A0A2K5Y4E3_MANLE Loading...

Ring finger and SPRY domain containing 1

AlphaFold DB , UniProt , Accession A0A2K5Y4E3, Species MANLE (Mandrillus leucophaeus, Drill), Gene RSPRY1, Length 576 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	28.8	Very low	30.9	Very low	211 Å²	211	117.4 Å²	117.4	100%	1.039	63%	0.632	S	S	*	*				0	-60.1	0	-61	-45.7	-77	0	0	111.9	V3 F4	M1-V3 PolarHBondContact O-N 3.11Å; M1-F4 PolarHBondContact O-N 2.9Å
2	I	29.7	Very low	30.8	Very low	154 Å²	154	112.9 Å²	112.9	79%	0.79	62%	0.616	S	S	*	*	H	α-helix	trans	-61.9	-43.4	-178.5	-60.3	175.2	0	0	0	112.7	F4 G5	I2-F4 PolarHBondContact O-N 3.41Å; I2-F4 VanDerWaalsContact O-N 3.07Å; I2-G5 PolarHBondContact O-N 3.01Å
3	V	34.1	Very low	31.3	Very low	128 Å²	128	115.2 Å²	115.2	78%	0.776	61%	0.61	S	S	*	*	H	α-helix	trans	-51.2	-34	177.1	-177.1	0	0	0	0	113.6	M1 G5	M1-V3 PolarHBondContact O-N 3.11Å; V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 3.47Å
4	F	25.4	Very low	31.7	Very low	167 Å²	167	112.8 Å²	112.8	73%	0.732	61%	0.607	S	S	*	*	H	α-helix	trans	-77.4	-18.5	-179.8	-134	-85.5	0	0	0	113.2	M1 I2 V8	M1-F4 PolarHBondContact O-N 2.9Å; I2-F4 PolarHBondContact O-N 3.41Å; I2-F4 VanDerWaalsContact O-N 3.07Å; F4-V8 HydrophobicContact CD1-CG2 4.26Å; F4-V8 WeakPolarHBondContact O-CG2 3.35Å
5	G	27.8	Very low	31.8	Very low	44 Å²	44	113.3 Å²	113.3	45%	0.454	61%	0.609	S	S	.	*	H	α-helix	trans	-75.8	-36.6	174.9	0	0	0	0	0	112.7	I2 V3 V8 F9	I2-G5 PolarHBondContact O-N 3.01Å; V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 3.47Å; G5-V8 PolarHBondContact O-N 3.34Å; G5-F9 WeakPolarHBondContact O-CB 3.41Å; G5-F9 PolarHBondContact O-N 3.29Å
6	W	33.6	Very low	32	Very low	168 Å²	168	108.3 Å²	108.3	64%	0.636	59%	0.592	S	S	*	*	H	α-helix	trans	-66.8	-50.1	-176.2	-124	57.4	0	0	0	112.3	V8 F9 L10	W6-V8 VanDerWaalsContact C-N 3.31Å; W6-V8 PolarHBondContact O-N 2.99Å; W6-F9 PolarHBondContact O-N 2.86Å; W6-L10 HydrophobicContact CE3-CD1 4.42Å; W6-L10 PolarHBondContact O-N 2.65Å; W6-L10 VanDerWaalsContact O-N 3.11Å
7	A	30.2	Very low	32.2	Very low	64 Å²	64	109.9 Å²	109.9	53%	0.529	60%	0.595	S	S	.	*	H	α-helix	trans	-61	-38.2	175.9	0	0	0	0	0	112.8	A11	A7-A11 WeakPolarHBondContact O-CB 3.28Å; A7-A11 PolarHBondContact O-N 3.44Å
8	V	31.3	Very low	32.2	Very low	83 Å²	83	105.8 Å²	105.8	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-70.7	-33.1	177.3	172.4	0	0	0	0	111.9	F4 G5 W6 S12	F4-V8 HydrophobicContact CD1-CG2 4.26Å; F4-V8 WeakPolarHBondContact O-CG2 3.35Å; G5-V8 PolarHBondContact O-N 3.34Å; W6-V8 VanDerWaalsContact C-N 3.31Å; W6-V8 PolarHBondContact O-N 2.99Å; V8-S12 VanDerWaalsContact O-CB 3.3Å; V8-S12 WeakPolarHBondContact O-CB 3.3Å; V8-S12 PolarHBondContact O-N 2.91Å; V8-S12 PolarHBondContact O-OG 3.35Å
9	F	34.5	Very low	32.2	Very low	118 Å²	118	105.7 Å²	105.7	52%	0.518	58%	0.58	S	S	.	*	H	α-helix	trans	-67.1	-45.1	175.8	-175.1	-107	0	0	0	112.1	G5 W6 S12 R13	G5-F9 WeakPolarHBondContact O-CB 3.41Å; G5-F9 PolarHBondContact O-N 3.29Å; W6-F9 PolarHBondContact O-N 2.86Å; F9-S12 PolarHBondContact O-N 3Å; F9-S12 PolarHBondContact O-OG 3.3Å; F9-S12 VanDerWaalsContact O-OG 3.12Å; F9-R13 PolarHBondContact O-N 2.73Å; F9-R13 VanDerWaalsContact O-N 3.12Å
10	L	34.2	Very low	32.4	Very low	100 Å²	100	106.2 Å²	106.2	52%	0.524	58%	0.581	S	S	.	*	H	α-helix	trans	-64.4	-47.5	175.9	-67	170.2	0	0	0	111.6	W6 S12 R13 S14	W6-L10 HydrophobicContact CE3-CD1 4.42Å; W6-L10 PolarHBondContact O-N 2.65Å; W6-L10 VanDerWaalsContact O-N 3.11Å; L10-S12 VanDerWaalsContact C-N 3.34Å; L10-S12 PolarHBondContact O-N 2.96Å; L10-R13 PolarHBondContact O-N 3.41Å; L10-S14 PolarHBondContact O-N 3.31Å; L10-S14 VanDerWaalsContact O-N 3.13Å
11	A	30.4	Very low	32.6	Very low	54 Å²	54	106.6 Å²	106.6	45%	0.446	58%	0.582	S	S	.	*	H	α-helix	trans	-61.4	-38.7	178.2	0	0	0	0	0	113.1	A7 L15	A7-A11 WeakPolarHBondContact O-CB 3.28Å; A7-A11 PolarHBondContact O-N 3.44Å; A11-L15 WeakPolarHBondContact O-CG 3.4Å; A11-L15 PolarHBondContact O-N 3.23Å; A11-L15 VanDerWaalsContact O-N 3.09Å
12	S	29.8	Very low	33	Very low	64 Å²	64	99.6 Å²	99.6	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-73.5	-29.6	178.8	54.2	0	0	0	0	113.7	V8 F9 L10 G16	V8-S12 VanDerWaalsContact O-CB 3.3Å; V8-S12 WeakPolarHBondContact O-CB 3.3Å; V8-S12 PolarHBondContact O-N 2.91Å; V8-S12 PolarHBondContact O-OG 3.35Å; F9-S12 PolarHBondContact O-N 3Å; F9-S12 PolarHBondContact O-OG 3.3Å; F9-S12 VanDerWaalsContact O-OG 3.12Å; L10-S12 VanDerWaalsContact C-N 3.34Å; L10-S12 PolarHBondContact O-N 2.96Å; S12-G16 PolarHBondContact O-N 2.91Å; S12-G16 VanDerWaalsContact O-N 3.11Å
13	R	37.1	Very low	33.1	Very low	143 Å²	143	97.2 Å²	97.2	54%	0.54	54%	0.54	S	S	.	.	H	α-helix	trans	-65.6	-47.3	169.1	-98.9	-175.7	160.2	-170.5	-4.6	112.4	F9 L10 L15 G16 Q17	F9-R13 PolarHBondContact O-N 2.73Å; F9-R13 VanDerWaalsContact O-N 3.12Å; L10-R13 PolarHBondContact O-N 3.41Å; R13-L15 PolarHBondContact O-N 3.32Å; R13-G16 WeakPolarHBondContact O-CA 3.12Å; R13-G16 PolarHBondContact O-N 2.78Å; R13-Q17 PolarHBondContact O-N 3.15Å
14	S	37.3	Very low	33.3	Very low	81 Å²	81	97.1 Å²	97.1	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-58.1	-47.1	177.2	176.9	0	0	0	0	111.9	L10 G16 Q17 G18	L10-S14 PolarHBondContact O-N 3.31Å; L10-S14 VanDerWaalsContact O-N 3.13Å; S14-G16 VanDerWaalsContact C-N 3.26Å; S14-G16 PolarHBondContact O-N 3.09Å; S14-Q17 PolarHBondContact O-N 3.39Å; S14-G18 PolarHBondContact O-N 3.38Å
15	L	33.5	Very low	33.9	Very low	120 Å²	120	95.9 Å²	95.9	63%	0.628	53%	0.527	S	S	*	.	H	α-helix	trans	-57.6	-36.8	172.8	-78.7	165.9	0	0	0	113	A11 R13 L19	A11-L15 WeakPolarHBondContact O-CG 3.4Å; A11-L15 PolarHBondContact O-N 3.23Å; A11-L15 VanDerWaalsContact O-N 3.09Å; R13-L15 PolarHBondContact O-N 3.32Å; L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 PolarHBondContact O-N 2.94Å
16	G	34.1	Very low	34.1	Very low	33 Å²	33	99.8 Å²	99.8	34%	0.34	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-42.2	176.3	0	0	0	0	0	113.8	S12 R13 S14 L19 L20	S12-G16 PolarHBondContact O-N 2.91Å; S12-G16 VanDerWaalsContact O-N 3.11Å; R13-G16 WeakPolarHBondContact O-CA 3.12Å; R13-G16 PolarHBondContact O-N 2.78Å; S14-G16 VanDerWaalsContact C-N 3.26Å; S14-G16 PolarHBondContact O-N 3.09Å; G16-L19 PolarHBondContact O-N 3.1Å; G16-L20 PolarHBondContact O-N 2.96Å; G16-L20 VanDerWaalsContact O-N 3.15Å
17	Q	35.8	Very low	34.3	Very low	137 Å²	137	96.3 Å²	96.3	64%	0.64	53%	0.526	S	S	*	.	H	α-helix	trans	-70.3	-41.2	177.6	-72.4	173.9	-73.3	0	0	111.9	R13 S14 L19 L20 L21	R13-Q17 PolarHBondContact O-N 3.15Å; S14-Q17 PolarHBondContact O-N 3.39Å; Q17-L19 VanDerWaalsContact C-N 3.27Å; Q17-L19 PolarHBondContact O-N 3.15Å; Q17-L20 PolarHBondContact O-N 2.81Å; Q17-L20 VanDerWaalsContact O-N 3.12Å; Q17-L21 PolarHBondContact O-N 3.29Å; Q17-L21 VanDerWaalsContact O-N 3.17Å
18	G	32.2	Very low	34.5	Very low	35 Å²	35	96.9 Å²	96.9	36%	0.361	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-33.4	172.4	0	0	0	0	0	113.3	S14 T22	S14-G18 PolarHBondContact O-N 3.38Å; G18-T22 WeakPolarHBondContact O-CG2 3.41Å; G18-T22 PolarHBondContact O-N 3.1Å; G18-T22 PolarHBondContact O-OG1 3.43Å
19	L	32.7	Very low	34.6	Very low	104 Å²	104	100.8 Å²	100.8	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-70.5	-27.8	173.1	-96.8	160.5	0	0	0	113.9	L15 G16 Q17 L23	L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 PolarHBondContact O-N 2.94Å; G16-L19 PolarHBondContact O-N 3.1Å; Q17-L19 VanDerWaalsContact C-N 3.27Å; Q17-L19 PolarHBondContact O-N 3.15Å; L19-L23 PolarHBondContact O-N 2.83Å
20	L	35.7	Very low	34.4	Very low	116 Å²	116	103.7 Å²	103.7	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-73.5	-50.9	174.8	-121.3	91.8	0	0	0	111.1	G16 Q17 T22 L23 E24	G16-L20 PolarHBondContact O-N 2.96Å; G16-L20 VanDerWaalsContact O-N 3.15Å; Q17-L20 PolarHBondContact O-N 2.81Å; Q17-L20 VanDerWaalsContact O-N 3.12Å; L20-T22 VanDerWaalsContact C-N 3.33Å; L20-T22 PolarHBondContact O-N 2.75Å; L20-L23 WeakPolarHBondContact O-CA 3.45Å; L20-L23 VanDerWaalsContact O-CB 3.3Å; L20-L23 WeakPolarHBondContact O-CB 3.2Å; L20-L23 PolarHBondContact O-N 2.92Å; L20-E24 PolarHBondContact O-N 2.78Å; L20-E24 VanDerWaalsContact O-N 3.15Å
21	L	36.7	Very low	34.2	Very low	114 Å²	114	105.9 Å²	105.9	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-57.1	-45.9	-179.2	-72.2	169.2	0	0	0	111.9	Q17 L23 E24 E25	Q17-L21 PolarHBondContact O-N 3.29Å; Q17-L21 VanDerWaalsContact O-N 3.17Å; L21-L23 PolarHBondContact O-N 2.83Å; L21-E24 PolarHBondContact O-N 2.83Å; L21-E25 PolarHBondContact O-N 3.19Å
22	T	36.7	Very low	34.3	Very low	64 Å²	64	106.3 Å²	106.3	39%	0.393	58%	0.577	S	S	.	*	H	α-helix	trans	-69.3	-15.8	177.7	51.6	0	0	0	0	113.9	G18 L20 H26	G18-T22 WeakPolarHBondContact O-CG2 3.41Å; G18-T22 PolarHBondContact O-N 3.1Å; G18-T22 PolarHBondContact O-OG1 3.43Å; L20-T22 VanDerWaalsContact C-N 3.33Å; L20-T22 PolarHBondContact O-N 2.75Å; T22-H26 PolarHBondContact O-ND1 2.71Å
23	L	32.9	Very low	34.4	Very low	105 Å²	105	109.2 Å²	109.2	55%	0.55	59%	0.592	S	S	.	*	H	α-helix	trans	-81.4	-41.4	172.9	-140.7	79	0	0	0	111.9	L19 L20 L21 E25 H26 I27	L19-L23 PolarHBondContact O-N 2.83Å; L20-L23 WeakPolarHBondContact O-CA 3.45Å; L20-L23 VanDerWaalsContact O-CB 3.3Å; L20-L23 WeakPolarHBondContact O-CB 3.2Å; L20-L23 PolarHBondContact O-N 2.92Å; L21-L23 PolarHBondContact O-N 2.83Å; L23-E25 PolarHBondContact O-N 3.19Å; L23-H26 PolarHBondContact O-N 3.29Å; L23-I27 WeakPolarHBondContact O-CG1 3.4Å; L23-I27 PolarHBondContact O-N 3.29Å
24	E	38	Very low	33.8	Very low	125 Å²	125	114.3 Å²	114.3	58%	0.584	61%	0.611	S	S	*	*	H	α-helix	trans	-63.7	-40.5	179.5	-67.1	-171	152.3	0	0	111.7	L20 L21 H26 I27 A28	L20-E24 PolarHBondContact O-N 2.78Å; L20-E24 VanDerWaalsContact O-N 3.15Å; L21-E24 PolarHBondContact O-N 2.83Å; E24-H26 VanDerWaalsContact C-N 3.34Å; E24-H26 PolarHBondContact O-N 2.9Å; E24-I27 PolarHBondContact O-N 3.04Å; E24-A28 PolarHBondContact O-N 3.42Å
25	E	36.6	Very low	33.1	Very low	142 Å²	142	114.5 Å²	114.5	66%	0.664	63%	0.626	S	S	*	*	H	α-helix	trans	-61	-40	173.4	-67.4	-172.7	138.9	0	0	112.6	L21 L23 H29	L21-E25 PolarHBondContact O-N 3.19Å; L23-E25 PolarHBondContact O-N 3.19Å; E25-H29 PolarHBondContact O-N 3.19Å; E25-H29 VanDerWaalsContact O-N 3.16Å
26	H	33.4	Very low	32.7	Very low	126 Å²	126	113.7 Å²	113.7	58%	0.583	64%	0.636	S	S	*	*	H	α-helix	trans	-69.2	-36	176.9	-84.3	82.8	0	0	0	113.1	T22 L23 E24 H29 F30	T22-H26 PolarHBondContact O-ND1 2.71Å; L23-H26 PolarHBondContact O-N 3.29Å; E24-H26 VanDerWaalsContact C-N 3.34Å; E24-H26 PolarHBondContact O-N 2.9Å; H26-H29 PolarHBondContact O-N 3.48Å; H26-F30 PolarHBondContact O-N 3.12Å
27	I	36.1	Very low	32.4	Very low	95 Å²	95	119.2 Å²	119.2	49%	0.487	66%	0.664	S	S	.	*	H	α-helix	trans	-67.9	-41.4	177.1	-67.9	168.6	0	0	0	110.4	L23 E24 H29 F30 L31	L23-I27 WeakPolarHBondContact O-CG1 3.4Å; L23-I27 PolarHBondContact O-N 3.29Å; E24-I27 PolarHBondContact O-N 3.04Å; I27-H29 VanDerWaalsContact C-N 3.29Å; I27-H29 PolarHBondContact O-N 2.85Å; I27-F30 PolarHBondContact O-N 3.47Å; I27-L31 HydrophobicContact CG2-CD1 4.24Å
