high	4 Å²	4	24.9 Å²	24.9	3%	0.026	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-36.3	-172.9	-32.2	37.6	0	0	0	115.2	N157 F158 R161 G187 Y189 L200	P155-N157 PolarHBondContact O-N 2.93Å; P155-F158 WeakPolarHBondContact O-CE2 3.19Å; P155-F158 WeakPolarHBondContact O-CZ 3.24Å; P155-R161 PolarHBondContact O-NH2 3.29Å; P155-G187 WeakPolarHBondContact CG-O 3.42Å; P155-Y189 HydrophobicContact CB-CD1 3.55Å; P155-Y189 HydrophobicContact CB-CE1 3.04Å; P155-Y189 HydrophobicContact CB-CE2 4.27Å; P155-Y189 HydrophobicContact CB-CG 4.33Å; P155-Y189 VanDerWaalsContact CB-CZ 3.45Å; P155-Y189 HydrophobicContact CG-CD1 4.08Å; P155-Y189 HydrophobicContact CG-CE1 3.98Å; P155-Y189 HydrophobicContact CG-CG 4.47Å; P155-L200 HydrophobicContact CB-CD2 4.3Å
156	A	96.1	Very high	98.2	Very high	63 Å²	63	29.2 Å²	29.2	52%	0.521	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-14.5	179.2	0	0	0	0	0	115.5	S154 F158 L196	S154-A156 PolarHBondContact O-N 2.96Å; A156-F158 WeakPolarHBondContact O-CD2 3.47Å; A156-F158 PolarHBondContact O-N 3.01Å; A156-L196 HydrophobicContact CB-CD1 3.89Å
157	N	97.5	Very high	98.2	Very high	42 Å²	42	29.1 Å²	29.1	23%	0.225	15%	0.149	C	C	.	.			trans	-80.7	43.7	-171	-70.8	-5.1	0	0	0	114.2	S154 P155 E159 R160 R161 D248	S154-N157 WeakPolarHBondContact O-CB 3.28Å; S154-N157 PolarHBondContact O-N 3.14Å; P155-N157 PolarHBondContact O-N 2.93Å; N157-E159 PolarHBondContact O-N 3.1Å; N157-R160 HydrophobicContact CB-CB 4.22Å; N157-R160 HydrophobicContact CB-CG 4.43Å; N157-R160 PolarHBondContact O-N 2.76Å; N157-R161 WeakPolarHBondContact O-CG 3.48Å; N157-R161 PolarHBondContact O-N 2.85Å; N157-R161 VanDerWaalsContact O-N 3.07Å; N157-R161 PolarHBondContact O-NH1 2.83Å; N157-D248 VanDerWaalsContact CB-OD2 3.27Å; N157-D248 WeakPolarHBondContact CB-OD2 3.18Å; N157-D248 PolarHBondContact ND2-OD1 2.81Å; N157-D248 PolarHBondContact ND2-OD2 2.78Å
158	F	98.3	Very high	98.2	Very high	54 Å²	54	29.1 Å²	29.1	24%	0.237	15%	0.149	C	C	.	.	H	α-helix	trans	-56	-46.5	-178.6	-66.8	-84.3	0	0	0	112.8	P155 A156 R160 R161 Q162 L196 L199 L200 E203	P155-F158 WeakPolarHBondContact O-CE2 3.19Å; P155-F158 WeakPolarHBondContact O-CZ 3.24Å; A156-F158 WeakPolarHBondContact O-CD2 3.47Å; A156-F158 PolarHBondContact O-N 3.01Å; F158-R160 PolarHBondContact O-N 2.95Å; F158-R161 VanDerWaalsContact CD1-NH2 3.25Å; F158-R161 PolarHBondContact O-N 3.22Å; F158-Q162 WeakPolarHBondContact O-CB 3.39Å; F158-Q162 PolarHBondContact O-N 2.77Å; F158-L196 HydrophobicContact CE2-CB 4.13Å; F158-L196 HydrophobicContact CE2-CD1 3.97Å; F158-L196 HydrophobicContact CZ-CB 4.28Å; F158-L199 HydrophobicContact CE1-CB 4.1Å; F158-L199 HydrophobicContact CZ-CB 3.76Å; F158-L200 HydrophobicContact CE1-CB 4.45Å; F158-L200 HydrophobicContact CE1-CD1 4.31Å; F158-L200 HydrophobicContact CZ-CB 4.22Å; F158-L200 HydrophobicContact CZ-CD1 4.43Å; F158-E203 WeakPolarHBondContact CD1-OE2 3.39Å; F158-E203 HydrophobicContact CE1-CB 4.25Å; F158-E203 WeakPolarHBondContact CE1-OE2 3.38Å
159	E	98.5	Very high	98.1	Very high	140 Å²	140	29.2 Å²	29.2	65%	0.654	15%	0.15	S	C	*	.	H	α-helix	trans	-64.2	-41.9	-178.6	-170.2	-172.9	-172.8	0	0	111.9	N157 Q162 A163 P382	N157-E159 PolarHBondContact O-N 3.1Å; E159-Q162 PolarHBondContact O-N 3.21Å; E159-A163 PolarHBondContact O-N 2.76Å; E159-P382 HydrophobicContact CB-CG 4.4Å; E159-P382 HydrophobicContact CG-CB 3.87Å; E159-P382 HydrophobicContact CG-CG 3.86Å
160	R	98.6	Very high	98.1	Very high	75 Å²	75	35.3 Å²	35.3	28%	0.283	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-49.9	176.4	-64.6	-173	175.5	-156.3	-11	110.9	N157 F158 Q162 A163 V164 D248 D249 P382	N157-R160 HydrophobicContact CB-CB 4.22Å; N157-R160 HydrophobicContact CB-CG 4.43Å; N157-R160 PolarHBondContact O-N 2.76Å; F158-R160 PolarHBondContact O-N 2.95Å; R160-Q162 VanDerWaalsContact C-N 3.28Å; R160-Q162 PolarHBondContact O-N 3.01Å; R160-A163 PolarHBondContact O-N 3.06Å; R160-V164 WeakPolarHBondContact O-CG2 3.43Å; R160-V164 PolarHBondContact O-N 3.3Å; R160-D248 HydrophobicContact CB-CB 4.11Å; R160-D248 VanDerWaalsContact CD-CG 3.5Å; R160-D248 WeakPolarHBondContact CD-OD1 3.38Å; R160-D248 IonicContact CZ-OD1 3.71Å; R160-D248 IonicContact NE-OD1 2.84Å; R160-D248 IonicContact NH1-OD1 3.74Å; R160-D248 PolarHBondContact NH1-OD1 2.85Å; R160-D249 IonicContact CZ-OD2 2.65Å; R160-D249 VanDerWaalsContact NH1-CB 3.26Å; R160-D249 IonicContact NH1-OD2 3.65Å; R160-D249 PolarHBondContact NH1-OD2 2.65Å; R160-D249 IonicContact NH2-OD2 3.55Å; R160-D249 PolarHBondContact NH2-OD2 2.92Å; R160-P382 HydrophobicContact CG-CG 3.93Å
161	R	98.8	Very high	98	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.3	-43.1	176.6	-66.5	-166.6	-70.2	-82.4	5.8	111.7	S153 S154 P155 N157 F158 V164 R165 F184 E203	S153-R161 WeakPolarHBondContact OG-CG 3.44Å; S153-R161 PolarHBondContact OG-NH1 2.72Å; S153-R161 VanDerWaalsContact OG-NH1 3.16Å; S154-R161 PolarHBondContact O-NH1 3.21Å; P155-R161 PolarHBondContact O-NH2 3.29Å; N157-R161 WeakPolarHBondContact O-CG 3.48Å; N157-R161 PolarHBondContact O-N 2.85Å; N157-R161 VanDerWaalsContact O-N 3.07Å; N157-R161 PolarHBondContact O-NH1 2.83Å; F158-R161 VanDerWaalsContact CD1-NH2 3.25Å; F158-R161 PolarHBondContact O-N 3.22Å; R161-V164 PolarHBondContact O-N 2.83Å; R161-R165 WeakPolarHBondContact O-CG 3.28Å; R161-R165 PolarHBondContact O-N 2.94Å; R161-F184 HydrophobicContact CB-CD1 4.15Å; R161-F184 HydrophobicContact CB-CD2 4.32Å; R161-F184 HydrophobicContact CB-CE1 3.84Å; R161-F184 HydrophobicContact CB-CE2 4.05Å; R161-F184 HydrophobicContact CB-CG 4.37Å; R161-F184 HydrophobicContact CB-CZ 3.8Å; R161-F184 VanDerWaalsContact CD-CG 3.48Å; R161-F184 HydrophobicContact CG-CB 4.42Å; R161-F184 HydrophobicContact CG-CD1 3.5Å; R161-F184 VanDerWaalsContact CG-CD1 3.5Å; R161-F184 HydrophobicContact CG-CD2 4.19Å; R161-F184 HydrophobicContact CG-CE1 3.66Å; R161-F184 HydrophobicContact CG-CE2 4.35Å; R161-F184 HydrophobicContact CG-CG 3.77Å; R161-F184 HydrophobicContact CG-CZ 4.09Å; R161-F184 WeakPolarHBondContact O-CZ 3.38Å; R161-E203 IonicContact CZ-OE1 3.41Å; R161-E203 IonicContact CZ-OE2 3.83Å; R161-E203 IonicContact NE-OE1 3.56Å; R161-E203 PolarHBondContact NE-OE1 3.43Å; R161-E203 IonicContact NE-OE2 3.21Å; R161-E203 PolarHBondContact NE-OE2 2.76Å; R161-E203 VanDerWaalsContact NE-OE2 3.15Å; R161-E203 IonicContact NH2-OE1 2.67Å; R161-E203 IonicContact NH2-OE2 2.72Å; R161-E203 PolarHBondContact NH2-OE2 2.94Å
162	Q	98.8	Very high	97.8	Very high	58 Å²	58	39.3 Å²	39.3	27%	0.271	20%	0.199	S	C	.	.	H	α-helix	trans	-63	-46.6	178.6	-170.3	60.1	22.2	0	0	112.4	F158 E159 R160 V164 R165 E166 F207	F158-Q162 WeakPolarHBondContact O-CB 3.39Å; F158-Q162 PolarHBondContact O-N 2.77Å; E159-Q162 PolarHBondContact O-N 3.21Å; R160-Q162 VanDerWaalsContact C-N 3.28Å; R160-Q162 PolarHBondContact O-N 3.01Å; Q162-V164 VanDerWaalsContact C-N 3.29Å; Q162-V164 PolarHBondContact O-N 3.26Å; Q162-R165 WeakPolarHBondContact O-CB 3.07Å; Q162-R165 PolarHBondContact O-N 2.95Å; Q162-E166 PolarHBondContact NE2-OE1 2.93Å; Q162-E166 WeakPolarHBondContact O-CG 3.35Å; Q162-E166 PolarHBondContact O-N 3.4Å; Q162-F207 VanDerWaalsContact OE1-CZ 3.23Å
163	A	98.8	Very high	97.8	Very high	2 Å²	2	43.3 Å²	43.3	2%	0.017	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-41.2	176.2	0	0	0	0	0	111.7	E159 R160 E166 T167 P382	E159-A163 PolarHBondContact O-N 2.76Å; R160-A163 PolarHBondContact O-N 3.06Å; A163-E166 PolarHBondContact O-N 2.03Å; A163-T167 WeakPolarHBondContact O-CB 3.29Å; A163-T167 WeakPolarHBondContact O-CG2 3.35Å; A163-T167 PolarHBondContact O-N 3.13Å; A163-T167 VanDerWaalsContact O-N 3.1Å; A163-T167 PolarHBondContact O-OG1 3.11Å; A163-P382 HydrophobicContact CB-CB 3.73Å
164	V	98.8	Very high	97.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-46.7	175.3	174	0	0	0	0	111.5	I151 R160 R161 Q162 E166 T167 W168 G169 F184	I151-V164 HydrophobicContact CD1-CG1 3.72Å; R160-V164 WeakPolarHBondContact O-CG2 3.43Å; R160-V164 PolarHBondContact O-N 3.3Å; R161-V164 PolarHBondContact O-N 2.83Å; Q162-V164 VanDerWaalsContact C-N 3.29Å; Q162-V164 PolarHBondContact O-N 3.26Å; V164-E166 VanDerWaalsContact C-N 3.32Å; V164-E166 PolarHBondContact O-N 3Å; V164-T167 CarbonylContact O-C 3.58Å; V164-T167 PolarHBondContact O-N 2.93Å; V164-W168 HydrophobicContact CB-CZ2 4.09Å; V164-W168 HydrophobicContact CG1-CD2 3.97Å; V164-W168 HydrophobicContact CG1-CE3 3.98Å; V164-W168 HydrophobicContact CG1-CH2 3.66Å; V164-W168 HydrophobicContact CG1-CZ2 3.63Å; V164-W168 HydrophobicContact CG1-CZ3 3.82Å; V164-W168 HydrophobicContact CG2-CH2 4.06Å; V164-W168 HydrophobicContact CG2-CZ2 3.31Å; V164-W168 PolarHBondContact O-N 2.83Å; V164-G169 CarbonylContact O-C 3.59Å; V164-G169 WeakPolarHBondContact O-CA 3.28Å; V164-G169 PolarHBondContact O-N 2.76Å; V164-F184 HydrophobicContact CB-CE1 4.04Å; V164-F184 HydrophobicContact CB-CZ 3.94Å; V164-F184 HydrophobicContact CG1-CE1 3.97Å; V164-F184 HydrophobicContact CG1-CZ 3.86Å
165	R	98.6	Very high	97.4	Very high	23 Å²	23	50 Å²	50	9%	0.087	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-41.4	177.2	-72	178.6	-171.9	112.4	5.4	112.9	R161 Q162 T167 R170 F184 E203 D209	R161-R165 WeakPolarHBondContact O-CG 3.28Å; R161-R165 PolarHBondContact O-N 2.94Å; Q162-R165 WeakPolarHBondContact O-CB 3.07Å; Q162-R165 PolarHBondContact O-N 2.95Å; R165-T167 VanDerWaalsContact C-N 3.26Å; R165-T167 PolarHBondContact O-N 2.88Å; R165-R170 WeakPolarHBondContact O-CA 3.42Å; R165-R170 WeakPolarHBondContact O-CB 3.44Å; R165-F184 HydrophobicContact CG-CE2 3.89Å; R165-F184 HydrophobicContact CG-CZ 4.13Å; R165-E203 IonicContact CZ-OE1 3.67Å; R165-E203 IonicContact NH1-OE1 3.96Å; R165-E203 PolarHBondContact NH1-OE1 2.67Å; R165-E203 IonicContact NH2-OE1 3.97Å; R165-E203 PolarHBondContact NH2-OE1 2.81Å; R165-D209 IonicContact CZ-OD1 2.74Å; R165-D209 IonicContact CZ-OD2 2.89Å; R165-D209 IonicContact NE-OD1 3.63Å; R165-D209 IonicContact NE-OD2 3.56Å; R165-D209 PolarHBondContact NE-OD2 3.13Å; R165-D209 IonicContact NH2-OD1 2.7Å; R165-D209 PolarHBondContact NH2-OD1 2.93Å; R165-D209 IonicContact NH2-OD2 2.94Å
166	E	98.3	Very high	97.2	Very high	92 Å²	92	55.6 Å²	55.6	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-77.3	-15.6	-177.6	-70	-176	-171.1	0	0	112.9	Q162 A163 V164 R170	Q162-E166 PolarHBondContact NE2-OE1 2.93Å; Q162-E166 WeakPolarHBondContact O-CG 3.35Å; Q162-E166 PolarHBondContact O-N 3.4Å; A163-E166 PolarHBondContact O-N 2.03Å; V164-E166 VanDerWaalsContact C-N 3.32Å; V164-E166 PolarHBondContact O-N 3Å; E166-R170 PolarHBondContact O-NH2 2.93Å
167	T	98.5	Very high	97.1	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.025	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-111.6	-175.1	64.2	0	0	0	0	111.8	A163 V164 R165 R170 I385 E386 W389	A163-T167 WeakPolarHBondContact O-CB 3.29Å; A163-T167 WeakPolarHBondContact O-CG2 3.35Å; A163-T167 PolarHBondContact O-N 3.13Å; A163-T167 VanDerWaalsContact O-N 3.1Å; A163-T167 PolarHBondContact O-OG1 3.11Å; V164-T167 CarbonylContact O-C 3.58Å; V164-T167 PolarHBondContact O-N 2.93Å; R165-T167 VanDerWaalsContact C-N 3.26Å; R165-T167 PolarHBondContact O-N 2.88Å; T167-R170 WeakPolarHBondContact O-CB 3.27Å; T167-R170 PolarHBondContact O-N 2.94Å; T167-I385 HydrophobicContact CG2-CG2 4.1Å; T167-I385 WeakPolarHBondContact OG1-CG2 3.47Å; T167-E386 HydrophobicContact CG2-CG 4.43Å; T167-W389 HydrophobicContact CG2-CB 3.64Å; T167-W389 HydrophobicContact CG2-CD2 4.42Å; T167-W389 HydrophobicContact CG2-CG 3.71Å; T167-W389 WeakPolarHBondContact O-CZ2 3.16Å
168	W	98	Very high	97.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26.3	-166.1	59.2	-101.4	0	0	0	114.2	F149 I151 V164 R170 F244 V250 V252 T254 W389	F149-W168 HydrophobicContact CD1-CE3 4.23Å; F149-W168 AromaticContact CD1-CZ3 3.9Å; F149-W168 HydrophobicContact CD1-CZ3 3.9Å; F149-W168 HydrophobicContact CE1-CE3 4.17Å; F149-W168 HydrophobicContact CE1-CZ3 4.22Å; F149-W168 HydrophobicContact CG-CZ3 4.43Å; I151-W168 HydrophobicContact CD1-CH2 4.26Å; I151-W168 HydrophobicContact CD1-CZ3 4.17Å; I151-W168 HydrophobicContact CG1-CH2 3.87Å; I151-W168 HydrophobicContact CG1-CZ3 4.03Å; I151-W168 HydrophobicContact CG2-CH2 4.39Å; V164-W168 HydrophobicContact CB-CZ2 4.09Å; V164-W168 HydrophobicContact CG1-CD2 3.97Å; V164-W168 HydrophobicContact CG1-CE3 3.98Å; V164-W168 HydrophobicContact CG1-CH2 3.66Å; V164-W168 HydrophobicContact CG1-CZ2 3.63Å; V164-W168 HydrophobicContact CG1-CZ3 3.82Å; V164-W168 HydrophobicContact CG2-CH2 4.06Å; V164-W168 HydrophobicContact CG2-CZ2 3.31Å; V164-W168 PolarHBondContact O-N 2.83Å; W168-R170 VanDerWaalsContact C-N 3.28Å; W168-R170 PolarHBondContact O-N 2.97Å; W168-F244 HydrophobicContact CZ3-CE1 4.38Å; W168-V250 HydrophobicContact CH2-CG2 4.1Å; W168-V250 HydrophobicContact CZ2-CG2 3.84Å; W168-V250 WeakPolarHBondContact CZ2-O 3.45Å; W168-V250 PolarHBondContact NE1-O 2.8Å; W168-V252 HydrophobicContact CB-CB 4.01Å; W168-V252 WeakPolarHBondContact CB-O 3.41Å; W168-V252 HydrophobicContact CD2-CB 3.85Å; W168-V252 HydrophobicContact CD2-CG2 4.05Å; W168-V252 HydrophobicContact CE3-CB 3.79Å; W168-V252 HydrophobicContact CE3-CG2 3.84Å; W168-V252 HydrophobicContact CG-CB 3.98Å; W168-V252 HydrophobicContact CH2-CG2 4.43Å; W168-V252 HydrophobicContact CZ3-CB 4.49Å; W168-V252 HydrophobicContact CZ3-CG2 4.06Å; W168-T254 WeakPolarHBondContact CA-OG1 3.42Å; W168-T254 PolarHBondContact O-OG1 2.9Å; W168-W389 VanDerWaalsContact CA-CZ3 3.43Å; W168-W389 HydrophobicContact CB-CE3 3.95Å; W168-W389 HydrophobicContact CB-CH2 4.5Å; W168-W389 HydrophobicContact CB-CZ3 3.66Å
169	G	97.9	Very high	97	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.021	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	20.8	176.7	0	0	0	0	0	113.2	V164 D171 S182	V164-G169 CarbonylContact O-C 3.59Å; V164-G169 WeakPolarHBondContact O-CA 3.28Å; V164-G169 PolarHBondContact O-N 2.76Å; G169-D171 PolarHBondContact O-N 2.88Å; G169-S182 VanDerWaalsContact O-CB 3.27Å; G169-S182 WeakPolarHBondContact O-CB 3.34Å; G169-S182 PolarHBondContact O-OG 2.9Å
170	R	97.4	Very high	97	Very high	129 Å²	129	51.2 Å²	51.2	49%	0.487	25%	0.253	S	S	.	.			trans	-68.3	120.8	-177.9	-174.5	-176.2	-64.9	-175.1	-2	111.6	R165 E166 T167 W168 Y174	R165-R170 WeakPolarHBondContact O-CA 3.42Å; R165-R170 WeakPolarHBondContact O-CB 3.44Å; E166-R170 PolarHBondContact O-NH2 2.93Å; T167-R170 WeakPolarHBondContact O-CB 3.27Å; T167-R170 PolarHBondContact O-N 2.94Å; W168-R170 VanDerWaalsContact C-N 3.28Å; W168-R170 PolarHBondContact O-N 2.97Å; R170-Y174 WeakPolarHBondContact O-CE2 3.31Å; R170-Y174 PolarHBondContact O-OH 2.93Å
171	D	96.2	Very high	97	Very high	62 Å²	62	50.2 Å²	50.2	33%	0.332	25%	0.249	S	C	.	.			trans	-58.2	137.1	169	-89.7	32.1	0	0	0	111.2	K140 G169 R181 S182	K140-D171 WeakPolarHBondContact CE-OD2 3.42Å; K140-D171 IonicContact NZ-OD1 2.7Å; K140-D171 PolarHBondContact NZ-OD1 3.35Å; K140-D171 IonicContact NZ-OD2 2.81Å; K140-D171 PolarHBondContact NZ-OD2 2.7Å; G169-D171 PolarHBondContact O-N 2.88Å; D171-R181 WeakPolarHBondContact OD2-CD 3.46Å; D171-S182 WeakPolarHBondContact OD1-CB 3.43Å; D171-S182 PolarHBondContact OD1-N 2.7Å
172	G	96.2	Very high	97	Very high	22 Å²	22	50.2 Å²	50.2	23%	0.227	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-169.7	177.4	0	0	0	0	0	115.2	V180	G172-V180 PolarHBondContact N-O 3.37Å; G172-V180 VanDerWaalsContact N-O 3.14Å; G172-V180 PolarHBondContact O-N 2.83Å
173	V	96.9	Very high	97	Very high	95 Å²	95	47.5 Å²	47.5	58%	0.576	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.1	167.4	-179.2	0	0	0	0	106.6	R178	V173-R178 WeakPolarHBondContact CA-O 3.32Å
174	Y	96	Very high	97	Very high	40 Å²	40	47.4 Å²	47.4	16%	0.157	24%	0.236	C	C	.	.			trans	-94.1	-173.7	-179.7	-73.3	-108.1	0	0	0	109.6	R170 G177 R178 V180 T254 I258	R170-Y174 WeakPolarHBondContact O-CE2 3.31Å; R170-Y174 PolarHBondContact O-OH 2.93Å; Y174-G177 PolarHBondContact O-N 3.07Å; Y174-R178 PolarHBondContact N-O 3.4Å; Y174-V180 HydrophobicContact CD2-CB 3.75Å; Y174-V180 HydrophobicContact CD2-CG2 3.33Å; Y174-V180 HydrophobicContact CE2-CB 3.58Å; Y174-V180 HydrophobicContact CE2-CG1 4.13Å; Y174-V180 HydrophobicContact CE2-CG2 3.58Å; Y174-V180 HydrophobicContact CG-CG2 4.1Å; Y174-T254 HydrophobicContact CD1-CG2 4.36Å; Y174-T254 HydrophobicContact CE1-CG2 3.76Å; Y174-I258 HydrophobicContact CD1-CD1 3.8Å; Y174-I258 HydrophobicContact CD2-CD1 4.32Å; Y174-I258 HydrophobicContact CG-CD1 3.65Å
175	K	90.5	Very high	97	Very high	143 Å²	143	47.4 Å²	47.4	62%	0.622	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-50.3	150.9	177	-65.5	179.1	-178.3	169.7	0	111.1	G177 R178	K175-G177 PolarHBondContact O-N 2.88Å; K175-G177 VanDerWaalsContact O-N 3.15Å; K175-R178 WeakPolarHBondContact O-CG 3.37Å; K175-R178 PolarHBondContact O-N 3.25Å
176	N	91.7	Very high	96.9	Very high	122 Å²	122	46.3 Å²	46.3	65%	0.652	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	59.5	20.8	-177	-51.2	-29.9	0	0	0	114.7	R178 E262	N176-R178 HydrophobicContact CB-CG 4.4Å; N176-R178 PolarHBondContact O-N 2.98Å; N176-E262 WeakPolarHBondContact CB-OE1 3.36Å; N176-E262 PolarHBondContact ND2-OE1 2.82Å; N176-E262 VanDerWaalsContact ND2-OE1 3.1Å; N176-E262 PolarHBondContact ND2-OE2 3.34Å
177	G	94.7	Very high	96.9	Very high	54 Å²	54	41.9 Å²	41.9	56%	0.557	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	72.6	15.8	179	0	0	0	0	0	113.9	Y174 K175 R179	Y174-G177 PolarHBondContact O-N 3.07Å; K175-G177 PolarHBondContact O-N 2.88Å; K175-G177 VanDerWaalsContact O-N 3.15Å; G177-R179 PolarHBondContact O-N 3.12Å
178	R	96.9	Very high	96.6	Very high	83 Å²	83	43.5 Å²	43.5	31%	0.313	22%	0.22	S	C	.	.			trans	-70.8	113.5	-178.5	-61.2	-50.8	-176.3	172.7	-0.6	110.9	F146 V173 Y174 K175 N176 I258 E262	F146-R178 HydrophobicContact CB-CB 4.13Å; F146-R178 HydrophobicContact CD1-CB 3.73Å; F146-R178 HydrophobicContact CD1-CG 3.94Å; F146-R178 HydrophobicContact CD2-CG 4.47Å; F146-R178 HydrophobicContact CE1-CB 4.33Å; F146-R178 HydrophobicContact CE1-CG 4.14Å; F146-R178 HydrophobicContact CG-CB 3.98Å; F146-R178 HydrophobicContact CG-CG 4.09Å; F146-R178 HydrophobicContact CZ-CG 4.47Å; V173-R178 WeakPolarHBondContact CA-O 3.32Å; Y174-R178 PolarHBondContact N-O 3.4Å; K175-R178 WeakPolarHBondContact O-CG 3.37Å; K175-R178 PolarHBondContact O-N 3.25Å; N176-R178 HydrophobicContact CB-CG 4.4Å; N176-R178 PolarHBondContact O-N 2.98Å; R178-I258 HydrophobicContact CB-CG2 4.38Å; R178-I258 HydrophobicContact CG-CG2 4.09Å; R178-E262 WeakPolarHBondContact CG-OE1 3.48Å; R178-E262 IonicContact CZ-OE1 3.23Å; R178-E262 IonicContact NE-OE1 2.76Å; R178-E262 PolarHBondContact NE-OE1 2.96Å; R178-E262 IonicContact NH2-OE1 3.45Å; R178-E262 PolarHBondContact NH2-OE1 3.22Å
179	R	97.8	Very high	96.3	Very high	69 Å²	69	44.8 Å²	44.8	26%	0.26	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.9	178	-175.5	175.5	-67.5	120.5	-2.1	110.5	H144 F146 L147 G177	H144-R179 WeakPolarHBondContact O-CD 3.33Å; H144-R179 PolarHBondContact O-NH1 2.98Å; F146-R179 WeakPolarHBondContact CB-O 3.43Å; F146-R179 PolarHBondContact N-O 3.46Å; L147-R179 PolarHBondContact N-O 2.71Å; G177-R179 PolarHBondContact O-N 3.12Å
180	V	98.3	Very high	95.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.7	176	178.8	0	0	0	0	109.5	L147 F149 G172 Y174 I258	L147-V180 HydrophobicContact CB-CG2 4.3Å; L147-V180 WeakPolarHBondContact O-CA 3.33Å; F149-V180 HydrophobicContact CD2-CG1 3.54Å; F149-V180 HydrophobicContact CE2-CG1 3.59Å; G172-V180 PolarHBondContact N-O 3.37Å; G172-V180 VanDerWaalsContact N-O 3.14Å; G172-V180 PolarHBondContact O-N 2.83Å; Y174-V180 HydrophobicContact CD2-CB 3.75Å; Y174-V180 HydrophobicContact CD2-CG2 3.33Å; Y174-V180 HydrophobicContact CE2-CB 3.58Å; Y174-V180 HydrophobicContact CE2-CG1 4.13Å; Y174-V180 HydrophobicContact CE2-CG2 3.58Å; Y174-V180 HydrophobicContact CG-CG2 4.1Å; V180-I258 HydrophobicContact CG2-CD1 3.95Å
181	R	98.3	Very high	95	Very high	54 Å²	54	46.6 Å²	46.6	20%	0.204	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.8	174.4	-66.8	-66.6	180	-103.6	12.3	109.2	K140 T145 L147 L148 F149 D171	K140-R181 PolarHBondContact O-NE 3.43Å; T145-R181 HydrophobicContact CG2-CB 3.98Å; T145-R181 HydrophobicContact CG2-CG 3.88Å; L147-R181 PolarHBondContact O-N 3.16Å; L148-R181 CarbonylContact C-O 3.56Å; L148-R181 WeakPolarHBondContact CA-O 3.25Å; L148-R181 HydrophobicContact CD1-CB 3.96Å; F149-R181 PolarHBondContact N-O 2.75Å; D171-R181 WeakPolarHBondContact OD2-CD 3.46Å
182	S	98.4	Very high	94.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.007	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.8	179.1	-56	0	0	0	0	110.9	K140 F149 G169 D171 D209	K140-S182 WeakPolarHBondContact CE-O 3.38Å; K140-S182 PolarHBondContact NZ-O 2.87Å; F149-S182 CarbonylContact O-C 3.57Å; F149-S182 VanDerWaalsContact O-CA 3.31Å; F149-S182 WeakPolarHBondContact O-CA 3.31Å; G169-S182 VanDerWaalsContact O-CB 3.27Å; G169-S182 WeakPolarHBondContact O-CB 3.34Å; G169-S182 PolarHBondContact O-OG 2.9Å; D171-S182 WeakPolarHBondContact OD1-CB 3.43Å; D171-S182 PolarHBondContact OD1-N 2.7Å; S182-D209 WeakPolarHBondContact O-CB 3.02Å
183	V	98.8	Very high	94.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.8	170.8	-64.7	0	0	0	0	110	K140 L148 F149 I151 D209 L211 F229 W232	K140-V183 HydrophobicContact CD-CG1 4.34Å; K140-V183 HydrophobicContact CG-CG1 3.74Å; L148-V183 HydrophobicContact CD1-CG1 4.42Å; L148-V183 HydrophobicContact CD1-CG2 4.18Å; F149-V183 PolarHBondContact O-N 3.2Å; I151-V183 PolarHBondContact N-O 3.46Å; V183-D209 CarbonylContact C-O 3.48Å; V183-D209 VanDerWaalsContact CA-O 3.25Å; V183-D209 WeakPolarHBondContact CA-O 3.3Å; V183-L211 HydrophobicContact CB-CD1 4.12Å; V183-L211 HydrophobicContact CB-CG 4.37Å; V183-L211 HydrophobicContact CG1-CD1 4.44Å; V183-L211 HydrophobicContact CG2-CD1 4.04Å; V183-F229 HydrophobicContact CG2-CD2 4.48Å; V183-F229 HydrophobicContact CG2-CE2 3.81Å; V183-W232 HydrophobicContact CG1-CH2 4.01Å; V183-W232 HydrophobicContact CG1-CZ3 4.47Å; V183-W232 HydrophobicContact CG2-CZ3 4.42Å
184	F	98.9	Very high	93.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.8	167.5	-58.3	-81.9	0	0	0	108.4	I151 R161 V164 R165 L186 D209 L211	I151-F184 HydrophobicContact CB-CD1 3.6Å; I151-F184 HydrophobicContact CB-CE1 3.88Å; I151-F184 HydrophobicContact CD1-CD1 4.05Å; I151-F184 HydrophobicContact CD1-CE1 3.64Å; I151-F184 HydrophobicContact CD1-CZ 3.98Å; I151-F184 HydrophobicContact CG1-CD1 4.44Å; I151-F184 HydrophobicContact CG1-CE1 4.31Å; I151-F184 HydrophobicContact CG2-CD1 3.59Å; I151-F184 HydrophobicContact CG2-CE1 3.68Å; I151-F184 VanDerWaalsContact O-CA 3.31Å; I151-F184 WeakPolarHBondContact O-CA 3.47Å; R161-F184 HydrophobicContact CB-CD1 4.15Å; R161-F184 HydrophobicContact CB-CD2 4.32Å; R161-F184 HydrophobicContact CB-CE1 3.84Å; R161-F184 HydrophobicContact CB-CE2 4.05Å; R161-F184 HydrophobicContact CB-CG 4.37Å; R161-F184 HydrophobicContact CB-CZ 3.8Å; R161-F184 VanDerWaalsContact CD-CG 3.48Å; R161-F184 HydrophobicContact CG-CB 4.42Å; R161-F184 HydrophobicContact CG-CD1 3.5Å; R161-F184 VanDerWaalsContact CG-CD1 3.5Å; R161-F184 HydrophobicContact CG-CD2 4.19Å; R161-F184 HydrophobicContact CG-CE1 3.66Å; R161-F184 HydrophobicContact CG-CE2 4.35Å; R161-F184 HydrophobicContact CG-CG 3.77Å; R161-F184 HydrophobicContact CG-CZ 4.09Å; R161-F184 WeakPolarHBondContact O-CZ 3.38Å; V164-F184 HydrophobicContact CB-CE1 4.04Å; V164-F184 HydrophobicContact CB-CZ 3.94Å; V164-F184 HydrophobicContact CG1-CE1 3.97Å; V164-F184 HydrophobicContact CG1-CZ 3.86Å; R165-F184 HydrophobicContact CG-CE2 3.89Å; R165-F184 HydrophobicContact CG-CZ 4.13Å; F184-L186 HydrophobicContact CB-CD1 4.44Å; F184-D209 HydrophobicContact CD2-CB 4.44Å; F184-D209 PolarHBondContact N-O 2.86Å; F184-L211 PolarHBondContact O-N 3.35Å
185	F	98.3	Very high	93.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.9	-179.8	63.1	-73.7	0	0	0	111.8	A150 I151 K152 S153 L211 W213 K225 M226 F229	A150-F185 VanDerWaalsContact C-CE1 3.45Å; A150-F185 HydrophobicContact CB-CD1 4.3Å; A150-F185 HydrophobicContact CB-CE1 3.74Å; I151-F185 VanDerWaalsContact C-CE1 3.44Å; I151-F185 VanDerWaalsContact O-CD1 3.28Å; I151-F185 WeakPolarHBondContact O-CD1 3.48Å; I151-F185 PolarHBondContact O-N 3.34Å; K152-F185 HydrophobicContact CB-CZ 4.35Å; K152-F185 HydrophobicContact CD-CZ 4.35Å; K152-F185 HydrophobicContact CG-CE1 3.88Å; K152-F185 HydrophobicContact CG-CE2 3.8Å; K152-F185 HydrophobicContact CG-CZ 3.3Å; S153-F185 PolarHBondContact N-O 2.9Å; F185-L211 WeakPolarHBondContact CA-O 3.3Å; F185-L211 HydrophobicContact CB-CB 4.13Å; F185-W213 HydrophobicContact CB-CZ3 3.91Å; F185-K225 HydrophobicContact CD2-CD 3.74Å; F185-K225 HydrophobicContact CD2-CG 3.38Å; F185-K225 HydrophobicContact CE2-CD 3.83Å; F185-K225 HydrophobicContact CE2-CG 3.55Å; F185-M226 HydrophobicContact CZ-SD 4.36Å; F185-F229 HydrophobicContact CD1-CD2 4.15Å; F185-F229 HydrophobicContact CD1-CG 4.4Å; F185-F229 HydrophobicContact CD2-CB 3.69Å; F185-F229 HydrophobicContact CD2-CG 4.21Å; F185-F229 HydrophobicContact CE1-CD2 4.44Å; F185-F229 HydrophobicContact CE1-CG 4.35Å; F185-F229 HydrophobicContact CE2-CB 3.73Å; F185-F229 HydrophobicContact CE2-CG 4.14Å; F185-F229 HydrophobicContact CG-CB 4.21Å; F185-F229 HydrophobicContact CG-CD2 4.21Å; F185-F229 HydrophobicContact CG-CG 4.35Å; F185-F229 HydrophobicContact CZ-CB 4.29Å; F185-F229 HydrophobicContact CZ-CD1 4.47Å; F185-F229 HydrophobicContact CZ-CG 4.22Å
186	L	98.1	Very high	93.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	155.2	-164.3	-44	104.5	0	0	0	111.6	S154 F184 I210 L211 Q212 W213	S154-L186 WeakPolarHBondContact O-CD2 3.44Å; F184-L186 HydrophobicContact CB-CD1 4.44Å; L186-I210 HydrophobicContact CD1-CG2 3.57Å; L186-L211 WeakPolarHBondContact CD1-O 3.45Å; L186-L211 PolarHBondContact N-O 2.88Å; L186-Q212 WeakPolarHBondContact O-CA 3.35Å; L186-W213 PolarHBondContact O-N 2.9Å; L186-W213 VanDerWaalsContact O-N 3.16Å
187	G	96.6	Very high	93.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-169.6	158.9	0	0	0	0	0	112.2	P155 Q212 W213 F215 E217	P155-G187 WeakPolarHBondContact CG-O 3.42Å; G187-Q212 WeakPolarHBondContact O-CG 3.36Å; G187-Q212 PolarHBondContact O-NE2 3.06Å; G187-Q212 VanDerWaalsContact O-NE2 3.14Å; G187-W213 CarbonylContact C-O 3.48Å; G187-F215 CarbonylContact C-O 3.59Å; G187-F215 VanDerWaalsContact CA-O 3.29Å; G187-F215 WeakPolarHBondContact CA-O 3.3Å; G187-E217 PolarHBondContact N-OE2 3.15Å
188	N	93.7	Very high	93.5	Very high	37 Å²	37	50 Å²	50	20%	0.198	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	160.8	172.6	-156.9	1.5	0	0	0	110.9	L134 W213 D214 F215 E217	L134-N188 HydrophobicContact CD1-CB 4.41Å; N188-W213 PolarHBondContact N-O 2.63Å; N188-D214 PolarHBondContact ND2-OD1 2.9Å; N188-F215 PolarHBondContact N-O 3Å; N188-E217 WeakPolarHBondContact O-CB 3.5Å; N188-E217 PolarHBondContact O-N 3.44Å
189	Y	90.4	Very high	93.5	Very high	27 Å²	27	50.9 Å²	50.9	11%	0.106	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-57.3	151.8	175.7	-53.1	-86.2	0	0	0	111.5	P155 D193 L196 G197 L200 H216	P155-Y189 HydrophobicContact CB-CD1 3.55Å; P155-Y189 HydrophobicContact CB-CE1 3.04Å; P155-Y189 HydrophobicContact CB-CE2 4.27Å; P155-Y189 HydrophobicContact CB-CG 4.33Å; P155-Y189 VanDerWaalsContact CB-CZ 3.45Å; P155-Y189 HydrophobicContact CG-CD1 4.08Å; P155-Y189 HydrophobicContact CG-CE1 3.98Å; P155-Y189 HydrophobicContact CG-CG 4.47Å; Y189-D193 HydrophobicContact CD1-CB 4.46Å; Y189-L196 HydrophobicContact CE1-CB 3.67Å; Y189-L196 HydrophobicContact CE1-CD1 4.37Å; Y189-L196 HydrophobicContact CE1-CG 4.26Å; Y189-L196 PolarHBondContact OH-O 3.22Å; Y189-L196 VanDerWaalsContact OH-O 3.1Å; Y189-G197 WeakPolarHBondContact OH-CA 3.45Å; Y189-G197 PolarHBondContact OH-N 2.95Å; Y189-L200 VanDerWaalsContact OH-CB 3.24Å; Y189-L200 WeakPolarHBondContact OH-CB 3.4Å; Y189-L200 WeakPolarHBondContact OH-CD2 3.44Å; Y189-H216 PolarHBondContact O-ND1 3.31Å
190	Q	85.8	Confident	93.5	Very high	65 Å²	65	47.7 Å²	47.7	30%	0.304	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-74.2	155.9	163.6	-67.1	-71.7	-11.6	0	0	109.8	D192 D193 E217	Q190-D192 PolarHBondContact O-N 3.3Å; Q190-D193 WeakPolarHBondContact CB-OD2 3.38Å; Q190-D193 PolarHBondContact N-OD2 2.82Å; Q190-D193 WeakPolarHBondContact O-CB 3.5Å; Q190-D193 PolarHBondContact O-N 3.18Å; Q190-E217 PolarHBondContact NE2-O 2.89Å
191	P	81.8	Confident	93.4	Very high	104 Å²	104	50.9 Å²	50.9	68%	0.675	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.6	178.4	-27.5	35.9	0	0	0	114.5
192	D	86.3	Confident	93.4	Very high	162 Å²	162	55.2 Å²	55.2	87%	0.866	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-5.6	-178.8	-59.2	-37.2	0	0	0	113.3	Q190	Q190-D192 PolarHBondContact O-N 3.3Å
193	D	87.6	Confident	93.5	Very high	75 Å²	75	55.7 Å²	55.7	40%	0.401	32%	0.317	S	S	.	.	S	Bend	trans	-74.3	149.2	179.1	-73.4	-25.6	0	0	0	111	Y189 Q190 N195	Y189-D193 HydrophobicContact CD1-CB 4.46Å; Q190-D193 WeakPolarHBondContact CB-OD2 3.38Å; Q190-D193 PolarHBondContact N-OD2 2.82Å; Q190-D193 WeakPolarHBondContact O-CB 3.5Å; Q190-D193 PolarHBondContact O-N 3.18Å; D193-N195 PolarHBondContact O-N 2.82Å
194	P	89.8	Confident	93.4	Very high	91 Å²	91	55.9 Å²	55.9	59%	0.591	32%	0.319	S	S	*	.			trans	-54.9	138	167.1	-22.4	32.7	0	0	0	111	L196	P194-L196 HydrophobicContact CB-CD2 4.24Å; P194-L196 HydrophobicContact CB-CG 4.3Å; P194-L196 PolarHBondContact O-N 3.46Å
195	N	88.1	Confident	93.4	Very high	146 Å²	146	65 Å²	65	78%	0.781	36%	0.359	S	S	*	.			trans	-72.4	96.3	174.8	-175.8	-8.5	0	0	0	110.4	D193 G197	D193-N195 PolarHBondContact O-N 2.82Å; N195-G197 PolarHBondContact OD1-N 3.22Å; N195-G197 VanDerWaalsContact OD1-N 3.08Å
196	L	91.8	Very high	93.4	Very high	39 Å²	39	70.9 Å²	70.9	20%	0.204	39%	0.386	C	S	.	.			trans	-100.2	13.3	176.8	-49.5	167.9	0	0	0	112.2	A156 F158 Y189 P194 A198 L199 L200	A156-L196 HydrophobicContact CB-CD1 3.89Å; F158-L196 HydrophobicContact CE2-CB 4.13Å; F158-L196 HydrophobicContact CE2-CD1 3.97Å; F158-L196 HydrophobicContact CZ-CB 4.28Å; Y189-L196 HydrophobicContact CE1-CB 3.67Å; Y189-L196 HydrophobicContact CE1-CD1 4.37Å; Y189-L196 HydrophobicContact CE1-CG 4.26Å; Y189-L196 PolarHBondContact OH-O 3.22Å; Y189-L196 VanDerWaalsContact OH-O 3.1Å; P194-L196 HydrophobicContact CB-CD2 4.24Å; P194-L196 HydrophobicContact CB-CG 4.3Å; P194-L196 PolarHBondContact O-N 3.46Å; L196-A198 VanDerWaalsContact C-N 3.32Å; L196-A198 PolarHBondContact O-N 3.12Å; L196-L199 HydrophobicContact CD2-CD1 4.11Å; L196-L199 PolarHBondContact O-N 2.99Å; L196-L200 PolarHBondContact O-N 3.16Å
197	G	93.1	Very high	93.4	Very high	18 Å²	18	74.3 Å²	74.3	19%	0.186	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-38.1	-171.1	0	0	0	0	0	113.8	Y189 N195 S201	Y189-G197 WeakPolarHBondContact OH-CA 3.45Å; Y189-G197 PolarHBondContact OH-N 2.95Å; N195-G197 PolarHBondContact OD1-N 3.22Å; N195-G197 VanDerWaalsContact OD1-N 3.08Å; G197-S201 WeakPolarHBondContact O-CB 3.08Å; G197-S201 PolarHBondContact O-N 3.24Å; G197-S201 PolarHBondContact O-OG 3.34Å
198	A	95.2	Very high	93.4	Very high	80 Å²	80	75.3 Å²	75.3	66%	0.661	41%	0.412	S	S	*	.	H	α-helix	trans	-65.9	-40.4	175.7	0	0	0	0	0	112.5	L196 S201 F202	L196-A198 VanDerWaalsContact C-N 3.32Å; L196-A198 PolarHBondContact O-N 3.12Å; A198-S201 PolarHBondContact O-N 2.79Å; A198-F202 WeakPolarHBondContact O-CB 3.49Å; A198-F202 PolarHBondContact O-N 3.1Å
199	L	96.8	Very high	93.7	Very high	101 Å²	101	73.9 Å²	73.9	53%	0.529	40%	0.404	S	S	.	.	H	α-helix	trans	-67.9	-43.3	177.1	-67.5	173	0	0	0	111.1	F158 L196 S201 F202 E203	F158-L199 HydrophobicContact CE1-CB 4.1Å; F158-L199 HydrophobicContact CZ-CB 3.76Å; L196-L199 HydrophobicContact CD2-CD1 4.11Å; L196-L199 PolarHBondContact O-N 2.99Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 3.16Å; L199-F202 WeakPolarHBondContact O-CB 3.35Å; L199-F202 PolarHBondContact O-N 3.07Å; L199-E203 WeakPolarHBondContact O-CB 2.97Å; L199-E203 PolarHBondContact O-N 2.73Å
200	L	97.6	Very high	94.1	Very high	1 Å²	1	72.6 Å²	72.6	1%	0.005	40%	0.399	C	S	.	.	H	α-helix	trans	-64.7	-39.3	177	-171.4	71.4	0	0	0	111.6	I135 P155 F158 Y189 L196 F202 E203 A204 I210	I135-L200 HydrophobicContact CD1-CD2 4.26Å; I135-L200 HydrophobicContact CD1-CG 4.3Å; P155-L200 HydrophobicContact CB-CD2 4.3Å; F158-L200 HydrophobicContact CE1-CB 4.45Å; F158-L200 HydrophobicContact CE1-CD1 4.31Å; F158-L200 HydrophobicContact CZ-CB 4.22Å; F158-L200 HydrophobicContact CZ-CD1 4.43Å; Y189-L200 VanDerWaalsContact OH-CB 3.24Å; Y189-L200 WeakPolarHBondContact OH-CB 3.4Å; Y189-L200 WeakPolarHBondContact OH-CD2 3.44Å; L196-L200 PolarHBondContact O-N 3.16Å; L200-F202 VanDerWaalsContact C-N 3.35Å; L200-E203 PolarHBondContact O-N 3.31Å; L200-A204 VanDerWaalsContact O-CB 3.23Å; L200-A204 WeakPolarHBondContact O-CB 3.35Å; L200-A204 PolarHBondContact O-N 3.32Å; L200-I210 HydrophobicContact CD1-CD1 3.71Å; L200-I210 HydrophobicContact CD1-CG2 4.47Å; L200-I210 HydrophobicContact CG-CD1 4.44Å
201	S	97.3	Very high	94.7	Very high	67 Å²	67	69.5 Å²	69.5	47%	0.469	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-40.3	175	-61.5	0	0	0	0	112	G197 A198 L199 K205	G197-S201 WeakPolarHBondContact O-CB 3.08Å; G197-S201 PolarHBondContact O-N 3.24Å; G197-S201 PolarHBondContact O-OG 3.34Å; A198-S201 PolarHBondContact O-N 2.79Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 3.16Å; S201-K205 WeakPolarHBondContact O-CB 3.16Å; S201-K205 PolarHBondContact O-N 3.32Å
202	F	98.3	Very high	95.5	Very high	145 Å²	145	65.1 Å²	65.1	64%	0.636	36%	0.355	S	S	*	.	H	α-helix	trans	-63.4	-48.4	174.4	177.1	-92.7	0	0	0	111.4	A198 L199 L200 A204 K205 H206	A198-F202 WeakPolarHBondContact O-CB 3.49Å; A198-F202 PolarHBondContact O-N 3.1Å; L199-F202 WeakPolarHBondContact O-CB 3.35Å; L199-F202 PolarHBondContact O-N 3.07Å; L200-F202 VanDerWaalsContact C-N 3.35Å; F202-A204 PolarHBondContact O-N 3.33Å; F202-K205 PolarHBondContact O-N 3.25Å; F202-H206 WeakPolarHBondContact O-CB 3.38Å; F202-H206 PolarHBondContact O-N 3.11Å
203	E	98.6	Very high	96	Very high	11 Å²	11	58 Å²	58	5%	0.051	32%	0.316	C	S	.	.	H	α-helix	trans	-57.9	-48.4	176.2	-173.1	-170.1	-175.7	0	0	111.2	F158 R161 R165 L199 L200 K205 H206 F207 I210	F158-E203 WeakPolarHBondContact CD1-OE2 3.39Å; F158-E203 HydrophobicContact CE1-CB 4.25Å; F158-E203 WeakPolarHBondContact CE1-OE2 3.38Å; R161-E203 IonicContact CZ-OE1 3.41Å; R161-E203 IonicContact CZ-OE2 3.83Å; R161-E203 IonicContact NE-OE1 3.56Å; R161-E203 PolarHBondContact NE-OE1 3.43Å; R161-E203 IonicContact NE-OE2 3.21Å; R161-E203 PolarHBondContact NE-OE2 2.76Å; R161-E203 VanDerWaalsContact NE-OE2 3.15Å; R161-E203 IonicContact NH2-OE1 2.67Å; R161-E203 IonicContact NH2-OE2 2.72Å; R161-E203 PolarHBondContact NH2-OE2 2.94Å; R165-E203 IonicContact CZ-OE1 3.67Å; R165-E203 IonicContact NH1-OE1 3.96Å; R165-E203 PolarHBondContact NH1-OE1 2.67Å; R165-E203 IonicContact NH2-OE1 3.97Å; R165-E203 PolarHBondContact NH2-OE1 2.81Å; L199-E203 WeakPolarHBondContact O-CB 2.97Å; L199-E203 PolarHBondContact O-N 2.73Å; L200-E203 PolarHBondContact O-N 3.31Å; E203-K205 VanDerWaalsContact C-N 3.32Å; E203-K205 PolarHBondContact O-N 3.26Å; E203-H206 PolarHBondContact O-N 3.02Å; E203-H206 VanDerWaalsContact O-N 3.13Å; E203-F207 HydrophobicContact CG-CD2 3.65Å; E203-F207 HydrophobicContact CG-CE2 3.99Å; E203-F207 WeakPolarHBondContact O-CD2 3.12Å; E203-F207 PolarHBondContact O-N 3.43Å; E203-I210 HydrophobicContact CB-CD1 4.02Å; E203-I210 VanDerWaalsContact CD-CD1 3.5Å; E203-I210 HydrophobicContact CG-CD1 3.72Å; E203-I210 WeakPolarHBondContact OE2-CD1 3.42Å
204	A	98.1	Very high	96.4	Very high	5 Å²	5	56.9 Å²	56.9	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-41.9	179.7	0	0	0	0	0	112.3	I135 L200 F202 G208 I210	I135-A204 HydrophobicContact CD1-CB 4.1Å; I135-A204 HydrophobicContact CG2-CB 3.7Å; L200-A204 VanDerWaalsContact O-CB 3.23Å; L200-A204 WeakPolarHBondContact O-CB 3.35Å; L200-A204 PolarHBondContact O-N 3.32Å; F202-A204 PolarHBondContact O-N 3.33Å; A204-G208 VanDerWaalsContact O-CA 3.31Å; A204-G208 WeakPolarHBondContact O-CA 3.48Å; A204-G208 PolarHBondContact O-N 2.87Å; A204-I210 HydrophobicContact CB-CB 3.73Å; A204-I210 HydrophobicContact CB-CD1 4.07Å; A204-I210 HydrophobicContact CB-CG1 4.25Å; A204-I210 HydrophobicContact CB-CG2 4.09Å
205	K	98.1	Very high	96.6	Very high	190 Å²	190	52.8 Å²	52.8	83%	0.826	28%	0.283	S	S	*	.	H	α-helix	trans	-69.3	-36.6	176.6	-175.4	178.6	179.3	-179	0	112	S201 F202 E203	S201-K205 WeakPolarHBondContact O-CB 3.16Å; S201-K205 PolarHBondContact O-N 3.32Å; F202-K205 PolarHBondContact O-N 3.25Å; E203-K205 VanDerWaalsContact C-N 3.32Å; E203-K205 PolarHBondContact O-N 3.26Å
206	H	98.1	Very high	96.8	Very high	124 Å²	124	48.9 Å²	48.9	57%	0.574	26%	0.26	S	S	*	.	H	α-helix	trans	-73.2	-45.8	-177	-172.6	78.1	0	0	0	112.3	F202 E203	F202-H206 WeakPolarHBondContact O-CB 3.38Å; F202-H206 PolarHBondContact O-N 3.11Å; E203-H206 PolarHBondContact O-N 3.02Å; E203-H206 VanDerWaalsContact O-N 3.13Å
207	F	98.2	Very high	96.9	Very high	72 Å²	72	48.1 Å²	48.1	32%	0.316	26%	0.255	S	S	.	.	H	α-helix	trans	-98.5	-21.8	-174.1	-64.4	-73.2	0	0	0	114.2	Q162 E203 D209	Q162-F207 VanDerWaalsContact OE1-CZ 3.23Å; E203-F207 HydrophobicContact CG-CD2 3.65Å; E203-F207 HydrophobicContact CG-CE2 3.99Å; E203-F207 WeakPolarHBondContact O-CD2 3.12Å; E203-F207 PolarHBondContact O-N 3.43Å; F207-D209 WeakPolarHBondContact CB-OD1 3.19Å; F207-D209 PolarHBondContact O-N 2.93Å
208	G	97.9	Very high	96.9	Very high	22 Å²	22	48 Å²	48	23%	0.227	25%	0.252	C	S	.	.	S	Bend	trans	62.5	31.1	178.5	0	0	0	0	0	113.6	Q137 A204	Q137-G208 VanDerWaalsContact CD-C 3.43Å; Q137-G208 WeakPolarHBondContact CG-O 3.47Å; A204-G208 VanDerWaalsContact O-CA 3.31Å; A204-G208 WeakPolarHBondContact O-CA 3.48Å; A204-G208 PolarHBondContact O-N 2.87Å
209	D	98.4	Very high	96.8	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	24%	0.237	C	C	.	.			trans	-129.7	10.9	-174	63.5	8.9	0	0	0	114.1	R165 S182 V183 F184 F207	R165-D209 IonicContact CZ-OD1 2.74Å; R165-D209 IonicContact CZ-OD2 2.89Å; R165-D209 IonicContact NE-OD1 3.63Å; R165-D209 IonicContact NE-OD2 3.56Å; R165-D209 PolarHBondContact NE-OD2 3.13Å; R165-D209 IonicContact NH2-OD1 2.7Å; R165-D209 PolarHBondContact NH2-OD1 2.93Å; R165-D209 IonicContact NH2-OD2 2.94Å; S182-D209 WeakPolarHBondContact O-CB 3.02Å; V183-D209 CarbonylContact C-O 3.48Å; V183-D209 VanDerWaalsContact CA-O 3.25Å; V183-D209 WeakPolarHBondContact CA-O 3.3Å; F184-D209 HydrophobicContact CD2-CB 4.44Å; F184-D209 PolarHBondContact N-O 2.86Å; F207-D209 WeakPolarHBondContact CB-OD1 3.19Å; F207-D209 PolarHBondContact O-N 2.93Å
210	I	98.8	Very high	96.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.6	-178.8	-66.2	-171.4	0	0	0	111.2	I135 Q137 L186 L200 E203 A204	I135-I210 HydrophobicContact CB-CG2 4.45Å; I135-I210 HydrophobicContact CD1-CG2 4.21Å; I135-I210 HydrophobicContact CG2-CB 4.46Å; I135-I210 HydrophobicContact CG2-CG2 4.13Å; I135-I210 WeakPolarHBondContact CG2-O 3.36Å; Q137-I210 VanDerWaalsContact CG-O 3.26Å; Q137-I210 WeakPolarHBondContact CG-O 3.45Å; Q137-I210 PolarHBondContact NE2-O 3.25Å; L186-I210 HydrophobicContact CD1-CG2 3.57Å; L200-I210 HydrophobicContact CD1-CD1 3.71Å; L200-I210 HydrophobicContact CD1-CG2 4.47Å; L200-I210 HydrophobicContact CG-CD1 4.44Å; E203-I210 HydrophobicContact CB-CD1 4.02Å; E203-I210 VanDerWaalsContact CD-CD1 3.5Å; E203-I210 HydrophobicContact CG-CD1 3.72Å; E203-I210 WeakPolarHBondContact OE2-CD1 3.42Å; A204-I210 HydrophobicContact CB-CB 3.73Å; A204-I210 HydrophobicContact CB-CD1 4.07Å; A204-I210 HydrophobicContact CB-CG1 4.25Å; A204-I210 HydrophobicContact CB-CG2 4.09Å
211	L	98.8	Very high	96.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.6	169.2	-55.3	177	0	0	0	109.1	I135 Q137 V183 F184 F185 L186 W213 F229 W232	I135-L211 WeakPolarHBondContact O-CA 3.07Å; Q137-L211 HydrophobicContact CB-CD2 3.97Å; Q137-L211 HydrophobicContact CG-CD2 3.97Å; V183-L211 HydrophobicContact CB-CD1 4.12Å; V183-L211 HydrophobicContact CB-CG 4.37Å; V183-L211 HydrophobicContact CG1-CD1 4.44Å; V183-L211 HydrophobicContact CG2-CD1 4.04Å; F184-L211 PolarHBondContact O-N 3.35Å; F185-L211 WeakPolarHBondContact CA-O 3.3Å; F185-L211 HydrophobicContact CB-CB 4.13Å; L186-L211 WeakPolarHBondContact CD1-O 3.45Å; L186-L211 PolarHBondContact N-O 2.88Å; L211-W213 HydrophobicContact CB-CE3 4.46Å; L211-W213 HydrophobicContact CB-CH2 3.76Å; L211-W213 HydrophobicContact CB-CZ3 3.55Å; L211-W213 HydrophobicContact CD1-CH2 4.03Å; L211-W213 HydrophobicContact CD1-CZ3 4.49Å; L211-W213 HydrophobicContact CG-CH2 4.47Å; L211-F229 HydrophobicContact CD1-CD2 4.43Å; L211-W232 HydrophobicContact CD1-CD2 3.46Å; L211-W232 VanDerWaalsContact CD1-CD2 3.46Å; L211-W232 HydrophobicContact CD1-CE3 3.69Å; L211-W232 HydrophobicContact CD1-CG 3.94Å; L211-W232 HydrophobicContact CD1-CH2 4.09Å; L211-W232 HydrophobicContact CD1-CZ2 3.88Å; L211-W232 HydrophobicContact CD1-CZ3 4Å; L211-W232 HydrophobicContact CD2-CD2 4.3Å; L211-W232 HydrophobicContact CD2-CZ2 3.77Å; L211-W232 HydrophobicContact CG-CZ2 4.4Å
212	Q	98.4	Very high	96.7	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.051	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.9	-178.8	-168.4	-176.9	21.6	0	0	110.7	L134 I135 L186 G187	L134-Q212 HydrophobicContact CB-CB 4.29Å; L134-Q212 HydrophobicContact CB-CG 4.31Å; L134-Q212 HydrophobicContact CD1-CG 4.27Å; L134-Q212 PolarHBondContact N-O 3.17Å; I135-Q212 HydrophobicContact CB-CB 3.85Å; I135-Q212 HydrophobicContact CD1-CB 4.2Å; I135-Q212 VanDerWaalsContact CD1-OE1 3.28Å; I135-Q212 HydrophobicContact CG1-CB 4Å; I135-Q212 PolarHBondContact N-O 2.82Å; I135-Q212 PolarHBondContact O-N 3.37Å; L186-Q212 WeakPolarHBondContact O-CA 3.35Å; G187-Q212 WeakPolarHBondContact O-CG 3.36Å; G187-Q212 PolarHBondContact O-NE2 3.06Å; G187-Q212 VanDerWaalsContact O-NE2 3.14Å
213	W	97.9	Very high	96.6	Very high	13 Å²	13	35.6 Å²	35.6	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	155.2	172.6	-71.1	-96.4	0	0	0	111.4	P131 P132 I133 F185 L186 G187 N188 L211 F215 M228 W232	P131-W213 HydrophobicContact CB-CB 4.32Å; P131-W213 HydrophobicContact CG-CB 4.21Å; P132-W213 WeakPolarHBondContact O-CA 3.31Å; I133-W213 HydrophobicContact CD1-CZ2 4.15Å; F185-W213 HydrophobicContact CB-CZ3 3.91Å; L186-W213 PolarHBondContact O-N 2.9Å; L186-W213 VanDerWaalsContact O-N 3.16Å; G187-W213 CarbonylContact C-O 3.48Å; N188-W213 PolarHBondContact N-O 2.63Å; L211-W213 HydrophobicContact CB-CE3 4.46Å; L211-W213 HydrophobicContact CB-CH2 3.76Å; L211-W213 HydrophobicContact CB-CZ3 3.55Å; L211-W213 HydrophobicContact CD1-CH2 4.03Å; L211-W213 HydrophobicContact CD1-CZ3 4.49Å; L211-W213 HydrophobicContact CG-CH2 4.47Å; W213-F215 HydrophobicContact CB-CD1 3.66Å; W213-F215 HydrophobicContact CB-CE1 3.69Å; W213-F215 PolarHBondContact O-N 3.45Å; W213-M228 HydrophobicContact CB-CG 4.49Å; W213-M228 HydrophobicContact CD2-CB 3.69Å; W213-M228 HydrophobicContact CD2-CG 4.11Å; W213-M228 HydrophobicContact CE3-CB 4.1Å; W213-M228 HydrophobicContact CG-CB 4.07Å; W213-M228 HydrophobicContact CG-CG 3.93Å; W213-M228 HydrophobicContact CG-SD 4.48Å; W213-M228 HydrophobicContact CH2-CB 4.27Å; W213-M228 HydrophobicContact CZ2-CB 3.89Å; W213-M228 WeakPolarHBondContact CZ2-O 3.13Å; W213-M228 HydrophobicContact CZ3-CB 4.38Å; W213-W232 HydrophobicContact CH2-CB 4.08Å; W213-W232 HydrophobicContact CH2-CG 4.35Å; W213-W232 HydrophobicContact CZ2-CB 3.89Å; W213-W232 HydrophobicContact CZ2-CG 4.32Å
214	D	94.5	Very high	96.6	Very high	52 Å²	52	35.4 Å²	35.4	28%	0.278	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	55.7	-177.3	-170.7	36.7	0	0	0	113	W94 P132 L134 N188	W94-D214 VanDerWaalsContact CE2-O 3.23Å; W94-D214 WeakPolarHBondContact CZ2-O 3.32Å; W94-D214 PolarHBondContact NE1-O 3.43Å; W94-D214 PolarHBondContact NE1-OD2 3.13Å; P132-D214 HydrophobicContact CB-CB 4.5Å; P132-D214 PolarHBondContact O-N 3.35Å; L134-D214 HydrophobicContact CD1-CB 3.9Å; L134-D214 HydrophobicContact CD2-CB 3.96Å; L134-D214 HydrophobicContact CG-CB 3.88Å; N188-D214 PolarHBondContact ND2-OD1 2.9Å
215	F	93.9	Very high	96.6	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145	166.8	67.7	-94.4	0	0	0	109.1	W94 P131 G187 N188 W213 E217 N221 L224 K225 M228	W94-F215 HydrophobicContact CH2-CB 3.82Å; W94-F215 HydrophobicContact CZ2-CB 4.22Å; P131-F215 HydrophobicContact CB-CB 4.32Å; P131-F215 HydrophobicContact CB-CD1 4.32Å; P131-F215 HydrophobicContact CG-CD1 3.92Å; G187-F215 CarbonylContact C-O 3.59Å; G187-F215 VanDerWaalsContact CA-O 3.29Å; G187-F215 WeakPolarHBondContact CA-O 3.3Å; N188-F215 PolarHBondContact N-O 3Å; W213-F215 HydrophobicContact CB-CD1 3.66Å; W213-F215 HydrophobicContact CB-CE1 3.69Å; W213-F215 PolarHBondContact O-N 3.45Å; F215-E217 PolarHBondContact O-N 2.86Å; F215-N221 HydrophobicContact CD2-CB 4.07Å; F215-N221 HydrophobicContact CE2-CB 4.2Å; F215-L224 HydrophobicContact CB-CD2 3.82Å; F215-L224 HydrophobicContact CD1-CD2 4.14Å; F215-L224 HydrophobicContact CD1-CG 4.32Å; F215-L224 HydrophobicContact CD2-CD2 4.3Å; F215-L224 HydrophobicContact CG-CD2 3.82Å; F215-L224 HydrophobicContact CG-CG 4.4Å; F215-K225 HydrophobicContact CE1-CB 4.34Å; F215-K225 HydrophobicContact CE2-CB 4.1Å; F215-K225 HydrophobicContact CZ-CB 3.49Å; F215-K225 VanDerWaalsContact CZ-CB 3.49Å; F215-K225 HydrophobicContact CZ-CG 3.81Å; F215-M228 HydrophobicContact CE1-CG 4.47Å
216	H	92.9	Very high	96.5	Very high	65 Å²	65	26.5 Å²	26.5	30%	0.301	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	132.3	-178.7	-62.5	-63.2	0	0	0	112	Y189 S218 N221	Y189-H216 PolarHBondContact O-ND1 3.31Å; H216-S218 PolarHBondContact O-N 3.39Å; H216-N221 PolarHBondContact O-ND2 3.26Å
217	E	93.8	Very high	96.5	Very high	22 Å²	22	20.6 Å²	20.6	10%	0.103	11%	0.108	C	C	.	.			trans	-61.2	123.1	177.6	-169.8	60.6	-95	0	0	110.9	G187 N188 Q190 F215 K225	G187-E217 PolarHBondContact N-OE2 3.15Å; N188-E217 WeakPolarHBondContact O-CB 3.5Å; N188-E217 PolarHBondContact O-N 3.44Å; Q190-E217 PolarHBondContact NE2-O 2.89Å; F215-E217 PolarHBondContact O-N 2.86Å; E217-K225 WeakPolarHBondContact OE1-CE 3.35Å; E217-K225 IonicContact OE1-NZ 2.85Å; E217-K225 PolarHBondContact OE1-NZ 3.31Å; E217-K225 VanDerWaalsContact OE2-CE 3.31Å; E217-K225 WeakPolarHBondContact OE2-CE 3.22Å; E217-K225 IonicContact OE2-NZ 3.5Å; E217-K225 PolarHBondContact OE2-NZ 2.78Å