28	A	35	Very low	31.8	Very low	75 Å²	75	117.6 Å²	117.6	62%	0.62	67%	0.674	S	S	*	*	H	α-helix	trans	-59.5	-39.9	173.9	0	0	0	0	0	112.2	E24 F30	E24-A28 PolarHBondContact O-N 3.42Å; A28-F30 VanDerWaalsContact C-N 3.35Å; A28-F30 PolarHBondContact O-N 2.96Å
29	H	33.6	Very low	31.4	Very low	166 Å²	166	122.2 Å²	122.2	77%	0.769	70%	0.696	S	S	*	*	H	α-helix	trans	-73.5	-21.8	-179.3	-152.4	-53.2	0	0	0	113.9	E25 H26 I27	E25-H29 PolarHBondContact O-N 3.19Å; E25-H29 VanDerWaalsContact O-N 3.16Å; H26-H29 PolarHBondContact O-N 3.48Å; I27-H29 VanDerWaalsContact C-N 3.29Å; I27-H29 PolarHBondContact O-N 2.85Å
30	F	29.8	Very low	31	Very low	178 Å²	178	126.2 Å²	126.2	78%	0.781	71%	0.714	S	S	*	*	H	α-helix	trans	-87.7	-21.9	-178	-109.9	-84.5	0	0	0	115.1	H26 I27 A28	H26-F30 PolarHBondContact O-N 3.12Å; I27-F30 PolarHBondContact O-N 3.47Å; A28-F30 VanDerWaalsContact C-N 3.35Å; A28-F30 PolarHBondContact O-N 2.96Å
31	L	30.7	Very low	30.4	Very low	147 Å²	147	124.3 Å²	124.3	77%	0.77	72%	0.722	S	S	*	*	S	Bend	trans	-89.3	1.4	-178.8	-72.9	164.3	0	0	0	113.9	I27 T33	I27-L31 HydrophobicContact CG2-CD1 4.24Å; L31-T33 PolarHBondContact O-N 3.03Å
32	G	32.9	Very low	30	Very low	62 Å²	62	127 Å²	127	64%	0.639	74%	0.737	S	S	*	*			trans	-77.2	2.3	-170.3	0	0	0	0	0	118.1
33	T	30.9	Very low	29.5	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	76%	0.756	S	S	*	*	S	Bend	trans	-143.6	102.4	-178.2	49.5	0	0	0	0	116.1	L31	L31-T33 PolarHBondContact O-N 3.03Å
34	R	25.7	Very low	29.1	Very low	250 Å²	250	130.2 Å²	130.2	94%	0.943	77%	0.77	S	S	*	*			trans	143.4	107.8	137.9	-82.8	177.7	166.7	-171.7	-3.3	112.5
35	G	22.5	Very low	28.5	Very low	85 Å²	85	131.7 Å²	131.7	88%	0.876	78%	0.78	S	S	*	*			trans	-96.4	125	158.6	0	0	0	0	0	110.8
36	A	25.3	Very low	28	Very low	103 Å²	103	130.4 Å²	130.4	85%	0.851	79%	0.785	S	S	*	*			trans	-154.2	139.3	164.1	0	0	0	0	0	109.3
37	T	26.6	Very low	27.6	Very low	149 Å²	149	134.4 Å²	134.4	91%	0.914	80%	0.795	S	S	*	*			trans	-88.6	134.6	-167.6	50.6	0	0	0	0	114.1
38	A	23.9	Very low	27.1	Very low	104 Å²	104	137 Å²	137	86%	0.86	81%	0.81	S	S	*	*			trans	-151.3	140.9	156.1	0	0	0	0	0	110.7
39	T	24.6	Very low	26.7	Very low	132 Å²	132	139.3 Å²	139.3	81%	0.81	81%	0.812	S	S	*	*			trans	-108.8	137.7	-179.1	50.3	0	0	0	0	112
40	M	23.7	Very low	26.5	Very low	187 Å²	187	137.4 Å²	137.4	92%	0.921	82%	0.817	S	S	*	*			trans	155	152.8	130.7	-87.6	-163.8	-66.4	0	0	112.9
41	G	23.4	Very low	26.3	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	81%	0.81	S	S	*	*			trans	114	103.4	147.3	0	0	0	0	0	117.1
42	N	26.8	Very low	26.1	Very low	171 Å²	171	130.9 Å²	130.9	91%	0.914	81%	0.811	S	S	*	*			trans	-78.6	143.3	160.3	-68.1	-3.7	0	0	0	110.4
43	S	26.7	Very low	25.9	Very low	112 Å²	112	134.9 Å²	134.9	78%	0.783	82%	0.818	S	S	*	*			trans	-163.8	132.2	134.6	43.4	0	0	0	0	112.2
44	C	25	Very low	25.7	Very low	125 Å²	125	136.1 Å²	136.1	85%	0.845	82%	0.82	S	S	*	*			trans	-86.7	149	162.5	-63.7	0	0	0	0	108.9
45	I	25.5	Very low	25.8	Very low	155 Å²	155	128.3 Å²	128.3	80%	0.795	80%	0.803	S	S	*	*			trans	-131.9	101	162.8	-60.1	-178.2	0	0	0	108.2
46	C	26	Very low	26	Very low	116 Å²	116	129.5 Å²	129.5	78%	0.784	79%	0.793	S	S	*	*			trans	-80.7	153.1	155.5	-57.1	0	0	0	0	108.2
47	R	25	Very low	26.1	Very low	209 Å²	209	131.5 Å²	131.5	79%	0.789	79%	0.79	S	S	*	*			trans	-150.4	98	166.9	-169.4	172.5	-178.1	170.1	1.3	112.3	D49	R47-D49 IonicContact CZ-OD2 2.85Å; R47-D49 IonicContact NE-OD2 2.67Å; R47-D49 PolarHBondContact NE-OD2 2.85Å; R47-D49 IonicContact NH2-OD2 2.74Å; R47-D49 PolarHBondContact NH2-OD2 3.26Å
48	D	26.6	Very low	26.1	Very low	149 Å²	149	129.3 Å²	129.3	80%	0.797	78%	0.776	S	S	*	*			trans	-77.1	154.9	150.6	-58	-65.6	0	0	0	109.6
49	D	26.3	Very low	26.2	Very low	124 Å²	124	132 Å²	132	66%	0.663	77%	0.771	S	S	*	*			trans	-157.2	138.3	158.1	-99.1	-48.4	0	0	0	107.4	R47	R47-D49 IonicContact CZ-OD2 2.85Å; R47-D49 IonicContact NE-OD2 2.67Å; R47-D49 PolarHBondContact NE-OD2 2.85Å; R47-D49 IonicContact NH2-OD2 2.74Å; R47-D49 PolarHBondContact NH2-OD2 3.26Å
50	S	28.1	Very low	26.4	Very low	126 Å²	126	133.2 Å²	133.2	88%	0.881	77%	0.768	S	S	*	*			trans	-147.5	137.6	-166.3	62.1	0	0	0	0	114.6
51	G	25.7	Very low	26.6	Very low	61 Å²	61	132 Å²	132	63%	0.629	76%	0.759	S	S	*	*			trans	167.1	129.6	166.2	0	0	0	0	0	111
52	T	26.8	Very low	26.8	Very low	127 Å²	127	137 Å²	137	78%	0.779	76%	0.762	S	S	*	*				72.4	120.9	54.4	65.3	0	0	0	0	113.3
53	D	28.3	Very low	26.8	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	76%	0.757	S	S	*	*			cis	-145	-170.6	-7.1	-61.3	-55.2	0	0	0	107.2
54	D	27.5	Very low	26.8	Very low	151 Å²	151	136.1 Å²	136.1	81%	0.807	76%	0.757	S	S	*	*			cis	-156.9	-166.4	6.8	-159.8	22	0	0	0	106
55	S	26.8	Very low	26.9	Very low	86 Å²	86	135.8 Å²	135.8	60%	0.601	75%	0.747	S	S	*	*			cis	-161.1	172.5	5.4	73.6	0	0	0	0	113.7
56	V	28.5	Very low	26.9	Very low	110 Å²	110	133.7 Å²	133.7	67%	0.667	75%	0.746	S	S	*	*			trans	17.9	128.8	139.8	179.9	0	0	0	0	118.4
57	D	25.8	Very low	27	Very low	145 Å²	145	133 Å²	133	78%	0.775	75%	0.749	S	S	*	*			cis	-154.4	172.8	46.3	-109.3	-43.6	0	0	0	109.9
58	T	26.5	Very low	27.1	Very low	103 Å²	103	129.7 Å²	129.7	63%	0.632	75%	0.751	S	S	*	*			cis	163.3	153.7	-30.5	-65.2	0	0	0	0	106
59	Q	27.4	Very low	27.9	Very low	161 Å²	161	127.6 Å²	127.6	75%	0.752	75%	0.746	S	S	*	*			trans	81.7	141.5	172.1	-47.5	-166.9	14.5	0	0	117.3
60	Q	28	Very low	27.9	Very low	157 Å²	157	129 Å²	129	73%	0.734	76%	0.759	S	S	*	*			cis	-154.8	177.1	-6.8	-123.6	169	15.4	0	0	114
61	Q	28.6	Very low	27.9	Very low	160 Å²	160	127 Å²	127	75%	0.748	75%	0.75	S	S	*	*			trans	-64.4	151.4	-176.9	-74.9	132.1	-33.6	0	0	114.6
62	Q	26	Very low	28	Very low	181 Å²	181	131.3 Å²	131.3	85%	0.846	76%	0.759	S	S	*	*				79.6	142.3	54.1	-128.1	-177.1	14.7	0	0	114.1
63	A	27.8	Very low	28.1	Very low	97 Å²	97	130 Å²	130	80%	0.802	75%	0.751	S	S	*	*			trans	99.5	148.2	-177	0	0	0	0	0	116.3
64	E	26.7	Very low	28.1	Very low	168 Å²	168	134.3 Å²	134.3	79%	0.785	76%	0.756	S	S	*	*			cis	-170.1	165.5	-34.9	-132.5	-177.3	-149.5	0	0	110.3
65	N	27.8	Very low	28.2	Very low	119 Å²	119	132.9 Å²	132.9	64%	0.636	76%	0.758	S	S	*	*			trans	55.4	107.8	151.4	-82.6	-55	0	0	0	123.9
66	S	25.7	Very low	28.4	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	77%	0.77	S	S	*	*				65.2	141.8	113.3	-55.3	0	0	0	0	124.1
67	A	27.4	Very low	28.9	Very low	102 Å²	102	137.7 Å²	137.7	84%	0.843	77%	0.773	S	S	*	*			trans	112.4	158.8	155.7	0	0	0	0	0	119.9
68	V	27.3	Very low	29.1	Very low	139 Å²	139	142.2 Å²	142.2	84%	0.842	78%	0.78	S	S	*	*			trans	-155.1	158.7	-161.9	162.5	0	0	0	0	106.5
69	P	42.5	Very low	29.4	Very low	105 Å²	105	144.7 Å²	144.7	68%	0.682	79%	0.789	S	S	*	*			cis	-128.4	-173.6	0.6	35.5	-16.4	0	0	0	115.1
70	T	27.7	Very low	30	Very low	153 Å²	153	142.1 Å²	142.1	94%	0.939	79%	0.786	S	S	*	*				-176.5	-177	123.9	23.5	0	0	0	0	112.2
71	A	26.8	Very low	30.3	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	79%	0.792	S	S	*	*			trans	-126.6	174.3	-155.5	0	0	0	0	0	116.4
72	D	28.2	Very low	30.4	Very low	151 Å²	151	145 Å²	145	81%	0.807	80%	0.799	S	S	*	*			trans	70	149.6	163.1	-72.7	-32.5	0	0	0	119.2
73	T	28	Very low	30.8	Very low	99 Å²	99	141.6 Å²	141.6	61%	0.607	79%	0.793	S	S	*	*			cis	-153.3	147.5	-4.4	6.7	0	0	0	0	113
74	R	29.9	Very low	31.1	Very low	238 Å²	238	142.8 Å²	142.8	90%	0.898	79%	0.792	S	S	*	*			trans	65	151.7	153.4	-63.1	166.5	-175.7	-176.4	0.8	117
75	S	28.4	Very low	31.4	Very low	121 Å²	121	146.6 Å²	146.6	85%	0.846	80%	0.799	S	S	*	*			cis	-140.9	179.1	25.4	57.6	0	0	0	0	115.8
76	Q	31	Very low	31.9	Very low	184 Å²	184	152.7 Å²	152.7	86%	0.86	81%	0.813	S	S	*	*			trans	-94.1	-175	-166.7	-89.8	178.1	-12	0	0	114.8
77	P	39.4	Very low	32.1	Very low	113 Å²	113	151.1 Å²	151.1	73%	0.734	81%	0.814	S	S	*	*			cis	-135.5	176.8	-22.7	29.7	-9.2	0	0	0	115.1
78	R	30.1	Very low	32.5	Very low	240 Å²	240	156 Å²	156	91%	0.906	81%	0.811	S	S	*	*			trans	-161.3	110.7	147.3	-114.7	-179.9	-171.9	175.4	4.2	113.8
79	D	32.2	Very low	32.7	Very low	155 Å²	155	152.1 Å²	152.1	83%	0.829	80%	0.799	S	S	*	*			trans	45.8	159.6	143.7	-69.8	-43.6	0	0	0	124.4
80	P	39.7	Very low	32.6	Very low	108 Å²	108	153.1 Å²	153.1	70%	0.701	81%	0.806	S	S	*	*			trans	-109.7	147.4	-142.3	39.2	-35.3	0	0	0	118.8
81	V	34.7	Very low	33	Very low	140 Å²	140	154.9 Å²	154.9	85%	0.848	80%	0.803	S	S	*	*			trans	49	119.3	137.3	-174.5	0	0	0	0	120
82	R	31.8	Very low	33.4	Very low	236 Å²	236	156 Å²	156	89%	0.891	79%	0.793	S	S	*	*			trans	-107	139	158.9	-166.5	177.8	-170.5	179	4.3	109.6
83	P	33.7	Very low	33.8	Very low	110 Å²	110	154.3 Å²	154.3	71%	0.714	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.8	159.2	-176.1	25.9	-34.4	0	0	0	114.2
84	P	33.8	Very low	34.2	Very low	122 Å²	122	161.3 Å²	161.3	79%	0.792	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.3	157.5	-166.2	30.6	-36.9	0	0	0	115
85	R	34.4	Very low	34.9	Very low	249 Å²	249	159.9 Å²	159.9	94%	0.94	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.5	132.8	173.3	-66.7	177.8	174.2	175.2	-3.4	110.7
86	R	36.5	Very low	35.7	Very low	247 Å²	247	162.7 Å²	162.7	93%	0.932	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.7	144.6	167.3	-71.7	-177.5	173.5	179.4	-2.3	110.1
87	G	30.4	Very low	36.3	Very low	76 Å²	76	164.1 Å²	164.1	78%	0.784	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.2	162.4	-179.6	0	0	0	0	0	113.7
88	R	35.4	Very low	37.4	Very low	205 Å²	205	163.1 Å²	163.1	77%	0.774	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.2	140.1	173	-66	-179	179.4	-137.6	2	110.5	E92	R88-E92 WeakPolarHBondContact CD-OE2 3.42Å; R88-E92 IonicContact CZ-OE2 2.85Å; R88-E92 IonicContact NE-OE2 2.8Å; R88-E92 IonicContact NH1-OE1 3.31Å; R88-E92 PolarHBondContact NH1-OE1 3.22Å; R88-E92 IonicContact NH1-OE2 3.29Å; R88-E92 PolarHBondContact NH1-OE2 3.32Å
89	G	31.2	Very low	40.1	Very low	57 Å²	57	156.3 Å²	156.3	59%	0.588	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.8	151.3	167.9	0	0	0	0	0	111.6	H91	G89-H91 PolarHBondContact O-N 3.03Å; G89-H91 VanDerWaalsContact O-N 3.14Å
90	P	40.4	Very low	43	Very low	127 Å²	127	149.6 Å²	149.6	83%	0.825	73%	0.732	S	S	*	*	S	Bend	trans	-84.4	85.5	-178.2	33.7	-33.7	0	0	0	111.3
91	H	37.2	Very low	45.6	Very low	190 Å²	190	146.1 Å²	146.1	88%	0.88	71%	0.708	S	S	*	*			trans	-174.1	37.7	153.6	-99.8	-60.5	0	0	0	114	G89 P93	G89-H91 PolarHBondContact O-N 3.03Å; G89-H91 VanDerWaalsContact O-N 3.14Å; H91-P93 WeakPolarHBondContact O-CD 3.18Å
92	E	35.1	Very low	48.5	Very low	108 Å²	108	140.2 Å²	140.2	51%	0.505	68%	0.675	S	S	.	*			trans	-72.4	123.2	160	-83	174.7	108.2	0	0	109.4	R88	R88-E92 WeakPolarHBondContact CD-OE2 3.42Å; R88-E92 IonicContact CZ-OE2 2.85Å; R88-E92 IonicContact NE-OE2 2.8Å; R88-E92 IonicContact NH1-OE1 3.31Å; R88-E92 PolarHBondContact NH1-OE1 3.22Å; R88-E92 IonicContact NH1-OE2 3.29Å; R88-E92 PolarHBondContact NH1-OE2 3.32Å
93	P	36.1	Very low	51.5	Low	115 Å²	115	129.3 Å²	129.3	75%	0.747	64%	0.635	S	S	*	*			trans	-63.3	137.9	170	26.8	-32.7	0	0	0	109.6	H91 R95	H91-P93 WeakPolarHBondContact O-CD 3.18Å; P93-R95 PolarHBondContact O-N 3.31Å
94	R	37.1	Very low	54.4	Low	247 Å²	247	124.1 Å²	124.1	93%	0.932	60%	0.601	S	S	*	*			trans	-58.2	107.5	179.9	-83.5	176.4	160.6	161	-7.1	110.2	K96	R94-K96 PolarHBondContact O-N 2.99Å
95	R	44.9	Very low	57.3	Low	207 Å²	207	121.9 Å²	121.9	78%	0.781	58%	0.582	S	S	*	*			trans	-52.6	111.2	171.7	-67.9	-174.5	-179.8	-160.7	-3.9	109.5	P93	P93-R95 PolarHBondContact O-N 3.31Å
96	K	44.3	Very low	60	Low	180 Å²	180	113.4 Å²	113.4	78%	0.783	56%	0.555	S	S	*	*			trans	-64.8	152.8	159.2	-70.2	177.3	177.1	176.2	0	107.6	R94 Q98	R94-K96 PolarHBondContact O-N 2.99Å; K96-Q98 PolarHBondContact O-N 3.41Å; K96-Q98 VanDerWaalsContact O-N 3.07Å
97	K	43.6	Very low	62.7	Low	214 Å²	214	101.6 Å²	101.6	93%	0.93	51%	0.511	S	S	*	.			trans	-63.7	108	154.2	-90.3	-169.6	168.4	-167.7	0	106.3
98	Q	62.4	Low	65.6	Low	93 Å²	93	98.6 Å²	98.6	44%	0.435	48%	0.476	S	S	.	.			trans	-78.7	133.5	169.3	-65.6	178.9	-82.6	0	0	107.7	K96 L103 D106	K96-Q98 PolarHBondContact O-N 3.41Å; K96-Q98 VanDerWaalsContact O-N 3.07Å; Q98-L103 HydrophobicContact CB-CD2 4.03Å; Q98-L103 HydrophobicContact CB-CG 4.32Å; Q98-D106 PolarHBondContact NE2-OD2 3.22Å
99	N	87.5	Confident	68.2	Low	97 Å²	97	92.7 Å²	92.7	52%	0.519	47%	0.471	S	S	.	.			trans	-84.6	165.8	164.7	56	-27.5	0	0	0	109.5	D101 G102 L103	N99-D101 WeakPolarHBondContact ND2-CB 3.19Å; N99-D101 PolarHBondContact ND2-OD1 3.43Å; N99-D101 PolarHBondContact O-N 2.91Å; N99-G102 WeakPolarHBondContact O-CA 3.25Å; N99-G102 PolarHBondContact O-N 3.17Å; N99-L103 PolarHBondContact O-N 2.95Å
100	V	92.8	Very high	70.9	Confident	13 Å²	13	92.4 Å²	92.4	8%	0.079	46%	0.458	C	S	.	.	H	α-helix	trans	-56	-35.9	-179	-168.1	0	0	0	0	111.7	G102 L103 V104 L128 M131 D140 V141 S144	V100-G102 VanDerWaalsContact C-N 3.33Å; V100-G102 PolarHBondContact O-N 2.96Å; V100-L103 PolarHBondContact O-N 2.89Å; V100-V104 WeakPolarHBondContact O-CG2 3.38Å; V100-V104 PolarHBondContact O-N 3.47Å; V100-L128 HydrophobicContact CG1-CD2 3.61Å; V100-M131 HydrophobicContact CG2-CE 3.49Å; V100-M131 VanDerWaalsContact CG2-CE 3.49Å; V100-M131 HydrophobicContact CG2-SD 4.17Å; V100-D140 HydrophobicContact CG2-CB 4.27Å; V100-V141 HydrophobicContact CG1-CB 4.44Å; V100-V141 HydrophobicContact CG1-CG2 3.92Å; V100-S144 VanDerWaalsContact C-OG 3.3Å; V100-S144 PolarHBondContact O-OG 3.28Å
101	D	95.1	Very high	73	Confident	36 Å²	36	87.2 Å²	87.2	19%	0.193	42%	0.424	C	S	.	.	H	α-helix	trans	-52.7	-47.2	171.2	-56	61	0	0	0	112.6	N99 L105 S144 R147 V148	N99-D101 WeakPolarHBondContact ND2-CB 3.19Å; N99-D101 PolarHBondContact ND2-OD1 3.43Å; N99-D101 PolarHBondContact O-N 2.91Å; D101-L105 VanDerWaalsContact O-CG 3.31Å; D101-L105 WeakPolarHBondContact O-CG 2.99Å; D101-L105 PolarHBondContact O-N 2.81Å; D101-L105 VanDerWaalsContact O-N 3.12Å; D101-S144 VanDerWaalsContact CA-OG 3.28Å; D101-S144 WeakPolarHBondContact CA-OG 3.28Å; D101-S144 PolarHBondContact N-OG 3.48Å; D101-R147 VanDerWaalsContact CG-NH2 3.27Å; D101-R147 IonicContact OD1-CZ 3.61Å; D101-R147 IonicContact OD1-NE 3.75Å; D101-R147 IonicContact OD1-NH2 2.73Å; D101-R147 PolarHBondContact OD1-NH2 2.87Å; D101-R147 IonicContact OD2-CZ 2.71Å; D101-R147 IonicContact OD2-NE 3.39Å; D101-R147 PolarHBondContact OD2-NE 3.04Å; D101-R147 IonicContact OD2-NH2 2.62Å; D101-R147 PolarHBondContact OD2-NH2 3.22Å; D101-R147 VanDerWaalsContact OD2-NH2 3.1Å; D101-V148 HydrophobicContact CB-CG1 3.69Å; D101-V148 VanDerWaalsContact OD2-CG1 3.25Å; D101-V148 WeakPolarHBondContact OD2-CG1 3.34Å
102	G	94.3	Very high	75.1	Confident	16 Å²	16	82.2 Å²	82.2	17%	0.165	40%	0.397	C	S	.	.	H	α-helix	trans	-67.9	-39.1	178.5	0	0	0	0	0	112.3	N99 V100 L105 D106	N99-G102 WeakPolarHBondContact O-CA 3.25Å; N99-G102 PolarHBondContact O-N 3.17Å; V100-G102 VanDerWaalsContact C-N 3.33Å; V100-G102 PolarHBondContact O-N 2.96Å; G102-L105 PolarHBondContact O-N 3.02Å; G102-D106 WeakPolarHBondContact O-CB 3.19Å; G102-D106 VanDerWaalsContact O-CG 3.23Å; G102-D106 PolarHBondContact O-N 3.47Å
103	L	94.5	Very high	77.2	Confident	7 Å²	7	81.5 Å²	81.5	4%	0.037	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-40.3	178.1	-60.3	174.9	0	0	0	111.9	Q98 N99 V100 D106 T107 S124 T127 L128 M131	Q98-L103 HydrophobicContact CB-CD2 4.03Å; Q98-L103 HydrophobicContact CB-CG 4.32Å; N99-L103 PolarHBondContact O-N 2.95Å; V100-L103 PolarHBondContact O-N 2.89Å; L103-D106 PolarHBondContact O-N 2.82Å; L103-T107 PolarHBondContact O-N 2.99Å; L103-T107 PolarHBondContact O-OG1 3.21Å; L103-T107 VanDerWaalsContact O-OG1 3.05Å; L103-S124 WeakPolarHBondContact O-CB 3.42Å; L103-T127 HydrophobicContact CD1-CG2 3.68Å; L103-L128 HydrophobicContact CB-CD1 4.08Å; L103-L128 HydrophobicContact CB-CD2 3.89Å; L103-L128 HydrophobicContact CB-CG 3.84Å; L103-L128 HydrophobicContact CD1-CD2 4.37Å; L103-L128 HydrophobicContact CD1-CG 4.45Å; L103-M131 HydrophobicContact CD1-SD 4.34Å
104	V	94.9	Very high	79.2	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.2	-42.8	175.6	169.2	0	0	0	0	111.1	V100 T107 L108 L128 S144 L145 V148 I149	V100-V104 WeakPolarHBondContact O-CG2 3.38Å; V100-V104 PolarHBondContact O-N 3.47Å; V104-T107 PolarHBondContact O-N 3.48Å; V104-L108 PolarHBondContact O-N 3.46Å; V104-L128 HydrophobicContact CG2-CD1 4.02Å; V104-L128 HydrophobicContact CG2-CD2 3.95Å; V104-S144 WeakPolarHBondContact CG2-OG 3.36Å; V104-L145 HydrophobicContact CG1-CD2 3.92Å; V104-L145 HydrophobicContact CG2-CD2 4.1Å; V104-V148 HydrophobicContact CB-CG2 3.89Å; V104-V148 HydrophobicContact CG1-CG2 3.51Å; V104-I149 HydrophobicContact CG1-CD1 3.86Å; V104-I149 HydrophobicContact CG1-CG1 3.7Å
105	L	94.7	Very high	80.7	Confident	76 Å²	76	67.8 Å²	67.8	40%	0.398	34%	0.34	S	S	.	.	H	α-helix	trans	-69	-37.7	177.1	-69.7	172.3	0	0	0	112.8	D101 G102 L108 A109 V148	D101-L105 VanDerWaalsContact O-CG 3.31Å; D101-L105 WeakPolarHBondContact O-CG 2.99Å; D101-L105 PolarHBondContact O-N 2.81Å; D101-L105 VanDerWaalsContact O-N 3.12Å; G102-L105 PolarHBondContact O-N 3.02Å; L105-L108 PolarHBondContact O-N 3.42Å; L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3.3Å; L105-V148 HydrophobicContact CD1-CB 4.37Å; L105-V148 HydrophobicContact CD2-CB 4.32Å; L105-V148 HydrophobicContact CD2-CG2 4.09Å; L105-V148 HydrophobicContact CG-CB 4.22Å; L105-V148 HydrophobicContact CG-CG2 3.92Å
106	D	92.5	Very high	81.6	Confident	70 Å²	70	61.2 Å²	61.2	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-44.6	173.3	-77.8	-5	0	0	0	110.9	Q98 G102 L103 A109 V110	Q98-D106 PolarHBondContact NE2-OD2 3.22Å; G102-D106 WeakPolarHBondContact O-CB 3.19Å; G102-D106 VanDerWaalsContact O-CG 3.23Å; G102-D106 PolarHBondContact O-N 3.47Å; L103-D106 PolarHBondContact O-N 2.82Å; D106-A109 PolarHBondContact O-N 3.37Å; D106-V110 WeakPolarHBondContact O-CG2 3.42Å; D106-V110 PolarHBondContact O-N 2.86Å
107	T	91.8	Very high	82.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-45.8	174.8	-62	0	0	0	0	111.4	L103 V104 A109 V110 I111 S124 M125 V159 L163	L103-T107 PolarHBondContact O-N 2.99Å; L103-T107 PolarHBondContact O-OG1 3.21Å; L103-T107 VanDerWaalsContact O-OG1 3.05Å; V104-T107 PolarHBondContact O-N 3.48Å; T107-A109 VanDerWaalsContact C-N 3.31Å; T107-A109 PolarHBondContact O-N 3.05Å; T107-V110 WeakPolarHBondContact O-CG2 3.39Å; T107-V110 PolarHBondContact O-N 2.88Å; T107-I111 WeakPolarHBondContact O-CB 3.32Å; T107-I111 PolarHBondContact O-N 3.04Å; T107-S124 PolarHBondContact N-OG 3.4Å; T107-S124 VanDerWaalsContact OG1-CB 3.3Å; T107-S124 WeakPolarHBondContact OG1-CB 3.39Å; T107-S124 PolarHBondContact OG1-OG 2.79Å; T107-M125 HydrophobicContact CG2-CB 4.39Å; T107-M125 PolarHBondContact OG1-N 3.23Å; T107-V159 HydrophobicContact CG2-CG1 4.39Å; T107-L163 HydrophobicContact CG2-CD1 4.19Å; T107-L163 HydrophobicContact CG2-CD2 4.32Å; T107-L163 HydrophobicContact CG2-CG 4.43Å
108	L	91.8	Very high	83.3	Confident	12 Å²	12	56.5 Å²	56.5	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-38.9	176.4	-178.6	61.2	0	0	0	112.2	V104 L105 V110 I111 I149 P150 D153 V159	V104-L108 PolarHBondContact O-N 3.46Å; L105-L108 PolarHBondContact O-N 3.42Å; L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 PolarHBondContact O-N 2.89Å; L108-I111 HydrophobicContact CD1-CG2 4.42Å; L108-I111 WeakPolarHBondContact O-CG2 3.32Å; L108-I149 HydrophobicContact CD2-CG2 4.4Å; L108-P150 HydrophobicContact CD2-CG 4.21Å; L108-D153 HydrophobicContact CD2-CB 4.31Å; L108-V159 HydrophobicContact CD1-CB 4.22Å; L108-V159 HydrophobicContact CD1-CG2 3.72Å
109	A	89.6	Confident	83.8	Confident	81 Å²	81	55.5 Å²	55.5	67%	0.669	31%	0.309	S	S	*	.	H	α-helix	trans	-66.2	-31.1	178.8	0	0	0	0	0	113.2	L105 D106 T107	L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3.3Å; D106-A109 PolarHBondContact O-N 3.37Å; T107-A109 VanDerWaalsContact C-N 3.31Å; T107-A109 PolarHBondContact O-N 3.05Å
110	V	88.3	Confident	83.3	Confident	52 Å²	52	59.5 Å²	59.5	32%	0.315	32%	0.324	S	S	.	.	H	α-helix	trans	-96.1	-14.9	179.9	-56.4	0	0	0	0	114.1	D106 T107 L108 R112 T113 P122	D106-V110 WeakPolarHBondContact O-CG2 3.42Å; D106-V110 PolarHBondContact O-N 2.86Å; T107-V110 WeakPolarHBondContact O-CG2 3.39Å; T107-V110 PolarHBondContact O-N 2.88Å; L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 PolarHBondContact O-N 2.89Å; V110-R112 VanDerWaalsContact C-N 3.28Å; V110-R112 PolarHBondContact O-N 3.05Å; V110-R112 VanDerWaalsContact O-N 3.14Å; V110-T113 WeakPolarHBondContact O-CA 3.39Å; V110-T113 WeakPolarHBondContact O-CB 3.41Å; V110-T113 PolarHBondContact O-N 2.93Å; V110-T113 PolarHBondContact O-OG1 3.44Å; V110-P122 HydrophobicContact CG2-CB 3.83Å; V110-P122 HydrophobicContact CG2-CG 3.54Å
111	I	84.5	Confident	82.9	Confident	18 Å²	18	62.1 Å²	62.1	9%	0.092	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-36.1	-170.8	-157.7	75.7	0	0	0	113.9	T107 L108 T113 L114 L155 V159 L162	T107-I111 WeakPolarHBondContact O-CB 3.32Å; T107-I111 PolarHBondContact O-N 3.04Å; L108-I111 HydrophobicContact CD1-CG2 4.42Å; L108-I111 WeakPolarHBondContact O-CG2 3.32Å; I111-T113 PolarHBondContact O-N 3.29Å; I111-T113 VanDerWaalsContact O-N 3.15Å; I111-L114 HydrophobicContact CD1-CD1 3.81Å; I111-L114 PolarHBondContact O-N 3.04Å; I111-L114 VanDerWaalsContact O-N 3.1Å; I111-L155 HydrophobicContact CG2-CB 3.94Å; I111-L155 HydrophobicContact CG2-CD1 3.74Å; I111-L155 HydrophobicContact CG2-CG 4.5Å; I111-V159 HydrophobicContact CB-CG2 3.94Å; I111-V159 HydrophobicContact CD1-CG2 4.29Å; I111-V159 HydrophobicContact CG1-CG2 3.83Å; I111-V159 HydrophobicContact CG2-CG2 3.78Å; I111-L162 HydrophobicContact CD1-CD2 3.42Å; I111-L162 VanDerWaalsContact CD1-CD2 3.42Å
112	R	81.8	Confident	82.5	Confident	85 Å²	85	61.3 Å²	61.3	32%	0.321	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20	175.6	-175.7	178.1	-84.3	110.5	-0.6	112.9	V110 L155 C404 R405	V110-R112 VanDerWaalsContact C-N 3.28Å; V110-R112 PolarHBondContact O-N 3.05Å; V110-R112 VanDerWaalsContact O-N 3.14Å; R112-L155 HydrophobicContact CB-CD1 3.89Å; R112-L155 HydrophobicContact CG-CD1 4.47Å; R112-C404 VanDerWaalsContact CD-O 3.31Å; R112-C404 WeakPolarHBondContact CD-O 3.39Å; R112-C404 PolarHBondContact NE-O 3.38Å; R112-C404 VanDerWaalsContact NE-O 3.12Å; R112-R405 HydrophobicContact CG-CG 4.1Å; R112-R405 WeakPolarHBondContact O-CD 3.34Å; R112-R405 WeakPolarHBondContact O-CG 3.49Å