218	S	93.4	Very high	96.5	Very high	17 Å²	17	17.6 Å²	17.6	12%	0.119	10%	0.095	C	C	.	.			trans	-162.9	145.7	-175.8	171.1	0	0	0	0	110.5	H216 L220 N221	H216-S218 PolarHBondContact O-N 3.39Å; S218-L220 PolarHBondContact O-N 2.84Å; S218-L220 PolarHBondContact OG-N 3Å; S218-N221 PolarHBondContact O-N 3.24Å
219	L	93.8	Very high	96.5	Very high	65 Å²	65	16.6 Å²	16.6	34%	0.34	9%	0.085	S	C	.	.	G	3₁₀ helix	trans	-53.6	-40.6	174.2	-177	68	0	0	0	112	N221 L222 K290	L219-N221 VanDerWaalsContact C-N 3.28Å; L219-N221 PolarHBondContact O-N 2.84Å; L219-L222 HydrophobicContact CD1-CD1 3.83Å; L219-L222 VanDerWaalsContact O-CG 3.29Å; L219-L222 WeakPolarHBondContact O-CG 3.5Å; L219-L222 PolarHBondContact O-N 2.83Å; L219-K290 HydrophobicContact CD2-CB 4Å; L219-K290 HydrophobicContact CD2-CD 4.47Å; L219-K290 WeakPolarHBondContact CD2-O 3.29Å
220	L	95.9	Very high	96.5	Very high	13 Å²	13	16.2 Å²	16.2	7%	0.068	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-76.8	-16.9	-177.9	-50.7	-172.9	0	0	0	112.7	L118 F119 Y122 S218 P332	L118-L220 HydrophobicContact CB-CD1 4.47Å; L118-L220 HydrophobicContact CD2-CD1 4.23Å; L118-L220 HydrophobicContact CD2-CG 4.11Å; L118-L220 HydrophobicContact CG-CD1 3.82Å; L118-L220 HydrophobicContact CG-CG 4.12Å; F119-L220 HydrophobicContact CB-CD1 4.26Å; F119-L220 HydrophobicContact CD2-CD1 3.95Å; F119-L220 HydrophobicContact CG-CD1 4.33Å; Y122-L220 HydrophobicContact CD2-CB 3.66Å; Y122-L220 VanDerWaalsContact CD2-O 3.31Å; Y122-L220 WeakPolarHBondContact CD2-O 3.47Å; Y122-L220 HydrophobicContact CE2-CB 4.41Å; Y122-L220 WeakPolarHBondContact CE2-O 3.38Å; Y122-L220 HydrophobicContact CG-CB 3.93Å; Y122-L220 HydrophobicContact CG-CD1 4.23Å; S218-L220 PolarHBondContact O-N 2.84Å; S218-L220 PolarHBondContact OG-N 3Å; L220-P332 HydrophobicContact CB-CB 4.16Å; L220-P332 HydrophobicContact CD2-CB 4.03Å
221	N	96.3	Very high	96.4	Very high	32 Å²	32	19 Å²	19	17%	0.171	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-91.2	4.7	177.6	-73.5	-18.6	0	0	0	113	F215 H216 S218 L219 S223 L224 K225	F215-N221 HydrophobicContact CD2-CB 4.07Å; F215-N221 HydrophobicContact CE2-CB 4.2Å; H216-N221 PolarHBondContact O-ND2 3.26Å; S218-N221 PolarHBondContact O-N 3.24Å; L219-N221 VanDerWaalsContact C-N 3.28Å; L219-N221 PolarHBondContact O-N 2.84Å; N221-S223 PolarHBondContact O-N 3.47Å; N221-L224 WeakPolarHBondContact O-CB 3.49Å; N221-L224 PolarHBondContact O-N 3.47Å; N221-L224 VanDerWaalsContact O-N 3.11Å; N221-K225 PolarHBondContact O-N 3.1Å
222	L	96.9	Very high	96.4	Very high	22 Å²	22	19.4 Å²	19.4	12%	0.115	10%	0.097	C	C	.	.	H	α-helix	trans	-61	-30.7	179.9	-70.9	-179.5	0	0	0	112.9	K152 L219 K225 M226 D334	K152-L222 HydrophobicContact CD-CD2 4.28Å; L219-L222 HydrophobicContact CD1-CD1 3.83Å; L219-L222 VanDerWaalsContact O-CG 3.29Å; L219-L222 WeakPolarHBondContact O-CG 3.5Å; L219-L222 PolarHBondContact O-N 2.83Å; L222-K225 HydrophobicContact CD2-CD 4.12Å; L222-K225 WeakPolarHBondContact O-CB 3.4Å; L222-K225 PolarHBondContact O-N 3.45Å; L222-M226 WeakPolarHBondContact O-CB 3.33Å; L222-M226 PolarHBondContact O-N 3.07Å; L222-D334 HydrophobicContact CB-CB 3.61Å
223	S	97.1	Very high	96.4	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-66.3	-43.6	173.5	-58.8	0	0	0	0	112.3	N221 K225 M226 D227 F331 D334 Y337	N221-S223 PolarHBondContact O-N 3.47Å; S223-K225 VanDerWaalsContact C-N 3.3Å; S223-K225 PolarHBondContact O-N 3.02Å; S223-M226 PolarHBondContact O-N 3.21Å; S223-D227 PolarHBondContact O-N 3.35Å; S223-F331 VanDerWaalsContact CB-O 3.28Å; S223-F331 WeakPolarHBondContact CB-O 3.36Å; S223-F331 PolarHBondContact OG-O 2.87Å; S223-D334 VanDerWaalsContact OG-CA 3.24Å; S223-D334 WeakPolarHBondContact OG-CA 3.46Å; S223-Y337 WeakPolarHBondContact OG-CB 3.45Å
224	L	97.1	Very high	96.3	Very high	7 Å²	7	20.6 Å²	20.6	4%	0.037	11%	0.107	C	C	.	.	H	α-helix	trans	-61.3	-42.4	173.1	177	60.5	0	0	0	110.8	P131 F215 N221 M226 D227 M228 L330	P131-L224 HydrophobicContact CG-CD1 4.41Å; P131-L224 HydrophobicContact CG-CD2 4.47Å; F215-L224 HydrophobicContact CB-CD2 3.82Å; F215-L224 HydrophobicContact CD1-CD2 4.14Å; F215-L224 HydrophobicContact CD1-CG 4.32Å; F215-L224 HydrophobicContact CD2-CD2 4.3Å; F215-L224 HydrophobicContact CG-CD2 3.82Å; F215-L224 HydrophobicContact CG-CG 4.4Å; N221-L224 WeakPolarHBondContact O-CB 3.49Å; N221-L224 PolarHBondContact O-N 3.47Å; N221-L224 VanDerWaalsContact O-N 3.11Å; L224-M226 VanDerWaalsContact C-N 3.32Å; L224-M226 PolarHBondContact O-N 3.28Å; L224-D227 WeakPolarHBondContact O-CB 3.43Å; L224-D227 PolarHBondContact O-N 2.87Å; L224-M228 HydrophobicContact CD1-CE 4.03Å; L224-M228 HydrophobicContact CD1-CG 4.46Å; L224-M228 WeakPolarHBondContact O-CG 3.03Å; L224-M228 PolarHBondContact O-N 3.46Å; L224-L330 HydrophobicContact CB-CD1 3.89Å; L224-L330 HydrophobicContact CD1-CD1 4.27Å
225	K	97.9	Very high	96.5	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.013	13%	0.127	C	C	.	.	H	α-helix	trans	-57.8	-45.6	175.7	-176.4	-175.7	-74.5	-173.5	0	111.2	K152 S153 F185 F215 E217 N221 L222 S223 M228 F229	K152-K225 HydrophobicContact CG-CD 4.3Å; S153-K225 PolarHBondContact O-NZ 3.29Å; F185-K225 HydrophobicContact CD2-CD 3.74Å; F185-K225 HydrophobicContact CD2-CG 3.38Å; F185-K225 HydrophobicContact CE2-CD 3.83Å; F185-K225 HydrophobicContact CE2-CG 3.55Å; F215-K225 HydrophobicContact CE1-CB 4.34Å; F215-K225 HydrophobicContact CE2-CB 4.1Å; F215-K225 HydrophobicContact CZ-CB 3.49Å; F215-K225 VanDerWaalsContact CZ-CB 3.49Å; F215-K225 HydrophobicContact CZ-CG 3.81Å; E217-K225 WeakPolarHBondContact OE1-CE 3.35Å; E217-K225 IonicContact OE1-NZ 2.85Å; E217-K225 PolarHBondContact OE1-NZ 3.31Å; E217-K225 VanDerWaalsContact OE2-CE 3.31Å; E217-K225 WeakPolarHBondContact OE2-CE 3.22Å; E217-K225 IonicContact OE2-NZ 3.5Å; E217-K225 PolarHBondContact OE2-NZ 2.78Å; N221-K225 PolarHBondContact O-N 3.1Å; L222-K225 HydrophobicContact CD2-CD 4.12Å; L222-K225 WeakPolarHBondContact O-CB 3.4Å; L222-K225 PolarHBondContact O-N 3.45Å; S223-K225 VanDerWaalsContact C-N 3.3Å; S223-K225 PolarHBondContact O-N 3.02Å; K225-M228 PolarHBondContact O-N 2.82Å; K225-F229 PolarHBondContact O-N 3.22Å; K225-F229 VanDerWaalsContact O-N 3.13Å
226	M	97.4	Very high	96.6	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.02	13%	0.133	C	C	.	.	H	α-helix	trans	-65.8	-42.4	178.4	-169.8	60.4	-172	0	0	111.6	F185 L222 S223 L224 M228 F229 L230 F311 I313 M338	F185-M226 HydrophobicContact CZ-SD 4.36Å; L222-M226 WeakPolarHBondContact O-CB 3.33Å; L222-M226 PolarHBondContact O-N 3.07Å; S223-M226 PolarHBondContact O-N 3.21Å; L224-M226 VanDerWaalsContact C-N 3.32Å; L224-M226 PolarHBondContact O-N 3.28Å; M226-M228 VanDerWaalsContact C-N 3.32Å; M226-M228 PolarHBondContact O-N 3.1Å; M226-F229 HydrophobicContact CE-CD1 4.25Å; M226-F229 WeakPolarHBondContact O-CB 3.31Å; M226-F229 PolarHBondContact O-N 2.94Å; M226-F229 VanDerWaalsContact O-N 3.15Å; M226-F229 HydrophobicContact SD-CD1 4.1Å; M226-L230 HydrophobicContact CE-CD2 3.99Å; M226-L230 HydrophobicContact CE-CG 4.26Å; M226-L230 WeakPolarHBondContact O-CG 3.37Å; M226-L230 PolarHBondContact O-N 3.14Å; M226-F311 HydrophobicContact CE-CE2 4.35Å; M226-F311 HydrophobicContact CE-CZ 4.34Å; M226-I313 HydrophobicContact CE-CD1 4.37Å; M226-M338 HydrophobicContact CB-SD 4.46Å; M226-M338 HydrophobicContact CE-CE 3.96Å; M226-M338 HydrophobicContact CE-SD 4.29Å; M226-M338 HydrophobicContact CG-CE 4.36Å; M226-M338 HydrophobicContact CG-CG 4.21Å; M226-M338 HydrophobicContact CG-SD 3.5Å; M226-M338 VanDerWaalsContact CG-SD 3.5Å
227	D	96.8	Very high	96.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-57.5	-44.3	174.8	-79.2	0.7	0	0	0	112.7	R129 S223 L224 F229 L230 Q231 S325 L330 Y337	R129-D227 IonicContact CZ-OD2 2.73Å; R129-D227 IonicContact NE-OD2 2.78Å; R129-D227 IonicContact NH2-OD2 2.93Å; R129-D227 PolarHBondContact NH2-OD2 3.03Å; S223-D227 PolarHBondContact O-N 3.35Å; L224-D227 WeakPolarHBondContact O-CB 3.43Å; L224-D227 PolarHBondContact O-N 2.87Å; D227-F229 VanDerWaalsContact C-N 3.29Å; D227-F229 PolarHBondContact O-N 2.99Å; D227-L230 PolarHBondContact O-N 3.12Å; D227-Q231 WeakPolarHBondContact O-CG 3.46Å; D227-Q231 PolarHBondContact O-N 3.31Å; D227-Q231 VanDerWaalsContact O-N 3.1Å; D227-S325 VanDerWaalsContact OD1-CB 3.29Å; D227-S325 WeakPolarHBondContact OD1-CB 3.32Å; D227-L330 WeakPolarHBondContact OD2-CD2 3.48Å; D227-Y337 VanDerWaalsContact OD1-CE1 3.24Å; D227-Y337 WeakPolarHBondContact OD1-CE1 3.24Å
228	M	97.7	Very high	97	Very high	9 Å²	9	27.5 Å²	27.5	4%	0.044	14%	0.143	C	C	.	.	H	α-helix	trans	-62.2	-41.8	177.8	-72.7	-50.5	97.8	0	0	111.3	R129 P131 W213 F215 L224 K225 M226 Q231 W232	R129-M228 WeakPolarHBondContact O-CE 3.38Å; P131-M228 HydrophobicContact CG-CG 3.82Å; P131-M228 HydrophobicContact CG-SD 3.62Å; W213-M228 HydrophobicContact CB-CG 4.49Å; W213-M228 HydrophobicContact CD2-CB 3.69Å; W213-M228 HydrophobicContact CD2-CG 4.11Å; W213-M228 HydrophobicContact CE3-CB 4.1Å; W213-M228 HydrophobicContact CG-CB 4.07Å; W213-M228 HydrophobicContact CG-CG 3.93Å; W213-M228 HydrophobicContact CG-SD 4.48Å; W213-M228 HydrophobicContact CH2-CB 4.27Å; W213-M228 HydrophobicContact CZ2-CB 3.89Å; W213-M228 WeakPolarHBondContact CZ2-O 3.13Å; W213-M228 HydrophobicContact CZ3-CB 4.38Å; F215-M228 HydrophobicContact CE1-CG 4.47Å; L224-M228 HydrophobicContact CD1-CE 4.03Å; L224-M228 HydrophobicContact CD1-CG 4.46Å; L224-M228 WeakPolarHBondContact O-CG 3.03Å; L224-M228 PolarHBondContact O-N 3.46Å; K225-M228 PolarHBondContact O-N 2.82Å; M226-M228 VanDerWaalsContact C-N 3.32Å; M226-M228 PolarHBondContact O-N 3.1Å; M228-Q231 PolarHBondContact O-N 3.47Å; M228-W232 WeakPolarHBondContact O-CB 3.29Å; M228-W232 PolarHBondContact O-N 3.14Å
229	F	98.3	Very high	97.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.7	-40.4	176.7	172.3	-98.9	0	0	0	113	L148 A150 V183 F185 L211 K225 M226 D227 Q231 W232 T233 V243	L148-F229 HydrophobicContact CD2-CE2 4.27Å; L148-F229 HydrophobicContact CD2-CZ 3.91Å; A150-F229 HydrophobicContact CB-CD1 4.13Å; A150-F229 HydrophobicContact CB-CD2 4.21Å; A150-F229 HydrophobicContact CB-CE1 3.45Å; A150-F229 VanDerWaalsContact CB-CE1 3.45Å; A150-F229 HydrophobicContact CB-CE2 3.54Å; A150-F229 HydrophobicContact CB-CG 4.48Å; A150-F229 HydrophobicContact CB-CZ 3.12Å; V183-F229 HydrophobicContact CG2-CD2 4.48Å; V183-F229 HydrophobicContact CG2-CE2 3.81Å; F185-F229 HydrophobicContact CD1-CD2 4.15Å; F185-F229 HydrophobicContact CD1-CG 4.4Å; F185-F229 HydrophobicContact CD2-CB 3.69Å; F185-F229 HydrophobicContact CD2-CG 4.21Å; F185-F229 HydrophobicContact CE1-CD2 4.44Å; F185-F229 HydrophobicContact CE1-CG 4.35Å; F185-F229 HydrophobicContact CE2-CB 3.73Å; F185-F229 HydrophobicContact CE2-CG 4.14Å; F185-F229 HydrophobicContact CG-CB 4.21Å; F185-F229 HydrophobicContact CG-CD2 4.21Å; F185-F229 HydrophobicContact CG-CG 4.35Å; F185-F229 HydrophobicContact CZ-CB 4.29Å; F185-F229 HydrophobicContact CZ-CD1 4.47Å; F185-F229 HydrophobicContact CZ-CG 4.22Å; L211-F229 HydrophobicContact CD1-CD2 4.43Å; K225-F229 PolarHBondContact O-N 3.22Å; K225-F229 VanDerWaalsContact O-N 3.13Å; M226-F229 HydrophobicContact CE-CD1 4.25Å; M226-F229 WeakPolarHBondContact O-CB 3.31Å; M226-F229 PolarHBondContact O-N 2.94Å; M226-F229 VanDerWaalsContact O-N 3.15Å; M226-F229 HydrophobicContact SD-CD1 4.1Å; D227-F229 VanDerWaalsContact C-N 3.29Å; D227-F229 PolarHBondContact O-N 2.99Å; F229-Q231 PolarHBondContact O-N 2.98Å; F229-W232 HydrophobicContact CD2-CE3 4.41Å; F229-W232 HydrophobicContact CE2-CE3 4.11Å; F229-W232 HydrophobicContact CE2-CZ3 4.34Å; F229-W232 PolarHBondContact O-N 3.11Å; F229-T233 WeakPolarHBondContact CE1-OG1 3.39Å; F229-T233 WeakPolarHBondContact CE2-OG1 2.91Å; F229-T233 WeakPolarHBondContact CZ-OG1 3.21Å; F229-T233 WeakPolarHBondContact O-CB 3.47Å; F229-T233 PolarHBondContact O-N 2.88Å; F229-T233 PolarHBondContact O-OG1 3.37Å; F229-V243 HydrophobicContact CE1-CG1 3.81Å; F229-V243 HydrophobicContact CZ-CG1 3.93Å
230	L	98.3	Very high	97.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-47.3	175.3	-71.5	172.9	0	0	0	111.1	M226 D227 W232 T233 V234 M318 L321 M338	M226-L230 HydrophobicContact CE-CD2 3.99Å; M226-L230 HydrophobicContact CE-CG 4.26Å; M226-L230 WeakPolarHBondContact O-CG 3.37Å; M226-L230 PolarHBondContact O-N 3.14Å; D227-L230 PolarHBondContact O-N 3.12Å; L230-W232 VanDerWaalsContact C-N 3.34Å; L230-W232 PolarHBondContact O-N 3.1Å; L230-T233 PolarHBondContact O-N 3.15Å; L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 2.96Å; L230-M318 HydrophobicContact CD2-CE 4.49Å; L230-M318 HydrophobicContact CD2-SD 4.04Å; L230-L321 HydrophobicContact CD1-CD2 4.42Å; L230-L321 HydrophobicContact CD1-CG 3.95Å; L230-L321 HydrophobicContact CD2-CD2 3.76Å; L230-L321 HydrophobicContact CD2-CG 4.06Å; L230-M338 HydrophobicContact CD1-CE 4.31Å; L230-M338 HydrophobicContact CD1-SD 4.49Å
231	Q	97.3	Very high	97.5	Very high	58 Å²	58	30.4 Å²	30.4	27%	0.271	16%	0.16	S	C	.	.	H	α-helix	trans	-62	-42.2	177.5	-69.3	-176.5	68.9	0	0	112.3	D227 M228 F229 K235 K326	D227-Q231 WeakPolarHBondContact O-CG 3.46Å; D227-Q231 PolarHBondContact O-N 3.31Å; D227-Q231 VanDerWaalsContact O-N 3.1Å; M228-Q231 PolarHBondContact O-N 3.47Å; F229-Q231 PolarHBondContact O-N 2.98Å; Q231-K235 PolarHBondContact O-N 3.29Å; Q231-K326 VanDerWaalsContact OE1-CE 3.23Å
232	W	98.3	Very high	97.6	Very high	8 Å²	8	29.5 Å²	29.5	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-43.4	175.9	-178	92.5	0	0	0	112.1	N136 Q137 K140 L148 V183 L211 W213 M228 F229 L230 K235 H236 C237	N136-W232 PolarHBondContact OD1-NE1 2.8Å; Q137-W232 HydrophobicContact CB-CZ2 4.49Å; Q137-W232 WeakPolarHBondContact O-CZ2 3.07Å; K140-W232 HydrophobicContact CB-CH2 4.11Å; K140-W232 HydrophobicContact CB-CZ2 4.36Å; L148-W232 HydrophobicContact CD2-CZ3 4.22Å; V183-W232 HydrophobicContact CG1-CH2 4.01Å; V183-W232 HydrophobicContact CG1-CZ3 4.47Å; V183-W232 HydrophobicContact CG2-CZ3 4.42Å; L211-W232 HydrophobicContact CD1-CD2 3.46Å; L211-W232 VanDerWaalsContact CD1-CD2 3.46Å; L211-W232 HydrophobicContact CD1-CE3 3.69Å; L211-W232 HydrophobicContact CD1-CG 3.94Å; L211-W232 HydrophobicContact CD1-CH2 4.09Å; L211-W232 HydrophobicContact CD1-CZ2 3.88Å; L211-W232 HydrophobicContact CD1-CZ3 4Å; L211-W232 HydrophobicContact CD2-CD2 4.3Å; L211-W232 HydrophobicContact CD2-CZ2 3.77Å; L211-W232 HydrophobicContact CG-CZ2 4.4Å; W213-W232 HydrophobicContact CH2-CB 4.08Å; W213-W232 HydrophobicContact CH2-CG 4.35Å; W213-W232 HydrophobicContact CZ2-CB 3.89Å; W213-W232 HydrophobicContact CZ2-CG 4.32Å; M228-W232 WeakPolarHBondContact O-CB 3.29Å; M228-W232 PolarHBondContact O-N 3.14Å; F229-W232 HydrophobicContact CD2-CE3 4.41Å; F229-W232 HydrophobicContact CE2-CE3 4.11Å; F229-W232 HydrophobicContact CE2-CZ3 4.34Å; F229-W232 PolarHBondContact O-N 3.11Å; L230-W232 VanDerWaalsContact C-N 3.34Å; L230-W232 PolarHBondContact O-N 3.1Å; W232-K235 PolarHBondContact O-N 3.12Å; W232-H236 AromaticContact CD1-CD2 3.36Å; W232-H236 HydrophobicContact CD2-CB 4.19Å; W232-H236 AromaticContact CE2-CD2 3.85Å; W232-H236 AromaticContact CG-CD2 3.87Å; W232-H236 HydrophobicContact CH2-CB 4.37Å; W232-H236 HydrophobicContact CZ2-CB 3.93Å; W232-H236 AromaticContact NE1-CD2 3.3Å; W232-H236 PolarHBondContact NE1-CD2 3.31Å; W232-H236 VanDerWaalsContact NE1-CD2 3.3Å; W232-H236 AromaticContact NE1-CG 3.87Å; W232-H236 WeakPolarHBondContact O-CB 3Å; W232-H236 PolarHBondContact O-N 3.46Å; W232-C237 VanDerWaalsContact CH2-SG 3.56Å; W232-C237 WeakPolarHBondContact CZ3-SG 3.3Å
233	T	98.3	Very high	97.7	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-45.5	-179	-60	0	0	0	0	111.4	L148 F229 L230 K235 H236 C237 V240 V243 M318	L148-T233 HydrophobicContact CD2-CG2 4.29Å; F229-T233 WeakPolarHBondContact CE1-OG1 3.39Å; F229-T233 WeakPolarHBondContact CE2-OG1 2.91Å; F229-T233 WeakPolarHBondContact CZ-OG1 3.21Å; F229-T233 WeakPolarHBondContact O-CB 3.47Å; F229-T233 PolarHBondContact O-N 2.88Å; F229-T233 PolarHBondContact O-OG1 3.37Å; L230-T233 PolarHBondContact O-N 3.15Å; T233-K235 PolarHBondContact O-N 2.81Å; T233-H236 PolarHBondContact O-N 3.38Å; T233-C237 HydrophobicContact CG2-CB 4.13Å; T233-C237 CarbonylContact O-C 3.42Å; T233-C237 VanDerWaalsContact O-C 3.23Å; T233-C237 VanDerWaalsContact O-CA 3.31Å; T233-C237 WeakPolarHBondContact O-CA 3.43Å; T233-C237 PolarHBondContact O-N 3.17Å; T233-V240 HydrophobicContact CG2-CG1 4.14Å; T233-V243 HydrophobicContact CG2-CG2 4.25Å; T233-M318 HydrophobicContact CG2-CG 4.03Å; T233-M318 HydrophobicContact CG2-SD 4.03Å
234	V	97.5	Very high	97.8	Very high	49 Å²	49	28.5 Å²	28.5	30%	0.297	15%	0.149	S	C	.	.	H	α-helix	trans	-58.4	-39	175.8	171.6	0	0	0	0	111.4	L230 M318	L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 2.96Å; V234-M318 HydrophobicContact CG2-CB 4.12Å; V234-M318 WeakPolarHBondContact CG2-O 3.35Å
235	K	97	Very high	97.8	Very high	160 Å²	160	28.2 Å²	28.2	70%	0.696	15%	0.148	S	C	*	.	H	α-helix	trans	-78.5	-40.3	-177.7	-174.6	174.3	178.3	178.4	0	113.6	Q231 W232 T233	Q231-K235 PolarHBondContact O-N 3.29Å; W232-K235 PolarHBondContact O-N 3.12Å; T233-K235 PolarHBondContact O-N 2.81Å
236	H	97.8	Very high	97.8	Very high	32 Å²	32	28.1 Å²	28.1	15%	0.148	15%	0.147	C	C	.	.	H	α-helix	trans	-112.5	-16.6	-165.9	-67	-64.6	0	0	0	114.1	P138 C141 W232 T233 P238	P138-H236 WeakPolarHBondContact CA-ND1 3.38Å; C141-H236 WeakPolarHBondContact CB-O 3.33Å; W232-H236 AromaticContact CD1-CD2 3.36Å; W232-H236 HydrophobicContact CD2-CB 4.19Å; W232-H236 AromaticContact CE2-CD2 3.85Å; W232-H236 AromaticContact CG-CD2 3.87Å; W232-H236 HydrophobicContact CH2-CB 4.37Å; W232-H236 HydrophobicContact CZ2-CB 3.93Å; W232-H236 AromaticContact NE1-CD2 3.3Å; W232-H236 PolarHBondContact NE1-CD2 3.31Å; W232-H236 VanDerWaalsContact NE1-CD2 3.3Å; W232-H236 AromaticContact NE1-CG 3.87Å; W232-H236 WeakPolarHBondContact O-CB 3Å; W232-H236 PolarHBondContact O-N 3.46Å; T233-H236 PolarHBondContact O-N 3.38Å; H236-P238 VanDerWaalsContact C-CD 3.45Å
237	C	97.6	Very high	97.8	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	15%	0.154	C	C	.	.			trans	-132.5	50.4	179.6	-58.9	0	0	0	0	112.5	C141 L148 W232 T233 L239 V240	C141-C237 HydrophobicContact CB-CB 3.55Å; C141-C237 WeakPolarHBondContact CB-SG 3.23Å; C141-C237 WeakPolarHBondContact SG-CB 3.37Å; C141-C237 CovalentContact SG-SG 2.03Å; C141-C237 PolarHBondContact SG-SG 3.11Å; L148-C237 HydrophobicContact CD2-CB 4.36Å; W232-C237 VanDerWaalsContact CH2-SG 3.56Å; W232-C237 WeakPolarHBondContact CZ3-SG 3.3Å; T233-C237 HydrophobicContact CG2-CB 4.13Å; T233-C237 CarbonylContact O-C 3.42Å; T233-C237 VanDerWaalsContact O-C 3.23Å; T233-C237 VanDerWaalsContact O-CA 3.31Å; T233-C237 WeakPolarHBondContact O-CA 3.43Å; T233-C237 PolarHBondContact O-N 3.17Å; C237-L239 PolarHBondContact O-N 3.12Å; C237-L239 VanDerWaalsContact O-N 3.12Å; C237-V240 HydrophobicContact CB-CB 4.4Å; C237-V240 WeakPolarHBondContact O-CB 3.43Å; C237-V240 VanDerWaalsContact O-CG1 3.28Å; C237-V240 WeakPolarHBondContact O-CG1 3.38Å; C237-V240 PolarHBondContact O-N 3.16Å
238	P	96.3	Very high	97.8	Very high	94 Å²	94	29.6 Å²	29.6	61%	0.61	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.4	-173.9	28.8	-37	0	0	0	114.3	H236	H236-P238 VanDerWaalsContact C-CD 3.45Å
239	L	97	Very high	97.8	Very high	115 Å²	115	30.2 Å²	30.2	60%	0.602	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.9	30.8	179.4	-57	179.8	0	0	0	112.1	H144 T145 C237	H144-L239 PolarHBondContact CD2-O 3.29Å; H144-L239 VanDerWaalsContact CD2-O 3.22Å; T145-L239 PolarHBondContact N-O 3.26Å; C237-L239 PolarHBondContact O-N 3.12Å; C237-L239 VanDerWaalsContact O-N 3.12Å
240	V	98.6	Very high	97.8	Very high	12 Å²	12	30.2 Å²	30.2	7%	0.073	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	133.5	173.7	69	0	0	0	0	109.7	T145 L148 T233 C237 F242 V243 G315 M318	T145-V240 HydrophobicContact CG2-CG2 4.29Å; T145-V240 CarbonylContact O-C 3.52Å; T145-V240 VanDerWaalsContact O-CA 3.24Å; T145-V240 WeakPolarHBondContact O-CA 3.27Å; L148-V240 HydrophobicContact CB-CG2 3.71Å; T233-V240 HydrophobicContact CG2-CG1 4.14Å; C237-V240 HydrophobicContact CB-CB 4.4Å; C237-V240 WeakPolarHBondContact O-CB 3.43Å; C237-V240 VanDerWaalsContact O-CG1 3.28Å; C237-V240 WeakPolarHBondContact O-CG1 3.38Å; C237-V240 PolarHBondContact O-N 3.16Å; V240-F242 WeakPolarHBondContact CG2-O 3.25Å; V240-V243 HydrophobicContact CG1-CG2 3.91Å; V240-V243 HydrophobicContact CG2-CG2 4Å; V240-G315 WeakPolarHBondContact O-CA 3.47Å; V240-M318 HydrophobicContact CG1-CG 4.41Å
241	S	98.6	Very high	97.7	Very high	29 Å²	29	30.3 Å²	30.3	20%	0.203	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-42.9	175.3	-39.1	0	0	0	0	111.7	H144 T145 F146 G315	H144-S241 PolarHBondContact CE1-OG 3.48Å; H144-S241 PolarHBondContact NE2-OG 2.54Å; T145-S241 PolarHBondContact O-N 3.09Å; F146-S241 VanDerWaalsContact O-CB 3.32Å; F146-S241 WeakPolarHBondContact O-CB 3.47Å; S241-G315 PolarHBondContact O-N 3.24Å
242	F	98.9	Very high	97.7	Very high	12 Å²	12	27.6 Å²	27.6	5%	0.053	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.5	179.9	-59	-75	0	0	0	111.3	F146 L147 L148 V240 L261 L264 A269 L272 V312 I313	F146-F242 HydrophobicContact CD2-CD2 4.37Å; F146-F242 HydrophobicContact CD2-CE2 4.47Å; F146-F242 AromaticContact CE2-CD2 3.94Å; F146-F242 HydrophobicContact CE2-CD2 3.94Å; F146-F242 AromaticContact CE2-CE2 3.74Å; F146-F242 HydrophobicContact CE2-CE2 3.74Å; F146-F242 HydrophobicContact CZ-CD2 4.04Å; F146-F242 AromaticContact CZ-CE2 3.98Å; F146-F242 HydrophobicContact CZ-CE2 3.98Å; F146-F242 PolarHBondContact O-N 2.84Å; L147-F242 WeakPolarHBondContact CA-O 3.46Å; L147-F242 HydrophobicContact CD1-CB 4.04Å; L148-F242 PolarHBondContact N-O 3.14Å; V240-F242 WeakPolarHBondContact CG2-O 3.25Å; F242-L261 HydrophobicContact CB-CD1 4.04Å; F242-L261 HydrophobicContact CD1-CD2 3.97Å; F242-L261 HydrophobicContact CD2-CB 4.12Å; F242-L261 HydrophobicContact CD2-CD1 3.94Å; F242-L261 HydrophobicContact CD2-CD2 4.34Å; F242-L261 HydrophobicContact CD2-CG 4.35Å; F242-L261 HydrophobicContact CE1-CD2 4.15Å; F242-L261 HydrophobicContact CE2-CB 3.97Å; F242-L261 HydrophobicContact CG-CD1 3.98Å; F242-L261 HydrophobicContact CG-CD2 4.06Å; F242-L261 HydrophobicContact CG-CG 4.45Å; F242-L261 HydrophobicContact CZ-CB 4.4Å; F242-L261 HydrophobicContact CZ-CD2 4.41Å; F242-L264 HydrophobicContact CE1-CD1 4.45Å; F242-A269 HydrophobicContact CE1-CB 4.15Å; F242-A269 HydrophobicContact CZ-CB 3.87Å; F242-L272 HydrophobicContact CD1-CD2 3.83Å; F242-L272 HydrophobicContact CE1-CB 4.45Å; F242-L272 HydrophobicContact CE1-CD2 3.75Å; F242-V312 HydrophobicContact CB-CG1 4.02Å; F242-V312 HydrophobicContact CD1-CG1 4.33Å; F242-I313 WeakPolarHBondContact CA-O 3.27Å