113	T	79.2	Confident	82.3	Confident	92 Å²	92	67 Å²	67	56%	0.564	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-6.2	178.1	63.3	0	0	0	0	114	V110 I111 V115 Q119	V110-T113 WeakPolarHBondContact O-CA 3.39Å; V110-T113 WeakPolarHBondContact O-CB 3.41Å; V110-T113 PolarHBondContact O-N 2.93Å; V110-T113 PolarHBondContact O-OG1 3.44Å; I111-T113 PolarHBondContact O-N 3.29Å; I111-T113 VanDerWaalsContact O-N 3.15Å; T113-V115 WeakPolarHBondContact O-CG2 3.44Å; T113-V115 PolarHBondContact O-N 3Å; T113-Q119 PolarHBondContact O-OE1 2.93Å
114	L	76.8	Confident	82.2	Confident	48 Å²	48	67 Å²	67	25%	0.251	36%	0.357	S	S	.	.			trans	-75.3	117.4	168	-59.5	-172.3	0	0	0	108.9	I111 P122 R405	I111-L114 HydrophobicContact CD1-CD1 3.81Å; I111-L114 PolarHBondContact O-N 3.04Å; I111-L114 VanDerWaalsContact O-N 3.1Å; L114-P122 HydrophobicContact CD1-CG 4.01Å; L114-P122 HydrophobicContact CD2-CG 4.01Å; L114-P122 HydrophobicContact CG-CG 4.41Å; L114-R405 PolarHBondContact O-NH1 3.24Å
115	V	70.6	Confident	82	Confident	27 Å²	27	67.7 Å²	67.7	16%	0.164	36%	0.36	C	S	.	.			trans	-129.1	-58.7	-165.7	169	0	0	0	0	109.8	T113 L407 W409 S414	T113-V115 WeakPolarHBondContact O-CG2 3.44Å; T113-V115 PolarHBondContact O-N 3Å; V115-L407 HydrophobicContact CG1-CD1 4.04Å; V115-L407 HydrophobicContact CG2-CD1 3.91Å; V115-W409 HydrophobicContact CB-CH2 4.38Å; V115-W409 HydrophobicContact CG1-CH2 3.42Å; V115-W409 VanDerWaalsContact CG1-CH2 3.42Å; V115-W409 HydrophobicContact CG1-CZ2 3.8Å; V115-W409 HydrophobicContact CG1-CZ3 4.37Å; V115-W409 WeakPolarHBondContact O-CH2 3.06Å; V115-S414 VanDerWaalsContact CG1-OG 3.27Å; V115-S414 WeakPolarHBondContact CG1-OG 3.47Å
116	D	63.3	Low	81.8	Confident	68 Å²	68	67.1 Å²	67.1	36%	0.364	36%	0.357	S	S	.	.			trans	-100	139.8	-178.3	-30.7	-71.2	0	0	0	111.4	D118 Q119	D116-D118 PolarHBondContact O-N 3.08Å; D116-D118 VanDerWaalsContact O-N 3.11Å; D116-Q119 HydrophobicContact CB-CG 4.11Å; D116-Q119 WeakPolarHBondContact O-CB 3.22Å; D116-Q119 WeakPolarHBondContact O-CG 3.3Å; D116-Q119 PolarHBondContact O-N 3.24Å; D116-Q119 PolarHBondContact OD2-NE2 3.29Å
117	N	60.8	Low	81.9	Confident	130 Å²	130	64.7 Å²	64.7	70%	0.695	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-14	176.6	-71.6	-12.1	0	0	0	113.9	E388	N117-E388 PolarHBondContact ND2-O 2.59Å
118	D	61.8	Low	81.9	Confident	165 Å²	165	64.7 Å²	64.7	88%	0.882	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.3	174.4	-74.9	-39.8	0	0	0	113.6	D116	D116-D118 PolarHBondContact O-N 3.08Å; D116-D118 VanDerWaalsContact O-N 3.11Å
119	Q	72.4	Confident	82	Confident	72 Å²	72	65.9 Å²	65.9	34%	0.336	35%	0.35	S	S	.	.	S	Bend	trans	-75.2	134.9	179.7	-65.2	177.8	7	0	0	111.4	T113 D116	T113-Q119 PolarHBondContact O-OE1 2.93Å; D116-Q119 HydrophobicContact CB-CG 4.11Å; D116-Q119 WeakPolarHBondContact O-CB 3.22Å; D116-Q119 WeakPolarHBondContact O-CG 3.3Å; D116-Q119 PolarHBondContact O-N 3.24Å; D116-Q119 PolarHBondContact OD2-NE2 3.29Å
120	E	78.4	Confident	82.1	Confident	181 Å²	181	67.8 Å²	67.8	85%	0.846	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-62	131.3	172.1	-68.5	-172.3	157.5	0	0	110.1
121	P	83.5	Confident	82.4	Confident	68 Å²	68	68.4 Å²	68.4	44%	0.442	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-63.1	149.3	-177.2	22.5	-31.5	0	0	0	111.6	M125 I126	P121-M125 HydrophobicContact CB-SD 4.38Å; P121-I126 HydrophobicContact CB-CG1 4.33Å; P121-I126 HydrophobicContact CG-CD1 4.15Å; P121-I126 HydrophobicContact CG-CG1 3.94Å; P121-I126 VanDerWaalsContact O-CD1 3.31Å; P121-I126 WeakPolarHBondContact O-CD1 3.34Å
122	P	87.5	Confident	82.8	Confident	20 Å²	20	67.7 Å²	67.7	13%	0.13	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-55	142.6	-177.1	-27.7	35.1	0	0	0	113.2	V110 L114 S124 M125 I126	V110-P122 HydrophobicContact CG2-CB 3.83Å; V110-P122 HydrophobicContact CG2-CG 3.54Å; L114-P122 HydrophobicContact CD1-CG 4.01Å; L114-P122 HydrophobicContact CD2-CG 4.01Å; L114-P122 HydrophobicContact CG-CG 4.41Å; P122-S124 PolarHBondContact O-N 3.32Å; P122-S124 VanDerWaalsContact O-N 3.09Å; P122-M125 HydrophobicContact CB-CB 4.2Å; P122-M125 HydrophobicContact CG-CB 4.49Å; P122-M125 WeakPolarHBondContact O-CA 3.29Å; P122-M125 WeakPolarHBondContact O-CB 3.41Å; P122-M125 PolarHBondContact O-N 3.28Å; P122-I126 PolarHBondContact O-N 2.96Å
123	Y	90.1	Very high	83.4	Confident	135 Å²	135	70.9 Å²	70.9	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-53.4	-34.7	176.6	173.5	-111.9	0	0	0	112.9	T127	Y123-T127 WeakPolarHBondContact CE2-OG1 3.42Å; Y123-T127 VanDerWaalsContact CZ-OG1 3.22Å; Y123-T127 WeakPolarHBondContact O-CB 3.48Å; Y123-T127 PolarHBondContact O-N 2.86Å; Y123-T127 PolarHBondContact O-OG1 3.44Å
124	S	91.8	Very high	84.1	Confident	8 Å²	8	70.5 Å²	70.5	6%	0.056	36%	0.358	C	S	.	.	H	α-helix	trans	-64.7	-42.9	174.5	54.6	0	0	0	0	112.5	L103 T107 P122 T127 L128	L103-S124 WeakPolarHBondContact O-CB 3.42Å; T107-S124 PolarHBondContact N-OG 3.4Å; T107-S124 VanDerWaalsContact OG1-CB 3.3Å; T107-S124 WeakPolarHBondContact OG1-CB 3.39Å; T107-S124 PolarHBondContact OG1-OG 2.79Å; P122-S124 PolarHBondContact O-N 3.32Å; P122-S124 VanDerWaalsContact O-N 3.09Å; S124-T127 PolarHBondContact O-N 3.45Å; S124-L128 WeakPolarHBondContact O-CB 3.21Å; S124-L128 WeakPolarHBondContact O-CD1 3.44Å; S124-L128 WeakPolarHBondContact O-CG 3.38Å; S124-L128 PolarHBondContact O-N 2.9Å
125	M	90.8	Very high	85	Confident	13 Å²	13	70.6 Å²	70.6	6%	0.064	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-47.8	176.6	-175.8	168	177	0	0	111.1	T107 P121 P122 T127 L128 H129 L162 L163 E166	T107-M125 HydrophobicContact CG2-CB 4.39Å; T107-M125 PolarHBondContact OG1-N 3.23Å; P121-M125 HydrophobicContact CB-SD 4.38Å; P122-M125 HydrophobicContact CB-CB 4.2Å; P122-M125 HydrophobicContact CG-CB 4.49Å; P122-M125 WeakPolarHBondContact O-CA 3.29Å; P122-M125 WeakPolarHBondContact O-CB 3.41Å; P122-M125 PolarHBondContact O-N 3.28Å; M125-T127 VanDerWaalsContact C-N 3.35Å; M125-T127 PolarHBondContact O-N 3.14Å; M125-L128 PolarHBondContact O-N 3.33Å; M125-H129 WeakPolarHBondContact CG-NE2 3.43Å; M125-H129 PolarHBondContact O-CD2 2.92Å; M125-H129 VanDerWaalsContact O-CG 3.28Å; M125-H129 PolarHBondContact O-N 2.91Å; M125-L162 HydrophobicContact CE-CD1 4.09Å; M125-L162 HydrophobicContact CE-CD2 3.91Å; M125-L162 HydrophobicContact CE-CG 3.79Å; M125-L162 HydrophobicContact SD-CD2 4.3Å; M125-L163 HydrophobicContact CB-CD2 4.46Å; M125-L163 HydrophobicContact CG-CD2 3.93Å; M125-E166 HydrophobicContact CE-CG 4.11Å
126	I	91.1	Very high	86.1	Confident	65 Å²	65	74.8 Å²	74.8	33%	0.333	38%	0.376	S	S	.	.	H	α-helix	trans	-55.5	-49.7	174.2	-61.9	168.6	0	0	0	110.7	P121 P122 L128 H129 E130	P121-I126 HydrophobicContact CB-CG1 4.33Å; P121-I126 HydrophobicContact CG-CD1 4.15Å; P121-I126 HydrophobicContact CG-CG1 3.94Å; P121-I126 VanDerWaalsContact O-CD1 3.31Å; P121-I126 WeakPolarHBondContact O-CD1 3.34Å; P122-I126 PolarHBondContact O-N 2.96Å; I126-L128 VanDerWaalsContact C-N 3.32Å; I126-L128 PolarHBondContact O-N 2.96Å; I126-H129 PolarHBondContact O-N 3.2Å; I126-H129 VanDerWaalsContact O-N 3.16Å; I126-E130 HydrophobicContact CG2-CG 4.4Å; I126-E130 WeakPolarHBondContact O-CG 3.24Å; I126-E130 PolarHBondContact O-N 2.97Å
127	T	93.1	Very high	87.6	Confident	18 Å²	18	71.9 Å²	71.9	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-64.1	-36.3	-178.8	-52.9	0	0	0	0	111.9	L103 Y123 S124 M125 M131	L103-T127 HydrophobicContact CD1-CG2 3.68Å; Y123-T127 WeakPolarHBondContact CE2-OG1 3.42Å; Y123-T127 VanDerWaalsContact CZ-OG1 3.22Å; Y123-T127 WeakPolarHBondContact O-CB 3.48Å; Y123-T127 PolarHBondContact O-N 2.86Å; Y123-T127 PolarHBondContact O-OG1 3.44Å; S124-T127 PolarHBondContact O-N 3.45Å; M125-T127 VanDerWaalsContact C-N 3.35Å; M125-T127 PolarHBondContact O-N 3.14Å; T127-M131 VanDerWaalsContact O-CG 3.3Å; T127-M131 WeakPolarHBondContact O-CG 3.4Å; T127-M131 PolarHBondContact O-N 3.44Å
128	L	93.8	Very high	89.3	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-40	174.8	-73.8	163.8	0	0	0	111.8	V100 L103 V104 S124 M125 I126 M131 A132 V141 L163	V100-L128 HydrophobicContact CG1-CD2 3.61Å; L103-L128 HydrophobicContact CB-CD1 4.08Å; L103-L128 HydrophobicContact CB-CD2 3.89Å; L103-L128 HydrophobicContact CB-CG 3.84Å; L103-L128 HydrophobicContact CD1-CD2 4.37Å; L103-L128 HydrophobicContact CD1-CG 4.45Å; V104-L128 HydrophobicContact CG2-CD1 4.02Å; V104-L128 HydrophobicContact CG2-CD2 3.95Å; S124-L128 WeakPolarHBondContact O-CB 3.21Å; S124-L128 WeakPolarHBondContact O-CD1 3.44Å; S124-L128 WeakPolarHBondContact O-CG 3.38Å; S124-L128 PolarHBondContact O-N 2.9Å; M125-L128 PolarHBondContact O-N 3.33Å; I126-L128 VanDerWaalsContact C-N 3.32Å; I126-L128 PolarHBondContact O-N 2.96Å; L128-M131 PolarHBondContact O-N 2.64Å; L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.41Å; L128-V141 HydrophobicContact CD2-CG1 4.47Å; L128-V141 HydrophobicContact CD2-CG2 3.87Å; L128-L163 HydrophobicContact CB-CD2 4.33Å; L128-L163 HydrophobicContact CD1-CD1 3.92Å; L128-L163 HydrophobicContact CD1-CD2 3.83Å
129	H	92.4	Very high	91	Very high	38 Å²	38	58.3 Å²	58.3	18%	0.176	29%	0.29	C	S	.	.	H	α-helix	trans	-69.4	-43.3	177.9	-59.7	-178.9	0	0	0	111.3	M125 I126 M131 A132 E133 E166	M125-H129 WeakPolarHBondContact CG-NE2 3.43Å; M125-H129 PolarHBondContact O-CD2 2.92Å; M125-H129 VanDerWaalsContact O-CG 3.28Å; M125-H129 PolarHBondContact O-N 2.91Å; I126-H129 PolarHBondContact O-N 3.2Å; I126-H129 VanDerWaalsContact O-N 3.16Å; H129-M131 VanDerWaalsContact C-N 3.26Å; H129-M131 PolarHBondContact O-N 2.94Å; H129-A132 PolarHBondContact O-N 3.07Å; H129-E133 PolarHBondContact O-N 3.02Å; H129-E166 WeakPolarHBondContact CE1-CB 3.27Å
130	E	92.9	Very high	92.1	Very high	121 Å²	121	58.8 Å²	58.8	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-57.1	-37.4	172.7	-72.4	178.5	171.3	0	0	112	I126	I126-E130 HydrophobicContact CG2-CG 4.4Å; I126-E130 WeakPolarHBondContact O-CG 3.24Å; I126-E130 PolarHBondContact O-N 2.97Å
131	M	93.2	Very high	92.9	Very high	64 Å²	64	50.2 Å²	50.2	32%	0.315	25%	0.254	S	S	.	.	H	α-helix	trans	-71.1	-35.6	174.7	-72.4	-175.1	65.2	0	0	112.8	V100 L103 T127 L128 H129 E133 T134 G137	V100-M131 HydrophobicContact CG2-CE 3.49Å; V100-M131 VanDerWaalsContact CG2-CE 3.49Å; V100-M131 HydrophobicContact CG2-SD 4.17Å; L103-M131 HydrophobicContact CD1-SD 4.34Å; T127-M131 VanDerWaalsContact O-CG 3.3Å; T127-M131 WeakPolarHBondContact O-CG 3.4Å; T127-M131 PolarHBondContact O-N 3.44Å; L128-M131 PolarHBondContact O-N 2.64Å; H129-M131 VanDerWaalsContact C-N 3.26Å; H129-M131 PolarHBondContact O-N 2.94Å; M131-E133 PolarHBondContact O-N 3.22Å; M131-T134 PolarHBondContact O-OG1 3.19Å; M131-G137 CarbonylContact O-C 3.56Å; M131-G137 WeakPolarHBondContact O-CA 3.41Å
132	A	94.6	Very high	93.6	Very high	3 Å²	3	47 Å²	47	3%	0.025	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-1.5	-179.5	0	0	0	0	0	114.6	L128 H129 T134 W138 C167	L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.41Å; H129-A132 PolarHBondContact O-N 3.07Å; A132-T134 PolarHBondContact O-N 2.95Å; A132-W138 HydrophobicContact CB-CB 4.49Å; A132-C167 HydrophobicContact CB-CB 4.32Å; A132-C167 WeakPolarHBondContact CB-SG 3.37Å
133	E	93.6	Very high	94	Very high	153 Å²	153	48.7 Å²	48.7	72%	0.715	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-8	168.7	-63.7	-166.9	163.1	0	0	113.7	H129 M131	H129-E133 PolarHBondContact O-N 3.02Å; M131-E133 PolarHBondContact O-N 3.22Å
134	T	94.7	Very high	94.3	Very high	83 Å²	83	42.2 Å²	42.2	51%	0.509	21%	0.214	S	C	.	.	S	Bend	trans	-126.3	143.7	179	65.5	0	0	0	0	111.5	M131 A132 E136 G137 W138	M131-T134 PolarHBondContact O-OG1 3.19Å; A132-T134 PolarHBondContact O-N 2.95Å; T134-E136 VanDerWaalsContact C-N 3.31Å; T134-E136 PolarHBondContact O-N 3.17Å; T134-G137 PolarHBondContact O-N 3.27Å; T134-G137 VanDerWaalsContact O-N 3.11Å; T134-G137 PolarHBondContact OG1-N 3.09Å; T134-W138 WeakPolarHBondContact O-CB 3.37Å; T134-W138 PolarHBondContact O-N 3.49Å
135	D	94.3	Very high	94.6	Very high	51 Å²	51	41.9 Å²	41.9	27%	0.273	21%	0.212	S	C	.	.	H	α-helix	trans	-53.9	-42.9	-179.1	-76.5	-8.8	0	0	0	113.4	L139 T171 A174	D135-L139 WeakPolarHBondContact O-CB 3.39Å; D135-L139 VanDerWaalsContact O-CG 3.23Å; D135-L139 WeakPolarHBondContact O-CG 3.22Å; D135-L139 PolarHBondContact O-N 3.24Å; D135-T171 VanDerWaalsContact OD1-CG2 3.27Å; D135-T171 WeakPolarHBondContact OD1-CG2 3.45Å; D135-T171 PolarHBondContact OD1-OG1 2.96Å; D135-T171 WeakPolarHBondContact OD2-CG2 3.44Å; D135-T171 PolarHBondContact OD2-OG1 2.7Å; D135-A174 HydrophobicContact CB-CB 4.03Å
136	E	94.6	Very high	94.9	Very high	114 Å²	114	41.8 Å²	41.8	53%	0.533	21%	0.211	S	C	.	.	H	α-helix	trans	-69	-42	178.3	-56.7	-60.8	139.8	0	0	111.8	T134 L139 D140 K177	T134-E136 VanDerWaalsContact C-N 3.31Å; T134-E136 PolarHBondContact O-N 3.17Å; E136-L139 PolarHBondContact O-N 2.67Å; E136-D140 PolarHBondContact O-N 3.32Å; E136-K177 IonicContact OE1-NZ 2.75Å; E136-K177 PolarHBondContact OE1-NZ 3.29Å
137	G	94.9	Very high	95.1	Very high	8 Å²	8	44.9 Å²	44.9	8%	0.082	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-35	177.2	0	0	0	0	0	112.8	M131 T134 D140 V141	M131-G137 CarbonylContact O-C 3.56Å; M131-G137 WeakPolarHBondContact O-CA 3.41Å; T134-G137 PolarHBondContact O-N 3.27Å; T134-G137 VanDerWaalsContact O-N 3.11Å; T134-G137 PolarHBondContact OG1-N 3.09Å; G137-D140 PolarHBondContact O-N 2.88Å; G137-V141 WeakPolarHBondContact O-CG2 3.41Å; G137-V141 PolarHBondContact O-N 3.21Å
138	W	96.2	Very high	95.2	Very high	7 Å²	7	45.3 Å²	45.3	3%	0.027	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-44.6	170.9	-176.7	96.1	0	0	0	111.3	A132 T134 D140 V141 V142 P170 A174 L175 L178 L209	A132-W138 HydrophobicContact CB-CB 4.49Å; T134-W138 WeakPolarHBondContact O-CB 3.37Å; T134-W138 PolarHBondContact O-N 3.49Å; W138-D140 VanDerWaalsContact C-N 3.33Å; W138-D140 PolarHBondContact O-N 2.95Å; W138-V141 PolarHBondContact O-N 3.04Å; W138-V142 HydrophobicContact CD2-CG2 3.92Å; W138-V142 HydrophobicContact CE3-CG2 3.99Å; W138-V142 HydrophobicContact CH2-CG2 3.87Å; W138-V142 HydrophobicContact CZ2-CG2 3.79Å; W138-V142 HydrophobicContact CZ3-CG2 3.98Å; W138-V142 WeakPolarHBondContact O-CG2 3.41Å; W138-V142 PolarHBondContact O-N 3.09Å; W138-P170 HydrophobicContact CD2-CB 4.03Å; W138-P170 HydrophobicContact CE3-CB 4.09Å; W138-P170 HydrophobicContact CH2-CB 3.64Å; W138-P170 HydrophobicContact CH2-CG 3.7Å; W138-P170 HydrophobicContact CZ2-CB 3.54Å; W138-P170 HydrophobicContact CZ2-CG 3.44Å; W138-P170 VanDerWaalsContact CZ2-CG 3.44Å; W138-P170 HydrophobicContact CZ3-CB 3.91Å; W138-P170 HydrophobicContact CZ3-CG 4.45Å; W138-A174 HydrophobicContact CE3-CB 4.27Å; W138-A174 HydrophobicContact CZ3-CB 4.4Å; W138-L175 HydrophobicContact CH2-CD2 4.25Å; W138-L178 HydrophobicContact CH2-CD2 3.78Å; W138-L178 HydrophobicContact CZ3-CB 4.39Å; W138-L178 HydrophobicContact CZ3-CD2 3.94Å; W138-L209 HydrophobicContact CH2-CD1 4.2Å; W138-L209 HydrophobicContact CH2-CD2 4.14Å; W138-L209 HydrophobicContact CZ2-CD2 3.72Å
139	L	96.5	Very high	95.3	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-39.2	173.6	-75.3	168.3	0	0	0	112.2	D135 E136 Q143 K177 L178 I181	D135-L139 WeakPolarHBondContact O-CB 3.39Å; D135-L139 VanDerWaalsContact O-CG 3.23Å; D135-L139 WeakPolarHBondContact O-CG 3.22Å; D135-L139 PolarHBondContact O-N 3.24Å; E136-L139 PolarHBondContact O-N 2.67Å; L139-Q143 WeakPolarHBondContact O-CB 3.31Å; L139-Q143 WeakPolarHBondContact O-CG 3.31Å; L139-Q143 PolarHBondContact O-N 3.47Å; L139-Q143 PolarHBondContact O-NE2 2.62Å; L139-K177 HydrophobicContact CD1-CB 3.75Å; L139-K177 HydrophobicContact CD1-CD 3.72Å; L139-K177 HydrophobicContact CD1-CG 4.41Å; L139-K177 HydrophobicContact CD2-CB 4.37Å; L139-L178 HydrophobicContact CD2-CB 3.72Å; L139-L178 HydrophobicContact CD2-CD1 4.18Å; L139-I181 HydrophobicContact CD1-CD1 4.46Å; L139-I181 HydrophobicContact CD2-CD1 4.28Å
140	D	95.8	Very high	95.4	Very high	82 Å²	82	46.2 Å²	46.2	44%	0.439	23%	0.231	S	C	.	.	H	α-helix	trans	-64.7	-42	174.1	-93.8	-12	0	0	0	112.2	V100 E136 G137 W138 S144	V100-D140 HydrophobicContact CG2-CB 4.27Å; E136-D140 PolarHBondContact O-N 3.32Å; G137-D140 PolarHBondContact O-N 2.88Å; W138-D140 VanDerWaalsContact C-N 3.33Å; W138-D140 PolarHBondContact O-N 2.95Å; D140-S144 VanDerWaalsContact O-CB 3.29Å; D140-S144 WeakPolarHBondContact O-CB 3.42Å; D140-S144 PolarHBondContact O-N 3.39Å
141	V	96.1	Very high	95.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-50.3	174.6	171.6	0	0	0	0	110.9	V100 L128 G137 W138 Q143 S144 L145	V100-V141 HydrophobicContact CG1-CB 4.44Å; V100-V141 HydrophobicContact CG1-CG2 3.92Å; L128-V141 HydrophobicContact CD2-CG1 4.47Å; L128-V141 HydrophobicContact CD2-CG2 3.87Å; G137-V141 WeakPolarHBondContact O-CG2 3.41Å; G137-V141 PolarHBondContact O-N 3.21Å; W138-V141 PolarHBondContact O-N 3.04Å; V141-Q143 PolarHBondContact O-N 3.34Å; V141-S144 WeakPolarHBondContact O-CB 3.42Å; V141-S144 PolarHBondContact O-N 3.13Å; V141-S144 VanDerWaalsContact O-N 3.14Å; V141-L145 HydrophobicContact CG1-CD1 4.21Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 WeakPolarHBondContact O-CG 3.29Å; V141-L145 PolarHBondContact O-N 3.05Å
142	V	96.8	Very high	95.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-45	178.8	173.7	0	0	0	0	111.7	W138 S144 L145 I146 L164 L178 V205	W138-V142 HydrophobicContact CD2-CG2 3.92Å; W138-V142 HydrophobicContact CE3-CG2 3.99Å; W138-V142 HydrophobicContact CH2-CG2 3.87Å; W138-V142 HydrophobicContact CZ2-CG2 3.79Å; W138-V142 HydrophobicContact CZ3-CG2 3.98Å; W138-V142 WeakPolarHBondContact O-CG2 3.41Å; W138-V142 PolarHBondContact O-N 3.09Å; V142-S144 VanDerWaalsContact C-N 3.31Å; V142-S144 PolarHBondContact O-N 2.95Å; V142-L145 PolarHBondContact O-N 3.08Å; V142-I146 HydrophobicContact CG1-CD1 4.17Å; V142-I146 WeakPolarHBondContact O-CG1 3.33Å; V142-I146 PolarHBondContact O-N 3.11Å; V142-I146 VanDerWaalsContact O-N 3.08Å; V142-L164 HydrophobicContact CG2-CD2 4.01Å; V142-L178 HydrophobicContact CB-CD1 4.46Å; V142-L178 HydrophobicContact CG1-CD1 3.63Å; V142-L178 HydrophobicContact CG1-CD2 4Å; V142-V205 HydrophobicContact CG1-CG1 3.75Å
143	Q	96.8	Very high	95	Very high	56 Å²	56	47.5 Å²	47.5	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-33.5	176.5	-73.3	173	90.9	0	0	112.6	L139 V141 R147 I181	L139-Q143 WeakPolarHBondContact O-CB 3.31Å; L139-Q143 WeakPolarHBondContact O-CG 3.31Å; L139-Q143 PolarHBondContact O-N 3.47Å; L139-Q143 PolarHBondContact O-NE2 2.62Å; V141-Q143 PolarHBondContact O-N 3.34Å; Q143-R147 WeakPolarHBondContact O-CB 3.23Å; Q143-R147 PolarHBondContact O-N 2.83Å; Q143-R147 PolarHBondContact O-NH1 2.84Å; Q143-I181 HydrophobicContact CG-CG2 4.26Å
144	S	97.1	Very high	94.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-50.9	173.2	-175.5	0	0	0	0	111.3	V100 D101 V104 D140 V141 V142 I146 R147 V148	V100-S144 VanDerWaalsContact C-OG 3.3Å; V100-S144 PolarHBondContact O-OG 3.28Å; D101-S144 VanDerWaalsContact CA-OG 3.28Å; D101-S144 WeakPolarHBondContact CA-OG 3.28Å; D101-S144 PolarHBondContact N-OG 3.48Å; V104-S144 WeakPolarHBondContact CG2-OG 3.36Å; D140-S144 VanDerWaalsContact O-CB 3.29Å; D140-S144 WeakPolarHBondContact O-CB 3.42Å; D140-S144 PolarHBondContact O-N 3.39Å; V141-S144 WeakPolarHBondContact O-CB 3.42Å; V141-S144 PolarHBondContact O-N 3.13Å; V141-S144 VanDerWaalsContact O-N 3.14Å; V142-S144 VanDerWaalsContact C-N 3.31Å; V142-S144 PolarHBondContact O-N 2.95Å; S144-I146 PolarHBondContact O-N 2.88Å; S144-R147 PolarHBondContact O-N 3.21Å; S144-V148 WeakPolarHBondContact O-CG2 3.45Å; S144-V148 PolarHBondContact O-N 3.11Å
145	L	97.1	Very high	94.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-52.2	-43.1	175.6	-69.1	173	0	0	0	111.9	V104 V141 V142 I149 I160 L163 L164 N201 V205	V104-L145 HydrophobicContact CG1-CD2 3.92Å; V104-L145 HydrophobicContact CG2-CD2 4.1Å; V141-L145 HydrophobicContact CG1-CD1 4.21Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 WeakPolarHBondContact O-CG 3.29Å; V141-L145 PolarHBondContact O-N 3.05Å; V142-L145 PolarHBondContact O-N 3.08Å; L145-I149 HydrophobicContact CB-CD1 4.44Å; L145-I149 HydrophobicContact CD2-CD1 3.66Å; L145-I160 HydrophobicContact CB-CG1 4.41Å; L145-I160 HydrophobicContact CD2-CG1 4.38Å; L145-L163 HydrophobicContact CD2-CB 4.4Å; L145-L163 HydrophobicContact CD2-CD1 3.76Å; L145-L164 HydrophobicContact CD1-CD1 4.43Å; L145-L164 HydrophobicContact CD1-CD2 3.85Å; L145-L164 HydrophobicContact CD1-CG 3.88Å; L145-N201 PolarHBondContact O-ND2 3.32Å; L145-V205 HydrophobicContact CB-CG2 4.48Å
146	I	96.6	Very high	94.3	Very high	11 Å²	11	35.8 Å²	35.8	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-43.3	176.6	-68.4	173.5	0	0	0	112	V142 S144 L182 K198 N201 T202 V205	V142-I146 HydrophobicContact CG1-CD1 4.17Å; V142-I146 WeakPolarHBondContact O-CG1 3.33Å; V142-I146 PolarHBondContact O-N 3.11Å; V142-I146 VanDerWaalsContact O-N 3.08Å; S144-I146 PolarHBondContact O-N 2.88Å; I146-L182 HydrophobicContact CD1-CD1 4.29Å; I146-L182 HydrophobicContact CD1-CD2 3.68Å; I146-K198 HydrophobicContact CG2-CG 4.1Å; I146-N201 PolarHBondContact O-ND2 3.01Å; I146-T202 WeakPolarHBondContact CG2-OG1 3.35Å; I146-V205 HydrophobicContact CD1-CB 4.44Å; I146-V205 HydrophobicContact CD1-CG1 4.45Å; I146-V205 HydrophobicContact CD1-CG2 4.28Å; I146-V205 HydrophobicContact CG1-CB 4.43Å; I146-V205 HydrophobicContact CG1-CG2 3.83Å
147	R	95.1	Very high	94.2	Very high	131 Å²	131	30.9 Å²	30.9	49%	0.494	16%	0.156	S	C	.	.	H	α-helix	trans	-78.2	-42.4	-171	177.2	171.3	59.2	-107.2	6.3	114.6	D101 Q143 S144	D101-R147 VanDerWaalsContact CG-NH2 3.27Å; D101-R147 IonicContact OD1-CZ 3.61Å; D101-R147 IonicContact OD1-NE 3.75Å; D101-R147 IonicContact OD1-NH2 2.73Å; D101-R147 PolarHBondContact OD1-NH2 2.87Å; D101-R147 IonicContact OD2-CZ 2.71Å; D101-R147 IonicContact OD2-NE 3.39Å; D101-R147 PolarHBondContact OD2-NE 3.04Å; D101-R147 IonicContact OD2-NH2 2.62Å; D101-R147 PolarHBondContact OD2-NH2 3.22Å; D101-R147 VanDerWaalsContact OD2-NH2 3.1Å; Q143-R147 WeakPolarHBondContact O-CB 3.23Å; Q143-R147 PolarHBondContact O-N 2.83Å; Q143-R147 PolarHBondContact O-NH1 2.84Å; S144-R147 PolarHBondContact O-N 3.21Å