243	V	98.8	Very high	97.7	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.3	172.7	-179.3	0	0	0	0	108.3	L148 A150 F229 T233 V240 V312 I313 M318	L148-V243 HydrophobicContact CB-CG2 4.4Å; L148-V243 CarbonylContact O-C 3.54Å; L148-V243 WeakPolarHBondContact O-CA 3.33Å; A150-V243 HydrophobicContact CB-CG1 4.11Å; F229-V243 HydrophobicContact CE1-CG1 3.81Å; F229-V243 HydrophobicContact CZ-CG1 3.93Å; T233-V243 HydrophobicContact CG2-CG2 4.25Å; V240-V243 HydrophobicContact CG1-CG2 3.91Å; V240-V243 HydrophobicContact CG2-CG2 4Å; V243-V312 CarbonylContact O-C 3.33Å; V243-V312 WeakPolarHBondContact O-CA 3.35Å; V243-I313 PolarHBondContact N-O 3.5Å; V243-I313 PolarHBondContact O-N 2.67Å; V243-M318 HydrophobicContact CB-CE 4.5Å; V243-M318 HydrophobicContact CB-SD 4.42Å; V243-M318 HydrophobicContact CG2-CE 4.36Å; V243-M318 HydrophobicContact CG2-CG 4.31Å; V243-M318 HydrophobicContact CG2-SD 3.83Å
244	F	98.7	Very high	97.6	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.7	163	172.4	-81.5	0	0	0	107.8	L147 L148 F149 A150 W168 V252 L257 F311 V312 F355 L376	L147-F244 HydrophobicContact CD1-CB 4Å; L148-F244 PolarHBondContact O-N 2.99Å; F149-F244 HydrophobicContact CD1-CB 3.73Å; F149-F244 AromaticContact CD1-CD1 3.4Å; F149-F244 HydrophobicContact CD1-CD1 3.4Å; F149-F244 HydrophobicContact CD1-CE1 4.11Å; F149-F244 AromaticContact CD1-CG 3.66Å; F149-F244 HydrophobicContact CD1-CG 3.66Å; F149-F244 HydrophobicContact CE1-CB 3.96Å; F149-F244 AromaticContact CE1-CD1 3.87Å; F149-F244 HydrophobicContact CE1-CD1 3.87Å; F149-F244 HydrophobicContact CE1-CD2 4.29Å; F149-F244 HydrophobicContact CE1-CE1 4.42Å; F149-F244 AromaticContact CE1-CG 3.77Å; F149-F244 HydrophobicContact CE1-CG 3.77Å; A150-F244 WeakPolarHBondContact CA-O 3.47Å; A150-F244 WeakPolarHBondContact CB-O 3.26Å; A150-F244 PolarHBondContact N-O 3.07Å; W168-F244 HydrophobicContact CZ3-CE1 4.38Å; F244-V252 HydrophobicContact CE1-CG2 4.27Å; F244-V252 HydrophobicContact CE2-CG2 4.02Å; F244-V252 HydrophobicContact CZ-CG2 3.65Å; F244-L257 HydrophobicContact CD2-CD2 4Å; F244-F311 CarbonylContact C-O 3.53Å; F244-F311 WeakPolarHBondContact CA-O 3.37Å; F244-V312 HydrophobicContact CB-CG2 4.18Å; F244-V312 HydrophobicContact CD2-CG2 3.88Å; F244-F355 HydrophobicContact CE2-CE1 4.37Å; F244-L376 HydrophobicContact CE2-CD1 3.66Å; F244-L376 HydrophobicContact CZ-CD1 3.5Å; F244-L376 VanDerWaalsContact CZ-CD1 3.5Å
245	S	97.7	Very high	97.6	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.5	168	-172	0	0	0	0	108.8	A150 G310 F311	A150-S245 VanDerWaalsContact O-CA 3.32Å; A150-S245 WeakPolarHBondContact O-CA 3.35Å; S245-G310 CarbonylContact O-C 3.5Å; S245-G310 WeakPolarHBondContact O-CA 3.49Å; S245-F311 VanDerWaalsContact CB-CE2 3.48Å; S245-F311 PolarHBondContact N-O 2.78Å; S245-F311 PolarHBondContact O-N 3.21Å
246	G	96.4	Very high	97.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	176.4	179.3	0	0	0	0	0	113.6	A150 I151 K152 G309	A150-G246 PolarHBondContact O-N 3.3Å; I151-G246 CarbonylContact C-O 3.59Å; I151-G246 WeakPolarHBondContact CA-O 3.39Å; K152-G246 PolarHBondContact N-O 3.19Å; G246-G309 CarbonylContact C-O 3.45Å; G246-G309 WeakPolarHBondContact CA-O 3.43Å
247	D	97.4	Very high	97.5	Very high	31 Å²	31	18.1 Å²	18.1	17%	0.166	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	162.3	-177.1	-57.5	-38.7	0	0	0	111.3	K152 D249 V250 G309	K152-D247 WeakPolarHBondContact CE-OD1 3.36Å; K152-D247 IonicContact NZ-OD1 3.33Å; K152-D247 PolarHBondContact NZ-OD1 3.32Å; D247-D249 VanDerWaalsContact C-N 3.26Å; D247-D249 WeakPolarHBondContact CB-OD1 3.28Å; D247-D249 PolarHBondContact O-N 3.14Å; D247-V250 HydrophobicContact CB-CG1 4.39Å; D247-V250 WeakPolarHBondContact O-CG2 2.81Å; D247-G309 PolarHBondContact N-O 2.82Å; D247-G309 VanDerWaalsContact OD2-CA 3.3Å; D247-G309 WeakPolarHBondContact OD2-CA 3.18Å; D247-G309 PolarHBondContact OD2-N 2.03Å
248	D	97.8	Very high	97.6	Very high	6 Å²	6	18.3 Å²	18.3	3%	0.032	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.4	-179	65.9	11.3	0	0	0	114.7	I151 K152 S153 N157 R160	I151-D248 HydrophobicContact CG2-CB 3.88Å; K152-D248 PolarHBondContact O-N 3.32Å; S153-D248 WeakPolarHBondContact CA-OD2 3.33Å; S153-D248 VanDerWaalsContact CB-OD2 3.29Å; S153-D248 WeakPolarHBondContact CB-OD2 3.3Å; S153-D248 PolarHBondContact OG-OD2 2.95Å; N157-D248 VanDerWaalsContact CB-OD2 3.27Å; N157-D248 WeakPolarHBondContact CB-OD2 3.18Å; N157-D248 PolarHBondContact ND2-OD1 2.81Å; N157-D248 PolarHBondContact ND2-OD2 2.78Å; R160-D248 HydrophobicContact CB-CB 4.11Å; R160-D248 VanDerWaalsContact CD-CG 3.5Å; R160-D248 WeakPolarHBondContact CD-OD1 3.38Å; R160-D248 IonicContact CZ-OD1 3.71Å; R160-D248 IonicContact NE-OD1 2.84Å; R160-D248 IonicContact NH1-OD1 3.74Å; R160-D248 PolarHBondContact NH1-OD1 2.85Å
249	D	97.4	Very high	97.6	Very high	22 Å²	22	20.9 Å²	20.9	12%	0.118	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	29.7	174.4	51.5	15.9	0	0	0	113.6	R160 D247 H378 Q379 R380	R160-D249 IonicContact CZ-OD2 2.65Å; R160-D249 VanDerWaalsContact NH1-CB 3.26Å; R160-D249 IonicContact NH1-OD2 3.65Å; R160-D249 PolarHBondContact NH1-OD2 2.65Å; R160-D249 IonicContact NH2-OD2 3.55Å; R160-D249 PolarHBondContact NH2-OD2 2.92Å; D247-D249 VanDerWaalsContact C-N 3.26Å; D247-D249 WeakPolarHBondContact CB-OD1 3.28Å; D247-D249 PolarHBondContact O-N 3.14Å; D249-H378 IonicContact OD1-CD2 2.92Å; D249-H378 IonicContact OD1-NE2 3.6Å; D249-Q379 CarbonylContact O-C 3.55Å; D249-Q379 VanDerWaalsContact O-CA 3.28Å; D249-Q379 WeakPolarHBondContact O-CA 3.42Å; D249-R380 PolarHBondContact O-N 3.44Å
250	V	97.4	Very high	97.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	157.5	168.2	-53.4	0	0	0	0	111.6	W168 D247 V252 G309 L376 H378 I385	W168-V250 HydrophobicContact CH2-CG2 4.1Å; W168-V250 HydrophobicContact CZ2-CG2 3.84Å; W168-V250 WeakPolarHBondContact CZ2-O 3.45Å; W168-V250 PolarHBondContact NE1-O 2.8Å; D247-V250 HydrophobicContact CB-CG1 4.39Å; D247-V250 WeakPolarHBondContact O-CG2 2.81Å; V250-V252 HydrophobicContact CG2-CG2 3.93Å; V250-G309 VanDerWaalsContact CG1-O 3.3Å; V250-G309 WeakPolarHBondContact CG1-O 3.08Å; V250-L376 HydrophobicContact CB-CD1 4.23Å; V250-L376 HydrophobicContact CB-CG 4.19Å; V250-L376 HydrophobicContact CG1-CD1 4.39Å; V250-L376 HydrophobicContact CG1-CD2 4.42Å; V250-L376 HydrophobicContact CG2-CD1 4.03Å; V250-L376 HydrophobicContact CG2-CG 4.42Å; V250-H378 HydrophobicContact CG1-CB 3.85Å; V250-I385 VanDerWaalsContact O-CD1 3.3Å; V250-I385 WeakPolarHBondContact O-CD1 3.39Å
251	F	97	Very high	97.7	Very high	2 Å²	2	17 Å²	17	1%	0.009	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.6	161.6	174.2	-95.3	0	0	0	109.4	N253 L376 V377 R380 I385 M388 W389 I392	F251-N253 HydrophobicContact CE1-CB 4.38Å; F251-L376 CarbonylContact O-C 3.53Å; F251-L376 VanDerWaalsContact O-CA 3.27Å; F251-L376 WeakPolarHBondContact O-CA 3.49Å; F251-V377 PolarHBondContact N-O 3.49Å; F251-V377 PolarHBondContact O-N 2.97Å; F251-R380 HydrophobicContact CB-CG 3.97Å; F251-I385 HydrophobicContact CD2-CG2 4.43Å; F251-M388 HydrophobicContact CB-CE 4.04Å; F251-M388 HydrophobicContact CB-SD 4.33Å; F251-M388 HydrophobicContact CD1-CE 3.55Å; F251-M388 HydrophobicContact CD2-CB 3.83Å; F251-M388 HydrophobicContact CD2-CE 4.26Å; F251-M388 HydrophobicContact CE1-CE 4.02Å; F251-M388 HydrophobicContact CE2-CB 3.7Å; F251-M388 HydrophobicContact CG-CB 4.37Å; F251-M388 HydrophobicContact CG-CE 3.67Å; F251-M388 HydrophobicContact CG-SD 4.28Å; F251-M388 HydrophobicContact CZ-CB 4.14Å; F251-W389 HydrophobicContact CE2-CB 4.16Å; F251-W389 HydrophobicContact CE2-CE3 4.08Å; F251-W389 HydrophobicContact CZ-CE3 4.39Å; F251-I392 HydrophobicContact CE1-CD1 4.26Å; F251-I392 HydrophobicContact CZ-CD1 3.62Å; F251-I392 HydrophobicContact CZ-CG1 4.02Å
252	V	97.9	Very high	97.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.8	173.8	178	0	0	0	0	110.6	F149 W168 F244 V250 T254 L257 L375 L376	F149-V252 HydrophobicContact CE1-CG1 4.03Å; F149-V252 HydrophobicContact CZ-CG1 4.19Å; W168-V252 HydrophobicContact CB-CB 4.01Å; W168-V252 WeakPolarHBondContact CB-O 3.41Å; W168-V252 HydrophobicContact CD2-CB 3.85Å; W168-V252 HydrophobicContact CD2-CG2 4.05Å; W168-V252 HydrophobicContact CE3-CB 3.79Å; W168-V252 HydrophobicContact CE3-CG2 3.84Å; W168-V252 HydrophobicContact CG-CB 3.98Å; W168-V252 HydrophobicContact CH2-CG2 4.43Å; W168-V252 HydrophobicContact CZ3-CB 4.49Å; W168-V252 HydrophobicContact CZ3-CG2 4.06Å; F244-V252 HydrophobicContact CE1-CG2 4.27Å; F244-V252 HydrophobicContact CE2-CG2 4.02Å; F244-V252 HydrophobicContact CZ-CG2 3.65Å; V250-V252 HydrophobicContact CG2-CG2 3.93Å; V252-T254 PolarHBondContact O-N 3.24Å; V252-L257 HydrophobicContact CG1-CD2 4.07Å; V252-L375 CarbonylContact C-O 3.5Å; V252-L375 WeakPolarHBondContact CA-O 3.36Å; V252-L376 HydrophobicContact CG2-CD1 4.2Å
253	N	97.1	Very high	97.5	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.027	11%	0.109	C	C	.	.			trans	-86.2	84.9	168.6	178.5	3.8	0	0	0	109.5	F251 D255 G256 L257 K372 N374 L375	F251-N253 HydrophobicContact CE1-CB 4.38Å; N253-D255 VanDerWaalsContact C-N 3.35Å; N253-D255 PolarHBondContact O-N 3.33Å; N253-G256 WeakPolarHBondContact O-CA 3.36Å; N253-G256 PolarHBondContact O-N 2.88Å; N253-G256 VanDerWaalsContact O-N 3.07Å; N253-G256 PolarHBondContact OD1-N 2.8Å; N253-G256 VanDerWaalsContact OD1-N 3.11Å; N253-L257 PolarHBondContact O-N 3.22Å; N253-K372 PolarHBondContact ND2-O 3Å; N253-N374 WeakPolarHBondContact CB-O 3.49Å; N253-N374 PolarHBondContact ND2-O 3.48Å; N253-N374 VanDerWaalsContact ND2-O 3.13Å; N253-L375 PolarHBondContact N-O 3.43Å
254	T	97.7	Very high	97.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.1	-40.8	-172.2	-52.9	0	0	0	0	113.3	F149 W168 Y174 V252 L257 I258	F149-T254 HydrophobicContact CE2-CG2 3.8Å; F149-T254 HydrophobicContact CZ-CG2 3.87Å; W168-T254 WeakPolarHBondContact CA-OG1 3.42Å; W168-T254 PolarHBondContact O-OG1 2.9Å; Y174-T254 HydrophobicContact CD1-CG2 4.36Å; Y174-T254 HydrophobicContact CE1-CG2 3.76Å; V252-T254 PolarHBondContact O-N 3.24Å; T254-L257 PolarHBondContact O-N 3.44Å; T254-I258 HydrophobicContact CG2-CD1 4.06Å; T254-I258 WeakPolarHBondContact O-CG1 3.41Å; T254-I258 PolarHBondContact O-N 2.92Å
255	D	95.6	Very high	97.5	Very high	38 Å²	38	26.7 Å²	26.7	20%	0.203	14%	0.135	C	C	.	.	H	α-helix	trans	-66	-38.8	175.6	-84.7	-15	0	0	0	112.1	N253 R259 H393	N253-D255 VanDerWaalsContact C-N 3.35Å; N253-D255 PolarHBondContact O-N 3.33Å; D255-R259 WeakPolarHBondContact O-CG 3.48Å; D255-R259 PolarHBondContact O-N 3.4Å; D255-R259 PolarHBondContact O-NE 3.38Å; D255-H393 IonicContact OD2-NE2 2.74Å
256	G	96.4	Very high	97.4	Very high	8 Å²	8	30.8 Å²	30.8	8%	0.082	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-46	171.6	0	0	0	0	0	111.8	N253 R259 Y260 L375	N253-G256 WeakPolarHBondContact O-CA 3.36Å; N253-G256 PolarHBondContact O-N 2.88Å; N253-G256 VanDerWaalsContact O-N 3.07Å; N253-G256 PolarHBondContact OD1-N 2.8Å; N253-G256 VanDerWaalsContact OD1-N 3.11Å; G256-R259 PolarHBondContact O-N 2.76Å; G256-Y260 PolarHBondContact O-N 3.33Å; G256-L375 VanDerWaalsContact C-CD2 3.42Å
257	L	98.1	Very high	97.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-45.6	-178.6	-174.4	60.9	0	0	0	111.8	L147 F149 F244 V252 N253 T254 R259 Y260 L261 V312 F355 L375	L147-L257 HydrophobicContact CD2-CD2 3.97Å; F149-L257 HydrophobicContact CE1-CD2 4.08Å; F149-L257 HydrophobicContact CZ-CD2 4.21Å; F244-L257 HydrophobicContact CD2-CD2 4Å; V252-L257 HydrophobicContact CG1-CD2 4.07Å; N253-L257 PolarHBondContact O-N 3.22Å; T254-L257 PolarHBondContact O-N 3.44Å; L257-R259 VanDerWaalsContact C-N 3.34Å; L257-R259 PolarHBondContact O-N 3.21Å; L257-Y260 HydrophobicContact CD1-CD1 4.42Å; L257-Y260 PolarHBondContact O-N 2.93Å; L257-L261 HydrophobicContact CD1-CG 4.5Å; L257-L261 HydrophobicContact CG-CD1 4.19Å; L257-L261 VanDerWaalsContact O-CG 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.32Å; L257-L261 PolarHBondContact O-N 2.91Å; L257-V312 HydrophobicContact CD1-CG2 4.03Å; L257-V312 HydrophobicContact CD2-CG2 4.42Å; L257-F355 HydrophobicContact CD1-CZ 4.41Å; L257-L375 HydrophobicContact CB-CD2 4.47Å; L257-L375 HydrophobicContact CD1-CD1 4.2Å
258	I	98.1	Very high	97.4	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-59.1	-46.7	176.4	-69.9	168.8	0	0	0	110.5	F146 Y174 R178 V180 T254 Y260 L261 E262	F146-I258 HydrophobicContact CE1-CB 4.45Å; F146-I258 HydrophobicContact CE1-CG1 4.27Å; F146-I258 HydrophobicContact CE1-CG2 4.02Å; Y174-I258 HydrophobicContact CD1-CD1 3.8Å; Y174-I258 HydrophobicContact CD2-CD1 4.32Å; Y174-I258 HydrophobicContact CG-CD1 3.65Å; R178-I258 HydrophobicContact CB-CG2 4.38Å; R178-I258 HydrophobicContact CG-CG2 4.09Å; V180-I258 HydrophobicContact CG2-CD1 3.95Å; T254-I258 HydrophobicContact CG2-CD1 4.06Å; T254-I258 WeakPolarHBondContact O-CG1 3.41Å; T254-I258 PolarHBondContact O-N 2.92Å; I258-Y260 VanDerWaalsContact C-N 3.32Å; I258-Y260 PolarHBondContact O-N 3.43Å; I258-L261 PolarHBondContact O-N 3.3Å; I258-E262 HydrophobicContact CG2-CG 4.25Å; I258-E262 WeakPolarHBondContact O-CB 3.37Å; I258-E262 WeakPolarHBondContact O-CG 2.97Å; I258-E262 PolarHBondContact O-N 3.19Å
259	R	97.4	Very high	97.4	Very high	148 Å²	148	37.3 Å²	37.3	56%	0.558	21%	0.211	S	C	*	.	H	α-helix	trans	-60.5	-41.3	177.8	-75.8	-177.1	-65	-165.6	3.1	112.6	D255 G256 L257 E262 S263	D255-R259 WeakPolarHBondContact O-CG 3.48Å; D255-R259 PolarHBondContact O-N 3.4Å; D255-R259 PolarHBondContact O-NE 3.38Å; G256-R259 PolarHBondContact O-N 2.76Å; L257-R259 VanDerWaalsContact C-N 3.34Å; L257-R259 PolarHBondContact O-N 3.21Å; R259-E262 PolarHBondContact O-N 3.27Å; R259-S263 WeakPolarHBondContact O-CB 3.43Å; R259-S263 PolarHBondContact O-N 2.76Å; R259-S263 VanDerWaalsContact O-N 3.12Å
260	Y	98.1	Very high	97.4	Very high	42 Å²	42	37.4 Å²	37.4	17%	0.165	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-49.9	174.7	167.5	-110.5	0	0	0	111	G256 L257 I258 E262 S263 L264 V274 H352 L375	G256-Y260 PolarHBondContact O-N 3.33Å; L257-Y260 HydrophobicContact CD1-CD1 4.42Å; L257-Y260 PolarHBondContact O-N 2.93Å; I258-Y260 VanDerWaalsContact C-N 3.32Å; I258-Y260 PolarHBondContact O-N 3.43Å; Y260-E262 VanDerWaalsContact C-N 3.32Å; Y260-E262 PolarHBondContact O-N 3.1Å; Y260-S263 WeakPolarHBondContact O-CB 3.45Å; Y260-S263 PolarHBondContact O-N 2.85Å; Y260-S263 PolarHBondContact O-OG 3.32Å; Y260-L264 HydrophobicContact CE1-CD1 4.5Å; Y260-L264 HydrophobicContact CE2-CD2 4Å; Y260-V274 HydrophobicContact CE1-CG1 4.07Å; Y260-V274 HydrophobicContact CE1-CG2 4.49Å; Y260-H352 AromaticContact CD2-CD2 3.75Å; Y260-H352 AromaticContact CD2-NE2 3.43Å; Y260-H352 WeakPolarHBondContact CD2-NE2 3.38Å; Y260-H352 AromaticContact CE1-CD2 3.91Å; Y260-H352 AromaticContact CE2-CD2 3.43Å; Y260-H352 VanDerWaalsContact CE2-CD2 3.43Å; Y260-H352 WeakPolarHBondContact CE2-CD2 3.18Å; Y260-H352 AromaticContact CE2-NE2 3.58Å; Y260-H352 AromaticContact CG-NE2 3.85Å; Y260-H352 AromaticContact CZ-CD2 3.52Å; Y260-L375 HydrophobicContact CD1-CD1 4.18Å; Y260-L375 HydrophobicContact CG-CD1 4.22Å
261	L	98.4	Very high	97.4	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-35.2	-179.5	-64.4	174	0	0	0	113	F146 L147 F242 L257 I258 S263 L264 L272 V312	F146-L261 HydrophobicContact CE1-CB 4.27Å; F146-L261 HydrophobicContact CE1-CD1 4.37Å; F146-L261 HydrophobicContact CZ-CB 3.84Å; L147-L261 HydrophobicContact CD1-CD1 4.13Å; F242-L261 HydrophobicContact CB-CD1 4.04Å; F242-L261 HydrophobicContact CD1-CD2 3.97Å; F242-L261 HydrophobicContact CD2-CB 4.12Å; F242-L261 HydrophobicContact CD2-CD1 3.94Å; F242-L261 HydrophobicContact CD2-CD2 4.34Å; F242-L261 HydrophobicContact CD2-CG 4.35Å; F242-L261 HydrophobicContact CE1-CD2 4.15Å; F242-L261 HydrophobicContact CE2-CB 3.97Å; F242-L261 HydrophobicContact CG-CD1 3.98Å; F242-L261 HydrophobicContact CG-CD2 4.06Å; F242-L261 HydrophobicContact CG-CG 4.45Å; F242-L261 HydrophobicContact CZ-CB 4.4Å; F242-L261 HydrophobicContact CZ-CD2 4.41Å; L257-L261 HydrophobicContact CD1-CG 4.5Å; L257-L261 HydrophobicContact CG-CD1 4.19Å; L257-L261 VanDerWaalsContact O-CG 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.32Å; L257-L261 PolarHBondContact O-N 2.91Å; I258-L261 PolarHBondContact O-N 3.3Å; L261-S263 VanDerWaalsContact C-N 3.27Å; L261-S263 PolarHBondContact O-N 3.39Å; L261-L264 HydrophobicContact CD2-CD1 4.19Å; L261-L272 HydrophobicContact CD2-CD2 3.54Å; L261-V312 HydrophobicContact CD2-CG1 3.96Å
262	E	97.6	Very high	97.4	Very high	55 Å²	55	42.5 Å²	42.5	26%	0.257	24%	0.237	S	C	.	.	H	α-helix	trans	-70.9	-21.3	174.6	-71.3	-173.4	129.7	0	0	113.5	F146 N176 R178 I258 R259 Y260 L264	F146-E262 HydrophobicContact CZ-CG 3.93Å; N176-E262 WeakPolarHBondContact CB-OE1 3.36Å; N176-E262 PolarHBondContact ND2-OE1 2.82Å; N176-E262 VanDerWaalsContact ND2-OE1 3.1Å; N176-E262 PolarHBondContact ND2-OE2 3.34Å; R178-E262 WeakPolarHBondContact CG-OE1 3.48Å; R178-E262 IonicContact CZ-OE1 3.23Å; R178-E262 IonicContact NE-OE1 2.76Å; R178-E262 PolarHBondContact NE-OE1 2.96Å; R178-E262 IonicContact NH2-OE1 3.45Å; R178-E262 PolarHBondContact NH2-OE1 3.22Å; I258-E262 HydrophobicContact CG2-CG 4.25Å; I258-E262 WeakPolarHBondContact O-CB 3.37Å; I258-E262 WeakPolarHBondContact O-CG 2.97Å; I258-E262 PolarHBondContact O-N 3.19Å; R259-E262 PolarHBondContact O-N 3.27Å; Y260-E262 VanDerWaalsContact C-N 3.32Å; Y260-E262 PolarHBondContact O-N 3.1Å; E262-L264 VanDerWaalsContact C-N 3.33Å
263	S	97.4	Very high	97.5	Very high	85 Å²	85	42.5 Å²	42.5	59%	0.594	24%	0.237	S	C	*	.	H	α-helix	trans	-81.3	-13.4	179.3	75.8	0	0	0	0	113.8	R259 Y260 L261	R259-S263 WeakPolarHBondContact O-CB 3.43Å; R259-S263 PolarHBondContact O-N 2.76Å; R259-S263 VanDerWaalsContact O-N 3.12Å; Y260-S263 WeakPolarHBondContact O-CB 3.45Å; Y260-S263 PolarHBondContact O-N 2.85Å; Y260-S263 PolarHBondContact O-OG 3.32Å; L261-S263 VanDerWaalsContact C-N 3.27Å; L261-S263 PolarHBondContact O-N 3.39Å
264	L	98.2	Very high	97.5	Very high	27 Å²	27	42.2 Å²	42.2	14%	0.141	24%	0.235	C	C	.	.	S	Bend	trans	-73	137.8	-179.6	-60.4	176.2	0	0	0	110.7	F242 Y260 L261 E262 Q268 A269 L272	F242-L264 HydrophobicContact CE1-CD1 4.45Å; Y260-L264 HydrophobicContact CE1-CD1 4.5Å; Y260-L264 HydrophobicContact CE2-CD2 4Å; L261-L264 HydrophobicContact CD2-CD1 4.19Å; E262-L264 VanDerWaalsContact C-N 3.33Å; L264-Q268 HydrophobicContact CB-CB 4.16Å; L264-Q268 HydrophobicContact CD2-CB 4.19Å; L264-A269 HydrophobicContact CB-CB 4.27Å; L264-L272 HydrophobicContact CD1-CD1 3.79Å; L264-L272 HydrophobicContact CD1-CD2 3.59Å; L264-L272 HydrophobicContact CD1-CG 4.23Å
265	D	97.7	Very high	97.6	Very high	81 Å²	81	42.2 Å²	42.2	43%	0.433	24%	0.235	S	C	.	.			trans	-71.2	167.2	166.4	70.1	54.5	0	0	0	111.2	S267 Q268 A269	D265-S267 VanDerWaalsContact C-N 3.27Å; D265-S267 PolarHBondContact O-N 2.75Å; D265-S267 WeakPolarHBondContact OD1-CA 3.36Å; D265-S267 VanDerWaalsContact OD1-CB 3.32Å; D265-S267 WeakPolarHBondContact OD1-CB 3.42Å; D265-S267 PolarHBondContact OD1-N 3.27Å; D265-Q268 PolarHBondContact O-N 3.37Å; D265-Q268 WeakPolarHBondContact OD1-CG 3.32Å; D265-Q268 PolarHBondContact OD1-N 3.16Å; D265-Q268 WeakPolarHBondContact OD2-CG 3.38Å; D265-Q268 PolarHBondContact OD2-NE2 3.16Å; D265-Q268 PolarHBondContact OD2-OE1 3.09Å; D265-A269 VanDerWaalsContact O-CB 3.3Å; D265-A269 WeakPolarHBondContact O-CB 3.28Å; D265-A269 PolarHBondContact O-N 3.26Å
266	A	96.8	Very high	97.6	Very high	86 Å²	86	42.7 Å²	42.7	71%	0.711	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-34.3	-176.2	0	0	0	0	0	113.5	S270	A266-S270 WeakPolarHBondContact O-CB 3.3Å; A266-S270 PolarHBondContact O-N 3.31Å; A266-S270 VanDerWaalsContact O-N 3.09Å; A266-S270 PolarHBondContact O-OG 2.82Å
267	S	95.8	Very high	97.6	Very high	81 Å²	81	43 Å²	43	57%	0.566	24%	0.236	S	C	*	.	H	α-helix	trans	-72.2	-41.2	178.7	179.6	0	0	0	0	111.2	D265 S270	D265-S267 VanDerWaalsContact C-N 3.27Å; D265-S267 PolarHBondContact O-N 2.75Å; D265-S267 WeakPolarHBondContact OD1-CA 3.36Å; D265-S267 VanDerWaalsContact OD1-CB 3.32Å; D265-S267 WeakPolarHBondContact OD1-CB 3.42Å; D265-S267 PolarHBondContact OD1-N 3.27Å; S267-S270 PolarHBondContact O-OG 2.98Å
268	Q	97.3	Very high	97.4	Very high	74 Å²	74	44.8 Å²	44.8	35%	0.346	25%	0.246	S	C	.	.	H	α-helix	trans	-66.3	-38.9	175.2	-68.1	173.2	-16.2	0	0	112.1	L264 D265 L272	L264-Q268 HydrophobicContact CB-CB 4.16Å; L264-Q268 HydrophobicContact CD2-CB 4.19Å; D265-Q268 PolarHBondContact O-N 3.37Å; D265-Q268 WeakPolarHBondContact OD1-CG 3.32Å; D265-Q268 PolarHBondContact OD1-N 3.16Å; D265-Q268 WeakPolarHBondContact OD2-CG 3.38Å; D265-Q268 PolarHBondContact OD2-NE2 3.16Å; D265-Q268 PolarHBondContact OD2-OE1 3.09Å; Q268-L272 PolarHBondContact O-N 2.83Å
269	A	98.2	Very high	97.1	Very high	20 Å²	20	52 Å²	52	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-41.7	-178.3	0	0	0	0	0	113	F242 L264 D265 Q271 L272 S314	F242-A269 HydrophobicContact CE1-CB 4.15Å; F242-A269 HydrophobicContact CZ-CB 3.87Å; L264-A269 HydrophobicContact CB-CB 4.27Å; D265-A269 VanDerWaalsContact O-CB 3.3Å; D265-A269 WeakPolarHBondContact O-CB 3.28Å; D265-A269 PolarHBondContact O-N 3.26Å; A269-Q271 VanDerWaalsContact C-N 3.29Å; A269-Q271 PolarHBondContact O-N 3Å; A269-L272 PolarHBondContact O-N 2.91Å; A269-S314 WeakPolarHBondContact O-CB 3.48Å; A269-S314 PolarHBondContact O-OG 2.84Å
270	S	97.5	Very high	96.5	Very high	23 Å²	23	50.3 Å²	50.3	16%	0.161	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-28.3	-177.9	58.1	0	0	0	0	113.6	A266 S267 S314 E316	A266-S270 WeakPolarHBondContact O-CB 3.3Å; A266-S270 PolarHBondContact O-N 3.31Å; A266-S270 VanDerWaalsContact O-N 3.09Å; A266-S270 PolarHBondContact O-OG 2.82Å; S267-S270 PolarHBondContact O-OG 2.98Å; S270-S314 WeakPolarHBondContact O-CB 3.38Å; S270-S314 PolarHBondContact O-OG 3.3Å; S270-E316 WeakPolarHBondContact CB-OE2 3.43Å
271	Q	96.8	Very high	96.2	Very high	109 Å²	109	49.3 Å²	49.3	51%	0.509	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	20.6	-179.1	-61.8	-176	10.9	0	0	113.1	A269 Y273 I347	A269-Q271 VanDerWaalsContact C-N 3.29Å; A269-Q271 PolarHBondContact O-N 3Å; Q271-Y273 PolarHBondContact O-N 3.45Å; Q271-I347 HydrophobicContact CB-CD1 4.02Å; Q271-I347 HydrophobicContact CG-CD1 4.13Å
272	L	98.6	Very high	95.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.312	C	S	.	.			trans	-67.8	122.3	-174.4	-168.6	69.6	0	0	0	111.4	F242 L261 L264 Q268 A269 V274 V312 I313 S314	F242-L272 HydrophobicContact CD1-CD2 3.83Å; F242-L272 HydrophobicContact CE1-CB 4.45Å; F242-L272 HydrophobicContact CE1-CD2 3.75Å; L261-L272 HydrophobicContact CD2-CD2 3.54Å; L264-L272 HydrophobicContact CD1-CD1 3.79Å; L264-L272 HydrophobicContact CD1-CD2 3.59Å; L264-L272 HydrophobicContact CD1-CG 4.23Å; Q268-L272 PolarHBondContact O-N 2.83Å; A269-L272 PolarHBondContact O-N 2.91Å; L272-V274 HydrophobicContact CD1-CB 3.95Å; L272-V274 HydrophobicContact CD1-CG1 3.78Å; L272-V274 HydrophobicContact CD2-CG1 3.93Å; L272-V274 HydrophobicContact CG-CB 4.33Å; L272-V274 HydrophobicContact CG-CG1 3.79Å; L272-V312 HydrophobicContact CD2-CB 4.47Å; L272-V312 HydrophobicContact CD2-CG1 3.96Å; L272-I313 CarbonylContact O-C 3.58Å; L272-I313 VanDerWaalsContact O-CA 3.32Å; L272-I313 WeakPolarHBondContact O-CA 3.31Å; L272-S314 PolarHBondContact O-N 3.35Å