148	V	95.9	Very high	94	Very high	27 Å²	27	30.7 Å²	30.7	16%	0.164	15%	0.154	C	C	.	.	H	α-helix	trans	-105.5	-23.6	-160.3	-47.6	0	0	0	0	115.2	D101 V104 L105 S144 P150	D101-V148 HydrophobicContact CB-CG1 3.69Å; D101-V148 VanDerWaalsContact OD2-CG1 3.25Å; D101-V148 WeakPolarHBondContact OD2-CG1 3.34Å; V104-V148 HydrophobicContact CB-CG2 3.89Å; V104-V148 HydrophobicContact CG1-CG2 3.51Å; L105-V148 HydrophobicContact CD1-CB 4.37Å; L105-V148 HydrophobicContact CD2-CB 4.32Å; L105-V148 HydrophobicContact CD2-CG2 4.09Å; L105-V148 HydrophobicContact CG-CB 4.22Å; L105-V148 HydrophobicContact CG-CG2 3.92Å; S144-V148 WeakPolarHBondContact O-CG2 3.45Å; S144-V148 PolarHBondContact O-N 3.11Å; V148-P150 WeakPolarHBondContact O-CD 3.48Å
149	I	96.1	Very high	93.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.153	C	C	.	.	S	Bend	trans	-71.4	118.6	-174	-67.5	177	0	0	0	109	V104 L108 L145 V159 I160 R200 N201	V104-I149 HydrophobicContact CG1-CD1 3.86Å; V104-I149 HydrophobicContact CG1-CG1 3.7Å; L108-I149 HydrophobicContact CD2-CG2 4.4Å; L145-I149 HydrophobicContact CB-CD1 4.44Å; L145-I149 HydrophobicContact CD2-CD1 3.66Å; I149-V159 HydrophobicContact CD1-CG1 4.35Å; I149-I160 HydrophobicContact CD1-CD1 4.14Å; I149-I160 HydrophobicContact CD1-CG1 3.47Å; I149-I160 VanDerWaalsContact CD1-CG1 3.47Å; I149-R200 VanDerWaalsContact CG2-NH1 3.34Å; I149-N201 PolarHBondContact O-ND2 3.48Å
150	P	95.1	Very high	93.7	Very high	56 Å²	56	30.3 Å²	30.3	36%	0.364	15%	0.152	S	C	.	.			trans	-70.5	151.6	-175.3	30.3	-36	0	0	0	111.2	L108 V148 E152 D153 R200	L108-P150 HydrophobicContact CD2-CG 4.21Å; V148-P150 WeakPolarHBondContact O-CD 3.48Å; P150-E152 VanDerWaalsContact C-N 3.34Å; P150-E152 PolarHBondContact O-N 2.89Å; P150-D153 HydrophobicContact CG-CB 3.93Å; P150-R200 PolarHBondContact O-NH2 3.38Å
151	L	92.1	Very high	93.5	Very high	20 Å²	20	26.8 Å²	26.8	11%	0.105	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-41.6	179.7	-179.5	62.1	0	0	0	112.2	D153 P196 A197 R200 T241	L151-D153 PolarHBondContact O-N 3.12Å; L151-P196 HydrophobicContact CD2-CB 4.03Å; L151-P196 HydrophobicContact CD2-CG 3.86Å; L151-A197 HydrophobicContact CB-CB 4Å; L151-R200 HydrophobicContact CD1-CB 4.28Å; L151-R200 HydrophobicContact CD1-CG 4.47Å; L151-R200 PolarHBondContact O-NH2 2.86Å; L151-T241 HydrophobicContact CD1-CG2 4.1Å
152	E	89.8	Confident	93.2	Very high	157 Å²	157	29.1 Å²	29.1	73%	0.734	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-1	-169	-35.3	-49	152.6	0	0	114.8	P150	P150-E152 VanDerWaalsContact C-N 3.34Å; P150-E152 PolarHBondContact O-N 2.89Å
153	D	90.1	Very high	92.9	Very high	37 Å²	37	29.2 Å²	29.2	20%	0.198	15%	0.146	C	C	.	.			trans	-85.1	119.5	173.1	-168.1	-65.6	0	0	0	110.2	L108 P150 L151 L155 G156	L108-D153 HydrophobicContact CD2-CB 4.31Å; P150-D153 HydrophobicContact CG-CB 3.93Å; L151-D153 PolarHBondContact O-N 3.12Å; D153-L155 PolarHBondContact O-N 3.22Å; D153-L155 WeakPolarHBondContact OD1-CA 3.5Å; D153-L155 WeakPolarHBondContact OD1-CB 3.33Å; D153-L155 PolarHBondContact OD1-N 3.44Å; D153-G156 PolarHBondContact O-N 3.45Å; D153-G156 VanDerWaalsContact O-N 3.17Å; D153-G156 PolarHBondContact OD1-N 2.89Å
154	P	85.2	Confident	92.7	Very high	37 Å²	37	26.7 Å²	26.7	24%	0.24	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.1	-175.2	30.2	-36.3	0	0	0	113.7	S370	P154-S370 WeakPolarHBondContact CB-OG 3.43Å
155	L	89.4	Confident	92.2	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.026	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-13.4	175	-52.4	-177	0	0	0	111.8	I111 R112 D153 A158 V159 V372	I111-L155 HydrophobicContact CG2-CB 3.94Å; I111-L155 HydrophobicContact CG2-CD1 3.74Å; I111-L155 HydrophobicContact CG2-CG 4.5Å; R112-L155 HydrophobicContact CB-CD1 3.89Å; R112-L155 HydrophobicContact CG-CD1 4.47Å; D153-L155 PolarHBondContact O-N 3.22Å; D153-L155 WeakPolarHBondContact OD1-CA 3.5Å; D153-L155 WeakPolarHBondContact OD1-CB 3.33Å; D153-L155 PolarHBondContact OD1-N 3.44Å; L155-A158 PolarHBondContact O-N 2.9Å; L155-V159 PolarHBondContact O-N 2.94Å; L155-V372 HydrophobicContact CD2-CG2 4Å
156	G	92.8	Very high	91.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-45.2	-48.8	176.9	0	0	0	0	0	115	D153 V159 I160	D153-G156 PolarHBondContact O-N 3.45Å; D153-G156 VanDerWaalsContact O-N 3.17Å; D153-G156 PolarHBondContact OD1-N 2.89Å; G156-V159 PolarHBondContact O-N 3.39Å; G156-I160 PolarHBondContact O-N 2.94Å
157	P	92.9	Very high	91.2	Very high	10 Å²	10	33.8 Å²	33.8	7%	0.065	17%	0.171	C	C	.	.	H	α-helix	trans	-68.6	-37.9	177	-14.5	27.2	0	0	0	113.1	V159 I160 T161 F245 Y471	P157-V159 VanDerWaalsContact C-N 3.27Å; P157-V159 PolarHBondContact O-N 3.34Å; P157-I160 WeakPolarHBondContact O-CB 3.16Å; P157-I160 PolarHBondContact O-N 3.5Å; P157-I160 VanDerWaalsContact O-N 3.1Å; P157-T161 PolarHBondContact O-N 3.09Å; P157-T161 VanDerWaalsContact O-N 3.14Å; P157-T161 PolarHBondContact O-OG1 2.93Å; P157-F245 HydrophobicContact CB-CE1 3.56Å; P157-F245 HydrophobicContact CB-CE2 4.24Å; P157-F245 HydrophobicContact CB-CZ 3.33Å; P157-F245 HydrophobicContact CG-CE1 4.28Å; P157-F245 HydrophobicContact CG-CE2 4.06Å; P157-F245 HydrophobicContact CG-CZ 3.58Å; P157-Y471 HydrophobicContact CB-CD2 3.7Å; P157-Y471 HydrophobicContact CB-CE2 3.89Å
158	A	90.5	Very high	90.9	Very high	5 Å²	5	30.6 Å²	30.6	4%	0.041	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-28.7	177.7	0	0	0	0	0	112.2	L155 T161 L162 M469	L155-A158 PolarHBondContact O-N 2.9Å; A158-T161 WeakPolarHBondContact O-CB 3.47Å; A158-T161 PolarHBondContact O-N 3.39Å; A158-L162 WeakPolarHBondContact O-CB 3.22Å; A158-L162 PolarHBondContact O-N 3.39Å; A158-M469 HydrophobicContact CB-CE 4.17Å; A158-M469 HydrophobicContact CB-SD 4.37Å
159	V	91.5	Very high	90.5	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-69.4	-31.3	171.2	169.3	0	0	0	0	112.3	T107 L108 I111 I149 L155 G156 P157 L163	T107-V159 HydrophobicContact CG2-CG1 4.39Å; L108-V159 HydrophobicContact CD1-CB 4.22Å; L108-V159 HydrophobicContact CD1-CG2 3.72Å; I111-V159 HydrophobicContact CB-CG2 3.94Å; I111-V159 HydrophobicContact CD1-CG2 4.29Å; I111-V159 HydrophobicContact CG1-CG2 3.83Å; I111-V159 HydrophobicContact CG2-CG2 3.78Å; I149-V159 HydrophobicContact CD1-CG1 4.35Å; L155-V159 PolarHBondContact O-N 2.94Å; G156-V159 PolarHBondContact O-N 3.39Å; P157-V159 VanDerWaalsContact C-N 3.27Å; P157-V159 PolarHBondContact O-N 3.34Å; V159-L163 HydrophobicContact CG1-CD1 3.71Å; V159-L163 HydrophobicContact CG1-CG 4.38Å; V159-L163 WeakPolarHBondContact O-CB 3.41Å; V159-L163 WeakPolarHBondContact O-CG 3.4Å; V159-L163 PolarHBondContact O-N 3.26Å; V159-L163 VanDerWaalsContact O-N 3.08Å
160	I	94.9	Very high	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-48.4	169.2	-62	172.5	0	0	0	109.5	L145 I149 G156 P157 L164 N201 A204 V205	L145-I160 HydrophobicContact CB-CG1 4.41Å; L145-I160 HydrophobicContact CD2-CG1 4.38Å; I149-I160 HydrophobicContact CD1-CD1 4.14Å; I149-I160 HydrophobicContact CD1-CG1 3.47Å; I149-I160 VanDerWaalsContact CD1-CG1 3.47Å; G156-I160 PolarHBondContact O-N 2.94Å; P157-I160 WeakPolarHBondContact O-CB 3.16Å; P157-I160 PolarHBondContact O-N 3.5Å; P157-I160 VanDerWaalsContact O-N 3.1Å; I160-L164 HydrophobicContact CG2-CD1 3.89Å; I160-L164 WeakPolarHBondContact O-CB 3.49Å; I160-L164 VanDerWaalsContact O-CG 3.28Å; I160-L164 WeakPolarHBondContact O-CG 3.46Å; I160-L164 PolarHBondContact O-N 3.25Å; I160-L164 VanDerWaalsContact O-N 3.08Å; I160-N201 HydrophobicContact CD1-CB 3.83Å; I160-A204 HydrophobicContact CD1-CB 3.84Å; I160-A204 HydrophobicContact CG2-CB 4.24Å; I160-V205 HydrophobicContact CG2-CG2 3.64Å
161	T	91.6	Very high	90.2	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-57.9	-54.2	177.9	-43.9	0	0	0	0	111.3	P157 A158 L164 D165 Y471	P157-T161 PolarHBondContact O-N 3.09Å; P157-T161 VanDerWaalsContact O-N 3.14Å; P157-T161 PolarHBondContact O-OG1 2.93Å; A158-T161 WeakPolarHBondContact O-CB 3.47Å; A158-T161 PolarHBondContact O-N 3.39Å; T161-L164 CarbonylContact O-C 3.59Å; T161-L164 PolarHBondContact O-N 3.43Å; T161-D165 WeakPolarHBondContact O-CB 3.42Å; T161-D165 PolarHBondContact O-N 3.17Å; T161-Y471 VanDerWaalsContact OG1-CE2 3.25Å; T161-Y471 WeakPolarHBondContact OG1-CE2 3.43Å; T161-Y471 PolarHBondContact OG1-OH 2.92Å
162	L	88.8	Confident	90.1	Very high	50 Å²	50	41.8 Å²	41.8	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-47.6	-175.7	179.7	67.5	0	0	0	113.1	I111 M125 A158 L164 D165 E166	I111-L162 HydrophobicContact CD1-CD2 3.42Å; I111-L162 VanDerWaalsContact CD1-CD2 3.42Å; M125-L162 HydrophobicContact CE-CD1 4.09Å; M125-L162 HydrophobicContact CE-CD2 3.91Å; M125-L162 HydrophobicContact CE-CG 3.79Å; M125-L162 HydrophobicContact SD-CD2 4.3Å; A158-L162 WeakPolarHBondContact O-CB 3.22Å; A158-L162 PolarHBondContact O-N 3.39Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 2.84Å; L162-D165 PolarHBondContact O-N 3.29Å; L162-E166 PolarHBondContact O-N 3.48Å
163	L	91.3	Very high	90.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.8	-34.8	180	-76.2	169.7	0	0	0	111.5	T107 M125 L128 L145 V159 D165 C167	T107-L163 HydrophobicContact CG2-CD1 4.19Å; T107-L163 HydrophobicContact CG2-CD2 4.32Å; T107-L163 HydrophobicContact CG2-CG 4.43Å; M125-L163 HydrophobicContact CB-CD2 4.46Å; M125-L163 HydrophobicContact CG-CD2 3.93Å; L128-L163 HydrophobicContact CB-CD2 4.33Å; L128-L163 HydrophobicContact CD1-CD1 3.92Å; L128-L163 HydrophobicContact CD1-CD2 3.83Å; L145-L163 HydrophobicContact CD2-CB 4.4Å; L145-L163 HydrophobicContact CD2-CD1 3.76Å; V159-L163 HydrophobicContact CG1-CD1 3.71Å; V159-L163 HydrophobicContact CG1-CG 4.38Å; V159-L163 WeakPolarHBondContact O-CB 3.41Å; V159-L163 WeakPolarHBondContact O-CG 3.4Å; V159-L163 PolarHBondContact O-N 3.26Å; V159-L163 VanDerWaalsContact O-N 3.08Å; L163-D165 VanDerWaalsContact C-N 3.32Å; L163-C167 PolarHBondContact O-N 2.89Å; L163-C167 PolarHBondContact O-SG 3.31Å
164	L	92.4	Very high	90.4	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-75.8	-19.5	170.8	-65.3	-179.7	0	0	0	112.9	V142 L145 I160 T161 L162 V205 C208 K212	V142-L164 HydrophobicContact CG2-CD2 4.01Å; L145-L164 HydrophobicContact CD1-CD1 4.43Å; L145-L164 HydrophobicContact CD1-CD2 3.85Å; L145-L164 HydrophobicContact CD1-CG 3.88Å; I160-L164 HydrophobicContact CG2-CD1 3.89Å; I160-L164 WeakPolarHBondContact O-CB 3.49Å; I160-L164 VanDerWaalsContact O-CG 3.28Å; I160-L164 WeakPolarHBondContact O-CG 3.46Å; I160-L164 PolarHBondContact O-N 3.25Å; I160-L164 VanDerWaalsContact O-N 3.08Å; T161-L164 CarbonylContact O-C 3.59Å; T161-L164 PolarHBondContact O-N 3.43Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 2.84Å; L164-V205 HydrophobicContact CD1-CB 4.41Å; L164-V205 HydrophobicContact CD1-CG1 4.29Å; L164-V205 HydrophobicContact CD1-CG2 4.17Å; L164-C208 HydrophobicContact CB-CB 4.45Å; L164-C208 HydrophobicContact CD1-CB 3.83Å; L164-K212 WeakPolarHBondContact O-CE 3.47Å; L164-K212 PolarHBondContact O-NZ 2.98Å