273	Y	98.5	Very high	95.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	105.8	159.8	174.7	-143.2	0	0	0	106.8	Q271 T306 F311 V312 I313 M342 I347 P349 K350	Q271-Y273 PolarHBondContact O-N 3.45Å; Y273-T306 HydrophobicContact CD2-CG2 4.18Å; Y273-T306 HydrophobicContact CE1-CG2 4.3Å; Y273-T306 HydrophobicContact CE2-CG2 3.73Å; Y273-T306 WeakPolarHBondContact CE2-OG1 3.41Å; Y273-T306 VanDerWaalsContact CZ-OG1 3.24Å; Y273-T306 PolarHBondContact OH-N 3.27Å; Y273-T306 PolarHBondContact OH-OG1 3.39Å; Y273-F311 HydrophobicContact CD2-CD2 4.49Å; Y273-F311 HydrophobicContact CE2-CB 4.4Å; Y273-F311 HydrophobicContact CE2-CD2 4.03Å; Y273-F311 HydrophobicContact CE2-CG 4.13Å; Y273-V312 CarbonylContact C-O 3.52Å; Y273-V312 WeakPolarHBondContact CA-O 3.43Å; Y273-I313 HydrophobicContact CD2-CG1 4.01Å; Y273-I313 HydrophobicContact CE2-CG1 4.49Å; Y273-M342 HydrophobicContact CD1-CB 3.84Å; Y273-M342 HydrophobicContact CD1-CE 4.37Å; Y273-M342 HydrophobicContact CD1-CG 3.57Å; Y273-M342 HydrophobicContact CD1-SD 4.21Å; Y273-M342 HydrophobicContact CD2-CE 3.95Å; Y273-M342 HydrophobicContact CE1-CB 3.81Å; Y273-M342 HydrophobicContact CE1-CG 3.55Å; Y273-M342 HydrophobicContact CE2-CE 4.38Å; Y273-M342 HydrophobicContact CG-CE 3.94Å; Y273-M342 HydrophobicContact CG-CG 4.08Å; Y273-M342 HydrophobicContact CG-SD 4.24Å; Y273-I347 HydrophobicContact CD1-CG2 4.48Å; Y273-P349 HydrophobicContact CD1-CB 3.66Å; Y273-P349 HydrophobicContact CE1-CB 3.66Å; Y273-P349 HydrophobicContact CE1-CG 4.4Å; Y273-P349 CarbonylContact O-C 3.52Å; Y273-P349 WeakPolarHBondContact O-CA 3.24Å; Y273-K350 PolarHBondContact O-N 2.8Å
274	V	98.4	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.5	-167.3	63	0	0	0	0	112.3	Y260 L272 F311 V312 K350 H352 F355	Y260-V274 HydrophobicContact CE1-CG1 4.07Å; Y260-V274 HydrophobicContact CE1-CG2 4.49Å; L272-V274 HydrophobicContact CD1-CB 3.95Å; L272-V274 HydrophobicContact CD1-CG1 3.78Å; L272-V274 HydrophobicContact CD2-CG1 3.93Å; L272-V274 HydrophobicContact CG-CB 4.33Å; L272-V274 HydrophobicContact CG-CG1 3.79Å; V274-F311 CarbonylContact O-C 3.55Å; V274-F311 VanDerWaalsContact O-CA 3.28Å; V274-F311 WeakPolarHBondContact O-CA 3.5Å; V274-F311 VanDerWaalsContact O-CB 3.3Å; V274-F311 WeakPolarHBondContact O-CB 3.29Å; V274-V312 HydrophobicContact CG1-CB 3.84Å; V274-V312 PolarHBondContact N-O 2.96Å; V274-V312 PolarHBondContact O-N 2.71Å; V274-K350 WeakPolarHBondContact CA-O 3.32Å; V274-K350 HydrophobicContact CB-CB 4.21Å; V274-K350 HydrophobicContact CG2-CB 4.18Å; V274-K350 WeakPolarHBondContact CG2-O 3.24Å; V274-H352 HydrophobicContact CG2-CB 3.65Å; V274-F355 HydrophobicContact CG2-CE2 4.47Å
275	G	97.9	Very high	95.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.3	-155.9	176.7	0	0	0	0	0	111.5	V277 K350 H352	G275-V277 PolarHBondContact O-N 3.11Å; G275-K350 PolarHBondContact N-O 3.12Å; G275-K350 VanDerWaalsContact N-O 3.12Å; G275-H352 PolarHBondContact O-N 3.15Å
276	H	96.8	Very high	95.5	Very high	48 Å²	48	53 Å²	53	22%	0.222	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	104.6	169.3	-173.3	-169.2	0	0	0	110.1	T306 G307 W351 F355 T357 F358	H276-T306 CarbonylContact O-C 3.5Å; H276-T306 WeakPolarHBondContact O-CA 3.32Å; H276-G307 PolarHBondContact O-N 3.27Å; H276-W351 AromaticContact CD2-NE1 3.99Å; H276-F355 HydrophobicContact CB-CB 4.16Å; H276-F355 WeakPolarHBondContact CB-O 3.24Å; H276-T357 HydrophobicContact CB-CG2 3.6Å; H276-T357 PolarHBondContact ND1-OG1 3.5Å; H276-F358 AromaticContact CE1-CD2 3.47Å; H276-F358 VanDerWaalsContact CE1-CD2 3.47Å; H276-F358 WeakPolarHBondContact CE1-CD2 3.35Å; H276-F358 AromaticContact CE1-CE2 3.62Å; H276-F358 AromaticContact ND1-CD2 3.64Å; H276-F358 AromaticContact ND1-CE2 3.76Å
277	V	97	Very high	95.4	Very high	13 Å²	13	54 Å²	54	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	122.4	-175.3	-178	0	0	0	0	112.1	G275 K279 A304 Y305 T306 P349 K350 W351	G275-V277 PolarHBondContact O-N 3.11Å; V277-K279 HydrophobicContact CG1-CG 4.04Å; V277-A304 HydrophobicContact CG1-CB 4.38Å; V277-Y305 WeakPolarHBondContact CA-O 3.39Å; V277-T306 HydrophobicContact CG2-CG2 4.19Å; V277-P349 HydrophobicContact CG1-CB 4.27Å; V277-P349 HydrophobicContact CG1-CG 4.01Å; V277-P349 HydrophobicContact CG2-CB 3.83Å; V277-P349 HydrophobicContact CG2-CG 4.45Å; V277-K350 VanDerWaalsContact CG2-C 3.47Å; V277-K350 WeakPolarHBondContact CG2-O 3.35Å; V277-W351 HydrophobicContact CB-CB 4.15Å; V277-W351 HydrophobicContact CG2-CB 3.98Å
278	L	94.1	Very high	95.3	Very high	40 Å²	40	59.3 Å²	59.3	21%	0.209	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.6	166.3	-67.5	95.5	0	0	0	109.2	A304 Y305 F358	L278-A304 WeakPolarHBondContact O-CA 3.48Å; L278-Y305 HydrophobicContact CB-CE1 4.18Å; L278-Y305 HydrophobicContact CB-CE2 4.36Å; L278-Y305 HydrophobicContact CD1-CD2 4.44Å; L278-Y305 HydrophobicContact CD1-CE2 3.87Å; L278-Y305 PolarHBondContact N-O 3.44Å; L278-Y305 PolarHBondContact O-N 3.32Å; L278-F358 HydrophobicContact CD2-CZ 4.43Å
279	K	90.9	Very high	95.2	Very high	157 Å²	157	57.3 Å²	57.3	68%	0.683	30%	0.302	S	S	*	.			trans	-107.4	144.3	174.3	-62.3	-176.8	-178.5	179.2	0	109.2	V277 A281	V277-K279 HydrophobicContact CG1-CG 4.04Å; K279-A281 PolarHBondContact O-N 2.89Å; K279-A281 VanDerWaalsContact O-N 3.12Å
280	S	85.5	Confident	94.9	Very high	111 Å²	111	62.7 Å²	62.7	78%	0.776	32%	0.322	S	S	*	.	S	Bend	trans	58.6	25.5	173.5	-50.7	0	0	0	0	114.7
281	A	90.6	Very high	94.8	Very high	21 Å²	21	66.3 Å²	66.3	17%	0.174	33%	0.332	C	S	.	.			trans	-67.2	146.6	173.8	0	0	0	0	0	110.2	K279 Y302 Y305	K279-A281 PolarHBondContact O-N 2.89Å; K279-A281 VanDerWaalsContact O-N 3.12Å; A281-Y302 HydrophobicContact CB-CD2 3.97Å; A281-Y302 WeakPolarHBondContact O-CB 3.48Å; A281-Y302 PolarHBondContact O-N 3.32Å; A281-Y305 HydrophobicContact CB-CE1 3.93Å
282	S	92.8	Very high	94.8	Very high	75 Å²	75	62.4 Å²	62.4	52%	0.524	31%	0.313	S	S	.	.			trans	-128.6	155.3	177.3	-69.3	0	0	0	0	110.5	V284	S282-V284 PolarHBondContact O-N 3.11Å
283	P	95.3	Very high	94.8	Very high	12 Å²	12	62.4 Å²	62.4	8%	0.078	31%	0.313	C	S	.	.			trans	-62.1	135.1	-178	-16.2	26.2	0	0	0	112.2	I293 Y298 G300 Y302	P283-I293 HydrophobicContact CB-CB 3.75Å; P283-I293 HydrophobicContact CB-CG1 4.27Å; P283-I293 HydrophobicContact CB-CG2 3.98Å; P283-Y298 HydrophobicContact CB-CD1 4.43Å; P283-Y298 HydrophobicContact CG-CD1 3.47Å; P283-Y298 VanDerWaalsContact CG-CD1 3.47Å; P283-Y298 HydrophobicContact CG-CE1 3.54Å; P283-G300 VanDerWaalsContact CD-O 3.23Å; P283-G300 WeakPolarHBondContact CD-O 3.48Å; P283-Y302 VanDerWaalsContact CA-OH 3.31Å; P283-Y302 WeakPolarHBondContact CA-OH 3.24Å; P283-Y302 HydrophobicContact CB-CE1 4.34Å; P283-Y302 HydrophobicContact CB-CE2 4.4Å; P283-Y302 VanDerWaalsContact CB-OH 3.27Å; P283-Y302 WeakPolarHBondContact CB-OH 3.29Å; P283-Y302 HydrophobicContact CG-CD1 4.47Å; P283-Y302 HydrophobicContact CG-CE1 3.72Å; P283-Y302 HydrophobicContact CG-CE2 4.29Å
284	V	96.2	Very high	94.6	Very high	62 Å²	62	62.4 Å²	62.4	38%	0.376	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-76.1	126.5	175.3	-178.4	0	0	0	0	108.9	S282 D286 Y292 I293	S282-V284 PolarHBondContact O-N 3.11Å; V284-D286 HydrophobicContact CG1-CB 4.18Å; V284-Y292 WeakPolarHBondContact O-CA 3.32Å; V284-I293 PolarHBondContact O-N 3.33Å
285	R	95.8	Very high	94.4	Very high	93 Å²	93	67.7 Å²	67.7	35%	0.351	34%	0.341	S	S	.	.			trans	-99.9	0.2	-176.5	-51.9	-53.3	-173.9	175.3	5.5	114.1	Y292 I293 P294 Y298	R285-Y292 VanDerWaalsContact O-CE2 3.29Å; R285-Y292 WeakPolarHBondContact O-CE2 3.49Å; R285-I293 WeakPolarHBondContact CD-O 3.37Å; R285-I293 PolarHBondContact NH1-O 3.38Å; R285-P294 VanDerWaalsContact NH1-C 3.26Å; R285-P294 PolarHBondContact NH1-O 2.87Å; R285-Y298 VanDerWaalsContact CZ-O 3.31Å; R285-Y298 PolarHBondContact NH1-O 2.97Å; R285-Y298 PolarHBondContact NH2-O 3.45Å
286	D	95.9	Very high	94.3	Very high	87 Å²	87	69 Å²	69	47%	0.465	35%	0.349	S	S	.	.			trans	-79.3	117.3	172.5	179.1	7	0	0	0	110.3	V284 K288 S289 Y292	V284-D286 HydrophobicContact CG1-CB 4.18Å; D286-K288 PolarHBondContact O-N 3.27Å; D286-K288 VanDerWaalsContact O-N 3.14Å; D286-K288 WeakPolarHBondContact OD1-CB 3.36Å; D286-K288 PolarHBondContact OD1-N 3.36Å; D286-S289 VanDerWaalsContact O-CB 3.24Å; D286-S289 WeakPolarHBondContact O-CB 3.4Å; D286-S289 PolarHBondContact O-N 2.94Å; D286-Y292 VanDerWaalsContact C-CD2 3.45Å; D286-Y292 WeakPolarHBondContact O-CB 3.15Å; D286-Y292 WeakPolarHBondContact O-CD2 3.31Å
287	Q	93.7	Very high	94.2	Very high	108 Å²	108	66.7 Å²	66.7	51%	0.505	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.6	178.2	-72.9	-175.5	-9.8	0	0	113.9	S289 Y292	Q287-S289 VanDerWaalsContact C-N 3.29Å; Q287-Y292 HydrophobicContact CG-CD1 4.28Å; Q287-Y292 HydrophobicContact CG-CD2 4.16Å; Q287-Y292 HydrophobicContact CG-CE1 3.8Å; Q287-Y292 HydrophobicContact CG-CE2 3.69Å; Q287-Y292 HydrophobicContact CG-CG 4.42Å; Q287-Y292 VanDerWaalsContact CG-CZ 3.48Å
288	K	93.4	Very high	94.1	Very high	192 Å²	192	66 Å²	66	84%	0.835	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.8	175.9	-60.5	179.3	-178	177.3	0	112.8	D286	D286-K288 PolarHBondContact O-N 3.27Å; D286-K288 VanDerWaalsContact O-N 3.14Å; D286-K288 WeakPolarHBondContact OD1-CB 3.36Å; D286-K288 PolarHBondContact OD1-N 3.36Å
289	S	95.2	Very high	94.1	Very high	32 Å²	32	65 Å²	65	22%	0.224	33%	0.33	C	S	.	.	S	Bend	trans	-74.3	136.2	178	-178.7	0	0	0	0	110.9	D286 Q287 Y291 Y292	D286-S289 VanDerWaalsContact O-CB 3.24Å; D286-S289 WeakPolarHBondContact O-CB 3.4Å; D286-S289 PolarHBondContact O-N 2.94Å; Q287-S289 VanDerWaalsContact C-N 3.29Å; S289-Y291 PolarHBondContact O-N 3.47Å; S289-Y291 VanDerWaalsContact O-N 3.14Å; S289-Y291 PolarHBondContact OG-N 2.88Å; S289-Y291 VanDerWaalsContact OG-N 3.11Å; S289-Y292 VanDerWaalsContact O-CB 3.24Å; S289-Y292 WeakPolarHBondContact O-CB 3.39Å; S289-Y292 PolarHBondContact O-N 3.16Å
290	K	92.9	Very high	94.1	Very high	134 Å²	134	58.5 Å²	58.5	58%	0.583	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.2	168.5	63.6	166.7	168.3	159.9	0	113.4	L219	L219-K290 HydrophobicContact CD2-CB 4Å; L219-K290 HydrophobicContact CD2-CD 4.47Å; L219-K290 WeakPolarHBondContact CD2-O 3.29Å
291	Y	94.8	Very high	94.4	Very high	99 Å²	99	56 Å²	56	39%	0.388	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	25.1	176.8	-55.1	-60.6	0	0	0	112	S289 I293	S289-Y291 PolarHBondContact O-N 3.47Å; S289-Y291 VanDerWaalsContact O-N 3.14Å; S289-Y291 PolarHBondContact OG-N 2.88Å; S289-Y291 VanDerWaalsContact OG-N 3.11Å; Y291-I293 PolarHBondContact O-N 3.44Å
292	Y	97.1	Very high	94.6	Very high	26 Å²	26	55.6 Å²	55.6	10%	0.102	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-60.1	131.3	175.5	172.1	-116	0	0	0	111.3	P116 V284 R285 D286 Q287 S289 P294	P116-Y292 HydrophobicContact CG-CD1 3.86Å; P116-Y292 HydrophobicContact CG-CE1 3.96Å; V284-Y292 WeakPolarHBondContact O-CA 3.32Å; R285-Y292 VanDerWaalsContact O-CE2 3.29Å; R285-Y292 WeakPolarHBondContact O-CE2 3.49Å; D286-Y292 VanDerWaalsContact C-CD2 3.45Å; D286-Y292 WeakPolarHBondContact O-CB 3.15Å; D286-Y292 WeakPolarHBondContact O-CD2 3.31Å; Q287-Y292 HydrophobicContact CG-CD1 4.28Å; Q287-Y292 HydrophobicContact CG-CD2 4.16Å; Q287-Y292 HydrophobicContact CG-CE1 3.8Å; Q287-Y292 HydrophobicContact CG-CE2 3.69Å; Q287-Y292 HydrophobicContact CG-CG 4.42Å; Q287-Y292 VanDerWaalsContact CG-CZ 3.48Å; S289-Y292 VanDerWaalsContact O-CB 3.24Å; S289-Y292 WeakPolarHBondContact O-CB 3.39Å; S289-Y292 PolarHBondContact O-N 3.16Å; Y292-P294 HydrophobicContact CD1-CG 4.41Å; Y292-P294 HydrophobicContact CE1-CB 4.4Å; Y292-P294 HydrophobicContact CE1-CG 3.58Å
293	I	97.3	Very high	94.5	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.26	C	S	.	.			trans	-131.4	117.9	174	-60.3	-64.9	0	0	0	108.1	F119 P283 V284 R285 Y291 F297 Y298 Y302 F331 P332 I333	F119-I293 HydrophobicContact CE2-CD1 4.04Å; P283-I293 HydrophobicContact CB-CB 3.75Å; P283-I293 HydrophobicContact CB-CG1 4.27Å; P283-I293 HydrophobicContact CB-CG2 3.98Å; V284-I293 PolarHBondContact O-N 3.33Å; R285-I293 WeakPolarHBondContact CD-O 3.37Å; R285-I293 PolarHBondContact NH1-O 3.38Å; Y291-I293 PolarHBondContact O-N 3.44Å; I293-F297 HydrophobicContact CG2-CD1 3.87Å; I293-F297 HydrophobicContact CG2-CE1 4.47Å; I293-Y298 HydrophobicContact CG2-CD1 4.39Å; I293-Y302 WeakPolarHBondContact CG1-OH 3.24Å; I293-F331 HydrophobicContact CD1-CE1 4.37Å; I293-F331 HydrophobicContact CD1-CZ 4.36Å; I293-F331 HydrophobicContact CG2-CZ 4.43Å; I293-P332 HydrophobicContact CD1-CB 4.46Å; I293-P332 HydrophobicContact CD1-CG 3.49Å; I293-P332 VanDerWaalsContact CD1-CG 3.49Å; I293-I333 HydrophobicContact CD1-CD1 4Å; I293-I333 HydrophobicContact CD1-CG1 4.06Å; I293-I333 HydrophobicContact CG1-CD1 3.93Å
294	P	95.9	Very high	94.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.			trans	-61.2	145.4	175.4	-19	28	0	0	0	112.6	Y115 F119 R285 Y292 T296 F297 Y298	Y115-P294 HydrophobicContact CD1-CB 3.98Å; Y115-P294 HydrophobicContact CD1-CG 3.7Å; Y115-P294 HydrophobicContact CD2-CG 4.05Å; Y115-P294 HydrophobicContact CE1-CB 3.23Å; Y115-P294 HydrophobicContact CE1-CG 3.41Å; Y115-P294 VanDerWaalsContact CE1-CG 3.41Å; Y115-P294 HydrophobicContact CE2-CB 4.18Å; Y115-P294 HydrophobicContact CE2-CG 3.79Å; Y115-P294 HydrophobicContact CG-CG 4Å; Y115-P294 VanDerWaalsContact CZ-CG 3.45Å; Y115-P294 WeakPolarHBondContact OH-CB 3.3Å; F119-P294 HydrophobicContact CD1-CG 4.34Å; F119-P294 HydrophobicContact CE1-CG 4.13Å; F119-P294 HydrophobicContact CE2-CG 4.47Å; F119-P294 HydrophobicContact CZ-CG 4.2Å; R285-P294 VanDerWaalsContact NH1-C 3.26Å; R285-P294 PolarHBondContact NH1-O 2.87Å; Y292-P294 HydrophobicContact CD1-CG 4.41Å; Y292-P294 HydrophobicContact CE1-CB 4.4Å; Y292-P294 HydrophobicContact CE1-CG 3.58Å; P294-T296 VanDerWaalsContact C-N 3.35Å; P294-F297 HydrophobicContact CB-CB 3.96Å; P294-F297 HydrophobicContact CG-CB 4.14Å; P294-F297 PolarHBondContact O-N 3.04Å; P294-Y298 PolarHBondContact O-N 2.89Å
295	L	94.2	Very high	94.5	Very high	110 Å²	110	51.7 Å²	51.7	58%	0.576	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-42	179.4	-178.7	63.2	0	0	0	111.9	A68 F297 Y298	A68-L295 WeakPolarHBondContact CB-O 3.28Å; L295-F297 VanDerWaalsContact C-N 3.27Å; L295-F297 PolarHBondContact O-N 3.29Å; L295-Y298 CarbonylContact O-C 3.5Å; L295-Y298 PolarHBondContact O-N 3.44Å
296	T	94.3	Very high	94.5	Very high	27 Å²	27	47.3 Å²	47.3	17%	0.166	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-21.8	177.9	44.7	0	0	0	0	113	A68 Y69 H110 D111 Y115 P294	A68-T296 CarbonylContact C-O 3.43Å; A68-T296 WeakPolarHBondContact CA-O 3.33Å; Y69-T296 PolarHBondContact N-O 3.47Å; H110-T296 WeakPolarHBondContact CE1-CG2 3.12Å; D111-T296 WeakPolarHBondContact OD1-CB 3.34Å; D111-T296 PolarHBondContact OD1-OG1 3.26Å; D111-T296 PolarHBondContact OD2-OG1 2.75Å; Y115-T296 PolarHBondContact OH-OG1 3.24Å; P294-T296 VanDerWaalsContact C-N 3.35Å
297	F	95.3	Very high	94	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-53	168.9	172.4	-99.6	0	0	0	111.8	Y69 W70 Y115 F119 Y122 L123 M126 I293 P294 L295 F331 P332	Y69-F297 HydrophobicContact CD1-CD2 4.28Å; Y69-F297 HydrophobicContact CD1-CE2 4.48Å; Y69-F297 PolarHBondContact N-O 2.91Å; W70-F297 HydrophobicContact CB-CD2 4.32Å; W70-F297 HydrophobicContact CB-CE1 4.15Å; W70-F297 HydrophobicContact CB-CE2 3.93Å; W70-F297 HydrophobicContact CB-CZ 3.86Å; W70-F297 WeakPolarHBondContact CB-O 3.48Å; W70-F297 AromaticContact CD1-CZ 3.58Å; W70-F297 HydrophobicContact CG-CE1 4.34Å; W70-F297 HydrophobicContact CG-CE2 4.37Å; W70-F297 AromaticContact CG-CZ 3.94Å; W70-F297 HydrophobicContact CG-CZ 3.94Å; W70-F297 PolarHBondContact N-O 3.16Å; Y115-F297 HydrophobicContact CE2-CB 4.41Å; Y115-F297 PolarHBondContact OH-N 3.37Å; Y115-F297 VanDerWaalsContact OH-N 3.17Å; F119-F297 HydrophobicContact CE1-CB 4.17Å; F119-F297 HydrophobicContact CE1-CD1 4.18Å; F119-F297 AromaticContact CE1-CD2 3.83Å; F119-F297 HydrophobicContact CE1-CD2 3.83Å; F119-F297 HydrophobicContact CE1-CE2 4.25Å; F119-F297 AromaticContact CE1-CG 3.77Å; F119-F297 HydrophobicContact CE1-CG 3.77Å; F119-F297 HydrophobicContact CZ-CB 4.28Å; F119-F297 AromaticContact CZ-CD1 3.63Å; F119-F297 HydrophobicContact CZ-CD1 3.63Å; F119-F297 HydrophobicContact CZ-CD2 4.09Å; F119-F297 AromaticContact CZ-CE1 3.9Å; F119-F297 HydrophobicContact CZ-CE1 3.9Å; F119-F297 HydrophobicContact CZ-CE2 4.34Å; F119-F297 AromaticContact CZ-CG 3.71Å; F119-F297 HydrophobicContact CZ-CG 3.71Å; F119-F297 HydrophobicContact CZ-CZ 4.25Å; Y122-F297 HydrophobicContact CE1-CE2 4.38Å; Y122-F297 HydrophobicContact CE1-CZ 4.19Å; L123-F297 HydrophobicContact CD2-CD2 3.73Å; L123-F297 HydrophobicContact CD2-CE2 3.55Å; M126-F297 HydrophobicContact SD-CE2 4.12Å; M126-F297 HydrophobicContact SD-CZ 4.45Å; I293-F297 HydrophobicContact CG2-CD1 3.87Å; I293-F297 HydrophobicContact CG2-CE1 4.47Å; P294-F297 HydrophobicContact CB-CB 3.96Å; P294-F297 HydrophobicContact CG-CB 4.14Å; P294-F297 PolarHBondContact O-N 3.04Å; L295-F297 VanDerWaalsContact C-N 3.27Å; L295-F297 PolarHBondContact O-N 3.29Å; F297-F331 HydrophobicContact CE1-CD2 4.19Å; F297-F331 AromaticContact CE1-CE2 3.81Å; F297-F331 HydrophobicContact CE1-CE2 3.81Å; F297-F331 HydrophobicContact CE1-CZ 4.37Å; F297-P332 HydrophobicContact CE1-CG 3.82Å; F297-P332 HydrophobicContact CZ-CG 4.11Å
298	Y	95.4	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.			trans	-143.1	131.3	-179.7	174.2	-97.7	0	0	0	112.1	I63 W70 N71 P283 R285 I293 P294 L295 G300 P301 Y302 F331	I63-Y298 HydrophobicContact CG2-CE2 4.37Å; W70-Y298 HydrophobicContact CD2-CD2 4.32Å; W70-Y298 AromaticContact CE3-CD2 3.62Å; W70-Y298 HydrophobicContact CE3-CD2 3.62Å; W70-Y298 AromaticContact CE3-CE2 3.89Å; W70-Y298 HydrophobicContact CE3-CE2 3.89Å; W70-Y298 HydrophobicContact CZ3-CD2 4.19Å; W70-Y298 AromaticContact CZ3-CE2 3.98Å; W70-Y298 HydrophobicContact CZ3-CE2 3.98Å; N71-Y298 WeakPolarHBondContact OD1-CA 3.46Å; N71-Y298 WeakPolarHBondContact OD1-CD2 2.97Å; P283-Y298 HydrophobicContact CB-CD1 4.43Å; P283-Y298 HydrophobicContact CG-CD1 3.47Å; P283-Y298 VanDerWaalsContact CG-CD1 3.47Å; P283-Y298 HydrophobicContact CG-CE1 3.54Å; R285-Y298 VanDerWaalsContact CZ-O 3.31Å; R285-Y298 PolarHBondContact NH1-O 2.97Å; R285-Y298 PolarHBondContact NH2-O 3.45Å; I293-Y298 HydrophobicContact CG2-CD1 4.39Å; P294-Y298 PolarHBondContact O-N 2.89Å; L295-Y298 CarbonylContact O-C 3.5Å; L295-Y298 PolarHBondContact O-N 3.44Å; Y298-G300 WeakPolarHBondContact CE1-O 3.2Å; Y298-P301 PolarHBondContact OH-O 3.48Å; Y298-Y302 AromaticContact CD1-CE1 3.94Å; Y298-Y302 HydrophobicContact CD1-CE1 3.94Å; Y298-Y302 AromaticContact CE1-CD1 3.72Å; Y298-Y302 HydrophobicContact CE1-CD1 3.72Å; Y298-Y302 AromaticContact CE1-CE1 3.48Å; Y298-Y302 HydrophobicContact CE1-CE1 3.48Å; Y298-Y302 VanDerWaalsContact CE1-CE1 3.48Å; Y298-F331 HydrophobicContact CD1-CE2 4.13Å; Y298-F331 HydrophobicContact CD1-CZ 4.02Å; Y298-F331 AromaticContact CD2-CE2 3.74Å; Y298-F331 HydrophobicContact CD2-CE2 3.74Å; Y298-F331 HydrophobicContact CD2-CZ 4.42Å; Y298-F331 HydrophobicContact CE1-CZ 4.47Å; Y298-F331 HydrophobicContact CE2-CE2 4.28Å; Y298-F331 AromaticContact CG-CE2 3.63Å; Y298-F331 HydrophobicContact CG-CE2 3.63Å; Y298-F331 AromaticContact CG-CZ 3.98Å; Y298-F331 HydrophobicContact CG-CZ 3.98Å
299	S	93	Very high	92.8	Very high	17 Å²	17	30 Å²	30	12%	0.119	17%	0.167	C	C	.	.			trans	-121	147.1	178.4	-174.7	0	0	0	0	111.1	P64 D66 N71	P64-S299 WeakPolarHBondContact CG-O 2.9Å; D66-S299 WeakPolarHBondContact OD2-CB 3.22Å; D66-S299 PolarHBondContact OD2-OG 2.88Å; N71-S299 PolarHBondContact ND2-O 2.96Å; N71-S299 PolarHBondContact OD1-N 2.94Å
300	G	91.6	Very high	92.8	Very high	21 Å²	21	28.6 Å²	28.6	22%	0.216	16%	0.157	C	C	.	.	S	Bend	trans	100.8	177.5	-177.4	0	0	0	0	0	115.3	P283 Y298	P283-G300 VanDerWaalsContact CD-O 3.23Å; P283-G300 WeakPolarHBondContact CD-O 3.48Å; Y298-G300 WeakPolarHBondContact CE1-O 3.2Å
301	P	92.1	Very high	93.1	Very high	58 Å²	58	22.3 Å²	22.3	38%	0.377	13%	0.13	S	C	.	.	P	Polyproline II helix	trans	-84.2	156.2	179.7	35	-34.8	0	0	0	111.9	Y298	Y298-P301 PolarHBondContact OH-O 3.48Å
302	Y	93.6	Very high	93.3	Very high	13 Å²	13	17.6 Å²	17.6	5%	0.051	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-75.8	151.2	171.7	-61.5	-39.9	0	0	0	112.2	A281 P283 I293 Y298 Y305 F331 I333 V336	A281-Y302 HydrophobicContact CB-CD2 3.97Å; A281-Y302 WeakPolarHBondContact O-CB 3.48Å; A281-Y302 PolarHBondContact O-N 3.32Å; P283-Y302 VanDerWaalsContact CA-OH 3.31Å; P283-Y302 WeakPolarHBondContact CA-OH 3.24Å; P283-Y302 HydrophobicContact CB-CE1 4.34Å; P283-Y302 HydrophobicContact CB-CE2 4.4Å; P283-Y302 VanDerWaalsContact CB-OH 3.27Å; P283-Y302 WeakPolarHBondContact CB-OH 3.29Å; P283-Y302 HydrophobicContact CG-CD1 4.47Å; P283-Y302 HydrophobicContact CG-CE1 3.72Å; P283-Y302 HydrophobicContact CG-CE2 4.29Å; I293-Y302 WeakPolarHBondContact CG1-OH 3.24Å; Y298-Y302 AromaticContact CD1-CE1 3.94Å; Y298-Y302 HydrophobicContact CD1-CE1 3.94Å; Y298-Y302 AromaticContact CE1-CD1 3.72Å; Y298-Y302 HydrophobicContact CE1-CD1 3.72Å; Y298-Y302 AromaticContact CE1-CE1 3.48Å; Y298-Y302 HydrophobicContact CE1-CE1 3.48Å; Y298-Y302 VanDerWaalsContact CE1-CE1 3.48Å; Y302-Y305 HydrophobicContact CD2-CE1 4.24Å; Y302-F331 AromaticContact CE1-CE1 3.78Å; Y302-F331 HydrophobicContact CE1-CE1 3.78Å; Y302-F331 AromaticContact CE1-CZ 3.61Å; Y302-F331 HydrophobicContact CE1-CZ 3.61Å; Y302-I333 HydrophobicContact CE2-CD1 4.4Å; Y302-I333 WeakPolarHBondContact OH-CD1 3.48Å; Y302-V336 HydrophobicContact CD1-CB 4.48Å; Y302-V336 HydrophobicContact CD1-CG1 3.48Å; Y302-V336 VanDerWaalsContact CD1-CG1 3.48Å; Y302-V336 HydrophobicContact CD1-CG2 4.14Å; Y302-V336 HydrophobicContact CD2-CG2 3.82Å; Y302-V336 HydrophobicContact CE1-CG1 3.84Å; Y302-V336 HydrophobicContact CE1-CG2 4.26Å; Y302-V336 HydrophobicContact CE2-CG2 3.96Å; Y302-V336 HydrophobicContact CG-CG1 3.9Å; Y302-V336 HydrophobicContact CG-CG2 3.9Å
303	P	92.5	Very high	93.3	Very high	7 Å²	7	16.4 Å²	16.4	5%	0.045	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-62.8	168.1	164.2	32.4	-37.8	0	0	0	110.1	Y305 L340	P303-Y305 WeakPolarHBondContact O-CD1 3.39Å; P303-Y305 PolarHBondContact O-N 3.41Å; P303-L340 HydrophobicContact CG-CD2 3.74Å; P303-L340 HydrophobicContact CG-CG 3.86Å
304	A	94.4	Very high	93.4	Very high	37 Å²	37	16.5 Å²	16.5	31%	0.306	11%	0.107	S	C	.	.	P	Polyproline II helix	trans	-64.1	136.3	166.7	0	0	0	0	0	109.9	V277 L278 P349	V277-A304 HydrophobicContact CG1-CB 4.38Å; L278-A304 WeakPolarHBondContact O-CA 3.48Å; A304-P349 HydrophobicContact CB-CG 3.8Å
305	Y	96.1	Very high	93.5	Very high	24 Å²	24	17.1 Å²	17.1	9%	0.094	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	160.9	179.1	66.8	-89.9	0	0	0	111	V277 L278 A281 Y302 P303 D335 V336	V277-Y305 WeakPolarHBondContact CA-O 3.39Å; L278-Y305 HydrophobicContact CB-CE1 4.18Å; L278-Y305 HydrophobicContact CB-CE2 4.36Å; L278-Y305 HydrophobicContact CD1-CD2 4.44Å; L278-Y305 HydrophobicContact CD1-CE2 3.87Å; L278-Y305 PolarHBondContact N-O 3.44Å; L278-Y305 PolarHBondContact O-N 3.32Å; A281-Y305 HydrophobicContact CB-CE1 3.93Å; Y302-Y305 HydrophobicContact CD2-CE1 4.24Å; P303-Y305 WeakPolarHBondContact O-CD1 3.39Å; P303-Y305 PolarHBondContact O-N 3.41Å; Y305-D335 WeakPolarHBondContact CB-O 3.36Å; Y305-D335 HydrophobicContact CD2-CB 3.58Å; Y305-D335 HydrophobicContact CE2-CB 3.76Å; Y305-V336 HydrophobicContact CD1-CG2 4.07Å; Y305-V336 HydrophobicContact CE1-CG2 3.73Å; Y305-V336 HydrophobicContact CE2-CG2 4.38Å
306	T	96	Very high	93.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.5	169.8	56.4	0	0	0	0	108.9	Y273 H276 V277 F311 D335 P349	Y273-T306 HydrophobicContact CD2-CG2 4.18Å; Y273-T306 HydrophobicContact CE1-CG2 4.3Å; Y273-T306 HydrophobicContact CE2-CG2 3.73Å; Y273-T306 WeakPolarHBondContact CE2-OG1 3.41Å; Y273-T306 VanDerWaalsContact CZ-OG1 3.24Å; Y273-T306 PolarHBondContact OH-N 3.27Å; Y273-T306 PolarHBondContact OH-OG1 3.39Å; H276-T306 CarbonylContact O-C 3.5Å; H276-T306 WeakPolarHBondContact O-CA 3.32Å; V277-T306 HydrophobicContact CG2-CG2 4.19Å; T306-F311 HydrophobicContact CG2-CB 4.22Å; T306-F311 WeakPolarHBondContact OG1-CB 3.38Å; T306-F311 VanDerWaalsContact OG1-CD1 3.25Å; T306-F311 WeakPolarHBondContact OG1-CD1 3.36Å; T306-F311 WeakPolarHBondContact OG1-CG 3.41Å; T306-D335 WeakPolarHBondContact O-CB 3.39Å; T306-P349 HydrophobicContact CG2-CB 4.02Å
307	G	84.8	Confident	93.9	Very high	3 Å²	3	18.3 Å²	18.3	3%	0.031	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	169.8	-179	0	0	0	0	0	114.1	H276	H276-G307 PolarHBondContact O-N 3.27Å
308	G	74.6	Confident	94	Very high	21 Å²	21	18.6 Å²	18.6	22%	0.216	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	178.9	-173.9	0	0	0	0	0	115.6	G310 D335 T357	G308-G310 PolarHBondContact O-N 3.1Å; G308-D335 WeakPolarHBondContact CA-OD2 3.47Å; G308-D335 PolarHBondContact N-OD2 3.44Å; G308-T357 WeakPolarHBondContact O-CB 3.09Å; G308-T357 WeakPolarHBondContact O-CG2 3.38Å
309	G	87.8	Confident	94	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.7	-54.2	-166.5	0	0	0	0	0	111.8	G246 D247 V250	G246-G309 CarbonylContact C-O 3.45Å; G246-G309 WeakPolarHBondContact CA-O 3.43Å; D247-G309 PolarHBondContact N-O 2.82Å; D247-G309 VanDerWaalsContact OD2-CA 3.3Å; D247-G309 WeakPolarHBondContact OD2-CA 3.18Å; D247-G309 PolarHBondContact OD2-N 2.03Å; V250-G309 VanDerWaalsContact CG1-O 3.3Å; V250-G309 WeakPolarHBondContact CG1-O 3.08Å
310	G	95.6	Very high	94.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.4	164.4	165.5	0	0	0	0	0	117.2	S245 G308 F355	S245-G310 CarbonylContact O-C 3.5Å; S245-G310 WeakPolarHBondContact O-CA 3.49Å; G308-G310 PolarHBondContact O-N 3.1Å; G310-F355 VanDerWaalsContact O-CD1 3.3Å; G310-F355 WeakPolarHBondContact O-CD1 3.18Å
311	F	98.1	Very high	94.4	Very high	3 Å²	3	23.8 Å²	23.8	1%	0.013	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	166.2	-178.4	52.4	-102.9	0	0	0	110.9	M226 F244 S245 Y273 V274 T306 I313 M338	M226-F311 HydrophobicContact CE-CE2 4.35Å; M226-F311 HydrophobicContact CE-CZ 4.34Å; F244-F311 CarbonylContact C-O 3.53Å; F244-F311 WeakPolarHBondContact CA-O 3.37Å; S245-F311 VanDerWaalsContact CB-CE2 3.48Å; S245-F311 PolarHBondContact N-O 2.78Å; S245-F311 PolarHBondContact O-N 3.21Å; Y273-F311 HydrophobicContact CD2-CD2 4.49Å; Y273-F311 HydrophobicContact CE2-CB 4.4Å; Y273-F311 HydrophobicContact CE2-CD2 4.03Å; Y273-F311 HydrophobicContact CE2-CG 4.13Å; V274-F311 CarbonylContact O-C 3.55Å; V274-F311 VanDerWaalsContact O-CA 3.28Å; V274-F311 WeakPolarHBondContact O-CA 3.5Å; V274-F311 VanDerWaalsContact O-CB 3.3Å; V274-F311 WeakPolarHBondContact O-CB 3.29Å; T306-F311 HydrophobicContact CG2-CB 4.22Å; T306-F311 WeakPolarHBondContact OG1-CB 3.38Å; T306-F311 VanDerWaalsContact OG1-CD1 3.25Å; T306-F311 WeakPolarHBondContact OG1-CD1 3.36Å; T306-F311 WeakPolarHBondContact OG1-CG 3.41Å; F311-I313 HydrophobicContact CD2-CD1 3.97Å; F311-I313 HydrophobicContact CD2-CG1 3.79Å; F311-I313 HydrophobicContact CE2-CD1 3.48Å; F311-I313 VanDerWaalsContact CE2-CD1 3.48Å; F311-I313 HydrophobicContact CE2-CG1 3.86Å; F311-M338 HydrophobicContact CZ-CG 4.3Å
312	V	98.8	Very high	94.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.5	173.6	-177	0	0	0	0	111	F242 V243 F244 L257 L261 L272 Y273 V274 F355	F242-V312 HydrophobicContact CB-CG1 4.02Å; F242-V312 HydrophobicContact CD1-CG1 4.33Å; V243-V312 CarbonylContact O-C 3.33Å; V243-V312 WeakPolarHBondContact O-CA 3.35Å; F244-V312 HydrophobicContact CB-CG2 4.18Å; F244-V312 HydrophobicContact CD2-CG2 3.88Å; L257-V312 HydrophobicContact CD1-CG2 4.03Å; L257-V312 HydrophobicContact CD2-CG2 4.42Å; L261-V312 HydrophobicContact CD2-CG1 3.96Å; L272-V312 HydrophobicContact CD2-CB 4.47Å; L272-V312 HydrophobicContact CD2-CG1 3.96Å; Y273-V312 CarbonylContact C-O 3.52Å; Y273-V312 WeakPolarHBondContact CA-O 3.43Å; V274-V312 HydrophobicContact CG1-CB 3.84Å; V274-V312 PolarHBondContact N-O 2.96Å; V274-V312 PolarHBondContact O-N 2.71Å; V312-F355 HydrophobicContact CG2-CZ 4.18Å
313	I	98.5	Very high	94.5	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.1	174.8	-52	172.4	0	0	0	109.3	M226 F242 V243 L272 Y273 F311 L317 M318 L321 M338 M342	M226-I313 HydrophobicContact CE-CD1 4.37Å; F242-I313 WeakPolarHBondContact CA-O 3.27Å; V243-I313 PolarHBondContact N-O 3.5Å; V243-I313 PolarHBondContact O-N 2.67Å; L272-I313 CarbonylContact O-C 3.58Å; L272-I313 VanDerWaalsContact O-CA 3.32Å; L272-I313 WeakPolarHBondContact O-CA 3.31Å; Y273-I313 HydrophobicContact CD2-CG1 4.01Å; Y273-I313 HydrophobicContact CE2-CG1 4.49Å; F311-I313 HydrophobicContact CD2-CD1 3.97Å; F311-I313 HydrophobicContact CD2-CG1 3.79Å; F311-I313 HydrophobicContact CE2-CD1 3.48Å; F311-I313 VanDerWaalsContact CE2-CD1 3.48Å; F311-I313 HydrophobicContact CE2-CG1 3.86Å; I313-L317 HydrophobicContact CG2-CB 4.03Å; I313-L317 HydrophobicContact CG2-CD1 4Å; I313-M318 HydrophobicContact CB-CE 3.67Å; I313-M318 HydrophobicContact CD1-CE 4.26Å; I313-M318 HydrophobicContact CG2-CE 3.28Å; I313-L321 HydrophobicContact CD1-CD2 3.87Å; I313-L321 HydrophobicContact CG2-CD2 4.34Å; I313-M338 HydrophobicContact CD1-CE 4.14Å; I313-M342 HydrophobicContact CB-CE 4.29Å; I313-M342 HydrophobicContact CD1-CE 3.57Å; I313-M342 HydrophobicContact CG1-CE 3.75Å; I313-M342 HydrophobicContact CG2-CE 3.5Å; I313-M342 VanDerWaalsContact CG2-CE 3.5Å
314	S	98.8	Very high	94.5	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	139.4	168	-171.5	0	0	0	0	112.3	A269 S270 L272 E316 L317 M318	A269-S314 WeakPolarHBondContact O-CB 3.48Å; A269-S314 PolarHBondContact O-OG 2.84Å; S270-S314 WeakPolarHBondContact O-CB 3.38Å; S270-S314 PolarHBondContact O-OG 3.3Å; L272-S314 PolarHBondContact O-N 3.35Å; S314-E316 PolarHBondContact O-N 3.24Å; S314-E316 PolarHBondContact OG-N 3.14Å; S314-L317 PolarHBondContact O-N 3.24Å; S314-M318 WeakPolarHBondContact O-CE 3.49Å
315	G	98.4	Very high	94.4	Very high	13 Å²	13	22.5 Å²	22.5	13%	0.134	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-60.9	-31.1	172.5	0	0	0	0	0	113.4	V240 S241 L317 M318	V240-G315 WeakPolarHBondContact O-CA 3.47Å; S241-G315 PolarHBondContact O-N 3.24Å; G315-L317 PolarHBondContact O-N 3.19Å; G315-M318 WeakPolarHBondContact O-CB 3.49Å; G315-M318 WeakPolarHBondContact O-CG 3.48Å; G315-M318 PolarHBondContact O-N 2.97Å; G315-M318 VanDerWaalsContact O-N 3.1Å
316	E	97.9	Very high	94.2	Very high	143 Å²	143	25.1 Å²	25.1	67%	0.668	13%	0.131	S	C	*	.	G	3₁₀ helix	trans	-64.2	-23.4	178.1	-66.9	-173.3	-153.9	0	0	112.6	S270 S314	S270-E316 WeakPolarHBondContact CB-OE2 3.43Å; S314-E316 PolarHBondContact O-N 3.24Å; S314-E316 PolarHBondContact OG-N 3.14Å
317	L	98	Very high	93.8	Very high	18 Å²	18	26.7 Å²	26.7	9%	0.094	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-83.4	-14	178	-61.3	176.2	0	0	0	113	I313 S314 G315 Q319 S320 L321 M342 I347	I313-L317 HydrophobicContact CG2-CB 4.03Å; I313-L317 HydrophobicContact CG2-CD1 4Å; S314-L317 PolarHBondContact O-N 3.24Å; G315-L317 PolarHBondContact O-N 3.19Å; L317-Q319 PolarHBondContact O-N 3.36Å; L317-S320 PolarHBondContact O-N 2.92Å; L317-L321 WeakPolarHBondContact O-CB 3.38Å; L317-L321 PolarHBondContact O-N 3.4Å; L317-M342 HydrophobicContact CD1-SD 4.42Å; L317-I347 HydrophobicContact CD1-CD1 4.38Å; L317-I347 HydrophobicContact CD1-CG1 4.17Å; L317-I347 HydrophobicContact CD1-CG2 4.23Å; L317-I347 HydrophobicContact CD2-CD1 3.87Å; L317-I347 HydrophobicContact CD2-CG1 3.97Å
318	M	97.6	Very high	94	Very high	7 Å²	7	26.6 Å²	26.6	3%	0.034	14%	0.138	C	C	.	.	H	α-helix	trans	-59.9	-41.9	-169.9	-69.2	-62.9	103.6	0	0	113.4	L230 T233 V234 V240 V243 I313 S314 G315 L321 S322	L230-M318 HydrophobicContact CD2-CE 4.49Å; L230-M318 HydrophobicContact CD2-SD 4.04Å; T233-M318 HydrophobicContact CG2-CG 4.03Å; T233-M318 HydrophobicContact CG2-SD 4.03Å; V234-M318 HydrophobicContact CG2-CB 4.12Å; V234-M318 WeakPolarHBondContact CG2-O 3.35Å; V240-M318 HydrophobicContact CG1-CG 4.41Å; V243-M318 HydrophobicContact CB-CE 4.5Å; V243-M318 HydrophobicContact CB-SD 4.42Å; V243-M318 HydrophobicContact CG2-CE 4.36Å; V243-M318 HydrophobicContact CG2-CG 4.31Å; V243-M318 HydrophobicContact CG2-SD 3.83Å; I313-M318 HydrophobicContact CB-CE 3.67Å; I313-M318 HydrophobicContact CD1-CE 4.26Å; I313-M318 HydrophobicContact CG2-CE 3.28Å; S314-M318 WeakPolarHBondContact O-CE 3.49Å; G315-M318 WeakPolarHBondContact O-CB 3.49Å; G315-M318 WeakPolarHBondContact O-CG 3.48Å; G315-M318 PolarHBondContact O-N 2.97Å; G315-M318 VanDerWaalsContact O-N 3.1Å; M318-L321 HydrophobicContact CE-CD2 4.11Å; M318-S322 WeakPolarHBondContact O-CB 3.35Å; M318-S322 PolarHBondContact O-N 3.37Å
319	Q	96.3	Very high	94.9	Very high	116 Å²	116	25.6 Å²	25.6	54%	0.542	13%	0.128	S	C	.	.	H	α-helix	trans	-66.7	-49.7	-179.8	-173.8	171.8	8.1	0	0	111.2	L317 L321 S322 F323	L317-Q319 PolarHBondContact O-N 3.36Å; Q319-L321 VanDerWaalsContact C-N 3.33Å; Q319-L321 PolarHBondContact O-N 3.44Å; Q319-S322 PolarHBondContact O-N 2.81Å; Q319-F323 WeakPolarHBondContact O-CB 3.43Å; Q319-F323 PolarHBondContact O-N 3.46Å
320	S	95.4	Very high	95.2	Very high	31 Å²	31	25.8 Å²	25.8	22%	0.217	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-36.6	-179.3	-52.9	0	0	0	0	112.4	L317 F323 V324	L317-S320 PolarHBondContact O-N 2.92Å; S320-F323 PolarHBondContact O-N 2.9Å; S320-V324 WeakPolarHBondContact O-CB 3.31Å; S320-V324 WeakPolarHBondContact O-CG2 3.43Å; S320-V324 PolarHBondContact O-N 2.66Å
321	L	96.3	Very high	95.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.1	-43.5	177.3	-173	59.1	0	0	0	112.1	L230 I313 L317 M318 Q319 F323 V324 S325 M338 C341 M342 L345	L230-L321 HydrophobicContact CD1-CD2 4.42Å; L230-L321 HydrophobicContact CD1-CG 3.95Å; L230-L321 HydrophobicContact CD2-CD2 3.76Å; L230-L321 HydrophobicContact CD2-CG 4.06Å; I313-L321 HydrophobicContact CD1-CD2 3.87Å; I313-L321 HydrophobicContact CG2-CD2 4.34Å; L317-L321 WeakPolarHBondContact O-CB 3.38Å; L317-L321 PolarHBondContact O-N 3.4Å; M318-L321 HydrophobicContact CE-CD2 4.11Å; Q319-L321 VanDerWaalsContact C-N 3.33Å; Q319-L321 PolarHBondContact O-N 3.44Å; L321-F323 VanDerWaalsContact C-N 3.3Å; L321-F323 PolarHBondContact O-N 3.47Å; L321-V324 PolarHBondContact O-N 3.06Å; L321-S325 WeakPolarHBondContact O-CB 3.39Å; L321-S325 PolarHBondContact O-N 3.23Å; L321-S325 PolarHBondContact O-OG 2.91Å; L321-M338 HydrophobicContact CD1-CE 3.85Å; L321-M338 HydrophobicContact CD2-CE 3.58Å; L321-M338 HydrophobicContact CG-CE 3.95Å; L321-C341 HydrophobicContact CD1-CB 3.64Å; L321-M342 HydrophobicContact CD1-CE 4.15Å; L321-M342 HydrophobicContact CD1-CG 4.44Å; L321-M342 HydrophobicContact CD1-SD 4.12Å; L321-M342 HydrophobicContact CD2-CE 3.5Å; L321-M342 VanDerWaalsContact CD2-CE 3.5Å; L321-M342 HydrophobicContact CD2-SD 4.43Å; L321-M342 HydrophobicContact CG-CE 4.44Å; L321-L345 HydrophobicContact CB-CD1 4.1Å; L321-L345 HydrophobicContact CD1-CD1 4.14Å
322	S	95.9	Very high	95.2	Very high	12 Å²	12	25.7 Å²	25.7	8%	0.084	13%	0.128	C	C	.	.	H	α-helix	trans	-58	-43.3	171.2	176.2	0	0	0	0	111.2	M318 Q319 S325 K326	M318-S322 WeakPolarHBondContact O-CB 3.35Å; M318-S322 PolarHBondContact O-N 3.37Å; Q319-S322 PolarHBondContact O-N 2.81Å; S322-S325 PolarHBondContact O-OG 3.2Å; S322-K326 WeakPolarHBondContact O-CG 3.28Å
323	F	93.1	Very high	95.1	Very high	75 Å²	75	26.4 Å²	26.4	33%	0.329	13%	0.132	S	C	.	.	H	α-helix	trans	-62.7	-54.9	176.7	177	-102.6	0	0	0	112.3	I52 Q319 S320 L321 S325 K326 L327	I52-F323 HydrophobicContact CB-CD1 4.28Å; I52-F323 HydrophobicContact CB-CE1 4.43Å; I52-F323 HydrophobicContact CD1-CB 3.76Å; I52-F323 HydrophobicContact CD1-CD1 3.43Å; I52-F323 VanDerWaalsContact CD1-CD1 3.43Å; I52-F323 HydrophobicContact CD1-CE1 4.17Å; I52-F323 HydrophobicContact CD1-CG 3.71Å; I52-F323 HydrophobicContact CG1-CD1 4.44Å; Q319-F323 WeakPolarHBondContact O-CB 3.43Å; Q319-F323 PolarHBondContact O-N 3.46Å; S320-F323 PolarHBondContact O-N 2.9Å; L321-F323 VanDerWaalsContact C-N 3.3Å; L321-F323 PolarHBondContact O-N 3.47Å; F323-S325 VanDerWaalsContact C-N 3.32Å; F323-S325 PolarHBondContact O-N 2.91Å; F323-K326 WeakPolarHBondContact O-CB 3.42Å; F323-K326 PolarHBondContact O-N 3.07Å; F323-L327 HydrophobicContact CD1-CD1 4.07Å; F323-L327 HydrophobicContact CE1-CD1 3.63Å; F323-L327 HydrophobicContact CZ-CD1 4.08Å; F323-L327 HydrophobicContact CZ-CD2 4.44Å
324	V	92.2	Very high	95	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-39.3	-178.1	165.6	0	0	0	0	112.3	I52 V54 S320 L321 K326 L327 F328 C341 A344 L345	I52-V324 HydrophobicContact CG2-CG2 4.45Å; V54-V324 HydrophobicContact CG2-CG2 4.35Å; S320-V324 WeakPolarHBondContact O-CB 3.31Å; S320-V324 WeakPolarHBondContact O-CG2 3.43Å; S320-V324 PolarHBondContact O-N 2.66Å; L321-V324 PolarHBondContact O-N 3.06Å; V324-K326 PolarHBondContact O-N 2.71Å; V324-L327 WeakPolarHBondContact O-CB 3.23Å; V324-L327 PolarHBondContact O-N 2.89Å; V324-F328 HydrophobicContact CG1-CD2 4.18Å; V324-F328 HydrophobicContact CG1-CE2 3.84Å; V324-F328 HydrophobicContact CG1-CZ 4.15Å; V324-F328 PolarHBondContact O-N 2.65Å; V324-C341 HydrophobicContact CG1-CB 4.02Å; V324-A344 HydrophobicContact CG1-CB 3.79Å; V324-L345 HydrophobicContact CB-CD2 4.44Å; V324-L345 HydrophobicContact CG2-CD2 3.51Å; V324-L345 HydrophobicContact CG2-CG 4.08Å
325	S	93.4	Very high	94.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-54	-43.9	178.1	69	0	0	0	0	111.1	R129 D227 L321 S322 F323 L327 F328 Y337	R129-S325 PolarHBondContact NH1-O 2.92Å; R129-S325 PolarHBondContact NH2-O 2.82Å; D227-S325 VanDerWaalsContact OD1-CB 3.29Å; D227-S325 WeakPolarHBondContact OD1-CB 3.32Å; L321-S325 WeakPolarHBondContact O-CB 3.39Å; L321-S325 PolarHBondContact O-N 3.23Å; L321-S325 PolarHBondContact O-OG 2.91Å; S322-S325 PolarHBondContact O-OG 3.2Å; F323-S325 VanDerWaalsContact C-N 3.32Å; F323-S325 PolarHBondContact O-N 2.91Å; S325-L327 PolarHBondContact O-N 3.33Å; S325-L327 VanDerWaalsContact O-N 3.14Å; S325-F328 PolarHBondContact O-N 3.18Å; S325-Y337 VanDerWaalsContact C-OH 3.25Å; S325-Y337 VanDerWaalsContact CA-OH 3.28Å; S325-Y337 WeakPolarHBondContact CA-OH 3.04Å; S325-Y337 PolarHBondContact O-OH 2.79Å
326	K	90.1	Very high	94.7	Very high	79 Å²	79	27 Å²	27	34%	0.343	13%	0.131	S	C	.	.	H	α-helix	trans	-62.6	-25.8	179.1	-66.1	179.7	179.1	-158.4	0	114	R129 Q231 S322 F323 V324	R129-K326 PolarHBondContact NH1-O 3.39Å; Q231-K326 VanDerWaalsContact OE1-CE 3.23Å; S322-K326 WeakPolarHBondContact O-CG 3.28Å; F323-K326 WeakPolarHBondContact O-CB 3.42Å; F323-K326 PolarHBondContact O-N 3.07Å; V324-K326 PolarHBondContact O-N 2.71Å
327	L	87.9	Confident	94.7	Very high	34 Å²	34	20.1 Å²	20.1	18%	0.178	10%	0.1	C	C	.	.	H	α-helix	trans	-77.7	-36	-179	-53.9	175.9	0	0	0	112.1	A77 I81 R89 F323 V324 S325	A77-L327 WeakPolarHBondContact CB-O 3.41Å; I81-L327 HydrophobicContact CD1-CB 3.83Å; I81-L327 HydrophobicContact CD1-CD1 3.64Å; I81-L327 HydrophobicContact CD1-CG 4.26Å; I81-L327 HydrophobicContact CG1-CB 4.41Å; I81-L327 HydrophobicContact CG1-CD1 3.95Å; R89-L327 PolarHBondContact NH2-O 3.45Å; F323-L327 HydrophobicContact CD1-CD1 4.07Å; F323-L327 HydrophobicContact CE1-CD1 3.63Å; F323-L327 HydrophobicContact CZ-CD1 4.08Å; F323-L327 HydrophobicContact CZ-CD2 4.44Å; V324-L327 WeakPolarHBondContact O-CB 3.23Å; V324-L327 PolarHBondContact O-N 2.89Å; S325-L327 PolarHBondContact O-N 3.33Å; S325-L327 VanDerWaalsContact O-N 3.14Å
328	F	90.1	Very high	94.6	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	10%	0.095	C	C	.	.	S	Bend	trans	-87.6	146.2	-175	-65.6	-12.4	0	0	0	112.7	L59 F74 V78 I81 R89 R129 V324 S325 Y337 A344	L59-F328 HydrophobicContact CD1-CE2 4.34Å; L59-F328 HydrophobicContact CD1-CZ 3.69Å; F74-F328 HydrophobicContact CD2-CD1 4.31Å; F74-F328 HydrophobicContact CD2-CG 4.31Å; F74-F328 AromaticContact CE2-CD1 3.94Å; F74-F328 HydrophobicContact CE2-CD1 3.94Å; F74-F328 AromaticContact CE2-CD2 3.95Å; F74-F328 HydrophobicContact CE2-CD2 3.95Å; F74-F328 AromaticContact CE2-CE1 3.9Å; F74-F328 HydrophobicContact CE2-CE1 3.9Å; F74-F328 AromaticContact CE2-CE2 3.88Å; F74-F328 HydrophobicContact CE2-CE2 3.88Å; F74-F328 AromaticContact CE2-CG 3.98Å; F74-F328 HydrophobicContact CE2-CG 3.98Å; F74-F328 AromaticContact CE2-CZ 3.87Å; F74-F328 HydrophobicContact CE2-CZ 3.87Å; F74-F328 HydrophobicContact CZ-CE1 4.5Å; F74-F328 HydrophobicContact CZ-CZ 4.31Å; V78-F328 HydrophobicContact CG2-CE1 4.14Å; I81-F328 HydrophobicContact CD1-CE1 4.05Å; R89-F328 VanDerWaalsContact NH1-C 3.33Å; R89-F328 PolarHBondContact NH1-O 3.17Å; R89-F328 VanDerWaalsContact NH1-O 3.1Å; R129-F328 PolarHBondContact NH1-O 2.82Å; R129-F328 PolarHBondContact NH2-O 3.29Å; V324-F328 HydrophobicContact CG1-CD2 4.18Å; V324-F328 HydrophobicContact CG1-CE2 3.84Å; V324-F328 HydrophobicContact CG1-CZ 4.15Å; V324-F328 PolarHBondContact O-N 2.65Å; S325-F328 PolarHBondContact O-N 3.18Å; F328-Y337 HydrophobicContact CB-CE2 4.26Å; F328-A344 HydrophobicContact CE2-CB 3.54Å; F328-A344 HydrophobicContact CZ-CB 3.52Å
329	P	92.5	Very high	94.5	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	P	Polyproline II helix	trans	-62.4	140.8	169.5	27.6	-30.6	0	0	0	109.6	W70 L73 F74 R89 Y337	W70-P329 HydrophobicContact CD2-CG 4.32Å; W70-P329 HydrophobicContact CZ2-CG 3.9Å; W70-P329 PolarHBondContact NE1-O 3.49Å; L73-P329 HydrophobicContact CB-CB 4.16Å; L73-P329 HydrophobicContact CB-CG 3.95Å; L73-P329 HydrophobicContact CD1-CB 4.34Å; F74-P329 HydrophobicContact CB-CG 4.26Å; R89-P329 VanDerWaalsContact NH2-CD 3.33Å; R89-P329 VanDerWaalsContact NH2-N 3.17Å; P329-Y337 WeakPolarHBondContact O-CE2 3.36Å
330	L	95.3	Very high	94.4	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.021	7%	0.069	C	C	.	.	P	Polyproline II helix	trans	-56.3	142.9	176.2	-71.4	178.5	0	0	0	110.1	W70 Y122 M126 R129 L224 D227 Y337	W70-L330 PolarHBondContact NE1-O 3.44Å; Y122-L330 PolarHBondContact OH-O 2.8Å; M126-L330 HydrophobicContact CG-CB 4.07Å; R129-L330 HydrophobicContact CG-CD1 4.16Å; R129-L330 HydrophobicContact CG-CG 4.47Å; L224-L330 HydrophobicContact CB-CD1 3.89Å; L224-L330 HydrophobicContact CD1-CD1 4.27Å; D227-L330 WeakPolarHBondContact OD2-CD2 3.48Å; L330-Y337 HydrophobicContact CD2-CE1 4.34Å; L330-Y337 HydrophobicContact CD2-CE2 4.47Å
331	F	96.6	Very high	94.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.059	C	C	.	.			trans	-114.6	138.9	173.2	-164.7	-95.4	0	0	0	109.2	W70 Y122 S223 I293 F297 Y298 Y302 I333 V336 Y337	W70-F331 AromaticContact CD2-CD2 3.81Å; W70-F331 HydrophobicContact CD2-CD2 3.81Å; W70-F331 HydrophobicContact CD2-CE2 4.25Å; W70-F331 AromaticContact CE2-CD2 3.56Å; W70-F331 HydrophobicContact CE3-CD2 4.4Å; W70-F331 HydrophobicContact CG-CD2 4.11Å; W70-F331 HydrophobicContact CG-CE2 4.45Å; W70-F331 HydrophobicContact CZ2-CB 4.26Å; W70-F331 AromaticContact CZ2-CD2 3.96Å; W70-F331 HydrophobicContact CZ2-CD2 3.96Å; W70-F331 AromaticContact NE1-CD2 3.67Å; Y122-F331 VanDerWaalsContact OH-C 3.25Å; Y122-F331 WeakPolarHBondContact OH-CA 3.43Å; Y122-F331 PolarHBondContact OH-N 3.19Å; S223-F331 VanDerWaalsContact CB-O 3.28Å; S223-F331 WeakPolarHBondContact CB-O 3.36Å; S223-F331 PolarHBondContact OG-O 2.87Å; I293-F331 HydrophobicContact CD1-CE1 4.37Å; I293-F331 HydrophobicContact CD1-CZ 4.36Å; I293-F331 HydrophobicContact CG2-CZ 4.43Å; F297-F331 HydrophobicContact CE1-CD2 4.19Å; F297-F331 AromaticContact CE1-CE2 3.81Å; F297-F331 HydrophobicContact CE1-CE2 3.81Å; F297-F331 HydrophobicContact CE1-CZ 4.37Å; Y298-F331 HydrophobicContact CD1-CE2 4.13Å; Y298-F331 HydrophobicContact CD1-CZ 4.02Å; Y298-F331 AromaticContact CD2-CE2 3.74Å; Y298-F331 HydrophobicContact CD2-CE2 3.74Å; Y298-F331 HydrophobicContact CD2-CZ 4.42Å; Y298-F331 HydrophobicContact CE1-CZ 4.47Å; Y298-F331 HydrophobicContact CE2-CE2 4.28Å; Y298-F331 AromaticContact CG-CE2 3.63Å; Y298-F331 HydrophobicContact CG-CE2 3.63Å; Y298-F331 AromaticContact CG-CZ 3.98Å; Y298-F331 HydrophobicContact CG-CZ 3.98Å; Y302-F331 AromaticContact CE1-CE1 3.78Å; Y302-F331 HydrophobicContact CE1-CE1 3.78Å; Y302-F331 AromaticContact CE1-CZ 3.61Å; Y302-F331 HydrophobicContact CE1-CZ 3.61Å; F331-I333 HydrophobicContact CD1-CB 4.06Å; F331-I333 HydrophobicContact CD1-CG1 4.47Å; F331-I333 HydrophobicContact CE1-CB 4.08Å; F331-I333 HydrophobicContact CE1-CD1 4.28Å; F331-I333 HydrophobicContact CE1-CG1 4.1Å; F331-I333 PolarHBondContact O-N 3.06Å; F331-I333 VanDerWaalsContact O-N 3.12Å; F331-V336 HydrophobicContact CD1-CB 3.98Å; F331-V336 HydrophobicContact CD1-CG1 3.79Å; F331-V336 HydrophobicContact CE1-CB 4.12Å; F331-V336 HydrophobicContact CE1-CG1 3.78Å; F331-Y337 HydrophobicContact CB-CD2 3.87Å; F331-Y337 HydrophobicContact CB-CG 4.36Å
332	P	96.3	Very high	94.4	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.013	6%	0.059	C	C	.	.	S	Bend	trans	-72	-6	-170.7	26.8	-36.7	0	0	0	115.2	F119 Y122 L220 I293 F297	F119-P332 HydrophobicContact CE2-CB 4.35Å; F119-P332 HydrophobicContact CE2-CG 3.99Å; F119-P332 HydrophobicContact CZ-CG 4.01Å; Y122-P332 HydrophobicContact CD1-CB 4.2Å; Y122-P332 HydrophobicContact CD2-CB 4.45Å; Y122-P332 HydrophobicContact CE1-CB 3.86Å; Y122-P332 HydrophobicContact CE1-CG 4.12Å; Y122-P332 HydrophobicContact CE2-CB 4.09Å; Y122-P332 HydrophobicContact CG-CB 4.5Å; Y122-P332 WeakPolarHBondContact OH-CD 3.45Å; L220-P332 HydrophobicContact CB-CB 4.16Å; L220-P332 HydrophobicContact CD2-CB 4.03Å; I293-P332 HydrophobicContact CD1-CB 4.46Å; I293-P332 HydrophobicContact CD1-CG 3.49Å; I293-P332 VanDerWaalsContact CD1-CG 3.49Å; F297-P332 HydrophobicContact CE1-CG 3.82Å; F297-P332 HydrophobicContact CZ-CG 4.11Å