165	D	87.3	Confident	90.8	Very high	58 Å²	58	36.4 Å²	36.4	31%	0.31	19%	0.192	S	C	.	.	H	α-helix	trans	-70.1	-49.3	-177.8	-136.3	-14	0	0	0	111.6	T161 L162 L163 K212 S345	T161-D165 WeakPolarHBondContact O-CB 3.42Å; T161-D165 PolarHBondContact O-N 3.17Å; L162-D165 PolarHBondContact O-N 3.29Å; L163-D165 VanDerWaalsContact C-N 3.32Å; D165-K212 VanDerWaalsContact CA-CE 3.46Å; D165-K212 VanDerWaalsContact CA-NZ 3.26Å; D165-K212 PolarHBondContact O-NZ 2.91Å; D165-K212 WeakPolarHBondContact OD1-CE 3.34Å; D165-K212 IonicContact OD1-NZ 3.55Å; D165-K212 PolarHBondContact OD1-NZ 3.26Å; D165-S345 WeakPolarHBondContact OD2-CB 3.48Å; D165-S345 PolarHBondContact OD2-OG 2.74Å
166	E	83.5	Confident	91	Very high	92 Å²	92	41 Å²	41	43%	0.43	21%	0.213	S	C	.	.	H	α-helix	trans	-78.1	-17.6	179.6	-64.3	-63.4	110.4	0	0	114.1	M125 H129 L162	M125-E166 HydrophobicContact CE-CG 4.11Å; H129-E166 WeakPolarHBondContact CE1-CB 3.27Å; L162-E166 PolarHBondContact O-N 3.48Å
167	C	88.6	Confident	91.2	Very high	10 Å²	10	44.5 Å²	44.5	7%	0.068	23%	0.228	C	C	.	.	S	Bend	trans	-66.1	150	176.6	-84.1	0	0	0	0	112.6	A132 L163	A132-C167 HydrophobicContact CB-CB 4.32Å; A132-C167 WeakPolarHBondContact CB-SG 3.37Å; L163-C167 PolarHBondContact O-N 2.89Å; L163-C167 PolarHBondContact O-SG 3.31Å
168	P	88.5	Confident	91.3	Very high	63 Å²	63	44.1 Å²	44.1	41%	0.409	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-53.3	148.3	166.3	-25.8	36	0	0	0	112.5
169	L	88.8	Confident	91.4	Very high	96 Å²	96	45.7 Å²	45.7	50%	0.503	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-68.1	130	171.1	-68	176.7	0	0	0	109.1	K212	L169-K212 HydrophobicContact CD2-CB 3.93Å; L169-K212 HydrophobicContact CD2-CD 4.46Å; L169-K212 HydrophobicContact CD2-CG 4.47Å
170	P	91.4	Very high	91.6	Very high	19 Å²	19	51.5 Å²	51.5	12%	0.123	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66	151.1	-177.1	27.7	-36.7	0	0	0	112.2	W138 A174 L175	W138-P170 HydrophobicContact CD2-CB 4.03Å; W138-P170 HydrophobicContact CE3-CB 4.09Å; W138-P170 HydrophobicContact CH2-CB 3.64Å; W138-P170 HydrophobicContact CH2-CG 3.7Å; W138-P170 HydrophobicContact CZ2-CB 3.54Å; W138-P170 HydrophobicContact CZ2-CG 3.44Å; W138-P170 VanDerWaalsContact CZ2-CG 3.44Å; W138-P170 HydrophobicContact CZ3-CB 3.91Å; W138-P170 HydrophobicContact CZ3-CG 4.45Å; P170-A174 HydrophobicContact CB-CB 4.01Å; P170-L175 HydrophobicContact CB-CD2 4.25Å; P170-L175 HydrophobicContact CB-CG 4.08Å; P170-L175 HydrophobicContact CG-CD1 4.18Å; P170-L175 HydrophobicContact CG-CD2 3.58Å; P170-L175 HydrophobicContact CG-CG 3.73Å
171	T	92.2	Very high	91.6	Very high	60 Å²	60	55.5 Å²	55.5	37%	0.368	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-65.4	162.5	167.7	68.6	0	0	0	0	111	D135 D173 A174 L175	D135-T171 VanDerWaalsContact OD1-CG2 3.27Å; D135-T171 WeakPolarHBondContact OD1-CG2 3.45Å; D135-T171 PolarHBondContact OD1-OG1 2.96Å; D135-T171 WeakPolarHBondContact OD2-CG2 3.44Å; D135-T171 PolarHBondContact OD2-OG1 2.7Å; T171-D173 PolarHBondContact O-N 3.5Å; T171-D173 PolarHBondContact OG1-N 2.82Å; T171-A174 PolarHBondContact O-N 2.88Å; T171-A174 WeakPolarHBondContact OG1-CB 3.14Å; T171-A174 PolarHBondContact OG1-N 3.05Å; T171-L175 PolarHBondContact O-N 3.38Å
172	K	91.1	Very high	91.7	Very high	165 Å²	165	56.6 Å²	56.6	72%	0.717	29%	0.288	S	S	*	.	H	α-helix	trans	-55.8	-38.1	170.5	-174.5	-171.4	171.9	-166.4	0	111.4	L175 Q176	K172-L175 PolarHBondContact O-N 3.43Å; K172-Q176 PolarHBondContact O-N 3.44Å
173	D	92.8	Very high	91.9	Very high	100 Å²	100	59.5 Å²	59.5	54%	0.535	30%	0.304	S	S	.	.	H	α-helix	trans	-73.5	-35.7	-176.6	-61	-2.2	0	0	0	110.9	T171 Q176 K177	T171-D173 PolarHBondContact O-N 3.5Å; T171-D173 PolarHBondContact OG1-N 2.82Å; D173-Q176 PolarHBondContact O-N 2.91Å; D173-K177 WeakPolarHBondContact O-CB 3.47Å; D173-K177 VanDerWaalsContact O-CG 3.28Å; D173-K177 WeakPolarHBondContact O-CG 3.49Å; D173-K177 PolarHBondContact O-N 3.34Å
174	A	93.9	Very high	92.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-42	169.1	0	0	0	0	0	112.3	D135 W138 P170 T171 K177 L178	D135-A174 HydrophobicContact CB-CB 4.03Å; W138-A174 HydrophobicContact CE3-CB 4.27Å; W138-A174 HydrophobicContact CZ3-CB 4.4Å; P170-A174 HydrophobicContact CB-CB 4.01Å; T171-A174 PolarHBondContact O-N 2.88Å; T171-A174 WeakPolarHBondContact OG1-CB 3.14Å; T171-A174 PolarHBondContact OG1-N 3.05Å; A174-K177 PolarHBondContact O-N 3.01Å; A174-L178 WeakPolarHBondContact O-CB 3.45Å; A174-L178 PolarHBondContact O-N 3.42Å
175	L	93.7	Very high	92.2	Very high	17 Å²	17	61.9 Å²	61.9	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-38.7	174.8	-71.6	172.3	0	0	0	112.5	W138 P170 T171 K172 T179 L209 L213 L221	W138-L175 HydrophobicContact CH2-CD2 4.25Å; P170-L175 HydrophobicContact CB-CD2 4.25Å; P170-L175 HydrophobicContact CB-CG 4.08Å; P170-L175 HydrophobicContact CG-CD1 4.18Å; P170-L175 HydrophobicContact CG-CD2 3.58Å; P170-L175 HydrophobicContact CG-CG 3.73Å; T171-L175 PolarHBondContact O-N 3.38Å; K172-L175 PolarHBondContact O-N 3.43Å; L175-T179 PolarHBondContact O-N 2.93Å; L175-T179 PolarHBondContact O-OG1 3.12Å; L175-L209 HydrophobicContact CD2-CD1 4.39Å; L175-L213 HydrophobicContact CD1-CD1 3.65Å; L175-L213 HydrophobicContact CD1-CD2 4.01Å; L175-L213 HydrophobicContact CD2-CD1 3.95Å; L175-L213 HydrophobicContact CG-CD1 4.48Å; L175-L221 HydrophobicContact CD2-CD1 4.47Å
176	Q	93.3	Very high	92.4	Very high	102 Å²	102	59.5 Å²	59.5	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-51.2	174.2	-178.9	174.5	-27.6	0	0	110.8	K172 D173 L178 T179 E180	K172-Q176 PolarHBondContact O-N 3.44Å; D173-Q176 PolarHBondContact O-N 2.91Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.41Å; Q176-T179 WeakPolarHBondContact O-CB 3.27Å; Q176-T179 PolarHBondContact O-N 3.38Å; Q176-E180 HydrophobicContact CG-CG 4.48Å; Q176-E180 VanDerWaalsContact CG-OE1 3.31Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.23Å; Q176-E180 PolarHBondContact NE2-OE1 2.91Å; Q176-E180 WeakPolarHBondContact O-CG 3.47Å; Q176-E180 PolarHBondContact O-N 2.99Å
177	K	95.3	Very high	92.6	Very high	73 Å²	73	61.3 Å²	61.3	32%	0.317	31%	0.314	S	S	.	.	H	α-helix	trans	-54.5	-43.9	174.8	-75.6	171.2	-178.4	174.1	0	112.1	E136 L139 D173 A174 T179 E180 I181	E136-K177 IonicContact OE1-NZ 2.75Å; E136-K177 PolarHBondContact OE1-NZ 3.29Å; L139-K177 HydrophobicContact CD1-CB 3.75Å; L139-K177 HydrophobicContact CD1-CD 3.72Å; L139-K177 HydrophobicContact CD1-CG 4.41Å; L139-K177 HydrophobicContact CD2-CB 4.37Å; D173-K177 WeakPolarHBondContact O-CB 3.47Å; D173-K177 VanDerWaalsContact O-CG 3.28Å; D173-K177 WeakPolarHBondContact O-CG 3.49Å; D173-K177 PolarHBondContact O-N 3.34Å; A174-K177 PolarHBondContact O-N 3.01Å; K177-T179 VanDerWaalsContact C-N 3.32Å; K177-T179 PolarHBondContact O-N 3.44Å; K177-E180 PolarHBondContact O-N 3.44Å; K177-I181 WeakPolarHBondContact O-CB 3.34Å; K177-I181 WeakPolarHBondContact O-CD1 3.34Å; K177-I181 WeakPolarHBondContact O-CG1 3.19Å; K177-I181 PolarHBondContact O-N 2.88Å
178	L	94.9	Very high	92.7	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-43.4	176.6	-178.6	62.7	0	0	0	111.4	W138 L139 V142 A174 Q176 I181 L182 L209	W138-L178 HydrophobicContact CH2-CD2 3.78Å; W138-L178 HydrophobicContact CZ3-CB 4.39Å; W138-L178 HydrophobicContact CZ3-CD2 3.94Å; L139-L178 HydrophobicContact CD2-CB 3.72Å; L139-L178 HydrophobicContact CD2-CD1 4.18Å; V142-L178 HydrophobicContact CB-CD1 4.46Å; V142-L178 HydrophobicContact CG1-CD1 3.63Å; V142-L178 HydrophobicContact CG1-CD2 4Å; A174-L178 WeakPolarHBondContact O-CB 3.45Å; A174-L178 PolarHBondContact O-N 3.42Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.41Å; L178-I181 PolarHBondContact O-N 3.25Å; L178-L182 HydrophobicContact CD1-CD1 3.77Å; L178-L182 HydrophobicContact CD1-CD2 4.49Å; L178-L182 HydrophobicContact CD1-CG 3.92Å; L178-L182 HydrophobicContact CG-CD1 3.85Å; L178-L182 HydrophobicContact CG-CG 4.32Å; L178-L182 WeakPolarHBondContact O-CB 3.38Å; L178-L182 VanDerWaalsContact O-CG 3.24Å; L178-L182 WeakPolarHBondContact O-CG 3.4Å; L178-L182 PolarHBondContact O-N 3.23Å; L178-L209 HydrophobicContact CD2-CD1 3.7Å
179	T	94.5	Very high	92.7	Very high	39 Å²	39	59.9 Å²	59.9	24%	0.239	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-41.4	178	-55.7	0	0	0	0	111.5	L175 Q176 K177 N183 I226	L175-T179 PolarHBondContact O-N 2.93Å; L175-T179 PolarHBondContact O-OG1 3.12Å; Q176-T179 WeakPolarHBondContact O-CB 3.27Å; Q176-T179 PolarHBondContact O-N 3.38Å; K177-T179 VanDerWaalsContact C-N 3.32Å; K177-T179 PolarHBondContact O-N 3.44Å; T179-N183 PolarHBondContact O-N 2.95Å; T179-I226 HydrophobicContact CG2-CD1 4.07Å
180	E	95.2	Very high	92.5	Very high	123 Å²	123	58.5 Å²	58.5	58%	0.575	30%	0.303	S	S	*	.	H	α-helix	trans	-67.1	-40.4	175.7	-69.2	171.4	-173.2	0	0	112.6	Q176 K177	Q176-E180 HydrophobicContact CG-CG 4.48Å; Q176-E180 VanDerWaalsContact CG-OE1 3.31Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.23Å; Q176-E180 PolarHBondContact NE2-OE1 2.91Å; Q176-E180 WeakPolarHBondContact O-CG 3.47Å; Q176-E180 PolarHBondContact O-N 2.99Å; K177-E180 PolarHBondContact O-N 3.44Å
181	I	94.5	Very high	91.5	Very high	83 Å²	83	64 Å²	64	43%	0.426	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-41.9	177.2	-73	163.5	0	0	0	111.6	L139 Q143 K177 L178	L139-I181 HydrophobicContact CD1-CD1 4.46Å; L139-I181 HydrophobicContact CD2-CD1 4.28Å; Q143-I181 HydrophobicContact CG-CG2 4.26Å; K177-I181 WeakPolarHBondContact O-CB 3.34Å; K177-I181 WeakPolarHBondContact O-CD1 3.34Å; K177-I181 WeakPolarHBondContact O-CG1 3.19Å; K177-I181 PolarHBondContact O-N 2.88Å; L178-I181 PolarHBondContact O-N 3.25Å
182	L	93.1	Very high	90	Very high	31 Å²	31	62.9 Å²	62.9	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-77.6	-30.9	-179.6	-64.3	176.7	0	0	0	112.6	I146 L178 L184	I146-L182 HydrophobicContact CD1-CD1 4.29Å; I146-L182 HydrophobicContact CD1-CD2 3.68Å; L178-L182 HydrophobicContact CD1-CD1 3.77Å; L178-L182 HydrophobicContact CD1-CD2 4.49Å; L178-L182 HydrophobicContact CD1-CG 3.92Å; L178-L182 HydrophobicContact CG-CD1 3.85Å; L178-L182 HydrophobicContact CG-CG 4.32Å; L178-L182 WeakPolarHBondContact O-CB 3.38Å; L178-L182 VanDerWaalsContact O-CG 3.24Å; L178-L182 WeakPolarHBondContact O-CG 3.4Å; L178-L182 PolarHBondContact O-N 3.23Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 HydrophobicContact CB-CD1 4.13Å; L182-L184 HydrophobicContact CB-CD2 4.08Å; L182-L184 HydrophobicContact CB-CG 3.76Å; L182-L184 HydrophobicContact CD1-CD1 4.28Å; L182-L184 WeakPolarHBondContact O-CD2 3.33Å; L182-L184 PolarHBondContact O-N 2.97Å; L182-L184 VanDerWaalsContact O-N 3.15Å
183	N	94.5	Very high	88.8	Confident	111 Å²	111	59.9 Å²	59.9	59%	0.594	32%	0.319	S	S	*	.			trans	46.2	44.3	175.6	-168.2	22.8	0	0	0	114	T179 N185	T179-N183 PolarHBondContact O-N 2.95Å; N183-N185 PolarHBondContact O-ND2 3.32Å; N183-N185 VanDerWaalsContact O-ND2 3.1Å