333	I	96.8	Very high	94.3	Very high	16 Å²	16	14 Å²	14	8%	0.082	7%	0.065	C	C	.	.	S	Bend	trans	-111.7	110.7	171.8	-52.8	179.1	0	0	0	107.1	I293 Y302 F331 D335 V336 Y337	I293-I333 HydrophobicContact CD1-CD1 4Å; I293-I333 HydrophobicContact CD1-CG1 4.06Å; I293-I333 HydrophobicContact CG1-CD1 3.93Å; Y302-I333 HydrophobicContact CE2-CD1 4.4Å; Y302-I333 WeakPolarHBondContact OH-CD1 3.48Å; F331-I333 HydrophobicContact CD1-CB 4.06Å; F331-I333 HydrophobicContact CD1-CG1 4.47Å; F331-I333 HydrophobicContact CE1-CB 4.08Å; F331-I333 HydrophobicContact CE1-CD1 4.28Å; F331-I333 HydrophobicContact CE1-CG1 4.1Å; F331-I333 PolarHBondContact O-N 3.06Å; F331-I333 VanDerWaalsContact O-N 3.12Å; I333-D335 PolarHBondContact O-N 2.94Å; I333-V336 HydrophobicContact CB-CB 4.08Å; I333-V336 HydrophobicContact CB-CG2 3.97Å; I333-V336 HydrophobicContact CD1-CG2 4.45Å; I333-V336 HydrophobicContact CG2-CB 4.18Å; I333-V336 HydrophobicContact CG2-CG2 3.72Å; I333-V336 PolarHBondContact O-N 3.12Å; I333-Y337 WeakPolarHBondContact O-CB 3.1Å; I333-Y337 PolarHBondContact O-N 3.03Å
334	D	95.9	Very high	94.2	Very high	14 Å²	14	10.4 Å²	10.4	8%	0.075	5%	0.049	C	C	.	.	H	α-helix	trans	-60.3	-44.4	-174.6	60.8	-31.6	0	0	0	112.9	K152 L222 S223 V336 Y337 M338	K152-D334 IonicContact NZ-OD2 3.47Å; K152-D334 PolarHBondContact NZ-OD2 3.45Å; L222-D334 HydrophobicContact CB-CB 3.61Å; S223-D334 VanDerWaalsContact OG-CA 3.24Å; S223-D334 WeakPolarHBondContact OG-CA 3.46Å; D334-V336 VanDerWaalsContact C-N 3.31Å; D334-V336 PolarHBondContact O-N 2.93Å; D334-Y337 WeakPolarHBondContact O-CB 3.48Å; D334-Y337 PolarHBondContact O-N 2.75Å; D334-Y337 VanDerWaalsContact O-N 3.14Å; D334-M338 WeakPolarHBondContact O-CG 3.32Å; D334-M338 PolarHBondContact O-N 2.86Å
335	D	95.6	Very high	94.2	Very high	14 Å²	14	11.7 Å²	11.7	8%	0.075	6%	0.056	C	C	.	.	H	α-helix	trans	-63.4	-38.6	179.8	-59.7	-35.1	0	0	0	112.2	Y305 T306 G308 I333 M338 G339	Y305-D335 WeakPolarHBondContact CB-O 3.36Å; Y305-D335 HydrophobicContact CD2-CB 3.58Å; Y305-D335 HydrophobicContact CE2-CB 3.76Å; T306-D335 WeakPolarHBondContact O-CB 3.39Å; G308-D335 WeakPolarHBondContact CA-OD2 3.47Å; G308-D335 PolarHBondContact N-OD2 3.44Å; I333-D335 PolarHBondContact O-N 2.94Å; D335-M338 PolarHBondContact O-N 3.03Å; D335-G339 PolarHBondContact O-N 3.46Å
336	V	96.4	Very high	94.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.5	-43.6	174.2	174.2	0	0	0	0	110.2	Y302 Y305 F331 I333 D334 M338 G339 L340	Y302-V336 HydrophobicContact CD1-CB 4.48Å; Y302-V336 HydrophobicContact CD1-CG1 3.48Å; Y302-V336 VanDerWaalsContact CD1-CG1 3.48Å; Y302-V336 HydrophobicContact CD1-CG2 4.14Å; Y302-V336 HydrophobicContact CD2-CG2 3.82Å; Y302-V336 HydrophobicContact CE1-CG1 3.84Å; Y302-V336 HydrophobicContact CE1-CG2 4.26Å; Y302-V336 HydrophobicContact CE2-CG2 3.96Å; Y302-V336 HydrophobicContact CG-CG1 3.9Å; Y302-V336 HydrophobicContact CG-CG2 3.9Å; Y305-V336 HydrophobicContact CD1-CG2 4.07Å; Y305-V336 HydrophobicContact CE1-CG2 3.73Å; Y305-V336 HydrophobicContact CE2-CG2 4.38Å; F331-V336 HydrophobicContact CD1-CB 3.98Å; F331-V336 HydrophobicContact CD1-CG1 3.79Å; F331-V336 HydrophobicContact CE1-CB 4.12Å; F331-V336 HydrophobicContact CE1-CG1 3.78Å; I333-V336 HydrophobicContact CB-CB 4.08Å; I333-V336 HydrophobicContact CB-CG2 3.97Å; I333-V336 HydrophobicContact CD1-CG2 4.45Å; I333-V336 HydrophobicContact CG2-CB 4.18Å; I333-V336 HydrophobicContact CG2-CG2 3.72Å; I333-V336 PolarHBondContact O-N 3.12Å; D334-V336 VanDerWaalsContact C-N 3.31Å; D334-V336 PolarHBondContact O-N 2.93Å; V336-M338 VanDerWaalsContact C-N 3.33Å; V336-M338 PolarHBondContact O-N 2.99Å; V336-G339 PolarHBondContact O-N 3.31Å; V336-G339 VanDerWaalsContact O-N 3.16Å; V336-L340 HydrophobicContact CG1-CD1 4.22Å; V336-L340 WeakPolarHBondContact O-CG 3.5Å; V336-L340 PolarHBondContact O-N 2.94Å
337	Y	96.4	Very high	94.5	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-58.6	-43.7	176.6	-176.4	-108.4	0	0	0	112.1	R129 S223 D227 S325 F328 P329 L330 F331 I333 D334 L340 C341	R129-Y337 PolarHBondContact NH2-OH 3.35Å; S223-Y337 WeakPolarHBondContact OG-CB 3.45Å; D227-Y337 VanDerWaalsContact OD1-CE1 3.24Å; D227-Y337 WeakPolarHBondContact OD1-CE1 3.24Å; S325-Y337 VanDerWaalsContact C-OH 3.25Å; S325-Y337 VanDerWaalsContact CA-OH 3.28Å; S325-Y337 WeakPolarHBondContact CA-OH 3.04Å; S325-Y337 PolarHBondContact O-OH 2.79Å; F328-Y337 HydrophobicContact CB-CE2 4.26Å; P329-Y337 WeakPolarHBondContact O-CE2 3.36Å; L330-Y337 HydrophobicContact CD2-CE1 4.34Å; L330-Y337 HydrophobicContact CD2-CE2 4.47Å; F331-Y337 HydrophobicContact CB-CD2 3.87Å; F331-Y337 HydrophobicContact CB-CG 4.36Å; I333-Y337 WeakPolarHBondContact O-CB 3.1Å; I333-Y337 PolarHBondContact O-N 3.03Å; D334-Y337 WeakPolarHBondContact O-CB 3.48Å; D334-Y337 PolarHBondContact O-N 2.75Å; D334-Y337 VanDerWaalsContact O-N 3.14Å; Y337-L340 WeakPolarHBondContact O-CB 3.45Å; Y337-L340 PolarHBondContact O-N 3.36Å; Y337-C341 PolarHBondContact O-N 2.83Å; Y337-C341 PolarHBondContact O-SG 2.81Å
338	M	96.3	Very high	94.8	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-64.9	-40.4	174.3	-67.1	-50.1	-61	0	0	111.9	M226 L230 F311 I313 L321 D334 D335 V336 L340 C341 M342	M226-M338 HydrophobicContact CB-SD 4.46Å; M226-M338 HydrophobicContact CE-CE 3.96Å; M226-M338 HydrophobicContact CE-SD 4.29Å; M226-M338 HydrophobicContact CG-CE 4.36Å; M226-M338 HydrophobicContact CG-CG 4.21Å; M226-M338 HydrophobicContact CG-SD 3.5Å; M226-M338 VanDerWaalsContact CG-SD 3.5Å; L230-M338 HydrophobicContact CD1-CE 4.31Å; L230-M338 HydrophobicContact CD1-SD 4.49Å; F311-M338 HydrophobicContact CZ-CG 4.3Å; I313-M338 HydrophobicContact CD1-CE 4.14Å; L321-M338 HydrophobicContact CD1-CE 3.85Å; L321-M338 HydrophobicContact CD2-CE 3.58Å; L321-M338 HydrophobicContact CG-CE 3.95Å; D334-M338 WeakPolarHBondContact O-CG 3.32Å; D334-M338 PolarHBondContact O-N 2.86Å; D335-M338 PolarHBondContact O-N 3.03Å; V336-M338 VanDerWaalsContact C-N 3.33Å; V336-M338 PolarHBondContact O-N 2.99Å; M338-L340 VanDerWaalsContact C-N 3.33Å; M338-L340 PolarHBondContact O-N 2.66Å; M338-C341 PolarHBondContact O-N 3.36Å; M338-M342 WeakPolarHBondContact O-CB 3.32Å; M338-M342 VanDerWaalsContact O-CG 3.23Å; M338-M342 WeakPolarHBondContact O-CG 3.2Å; M338-M342 PolarHBondContact O-N 3.1Å
339	G	95.4	Very high	95.1	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-57.9	-42.7	172.5	0	0	0	0	0	113.3	D335 V336 M342 K343	D335-G339 PolarHBondContact O-N 3.46Å; V336-G339 PolarHBondContact O-N 3.31Å; V336-G339 VanDerWaalsContact O-N 3.16Å; G339-M342 PolarHBondContact O-N 3.48Å; G339-K343 VanDerWaalsContact O-CB 3.31Å; G339-K343 WeakPolarHBondContact O-CB 3.18Å; G339-K343 PolarHBondContact O-N 3.35Å
340	L	94.6	Very high	95.3	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-61.8	-48.2	175.4	-71.2	164.2	0	0	0	111.7	I63 W70 P303 V336 Y337 M338 M342 K343 A344	I63-L340 HydrophobicContact CD1-CD2 3.29Å; I63-L340 HydrophobicContact CG1-CD2 4.24Å; W70-L340 HydrophobicContact CH2-CD1 3.55Å; W70-L340 HydrophobicContact CH2-CD2 4.43Å; W70-L340 HydrophobicContact CZ2-CD1 3.89Å; W70-L340 HydrophobicContact CZ3-CD1 4.48Å; P303-L340 HydrophobicContact CG-CD2 3.74Å; P303-L340 HydrophobicContact CG-CG 3.86Å; V336-L340 HydrophobicContact CG1-CD1 4.22Å; V336-L340 WeakPolarHBondContact O-CG 3.5Å; V336-L340 PolarHBondContact O-N 2.94Å; Y337-L340 WeakPolarHBondContact O-CB 3.45Å; Y337-L340 PolarHBondContact O-N 3.36Å; M338-L340 VanDerWaalsContact C-N 3.33Å; M338-L340 PolarHBondContact O-N 2.66Å; L340-M342 PolarHBondContact O-N 3.4Å; L340-K343 PolarHBondContact O-N 2.95Å; L340-A344 PolarHBondContact O-N 3.3Å
341	C	95.5	Very high	95.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.8	-39.9	179.2	-62.3	0	0	0	0	112.1	L321 V324 Y337 M338 A344 L345	L321-C341 HydrophobicContact CD1-CB 3.64Å; V324-C341 HydrophobicContact CG1-CB 4.02Å; Y337-C341 PolarHBondContact O-N 2.83Å; Y337-C341 PolarHBondContact O-SG 2.81Å; M338-C341 PolarHBondContact O-N 3.36Å; C341-A344 WeakPolarHBondContact O-CB 3.37Å; C341-A344 PolarHBondContact O-N 3.05Å; C341-L345 WeakPolarHBondContact O-CG 3.42Å; C341-L345 PolarHBondContact O-N 3.36Å
342	M	95.8	Very high	95.4	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-67	-42	177	-72.3	-67.1	-168.8	0	0	112.1	Y273 I313 L317 L321 M338 G339 L340 A344 L345 G346 I347	Y273-M342 HydrophobicContact CD1-CB 3.84Å; Y273-M342 HydrophobicContact CD1-CE 4.37Å; Y273-M342 HydrophobicContact CD1-CG 3.57Å; Y273-M342 HydrophobicContact CD1-SD 4.21Å; Y273-M342 HydrophobicContact CD2-CE 3.95Å; Y273-M342 HydrophobicContact CE1-CB 3.81Å; Y273-M342 HydrophobicContact CE1-CG 3.55Å; Y273-M342 HydrophobicContact CE2-CE 4.38Å; Y273-M342 HydrophobicContact CG-CE 3.94Å; Y273-M342 HydrophobicContact CG-CG 4.08Å; Y273-M342 HydrophobicContact CG-SD 4.24Å; I313-M342 HydrophobicContact CB-CE 4.29Å; I313-M342 HydrophobicContact CD1-CE 3.57Å; I313-M342 HydrophobicContact CG1-CE 3.75Å; I313-M342 HydrophobicContact CG2-CE 3.5Å; I313-M342 VanDerWaalsContact CG2-CE 3.5Å; L317-M342 HydrophobicContact CD1-SD 4.42Å; L321-M342 HydrophobicContact CD1-CE 4.15Å; L321-M342 HydrophobicContact CD1-CG 4.44Å; L321-M342 HydrophobicContact CD1-SD 4.12Å; L321-M342 HydrophobicContact CD2-CE 3.5Å; L321-M342 VanDerWaalsContact CD2-CE 3.5Å; L321-M342 HydrophobicContact CD2-SD 4.43Å; L321-M342 HydrophobicContact CG-CE 4.44Å; M338-M342 WeakPolarHBondContact O-CB 3.32Å; M338-M342 VanDerWaalsContact O-CG 3.23Å; M338-M342 WeakPolarHBondContact O-CG 3.2Å; M338-M342 PolarHBondContact O-N 3.1Å; G339-M342 PolarHBondContact O-N 3.48Å; L340-M342 PolarHBondContact O-N 3.4Å; M342-A344 VanDerWaalsContact C-N 3.26Å; M342-A344 PolarHBondContact O-N 2.98Å; M342-L345 CarbonylContact O-C 3.53Å; M342-L345 WeakPolarHBondContact O-CA 3.49Å; M342-L345 WeakPolarHBondContact O-CB 3.23Å; M342-L345 PolarHBondContact O-N 3.45Å; M342-G346 PolarHBondContact O-N 3.04Å; M342-I347 CarbonylContact C-O 3.49Å; M342-I347 HydrophobicContact CB-CB 4.32Å; M342-I347 PolarHBondContact O-N 2.63Å; M342-I347 HydrophobicContact SD-CB 4.12Å; M342-I347 HydrophobicContact SD-CG2 4.07Å
343	K	93.3	Very high	95.3	Very high	49 Å²	49	33.4 Å²	33.4	21%	0.213	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-38.3	175.6	-178.4	56.2	171.6	158.9	0	111.5	D58 L59 I62 G339 L340 L345 G346	D58-K343 IonicContact OD2-NZ 3.07Å; D58-K343 PolarHBondContact OD2-NZ 2.9Å; L59-K343 HydrophobicContact CD2-CB 4.13Å; L59-K343 HydrophobicContact CD2-CG 3.85Å; I62-K343 HydrophobicContact CD1-CD 4.41Å; I62-K343 VanDerWaalsContact CD1-CE 3.48Å; I62-K343 HydrophobicContact CD1-CG 4.32Å; G339-K343 VanDerWaalsContact O-CB 3.31Å; G339-K343 WeakPolarHBondContact O-CB 3.18Å; G339-K343 PolarHBondContact O-N 3.35Å; L340-K343 PolarHBondContact O-N 2.95Å; K343-L345 VanDerWaalsContact C-N 3.25Å; K343-L345 PolarHBondContact O-N 3.38Å; K343-G346 PolarHBondContact O-N 2.81Å
344	A	91.9	Very high	95.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-31.8	174.5	0	0	0	0	0	113.5	V54 A55 L59 V324 F328 L340 C341 M342 G346	V54-A344 CarbonylContact C-O 3.59Å; V54-A344 WeakPolarHBondContact CA-O 3.47Å; V54-A344 HydrophobicContact CG1-CB 4.21Å; A55-A344 PolarHBondContact N-O 3.28Å; L59-A344 HydrophobicContact CD1-CB 3.64Å; L59-A344 HydrophobicContact CD2-CB 4.36Å; L59-A344 HydrophobicContact CG-CB 4.45Å; V324-A344 HydrophobicContact CG1-CB 3.79Å; F328-A344 HydrophobicContact CE2-CB 3.54Å; F328-A344 HydrophobicContact CZ-CB 3.52Å; L340-A344 PolarHBondContact O-N 3.3Å; C341-A344 WeakPolarHBondContact O-CB 3.37Å; C341-A344 PolarHBondContact O-N 3.05Å; M342-A344 VanDerWaalsContact C-N 3.26Å; M342-A344 PolarHBondContact O-N 2.98Å; A344-G346 PolarHBondContact O-N 2.8Å
345	L	92.8	Very high	95.3	Very high	28 Å²	28	32.3 Å²	32.3	15%	0.147	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.8	173.3	-64.8	175.7	0	0	0	113.3	I52 L321 V324 C341 M342 K343 I347	I52-L345 HydrophobicContact CG2-CD2 3.48Å; I52-L345 VanDerWaalsContact CG2-CD2 3.48Å; L321-L345 HydrophobicContact CB-CD1 4.1Å; L321-L345 HydrophobicContact CD1-CD1 4.14Å; V324-L345 HydrophobicContact CB-CD2 4.44Å; V324-L345 HydrophobicContact CG2-CD2 3.51Å; V324-L345 HydrophobicContact CG2-CG 4.08Å; C341-L345 WeakPolarHBondContact O-CG 3.42Å; C341-L345 PolarHBondContact O-N 3.36Å; M342-L345 CarbonylContact O-C 3.53Å; M342-L345 WeakPolarHBondContact O-CA 3.49Å; M342-L345 WeakPolarHBondContact O-CB 3.23Å; M342-L345 PolarHBondContact O-N 3.45Å; K343-L345 VanDerWaalsContact C-N 3.25Å; K343-L345 PolarHBondContact O-N 3.38Å; L345-I347 HydrophobicContact CB-CG1 3.89Å; L345-I347 PolarHBondContact O-N 2.71Å
346	G	93.3	Very high	95.3	Very high	43 Å²	43	34.4 Å²	34.4	44%	0.443	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	10.9	-173	0	0	0	0	0	114	M342 K343 A344	M342-G346 PolarHBondContact O-N 3.04Å; K343-G346 PolarHBondContact O-N 2.81Å; A344-G346 PolarHBondContact O-N 2.8Å
347	I	95.2	Very high	95	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.062	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-86.9	123.3	-178.7	-56.7	-59.8	0	0	0	109.7	Q271 Y273 L317 M342 L345	Q271-I347 HydrophobicContact CB-CD1 4.02Å; Q271-I347 HydrophobicContact CG-CD1 4.13Å; Y273-I347 HydrophobicContact CD1-CG2 4.48Å; L317-I347 HydrophobicContact CD1-CD1 4.38Å; L317-I347 HydrophobicContact CD1-CG1 4.17Å; L317-I347 HydrophobicContact CD1-CG2 4.23Å; L317-I347 HydrophobicContact CD2-CD1 3.87Å; L317-I347 HydrophobicContact CD2-CG1 3.97Å; M342-I347 CarbonylContact C-O 3.49Å; M342-I347 HydrophobicContact CB-CB 4.32Å; M342-I347 PolarHBondContact O-N 2.63Å; M342-I347 HydrophobicContact SD-CB 4.12Å; M342-I347 HydrophobicContact SD-CG2 4.07Å; L345-I347 HydrophobicContact CB-CG1 3.89Å; L345-I347 PolarHBondContact O-N 2.71Å
348	T	94.4	Very high	94.7	Very high	101 Å²	101	42.1 Å²	42.1	62%	0.62	21%	0.209	S	C	*	.	P	Polyproline II helix	trans	-95.4	129.8	177.5	-61.8	0	0	0	0	110.2	K350	T348-K350 PolarHBondContact O-N 2.7Å
349	P	96.9	Very high	94.3	Very high	18 Å²	18	43.5 Å²	43.5	12%	0.117	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-64.5	131.5	176.3	27.5	-35.2	0	0	0	111.1	Y273 V277 A304 T306	Y273-P349 HydrophobicContact CD1-CB 3.66Å; Y273-P349 HydrophobicContact CE1-CB 3.66Å; Y273-P349 HydrophobicContact CE1-CG 4.4Å; Y273-P349 CarbonylContact O-C 3.52Å; Y273-P349 WeakPolarHBondContact O-CA 3.24Å; V277-P349 HydrophobicContact CG1-CB 4.27Å; V277-P349 HydrophobicContact CG1-CG 4.01Å; V277-P349 HydrophobicContact CG2-CB 3.83Å; V277-P349 HydrophobicContact CG2-CG 4.45Å; A304-P349 HydrophobicContact CB-CG 3.8Å; T306-P349 HydrophobicContact CG2-CB 4.02Å
350	K	97.5	Very high	93.9	Very high	81 Å²	81	44 Å²	44	35%	0.352	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.2	176.1	-67.3	-176.5	-179.9	174	0	109.9	Y273 V274 G275 V277 T348	Y273-K350 PolarHBondContact O-N 2.8Å; V274-K350 WeakPolarHBondContact CA-O 3.32Å; V274-K350 HydrophobicContact CB-CB 4.21Å; V274-K350 HydrophobicContact CG2-CB 4.18Å; V274-K350 WeakPolarHBondContact CG2-O 3.24Å; G275-K350 PolarHBondContact N-O 3.12Å; G275-K350 VanDerWaalsContact N-O 3.12Å; V277-K350 VanDerWaalsContact CG2-C 3.47Å; V277-K350 WeakPolarHBondContact CG2-O 3.35Å; T348-K350 PolarHBondContact O-N 2.7Å
351	W	97.1	Very high	93.5	Very high	155 Å²	155	51 Å²	51	59%	0.587	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	138	173	176.5	88.9	0	0	0	110.3	H276 V277 E353	H276-W351 AromaticContact CD2-NE1 3.99Å; V277-W351 HydrophobicContact CB-CB 4.15Å; V277-W351 HydrophobicContact CG2-CB 3.98Å; W351-E353 HydrophobicContact CH2-CB 3.46Å; W351-E353 VanDerWaalsContact CH2-CB 3.46Å; W351-E353 HydrophobicContact CZ2-CB 3.77Å; W351-E353 HydrophobicContact CZ3-CB 4.09Å
352	H	96.8	Very high	93.1	Very high	37 Å²	37	59.3 Å²	59.3	17%	0.171	29%	0.285	C	S	.	.			trans	-138	126.7	170.1	-172.3	-24.4	0	0	0	110.4	Y260 V274 G275 G354 F355 L375	Y260-H352 AromaticContact CD2-CD2 3.75Å; Y260-H352 AromaticContact CD2-NE2 3.43Å; Y260-H352 WeakPolarHBondContact CD2-NE2 3.38Å; Y260-H352 AromaticContact CE1-CD2 3.91Å; Y260-H352 AromaticContact CE2-CD2 3.43Å; Y260-H352 VanDerWaalsContact CE2-CD2 3.43Å; Y260-H352 WeakPolarHBondContact CE2-CD2 3.18Å; Y260-H352 AromaticContact CE2-NE2 3.58Å; Y260-H352 AromaticContact CG-NE2 3.85Å; Y260-H352 AromaticContact CZ-CD2 3.52Å; V274-H352 HydrophobicContact CG2-CB 3.65Å; G275-H352 PolarHBondContact O-N 3.15Å; H352-G354 PolarHBondContact ND1-N 3.43Å; H352-G354 PolarHBondContact O-N 2.66Å; H352-G354 VanDerWaalsContact O-N 3.1Å; H352-F355 HydrophobicContact CB-CD2 3.91Å; H352-F355 HydrophobicContact CB-CE2 4.24Å; H352-F355 PolarHBondContact O-N 3.42Å; H352-F355 VanDerWaalsContact O-N 3.16Å; H352-L375 WeakPolarHBondContact NE2-CD1 3.34Å
353	E	94.2	Very high	92.7	Very high	129 Å²	129	66.6 Å²	66.6	60%	0.603	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.7	-178.7	68.4	-170.3	154.8	0	0	115.3	W351 F355 Q356	W351-E353 HydrophobicContact CH2-CB 3.46Å; W351-E353 VanDerWaalsContact CH2-CB 3.46Å; W351-E353 HydrophobicContact CZ2-CB 3.77Å; W351-E353 HydrophobicContact CZ3-CB 4.09Å; E353-F355 PolarHBondContact O-N 3.48Å; E353-Q356 PolarHBondContact O-NE2 2.91Å
354	G	95.6	Very high	92.4	Very high	2 Å²	2	66.5 Å²	66.5	2%	0.021	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-10.8	-179.8	0	0	0	0	0	113.4	H352 L375 L376	H352-G354 PolarHBondContact ND1-N 3.43Å; H352-G354 PolarHBondContact O-N 2.66Å; H352-G354 VanDerWaalsContact O-N 3.1Å; G354-L375 WeakPolarHBondContact O-CA 3.4Å; G354-L375 PolarHBondContact O-N 2.63Å; G354-L376 PolarHBondContact O-N 2.82Å
355	F	96.9	Very high	92.1	Very high	4 Å²	4	72.5 Å²	72.5	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	98.1	177.8	-72.5	-102	0	0	0	110.3	F244 L257 V274 H276 G310 V312 H352 E353 L375 L376	F244-F355 HydrophobicContact CE2-CE1 4.37Å; L257-F355 HydrophobicContact CD1-CZ 4.41Å; V274-F355 HydrophobicContact CG2-CE2 4.47Å; H276-F355 HydrophobicContact CB-CB 4.16Å; H276-F355 WeakPolarHBondContact CB-O 3.24Å; G310-F355 VanDerWaalsContact O-CD1 3.3Å; G310-F355 WeakPolarHBondContact O-CD1 3.18Å; V312-F355 HydrophobicContact CG2-CZ 4.18Å; H352-F355 HydrophobicContact CB-CD2 3.91Å; H352-F355 HydrophobicContact CB-CE2 4.24Å; H352-F355 PolarHBondContact O-N 3.42Å; H352-F355 VanDerWaalsContact O-N 3.16Å; E353-F355 PolarHBondContact O-N 3.48Å; F355-L375 HydrophobicContact CD2-CB 4.45Å; F355-L375 HydrophobicContact CD2-CD1 4.25Å; F355-L375 HydrophobicContact CE2-CB 4.29Å; F355-L375 HydrophobicContact CE2-CD1 3.69Å; F355-L375 HydrophobicContact CZ-CD1 4.44Å; F355-L376 HydrophobicContact CD1-CB 3.96Å; F355-L376 HydrophobicContact CD1-CD1 4.36Å; F355-L376 HydrophobicContact CE1-CB 4.42Å; F355-L376 HydrophobicContact CG-CB 4.5Å
356	Q	94.6	Very high	91.7	Very high	58 Å²	58	74.7 Å²	74.7	27%	0.271	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	82.5	-176.1	-61.1	-70.5	-30.5	0	0	110.4	E353 I360 N374 L376 V377 H378	E353-Q356 PolarHBondContact O-NE2 2.91Å; Q356-I360 HydrophobicContact CB-CG2 4Å; Q356-I360 HydrophobicContact CG-CG2 3.8Å; Q356-N374 HydrophobicContact CG-CB 4.43Å; Q356-N374 WeakPolarHBondContact CG-OD1 3.44Å; Q356-L376 WeakPolarHBondContact CB-O 3.47Å; Q356-L376 PolarHBondContact N-O 3.1Å; Q356-V377 HydrophobicContact CB-CG1 4.26Å; Q356-V377 HydrophobicContact CB-CG2 4.34Å; Q356-V377 WeakPolarHBondContact O-CA 3.44Å; Q356-H378 PolarHBondContact O-N 3.43Å
357	T	91.7	Very high	91.5	Very high	9 Å²	9	76.1 Å²	76.1	6%	0.055	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-15.1	-174.6	67.3	0	0	0	0	113.9	H276 G308 L376 H378	H276-T357 HydrophobicContact CB-CG2 3.6Å; H276-T357 PolarHBondContact ND1-OG1 3.5Å; G308-T357 WeakPolarHBondContact O-CB 3.09Å; G308-T357 WeakPolarHBondContact O-CG2 3.38Å; T357-L376 HydrophobicContact CG2-CD2 4.23Å; T357-H378 PolarHBondContact O-ND1 2.79Å
358	F	88.9	Confident	91.3	Very high	154 Å²	154	77.1 Å²	77.1	68%	0.675	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	30	174.8	-63.4	-86.9	0	0	0	112.3	H276 L278	H276-F358 AromaticContact CE1-CD2 3.47Å; H276-F358 VanDerWaalsContact CE1-CD2 3.47Å; H276-F358 WeakPolarHBondContact CE1-CD2 3.35Å; H276-F358 AromaticContact CE1-CE2 3.62Å; H276-F358 AromaticContact ND1-CD2 3.64Å; H276-F358 AromaticContact ND1-CE2 3.76Å; L278-F358 HydrophobicContact CD2-CZ 4.43Å
359	D	87.8	Confident	91.1	Very high	29 Å²	29	73.3 Å²	73.3	16%	0.155	35%	0.354	C	S	.	.			trans	60.8	169.7	-173	-158.5	6.6	0	0	0	113.6	R365 H378 R380	D359-R365 IonicContact OD2-CZ 3.57Å; D359-R365 IonicContact OD2-NE 3.82Å; D359-R365 PolarHBondContact OD2-NE 2.85Å; D359-R365 IonicContact OD2-NH2 3.2Å; D359-R365 PolarHBondContact OD2-NH2 2.99Å; D359-H378 WeakPolarHBondContact CA-O 3.29Å; D359-H378 WeakPolarHBondContact CB-O 3.38Å; D359-H378 PolarHBondContact N-O 2.91Å; D359-R380 VanDerWaalsContact CG-NH1 3.34Å; D359-R380 IonicContact OD1-CZ 3.32Å; D359-R380 VanDerWaalsContact OD1-CZ 3.24Å; D359-R380 IonicContact OD1-NH1 3.15Å; D359-R380 PolarHBondContact OD1-NH1 3.34Å; D359-R380 IonicContact OD1-NH2 2.7Å; D359-R380 PolarHBondContact OD1-NH2 3.47Å; D359-R380 IonicContact OD2-NH1 2.91Å
360	I	86.8	Confident	90.7	Very high	13 Å²	13	73.2 Å²	73.2	7%	0.067	36%	0.355	C	S	.	.			trans	-87.2	163.3	172.1	65.4	171.9	0	0	0	111.2	Q356 K362 D364 R365 H371 V377	Q356-I360 HydrophobicContact CB-CG2 4Å; Q356-I360 HydrophobicContact CG-CG2 3.8Å; I360-K362 PolarHBondContact O-N 3.14Å; I360-D364 HydrophobicContact CD1-CB 3.91Å; I360-D364 WeakPolarHBondContact CD1-O 3.38Å; I360-R365 HydrophobicContact CG1-CG 3.99Å; I360-H371 WeakPolarHBondContact CD1-CE1 3.35Å; I360-V377 HydrophobicContact CG2-CG1 4.09Å; I360-V377 HydrophobicContact CG2-CG2 4.33Å
361	K	87.6	Confident	90.2	Very high	147 Å²	147	69.9 Å²	69.9	64%	0.639	34%	0.34	S	S	*	.			trans	-52.5	138.1	176.1	-63.7	176.4	-178.3	173.7	0	110.1	Q363 D364 R365	K361-Q363 HydrophobicContact CB-CG 4.14Å; K361-Q363 PolarHBondContact O-N 2.88Å; K361-D364 WeakPolarHBondContact CB-OD2 3.32Å; K361-D364 PolarHBondContact O-N 3.41Å; K361-R365 PolarHBondContact O-N 3.13Å
362	K	86.5	Confident	89.9	Confident	176 Å²	176	66.2 Å²	66.2	77%	0.765	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-51.6	-38.5	-175.7	-172.4	179.1	178.7	-178.1	0	113.3	I360 D364 R365	I360-K362 PolarHBondContact O-N 3.14Å; K362-D364 VanDerWaalsContact C-N 3.28Å; K362-D364 PolarHBondContact O-N 2.75Å; K362-R365 WeakPolarHBondContact O-CB 3.49Å; K362-R365 PolarHBondContact O-N 2.85Å
363	Q	87.4	Confident	89.6	Confident	154 Å²	154	71.9 Å²	71.9	72%	0.72	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-65.5	-28.1	178.2	67.5	-163.1	30.5	0	0	113.8	K361	K361-Q363 HydrophobicContact CB-CG 4.14Å; K361-Q363 PolarHBondContact O-N 2.88Å
364	D	87.4	Confident	89.5	Confident	47 Å²	47	66.7 Å²	66.7	25%	0.251	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-91.3	-8.3	-177.2	-60.2	-40.2	0	0	0	112	I360 K361 K362 G366 N367 A370	I360-D364 HydrophobicContact CD1-CB 3.91Å; I360-D364 WeakPolarHBondContact CD1-O 3.38Å; K361-D364 WeakPolarHBondContact CB-OD2 3.32Å; K361-D364 PolarHBondContact O-N 3.41Å; K362-D364 VanDerWaalsContact C-N 3.28Å; K362-D364 PolarHBondContact O-N 2.75Å; D364-G366 PolarHBondContact O-N 2.89Å; D364-N367 WeakPolarHBondContact O-CB 3.48Å; D364-N367 PolarHBondContact O-N 2.87Å; D364-A370 HydrophobicContact CB-CB 4.01Å
365	R	85.1	Confident	89.6	Confident	126 Å²	126	67.1 Å²	67.1	48%	0.475	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.5	-179.6	-70.7	-177.6	178.3	169.7	-0.9	113.8	D359 I360 K361 K362 H371	D359-R365 IonicContact OD2-CZ 3.57Å; D359-R365 IonicContact OD2-NE 3.82Å; D359-R365 PolarHBondContact OD2-NE 2.85Å; D359-R365 IonicContact OD2-NH2 3.2Å; D359-R365 PolarHBondContact OD2-NH2 2.99Å; I360-R365 HydrophobicContact CG1-CG 3.99Å; K361-R365 PolarHBondContact O-N 3.13Å; K362-R365 WeakPolarHBondContact O-CB 3.49Å; K362-R365 PolarHBondContact O-N 2.85Å; R365-H371 PolarHBondContact O-NE2 3.24Å
366	G	84.6	Confident	89.6	Confident	74 Å²	74	67 Å²	67	76%	0.763	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.1	173.9	0	0	0	0	0	114.2	D364 V368	D364-G366 PolarHBondContact O-N 2.89Å; G366-V368 PolarHBondContact O-N 3.02Å
367	N	88.8	Confident	89.6	Confident	72 Å²	72	64.2 Å²	64.2	39%	0.385	32%	0.32	S	S	.	.			trans	-88.9	104.5	-174.6	-175.4	-13.1	0	0	0	110.8	D364 C369 A370 H371	D364-N367 WeakPolarHBondContact O-CB 3.48Å; D364-N367 PolarHBondContact O-N 2.87Å; N367-C369 PolarHBondContact O-N 3.47Å; N367-C369 VanDerWaalsContact OD1-CB 3.31Å; N367-C369 WeakPolarHBondContact OD1-CB 3.44Å; N367-C369 PolarHBondContact OD1-N 3.41Å; N367-A370 HydrophobicContact CB-CB 4.01Å; N367-A370 WeakPolarHBondContact O-CB 3.49Å; N367-A370 PolarHBondContact O-N 3.18Å; N367-A370 VanDerWaalsContact O-N 3.17Å; N367-A370 PolarHBondContact OD1-N 3.16Å; N367-H371 PolarHBondContact O-CD2 2.73Å; N367-H371 PolarHBondContact O-N 3.27Å
368	V	90.7	Very high	89.8	Confident	33 Å²	33	65.8 Å²	65.8	20%	0.2	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-33.5	179	-174.3	0	0	0	0	112.2	G366 H371 K372 N391 I392 L397	G366-V368 PolarHBondContact O-N 3.02Å; V368-H371 PolarHBondContact O-N 3.23Å; V368-K372 PolarHBondContact O-N 3.31Å; V368-N391 HydrophobicContact CG1-CB 3.71Å; V368-N391 HydrophobicContact CG2-CB 3.91Å; V368-I392 HydrophobicContact CG1-CG2 3.96Å; V368-L397 HydrophobicContact CB-CD1 3.94Å; V368-L397 HydrophobicContact CB-CD2 4.43Å; V368-L397 HydrophobicContact CG1-CD1 3.88Å; V368-L397 HydrophobicContact CG1-CD2 3.54Å; V368-L397 HydrophobicContact CG1-CG 4.36Å
369	C	90.1	Very high	90	Very high	22 Å²	22	64.2 Å²	64.2	15%	0.149	32%	0.321	C	S	.	.	H	α-helix	trans	-68.5	-36	178.4	-64.8	0	0	0	0	112.6	N367 H371 K372 Q373 T398 C399	N367-C369 PolarHBondContact O-N 3.47Å; N367-C369 VanDerWaalsContact OD1-CB 3.31Å; N367-C369 WeakPolarHBondContact OD1-CB 3.44Å; N367-C369 PolarHBondContact OD1-N 3.41Å; C369-H371 VanDerWaalsContact C-N 3.34Å; C369-K372 PolarHBondContact O-N 2.93Å; C369-Q373 WeakPolarHBondContact O-CG 3.17Å; C369-Q373 PolarHBondContact O-N 3.37Å; C369-Q373 VanDerWaalsContact O-N 3.15Å; C369-T398 PolarHBondContact SG-O 3.21Å; C369-T398 VanDerWaalsContact SG-O 3.39Å; C369-C399 WeakPolarHBondContact CA-SG 3.19Å; C369-C399 HydrophobicContact CB-CB 3.68Å; C369-C399 WeakPolarHBondContact CB-SG 3.26Å; C369-C399 WeakPolarHBondContact SG-CA 3.42Å; C369-C399 WeakPolarHBondContact SG-CB 3.45Å; C369-C399 CovalentContact SG-SG 2.04Å; C369-C399 PolarHBondContact SG-SG 2.85Å
370	A	88.3	Confident	90.4	Very high	15 Å²	15	63.6 Å²	63.6	12%	0.124	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-43.8	172.7	0	0	0	0	0	110.7	D364 N367 K372 Q373 N374	D364-A370 HydrophobicContact CB-CB 4.01Å; N367-A370 HydrophobicContact CB-CB 4.01Å; N367-A370 WeakPolarHBondContact O-CB 3.49Å; N367-A370 PolarHBondContact O-N 3.18Å; N367-A370 VanDerWaalsContact O-N 3.17Å; N367-A370 PolarHBondContact OD1-N 3.16Å; A370-K372 VanDerWaalsContact C-N 3.33Å; A370-K372 PolarHBondContact O-N 3.12Å; A370-Q373 PolarHBondContact O-N 3.28Å; A370-N374 PolarHBondContact O-N 3.47Å; A370-N374 PolarHBondContact O-ND2 3.24Å
371	H	86.9	Confident	90.9	Very high	12 Å²	12	65.2 Å²	65.2	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-64.2	-35.6	175.5	-62.6	-61.9	0	0	0	113	I360 R365 N367 V368 C369 Q373 N374 M388 I392	I360-H371 WeakPolarHBondContact CD1-CE1 3.35Å; R365-H371 PolarHBondContact O-NE2 3.24Å; N367-H371 PolarHBondContact O-CD2 2.73Å; N367-H371 PolarHBondContact O-N 3.27Å; V368-H371 PolarHBondContact O-N 3.23Å; C369-H371 VanDerWaalsContact C-N 3.34Å; H371-Q373 VanDerWaalsContact C-N 3.3Å; H371-Q373 PolarHBondContact O-N 3.42Å; H371-N374 PolarHBondContact O-N 3.27Å; H371-M388 HydrophobicContact CB-CE 3.95Å; H371-M388 WeakPolarHBondContact ND1-CE 3.04Å; H371-I392 HydrophobicContact CB-CG2 4.17Å
372	K	90.6	Very high	91.4	Very high	77 Å²	77	58.9 Å²	58.9	34%	0.335	30%	0.303	S	S	.	.	H	α-helix	trans	-69.8	-23.8	178.6	-169.6	173.1	-176.8	174.8	0	113.6	N253 V368 C369 A370 I392 L397	N253-K372 PolarHBondContact ND2-O 3Å; V368-K372 PolarHBondContact O-N 3.31Å; C369-K372 PolarHBondContact O-N 2.93Å; A370-K372 VanDerWaalsContact C-N 3.33Å; A370-K372 PolarHBondContact O-N 3.12Å; K372-I392 HydrophobicContact CB-CB 4.45Å; K372-I392 HydrophobicContact CB-CG2 4.21Å; K372-L397 HydrophobicContact CD-CD2 3.8Å
373	Q	90.5	Very high	91.9	Very high	156 Å²	156	57.8 Å²	57.8	73%	0.729	29%	0.294	S	S	*	.	H	α-helix	trans	-83.7	-25.5	175.8	-71.2	175.1	-5.8	0	0	112.6	C369 A370 H371	C369-Q373 WeakPolarHBondContact O-CG 3.17Å; C369-Q373 PolarHBondContact O-N 3.37Å; C369-Q373 VanDerWaalsContact O-N 3.15Å; A370-Q373 PolarHBondContact O-N 3.28Å; H371-Q373 VanDerWaalsContact C-N 3.3Å; H371-Q373 PolarHBondContact O-N 3.42Å
374	N	93.8	Very high	92.3	Very high	20 Å²	20	55 Å²	55	11%	0.107	28%	0.281	C	S	.	.			trans	-77.5	152.6	176	-69.5	-59.2	0	0	0	111.6	N253 Q356 A370 H371 V377	N253-N374 WeakPolarHBondContact CB-O 3.49Å; N253-N374 PolarHBondContact ND2-O 3.48Å; N253-N374 VanDerWaalsContact ND2-O 3.13Å; Q356-N374 HydrophobicContact CG-CB 4.43Å; Q356-N374 WeakPolarHBondContact CG-OD1 3.44Å; A370-N374 PolarHBondContact O-N 3.47Å; A370-N374 PolarHBondContact O-ND2 3.24Å; H371-N374 PolarHBondContact O-N 3.27Å; N374-V377 HydrophobicContact CB-CG2 3.87Å
375	L	96.6	Very high	92.8	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.058	27%	0.269	C	S	.	.	S	Bend	trans	-92	-40.3	173.6	-64.6	-175.5	0	0	0	111.3	V252 N253 G256 L257 Y260 H352 G354 F355	V252-L375 CarbonylContact C-O 3.5Å; V252-L375 WeakPolarHBondContact CA-O 3.36Å; N253-L375 PolarHBondContact N-O 3.43Å; G256-L375 VanDerWaalsContact C-CD2 3.42Å; L257-L375 HydrophobicContact CB-CD2 4.47Å; L257-L375 HydrophobicContact CD1-CD1 4.2Å; Y260-L375 HydrophobicContact CD1-CD1 4.18Å; Y260-L375 HydrophobicContact CG-CD1 4.22Å; H352-L375 WeakPolarHBondContact NE2-CD1 3.34Å; G354-L375 WeakPolarHBondContact O-CA 3.4Å; G354-L375 PolarHBondContact O-N 2.63Å; F355-L375 HydrophobicContact CD2-CB 4.45Å; F355-L375 HydrophobicContact CD2-CD1 4.25Å; F355-L375 HydrophobicContact CE2-CB 4.29Å; F355-L375 HydrophobicContact CE2-CD1 3.69Å; F355-L375 HydrophobicContact CZ-CD1 4.44Å
376	L	97.1	Very high	93.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139.3	-179.7	178	146.8	0	0	0	110.2	F244 V250 F251 V252 G354 F355 Q356 T357 H378	F244-L376 HydrophobicContact CE2-CD1 3.66Å; F244-L376 HydrophobicContact CZ-CD1 3.5Å; F244-L376 VanDerWaalsContact CZ-CD1 3.5Å; V250-L376 HydrophobicContact CB-CD1 4.23Å; V250-L376 HydrophobicContact CB-CG 4.19Å; V250-L376 HydrophobicContact CG1-CD1 4.39Å; V250-L376 HydrophobicContact CG1-CD2 4.42Å; V250-L376 HydrophobicContact CG2-CD1 4.03Å; V250-L376 HydrophobicContact CG2-CG 4.42Å; F251-L376 CarbonylContact O-C 3.53Å; F251-L376 VanDerWaalsContact O-CA 3.27Å; F251-L376 WeakPolarHBondContact O-CA 3.49Å; V252-L376 HydrophobicContact CG2-CD1 4.2Å; G354-L376 PolarHBondContact O-N 2.82Å; F355-L376 HydrophobicContact CD1-CB 3.96Å; F355-L376 HydrophobicContact CD1-CD1 4.36Å; F355-L376 HydrophobicContact CE1-CB 4.42Å; F355-L376 HydrophobicContact CG-CB 4.5Å; Q356-L376 WeakPolarHBondContact CB-O 3.47Å; Q356-L376 PolarHBondContact N-O 3.1Å; T357-L376 HydrophobicContact CG2-CD2 4.23Å; L376-H378 HydrophobicContact CD2-CB 4.35Å
377	V	95.6	Very high	93.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.9	170.4	-166.2	0	0	0	0	110.5	F251 Q356 I360 N374	F251-V377 PolarHBondContact N-O 3.49Å; F251-V377 PolarHBondContact O-N 2.97Å; Q356-V377 HydrophobicContact CB-CG1 4.26Å; Q356-V377 HydrophobicContact CB-CG2 4.34Å; Q356-V377 WeakPolarHBondContact O-CA 3.44Å; I360-V377 HydrophobicContact CG2-CG1 4.09Å; I360-V377 HydrophobicContact CG2-CG2 4.33Å; N374-V377 HydrophobicContact CB-CG2 3.87Å
378	H	94.9	Very high	94.1	Very high	43 Å²	43	45.4 Å²	45.4	20%	0.199	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.4	174.6	169	-91.7	0	0	0	109.9	D249 V250 Q356 T357 D359 L376	D249-H378 IonicContact OD1-CD2 2.92Å; D249-H378 IonicContact OD1-NE2 3.6Å; V250-H378 HydrophobicContact CG1-CB 3.85Å; Q356-H378 PolarHBondContact O-N 3.43Å; T357-H378 PolarHBondContact O-ND1 2.79Å; D359-H378 WeakPolarHBondContact CA-O 3.29Å; D359-H378 WeakPolarHBondContact CB-O 3.38Å; D359-H378 PolarHBondContact N-O 2.91Å; L376-H378 HydrophobicContact CD2-CB 4.35Å
379	Q	93.8	Very high	94.4	Very high	121 Å²	121	45.3 Å²	45.3	57%	0.565	22%	0.218	S	C	*	.			cis	-105.6	154.5	-7	65.6	-171.8	8.3	0	0	110.7	D249	D249-Q379 CarbonylContact O-C 3.55Å; D249-Q379 VanDerWaalsContact O-CA 3.28Å; D249-Q379 WeakPolarHBondContact O-CA 3.42Å
380	R	94.9	Very high	94.7	Very high	16 Å²	16	50.5 Å²	50.5	6%	0.06	24%	0.238	C	C	.	.			trans	-137.8	136.2	177.3	-63.6	-63.5	-178.9	-95	2.9	110.5	D249 F251 D359 E384 I385 M388	D249-R380 PolarHBondContact O-N 3.44Å; F251-R380 HydrophobicContact CB-CG 3.97Å; D359-R380 VanDerWaalsContact CG-NH1 3.34Å; D359-R380 IonicContact OD1-CZ 3.32Å; D359-R380 VanDerWaalsContact OD1-CZ 3.24Å; D359-R380 IonicContact OD1-NH1 3.15Å; D359-R380 PolarHBondContact OD1-NH1 3.34Å; D359-R380 IonicContact OD1-NH2 2.7Å; D359-R380 PolarHBondContact OD1-NH2 3.47Å; D359-R380 IonicContact OD2-NH1 2.91Å; R380-E384 HydrophobicContact CB-CB 4.18Å; R380-I385 HydrophobicContact CB-CD1 4.34Å; R380-I385 HydrophobicContact CB-CG1 3.64Å; R380-M388 VanDerWaalsContact CD-SD 3.5Å; R380-M388 HydrophobicContact CG-SD 3.86Å; R380-M388 PolarHBondContact NE-SD 3.39Å
381	S	97.2	Very high	94.9	Very high	47 Å²	47	53 Å²	53	33%	0.329	25%	0.249	S	C	.	.			trans	-69	159.8	168.8	62.6	0	0	0	0	111.3	R383 E384 I385	S381-R383 PolarHBondContact O-N 3.47Å; S381-E384 WeakPolarHBondContact CB-OE2 3.49Å; S381-E384 PolarHBondContact N-OE2 3.5Å; S381-E384 PolarHBondContact O-N 2.94Å; S381-E384 VanDerWaalsContact OG-CD 3.29Å; S381-E384 VanDerWaalsContact OG-CG 3.24Å; S381-E384 WeakPolarHBondContact OG-CG 3.18Å; S381-E384 PolarHBondContact OG-N 3.2Å; S381-E384 PolarHBondContact OG-OE2 3.35Å; S381-I385 WeakPolarHBondContact O-CG1 3.46Å; S381-I385 PolarHBondContact O-N 3.24Å
382	P	98.3	Very high	95.3	Very high	13 Å²	13	52.9 Å²	52.9	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-48.6	-44.8	175.1	-30.3	36.7	0	0	0	112.9	E159 R160 A163 I385 E386	E159-P382 HydrophobicContact CB-CG 4.4Å; E159-P382 HydrophobicContact CG-CB 3.87Å; E159-P382 HydrophobicContact CG-CG 3.86Å; R160-P382 HydrophobicContact CG-CG 3.93Å; A163-P382 HydrophobicContact CB-CB 3.73Å; P382-I385 WeakPolarHBondContact O-CB 3.41Å; P382-I385 PolarHBondContact O-N 3.02Å; P382-E386 PolarHBondContact O-N 3.42Å; P382-E386 VanDerWaalsContact O-N 3.08Å
383	R	97.5	Very high	95.5	Very high	153 Å²	153	52.5 Å²	52.5	58%	0.577	25%	0.248	S	C	*	.	H	α-helix	trans	-66.4	-41.8	179.5	-176.1	54.3	176.2	-176.1	-6.3	113.2	S381 I385 E386 V387	S381-R383 PolarHBondContact O-N 3.47Å; R383-I385 VanDerWaalsContact C-N 3.33Å; R383-E386 IonicContact CZ-OE2 3.72Å; R383-E386 IonicContact NH1-OE2 2.81Å; R383-E386 PolarHBondContact NH1-OE2 2.62Å; R383-E386 PolarHBondContact O-N 3.32Å; R383-V387 WeakPolarHBondContact O-CG2 3.42Å; R383-V387 PolarHBondContact O-N 3.34Å; R383-V387 VanDerWaalsContact O-N 3.08Å
384	E	95.9	Very high	95.6	Very high	95 Å²	95	48.3 Å²	48.3	44%	0.444	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-40.6	176	-72.3	165.7	134	0	0	111	R380 S381 E386 V387 M388	R380-E384 HydrophobicContact CB-CB 4.18Å; S381-E384 WeakPolarHBondContact CB-OE2 3.49Å; S381-E384 PolarHBondContact N-OE2 3.5Å; S381-E384 PolarHBondContact O-N 2.94Å; S381-E384 VanDerWaalsContact OG-CD 3.29Å; S381-E384 VanDerWaalsContact OG-CG 3.24Å; S381-E384 WeakPolarHBondContact OG-CG 3.18Å; S381-E384 PolarHBondContact OG-N 3.2Å; S381-E384 PolarHBondContact OG-OE2 3.35Å; E384-E386 PolarHBondContact O-N 3.43Å; E384-V387 PolarHBondContact O-N 2.96Å; E384-M388 VanDerWaalsContact O-CB 3.31Å; E384-M388 WeakPolarHBondContact O-CB 3.41Å; E384-M388 WeakPolarHBondContact O-CG 3.43Å; E384-M388 PolarHBondContact O-N 3.48Å
385	I	96.8	Very high	95.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.4	-49.7	175.4	-69.9	169.9	0	0	0	110.6	T167 V250 F251 R380 S381 P382 R383 V387 M388 W389	T167-I385 HydrophobicContact CG2-CG2 4.1Å; T167-I385 WeakPolarHBondContact OG1-CG2 3.47Å; V250-I385 VanDerWaalsContact O-CD1 3.3Å; V250-I385 WeakPolarHBondContact O-CD1 3.39Å; F251-I385 HydrophobicContact CD2-CG2 4.43Å; R380-I385 HydrophobicContact CB-CD1 4.34Å; R380-I385 HydrophobicContact CB-CG1 3.64Å; S381-I385 WeakPolarHBondContact O-CG1 3.46Å; S381-I385 PolarHBondContact O-N 3.24Å; P382-I385 WeakPolarHBondContact O-CB 3.41Å; P382-I385 PolarHBondContact O-N 3.02Å; R383-I385 VanDerWaalsContact C-N 3.33Å; I385-V387 PolarHBondContact O-N 2.99Å; I385-M388 PolarHBondContact O-N 3.22Å; I385-W389 VanDerWaalsContact O-CB 3.28Å; I385-W389 WeakPolarHBondContact O-CB 3.37Å; I385-W389 PolarHBondContact O-N 3.42Å
386	E	97.1	Very high	95.4	Very high	45 Å²	45	59.8 Å²	59.8	21%	0.21	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-46.3	177.2	-71.6	174.8	-170.1	0	0	113.1	T167 P382 R383 E384 W389 K390	T167-E386 HydrophobicContact CG2-CG 4.43Å; P382-E386 PolarHBondContact O-N 3.42Å; P382-E386 VanDerWaalsContact O-N 3.08Å; R383-E386 IonicContact CZ-OE2 3.72Å; R383-E386 IonicContact NH1-OE2 2.81Å; R383-E386 PolarHBondContact NH1-OE2 2.62Å; R383-E386 PolarHBondContact O-N 3.32Å; E384-E386 PolarHBondContact O-N 3.43Å; E386-W389 PolarHBondContact O-N 3.48Å; E386-K390 WeakPolarHBondContact O-CG 3.44Å; E386-K390 PolarHBondContact O-N 3.08Å
387	V	95.4	Very high	95.1	Very high	58 Å²	58	61.6 Å²	61.6	35%	0.352	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-46.7	-178.5	169.8	0	0	0	0	110.2	R383 E384 I385 W389 K390 N391	R383-V387 WeakPolarHBondContact O-CG2 3.42Å; R383-V387 PolarHBondContact O-N 3.34Å; R383-V387 VanDerWaalsContact O-N 3.08Å; E384-V387 PolarHBondContact O-N 2.96Å; I385-V387 PolarHBondContact O-N 2.99Å; V387-W389 VanDerWaalsContact C-N 3.34Å; V387-W389 PolarHBondContact O-N 2.98Å; V387-K390 PolarHBondContact O-N 3.15Å; V387-N391 WeakPolarHBondContact O-CB 3.47Å; V387-N391 PolarHBondContact O-N 2.7Å; V387-N391 PolarHBondContact O-ND2 3.13Å
388	M	94.7	Very high	94.7	Very high	15 Å²	15	67.6 Å²	67.6	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-45.7	176.8	-72.4	178.8	65	0	0	111.1	F251 H371 R380 E384 I385 K390 N391 I392	F251-M388 HydrophobicContact CB-CE 4.04Å; F251-M388 HydrophobicContact CB-SD 4.33Å; F251-M388 HydrophobicContact CD1-CE 3.55Å; F251-M388 HydrophobicContact CD2-CB 3.83Å; F251-M388 HydrophobicContact CD2-CE 4.26Å; F251-M388 HydrophobicContact CE1-CE 4.02Å; F251-M388 HydrophobicContact CE2-CB 3.7Å; F251-M388 HydrophobicContact CG-CB 4.37Å; F251-M388 HydrophobicContact CG-CE 3.67Å; F251-M388 HydrophobicContact CG-SD 4.28Å; F251-M388 HydrophobicContact CZ-CB 4.14Å; H371-M388 HydrophobicContact CB-CE 3.95Å; H371-M388 WeakPolarHBondContact ND1-CE 3.04Å; R380-M388 VanDerWaalsContact CD-SD 3.5Å; R380-M388 HydrophobicContact CG-SD 3.86Å; R380-M388 PolarHBondContact NE-SD 3.39Å; E384-M388 VanDerWaalsContact O-CB 3.31Å; E384-M388 WeakPolarHBondContact O-CB 3.41Å; E384-M388 WeakPolarHBondContact O-CG 3.43Å; E384-M388 PolarHBondContact O-N 3.48Å; I385-M388 PolarHBondContact O-N 3.22Å; M388-K390 PolarHBondContact O-N 2.95Å; M388-N391 PolarHBondContact O-N 2.94Å; M388-I392 WeakPolarHBondContact O-CG1 3.43Å; M388-I392 PolarHBondContact O-N 3.47Å
389	W	96.2	Very high	94.3	Very high	32 Å²	32	71.3 Å²	71.3	12%	0.121	37%	0.374	C	S	.	.	H	α-helix	trans	-58.7	-47.7	178.4	-174.8	-100.5	0	0	0	112.1	T167 W168 F251 I385 E386 V387 N391 H393	T167-W389 HydrophobicContact CG2-CB 3.64Å; T167-W389 HydrophobicContact CG2-CD2 4.42Å; T167-W389 HydrophobicContact CG2-CG 3.71Å; T167-W389 WeakPolarHBondContact O-CZ2 3.16Å; W168-W389 VanDerWaalsContact CA-CZ3 3.43Å; W168-W389 HydrophobicContact CB-CE3 3.95Å; W168-W389 HydrophobicContact CB-CH2 4.5Å; W168-W389 HydrophobicContact CB-CZ3 3.66Å; F251-W389 HydrophobicContact CE2-CB 4.16Å; F251-W389 HydrophobicContact CE2-CE3 4.08Å; F251-W389 HydrophobicContact CZ-CE3 4.39Å; I385-W389 VanDerWaalsContact O-CB 3.28Å; I385-W389 WeakPolarHBondContact O-CB 3.37Å; I385-W389 PolarHBondContact O-N 3.42Å; E386-W389 PolarHBondContact O-N 3.48Å; V387-W389 VanDerWaalsContact C-N 3.34Å; V387-W389 PolarHBondContact O-N 2.98Å; W389-N391 VanDerWaalsContact C-N 3.32Å; W389-N391 PolarHBondContact O-N 3.44Å; W389-H393 AromaticContact CD2-CE1 3.5Å; W389-H393 AromaticContact CD2-ND1 3.61Å; W389-H393 AromaticContact CE2-CE1 3.4Å; W389-H393 AromaticContact CE2-ND1 3.57Å; W389-H393 AromaticContact CE3-CE1 3.51Å; W389-H393 AromaticContact CG-ND1 3.99Å; W389-H393 AromaticContact CH2-CE1 3.36Å; W389-H393 WeakPolarHBondContact CH2-CE1 3.42Å; W389-H393 AromaticContact CH2-NE2 3.83Å; W389-H393 AromaticContact CZ2-CE1 3.34Å; W389-H393 WeakPolarHBondContact CZ2-CE1 3.23Å; W389-H393 AromaticContact CZ2-ND1 3.95Å; W389-H393 AromaticContact CZ2-NE2 3.82Å; W389-H393 AromaticContact CZ3-CE1 3.44Å; W389-H393 VanDerWaalsContact CZ3-CE1 3.44Å; W389-H393 WeakPolarHBondContact CZ3-CE1 2.7Å; W389-H393 AromaticContact NE1-ND1 3.9Å; W389-H393 PolarHBondContact O-N 2.78Å; W389-H393 PolarHBondContact O-ND1 3.09Å
390	K	95.9	Very high	94.4	Very high	131 Å²	131	68.9 Å²	68.9	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-61.3	-41.1	176.7	-72.5	173.5	-174.2	174.3	0	111.9	E386 V387 M388 N394	E386-K390 WeakPolarHBondContact O-CG 3.44Å; E386-K390 PolarHBondContact O-N 3.08Å; V387-K390 PolarHBondContact O-N 3.15Å; M388-K390 PolarHBondContact O-N 2.95Å; K390-N394 PolarHBondContact O-N 3.33Å; K390-N394 VanDerWaalsContact O-N 3.17Å
391	N	94.3	Very high	94.3	Very high	67 Å²	67	71.6 Å²	71.6	36%	0.358	38%	0.381	S	S	.	.	H	α-helix	trans	-69.7	-46.1	-176.7	-71.8	-16.7	0	0	0	112.5	V368 V387 M388 W389 H393 N394	V368-N391 HydrophobicContact CG1-CB 3.71Å; V368-N391 HydrophobicContact CG2-CB 3.91Å; V387-N391 WeakPolarHBondContact O-CB 3.47Å; V387-N391 PolarHBondContact O-N 2.7Å; V387-N391 PolarHBondContact O-ND2 3.13Å; M388-N391 PolarHBondContact O-N 2.94Å; W389-N391 VanDerWaalsContact C-N 3.32Å; W389-N391 PolarHBondContact O-N 3.44Å; N391-H393 PolarHBondContact O-N 3.12Å; N391-N394 VanDerWaalsContact O-CB 3.29Å; N391-N394 WeakPolarHBondContact O-CB 3.41Å; N391-N394 PolarHBondContact O-N 3.09Å; N391-N394 VanDerWaalsContact O-N 3.15Å
392	I	94.6	Very high	94.2	Very high	9 Å²	9	73 Å²	73	5%	0.046	38%	0.383	C	S	.	.	H	α-helix	trans	-68.9	-23.7	-178.3	65.2	149.4	0	0	0	113.1	F251 V368 H371 K372 M388	F251-I392 HydrophobicContact CE1-CD1 4.26Å; F251-I392 HydrophobicContact CZ-CD1 3.62Å; F251-I392 HydrophobicContact CZ-CG1 4.02Å; V368-I392 HydrophobicContact CG1-CG2 3.96Å; H371-I392 HydrophobicContact CB-CG2 4.17Å; K372-I392 HydrophobicContact CB-CB 4.45Å; K372-I392 HydrophobicContact CB-CG2 4.21Å; M388-I392 WeakPolarHBondContact O-CG1 3.43Å; M388-I392 PolarHBondContact O-N 3.47Å
393	H	93.8	Very high	93.9	Very high	70 Å²	70	76.5 Å²	76.5	32%	0.324	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	4.9	175.9	-65.1	95.6	0	0	0	113.4	D255 W389 N391 P395	D255-H393 IonicContact OD2-NE2 2.74Å; W389-H393 AromaticContact CD2-CE1 3.5Å; W389-H393 AromaticContact CD2-ND1 3.61Å; W389-H393 AromaticContact CE2-CE1 3.4Å; W389-H393 AromaticContact CE2-ND1 3.57Å; W389-H393 AromaticContact CE3-CE1 3.51Å; W389-H393 AromaticContact CG-ND1 3.99Å; W389-H393 AromaticContact CH2-CE1 3.36Å; W389-H393 WeakPolarHBondContact CH2-CE1 3.42Å; W389-H393 AromaticContact CH2-NE2 3.83Å; W389-H393 AromaticContact CZ2-CE1 3.34Å; W389-H393 WeakPolarHBondContact CZ2-CE1 3.23Å; W389-H393 AromaticContact CZ2-ND1 3.95Å; W389-H393 AromaticContact CZ2-NE2 3.82Å; W389-H393 AromaticContact CZ3-CE1 3.44Å; W389-H393 VanDerWaalsContact CZ3-CE1 3.44Å; W389-H393 WeakPolarHBondContact CZ3-CE1 2.7Å; W389-H393 AromaticContact NE1-ND1 3.9Å; W389-H393 PolarHBondContact O-N 2.78Å; W389-H393 PolarHBondContact O-ND1 3.09Å; N391-H393 PolarHBondContact O-N 3.12Å; H393-P395 WeakPolarHBondContact O-CD 3.46Å
394	N	93.9	Very high	93.7	Very high	68 Å²	68	71.8 Å²	71.8	36%	0.364	39%	0.39	S	S	.	.			trans	-64.4	121.1	176.4	-176	-19.8	0	0	0	109.1	K390 N391 L396 L397	K390-N394 PolarHBondContact O-N 3.33Å; K390-N394 VanDerWaalsContact O-N 3.17Å; N391-N394 VanDerWaalsContact O-CB 3.29Å; N391-N394 WeakPolarHBondContact O-CB 3.41Å; N391-N394 PolarHBondContact O-N 3.09Å; N391-N394 VanDerWaalsContact O-N 3.15Å; N394-L396 PolarHBondContact O-N 2.6Å; N394-L396 VanDerWaalsContact O-N 3.14Å; N394-L396 WeakPolarHBondContact OD1-CB 3.36Å; N394-L396 PolarHBondContact OD1-N 3.27Å; N394-L397 HydrophobicContact CB-CB 4.26Å; N394-L397 VanDerWaalsContact O-CB 3.24Å; N394-L397 WeakPolarHBondContact O-CB 2.98Å; N394-L397 PolarHBondContact O-N 3.36Å
395	P	91.6	Very high	93.6	Very high	125 Å²	125	70.2 Å²	70.2	81%	0.812	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-17.4	-178.8	26.9	-35.4	0	0	0	113.3	H393	H393-P395 WeakPolarHBondContact O-CD 3.46Å
396	L	93.1	Very high	93.3	Very high	146 Å²	146	75.2 Å²	75.2	76%	0.764	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-4.9	176.4	-54.9	177.3	0	0	0	113	N394 T398	N394-L396 PolarHBondContact O-N 2.6Å; N394-L396 VanDerWaalsContact O-N 3.14Å; N394-L396 WeakPolarHBondContact OD1-CB 3.36Å; N394-L396 PolarHBondContact OD1-N 3.27Å; L396-T398 PolarHBondContact O-N 2.91Å
397	L	91.4	Very high	93	Very high	39 Å²	39	77.5 Å²	77.5	20%	0.204	43%	0.43	C	S	.	.			trans	-69.9	117.2	179.5	176.7	68.1	0	0	0	110.6	V368 K372 N394	V368-L397 HydrophobicContact CB-CD1 3.94Å; V368-L397 HydrophobicContact CB-CD2 4.43Å; V368-L397 HydrophobicContact CG1-CD1 3.88Å; V368-L397 HydrophobicContact CG1-CD2 3.54Å; V368-L397 HydrophobicContact CG1-CG 4.36Å; K372-L397 HydrophobicContact CD-CD2 3.8Å; N394-L397 HydrophobicContact CB-CB 4.26Å; N394-L397 VanDerWaalsContact O-CB 3.24Å; N394-L397 WeakPolarHBondContact O-CB 2.98Å; N394-L397 PolarHBondContact O-N 3.36Å
398	T	87.5	Confident	92.8	Very high	127 Å²	127	79.2 Å²	79.2	78%	0.779	44%	0.436	S	S	*	.			trans	-104.5	125.8	170.3	47.5	0	0	0	0	110.9	C369 L396	C369-T398 PolarHBondContact SG-O 3.21Å; C369-T398 VanDerWaalsContact SG-O 3.39Å; L396-T398 PolarHBondContact O-N 2.91Å
399	C	87.1	Confident	92.7	Very high	121 Å²	121	85 Å²	85	82%	0.818	47%	0.469	S	S	*	.			trans	-133	0	170.8	-50.2	0	0	0	0	105.5	C369	C369-C399 WeakPolarHBondContact CA-SG 3.19Å; C369-C399 HydrophobicContact CB-CB 3.68Å; C369-C399 WeakPolarHBondContact CB-SG 3.26Å; C369-C399 WeakPolarHBondContact SG-CA 3.42Å; C369-C399 WeakPolarHBondContact SG-CB 3.45Å; C369-C399 CovalentContact SG-SG 2.04Å; C369-C399 PolarHBondContact SG-SG 2.85Å

Retrieved 399 of 399 residues in 208.6 ms (Link to these results)

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