184	L	95.5	Very high	88	Confident	17 Å²	17	58 Å²	58	9%	0.089	32%	0.322	C	S	.	.			trans	-75.4	135.6	-169.3	-57.2	178	0	0	0	112.1	L182 V188 T202 L206 G225 I226 Y229	L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 HydrophobicContact CB-CD1 4.13Å; L182-L184 HydrophobicContact CB-CD2 4.08Å; L182-L184 HydrophobicContact CB-CG 3.76Å; L182-L184 HydrophobicContact CD1-CD1 4.28Å; L182-L184 WeakPolarHBondContact O-CD2 3.33Å; L182-L184 PolarHBondContact O-N 2.97Å; L182-L184 VanDerWaalsContact O-N 3.15Å; L184-V188 HydrophobicContact CD2-CG1 4.29Å; L184-T202 HydrophobicContact CD1-CG2 3.6Å; L184-T202 HydrophobicContact CD2-CG2 4.23Å; L184-L206 HydrophobicContact CD1-CD1 3.83Å; L184-G225 CarbonylContact C-O 3.54Å; L184-G225 CarbonylContact O-C 3.58Å; L184-G225 WeakPolarHBondContact O-CA 3.26Å; L184-I226 HydrophobicContact CB-CG1 4.08Å; L184-I226 HydrophobicContact CD1-CG1 4.17Å; L184-Y229 HydrophobicContact CB-CD1 4.45Å; L184-Y229 HydrophobicContact CB-CD2 4.11Å; L184-Y229 HydrophobicContact CB-CG 3.95Å; L184-Y229 HydrophobicContact CD1-CD1 4.11Å; L184-Y229 HydrophobicContact CD1-CE1 4.15Å; L184-Y229 HydrophobicContact CD1-CG 4.41Å; L184-Y229 HydrophobicContact CD2-CD2 3.93Å; L184-Y229 HydrophobicContact CD2-CE1 4.44Å; L184-Y229 HydrophobicContact CD2-CE2 3.73Å; L184-Y229 HydrophobicContact CD2-CG 4.37Å; L184-Y229 HydrophobicContact CG-CD2 4.46Å; L184-Y229 HydrophobicContact CG-CG 4.47Å
185	N	94.7	Very high	87.7	Confident	39 Å²	39	63.2 Å²	63.2	21%	0.209	35%	0.347	C	S	.	.			trans	-160	176.4	178	58.6	62.5	0	0	0	110	N183 E187 V188 A189 G225	N183-N185 PolarHBondContact O-ND2 3.32Å; N183-N185 VanDerWaalsContact O-ND2 3.1Å; N185-E187 VanDerWaalsContact C-N 3.28Å; N185-E187 PolarHBondContact O-N 2.99Å; N185-E187 WeakPolarHBondContact OD1-CA 3.46Å; N185-E187 VanDerWaalsContact OD1-CB 3.3Å; N185-E187 WeakPolarHBondContact OD1-CB 3.18Å; N185-E187 PolarHBondContact OD1-N 2.67Å; N185-V188 PolarHBondContact O-N 2.86Å; N185-V188 PolarHBondContact OD1-N 3.45Å; N185-A189 PolarHBondContact O-N 3.05Å; N185-G225 WeakPolarHBondContact CA-O 3.43Å
186	G	90.1	Very high	87.7	Confident	8 Å²	8	63.9 Å²	63.9	8%	0.082	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.6	179.2	0	0	0	0	0	114.9	C190 E228	G186-C190 PolarHBondContact O-N 2.8Å; G186-C190 PolarHBondContact O-SG 3.32Å; G186-E228 WeakPolarHBondContact CA-OE2 3.28Å; G186-E228 PolarHBondContact N-OE2 3.45Å
187	E	89.1	Confident	87.8	Confident	129 Å²	129	60.4 Å²	60.4	60%	0.603	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-44.8	175.8	-57.2	-165.2	173.4	0	0	111.7	N185 A189 C190 Q191	N185-E187 VanDerWaalsContact C-N 3.28Å; N185-E187 PolarHBondContact O-N 2.99Å; N185-E187 WeakPolarHBondContact OD1-CA 3.46Å; N185-E187 VanDerWaalsContact OD1-CB 3.3Å; N185-E187 WeakPolarHBondContact OD1-CB 3.18Å; N185-E187 PolarHBondContact OD1-N 2.67Å; E187-A189 PolarHBondContact O-N 3.4Å; E187-C190 WeakPolarHBondContact O-CA 3.37Å; E187-C190 WeakPolarHBondContact O-CB 3.48Å; E187-C190 PolarHBondContact O-N 2.97Å; E187-Q191 VanDerWaalsContact O-CG 3.28Å; E187-Q191 WeakPolarHBondContact O-CG 3.4Å; E187-Q191 PolarHBondContact O-N 3.11Å; E187-Q191 PolarHBondContact OE2-NE2 2.67Å
188	V	89.9	Confident	87.8	Confident	33 Å²	33	61.3 Å²	61.3	20%	0.2	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-37.6	175.8	178.4	0	0	0	0	110.6	L184 N185 C190 Q191 H199 Y229	L184-V188 HydrophobicContact CD2-CG1 4.29Å; N185-V188 PolarHBondContact O-N 2.86Å; N185-V188 PolarHBondContact OD1-N 3.45Å; V188-C190 PolarHBondContact O-N 3.28Å; V188-Q191 PolarHBondContact O-N 3.25Å; V188-H199 PolarHBondContact O-CE1 3.27Å; V188-Y229 HydrophobicContact CB-CD2 4.41Å; V188-Y229 HydrophobicContact CG1-CD2 4.38Å; V188-Y229 HydrophobicContact CG1-CE2 4.08Å
189	A	88.8	Confident	87.8	Confident	11 Å²	11	61.7 Å²	61.7	9%	0.091	35%	0.346	C	S	.	.	H	α-helix	trans	-68.9	-14.1	172.6	0	0	0	0	0	115	N185 E187 Y229 Q232	N185-A189 PolarHBondContact O-N 3.05Å; E187-A189 PolarHBondContact O-N 3.4Å; A189-Y229 HydrophobicContact CB-CD2 3.65Å; A189-Y229 HydrophobicContact CB-CE2 4.17Å; A189-Y229 HydrophobicContact CB-CG 4.24Å; A189-Q232 HydrophobicContact CB-CB 3.58Å; A189-Q232 HydrophobicContact CB-CG 3.5Å
190	C	83.8	Confident	87.9	Confident	67 Å²	67	59.9 Å²	59.9	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-92.8	-41.4	170.2	-60.6	0	0	0	0	112.9	G186 E187 V188 Q232	G186-C190 PolarHBondContact O-N 2.8Å; G186-C190 PolarHBondContact O-SG 3.32Å; E187-C190 WeakPolarHBondContact O-CA 3.37Å; E187-C190 WeakPolarHBondContact O-CB 3.48Å; E187-C190 PolarHBondContact O-N 2.97Å; V188-C190 PolarHBondContact O-N 3.28Å; C190-Q232 PolarHBondContact SG-NE2 3.27Å
191	Q	71.6	Confident	88	Confident	135 Å²	135	54 Å²	54	63%	0.631	31%	0.308	S	S	*	.	H	α-helix	trans	-75.6	-37.7	-163.6	-71.7	170	13.5	0	0	113	E187 V188 S193	E187-Q191 VanDerWaalsContact O-CG 3.28Å; E187-Q191 WeakPolarHBondContact O-CG 3.4Å; E187-Q191 PolarHBondContact O-N 3.11Å; E187-Q191 PolarHBondContact OE2-NE2 2.67Å; V188-Q191 PolarHBondContact O-N 3.25Å; Q191-S193 VanDerWaalsContact C-N 3.31Å; Q191-S193 PolarHBondContact O-N 3.07Å
192	D	60.7	Low	88.1	Confident	35 Å²	35	50.2 Å²	50.2	19%	0.187	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	30.5	-174.5	-105.4	-20.2	0	0	0	113.9	G194 H195 K198 H199	D192-G194 PolarHBondContact O-N 3.44Å; D192-H195 HydrophobicContact CB-CB 4.45Å; D192-H195 PolarHBondContact O-N 2.74Å; D192-H195 IonicContact OD1-CE1 2.74Å; D192-H195 IonicContact OD1-CG 3.64Å; D192-H195 IonicContact OD1-ND1 2.79Å; D192-H195 PolarHBondContact OD1-ND1 2.99Å; D192-K198 IonicContact OD2-NZ 3.69Å; D192-K198 PolarHBondContact OD2-NZ 3.24Å; D192-H199 WeakPolarHBondContact CB-NE2 3.36Å; D192-H199 PolarHBondContact O-CD2 3.14Å; D192-H199 PolarHBondContact O-NE2 2.66Å
193	S	65.6	Low	88.3	Confident	103 Å²	103	48.8 Å²	48.8	72%	0.72	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18	177.8	72	0	0	0	0	114.1	Q191 H195	Q191-S193 VanDerWaalsContact C-N 3.31Å; Q191-S193 PolarHBondContact O-N 3.07Å; S193-H195 VanDerWaalsContact C-N 3.35Å
194	G	74.5	Confident	88.4	Confident	60 Å²	60	43.6 Å²	43.6	62%	0.619	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.3	171	0	0	0	0	0	115.3	D192 P196	D192-G194 PolarHBondContact O-N 3.44Å; G194-P196 WeakPolarHBondContact O-CD 3.34Å
195	H	89.4	Confident	88.5	Confident	109 Å²	109	42.8 Å²	42.8	51%	0.505	25%	0.249	S	C	.	.			trans	-123.5	55	-176.2	-59.2	121.1	0	0	0	113	D192 S193 A197 K198 H199	D192-H195 HydrophobicContact CB-CB 4.45Å; D192-H195 PolarHBondContact O-N 2.74Å; D192-H195 IonicContact OD1-CE1 2.74Å; D192-H195 IonicContact OD1-CG 3.64Å; D192-H195 IonicContact OD1-ND1 2.79Å; D192-H195 PolarHBondContact OD1-ND1 2.99Å; S193-H195 VanDerWaalsContact C-N 3.35Å; H195-A197 PolarHBondContact O-N 2.74Å; H195-A197 VanDerWaalsContact O-N 3.15Å; H195-K198 HydrophobicContact CB-CB 4.23Å; H195-K198 WeakPolarHBondContact O-CB 3.35Å; H195-K198 PolarHBondContact O-N 2.96Å; H195-K198 VanDerWaalsContact O-N 3.09Å; H195-H199 PolarHBondContact O-N 3.44Å
196	P	93.6	Very high	88.7	Confident	32 Å²	32	41 Å²	41	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-27.9	-175.4	24.6	-34.8	0	0	0	114.3	L151 G194 H199 R200 H239 V242	L151-P196 HydrophobicContact CD2-CB 4.03Å; L151-P196 HydrophobicContact CD2-CG 3.86Å; G194-P196 WeakPolarHBondContact O-CD 3.34Å; P196-H199 PolarHBondContact O-N 3.39Å; P196-R200 WeakPolarHBondContact O-CB 3.42Å; P196-R200 PolarHBondContact O-N 3.04Å; P196-H239 HydrophobicContact CB-CB 3.79Å; P196-V242 HydrophobicContact CB-CG2 4Å; P196-V242 VanDerWaalsContact O-CG2 3.29Å; P196-V242 WeakPolarHBondContact O-CG2 3.28Å
197	A	95	Very high	89	Confident	29 Å²	29	40.9 Å²	40.9	24%	0.24	24%	0.238	C	C	.	.	H	α-helix	trans	-57.2	-51.7	172.4	0	0	0	0	0	111.8	L151 H195 H199 R200 N201	L151-A197 HydrophobicContact CB-CB 4Å; H195-A197 PolarHBondContact O-N 2.74Å; H195-A197 VanDerWaalsContact O-N 3.15Å; A197-H199 PolarHBondContact O-N 2.91Å; A197-R200 PolarHBondContact O-N 2.8Å; A197-N201 WeakPolarHBondContact O-CB 3.34Å; A197-N201 PolarHBondContact O-N 3.5Å; A197-N201 PolarHBondContact O-ND2 3.36Å; A197-N201 PolarHBondContact O-OD1 2.92Å
198	K	94.8	Very high	89.3	Confident	92 Å²	92	35 Å²	35	40%	0.4	21%	0.211	S	C	.	.	H	α-helix	trans	-56.3	-49.3	178.4	179.6	-173.1	173.5	-170.1	0	110.9	I146 D192 H195 R200 N201 T202	I146-K198 HydrophobicContact CG2-CG 4.1Å; D192-K198 IonicContact OD2-NZ 3.69Å; D192-K198 PolarHBondContact OD2-NZ 3.24Å; H195-K198 HydrophobicContact CB-CB 4.23Å; H195-K198 WeakPolarHBondContact O-CB 3.35Å; H195-K198 PolarHBondContact O-N 2.96Å; H195-K198 VanDerWaalsContact O-N 3.09Å; K198-R200 PolarHBondContact O-N 2.89Å; K198-N201 PolarHBondContact O-N 3.43Å; K198-T202 WeakPolarHBondContact O-CB 3.4Å; K198-T202 PolarHBondContact O-N 2.87Å; K198-T202 PolarHBondContact O-OG1 2.93Å; K198-T202 VanDerWaalsContact O-OG1 3.05Å
199	H	95	Very high	89.5	Confident	9 Å²	9	33.6 Å²	33.6	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-43.3	177.4	-77.8	-82.1	0	0	0	113.5	V188 D192 H195 P196 A197 S203 Y229 V242	V188-H199 PolarHBondContact O-CE1 3.27Å; D192-H199 WeakPolarHBondContact CB-NE2 3.36Å; D192-H199 PolarHBondContact O-CD2 3.14Å; D192-H199 PolarHBondContact O-NE2 2.66Å; H195-H199 PolarHBondContact O-N 3.44Å; P196-H199 PolarHBondContact O-N 3.39Å; A197-H199 PolarHBondContact O-N 2.91Å; H199-S203 WeakPolarHBondContact O-CB 3.28Å; H199-S203 PolarHBondContact O-N 3.45Å; H199-S203 PolarHBondContact O-OG 2.94Å; H199-Y229 AromaticContact CE1-CE2 3.77Å; H199-Y229 AromaticContact ND1-CE2 3.6Å; H199-Y229 AromaticContact ND1-CZ 3.49Å; H199-Y229 PolarHBondContact ND1-OH 3.14Å; H199-V242 HydrophobicContact CB-CB 4.32Å; H199-V242 HydrophobicContact CB-CG1 3.71Å; H199-V242 HydrophobicContact CB-CG2 3.6Å
200	R	95.6	Very high	89.8	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-44.6	176.5	-179.3	-95.1	-91.7	169.4	-10.7	110.7	I149 P150 L151 P196 A197 K198 S203 A204 T241 V242 F245	I149-R200 VanDerWaalsContact CG2-NH1 3.34Å; P150-R200 PolarHBondContact O-NH2 3.38Å; L151-R200 HydrophobicContact CD1-CB 4.28Å; L151-R200 HydrophobicContact CD1-CG 4.47Å; L151-R200 PolarHBondContact O-NH2 2.86Å; P196-R200 WeakPolarHBondContact O-CB 3.42Å; P196-R200 PolarHBondContact O-N 3.04Å; A197-R200 PolarHBondContact O-N 2.8Å; K198-R200 PolarHBondContact O-N 2.89Å; R200-S203 PolarHBondContact O-N 3Å; R200-A204 WeakPolarHBondContact O-CB 3.45Å; R200-A204 PolarHBondContact O-N 3.23Å; R200-T241 HydrophobicContact CG-CG2 4.12Å; R200-V242 HydrophobicContact CB-CG2 4.35Å; R200-F245 HydrophobicContact CG-CB 4.21Å; R200-F245 HydrophobicContact CG-CD2 3.61Å; R200-F245 HydrophobicContact CG-CE2 4.21Å; R200-F245 HydrophobicContact CG-CG 3.92Å
201	N	97.5	Very high	90.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69	-43.7	-179.3	-58.5	-20.7	0	0	0	111.9	L145 I146 I149 I160 A197 K198 S203 A204 V205	L145-N201 PolarHBondContact O-ND2 3.32Å; I146-N201 PolarHBondContact O-ND2 3.01Å; I149-N201 PolarHBondContact O-ND2 3.48Å; I160-N201 HydrophobicContact CD1-CB 3.83Å; A197-N201 WeakPolarHBondContact O-CB 3.34Å; A197-N201 PolarHBondContact O-N 3.5Å; A197-N201 PolarHBondContact O-ND2 3.36Å; A197-N201 PolarHBondContact O-OD1 2.92Å; K198-N201 PolarHBondContact O-N 3.43Å; N201-S203 VanDerWaalsContact C-N 3.29Å; N201-S203 PolarHBondContact O-N 2.84Å; N201-A204 PolarHBondContact O-N 3.11Å; N201-V205 WeakPolarHBondContact O-CG2 3.43Å; N201-V205 PolarHBondContact O-N 3.16Å
202	T	97.3	Very high	91	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-55.5	-45.6	172.5	-64.3	0	0	0	0	111.2	I146 L184 K198 V205 L206 Y229	I146-T202 WeakPolarHBondContact CG2-OG1 3.35Å; L184-T202 HydrophobicContact CD1-CG2 3.6Å; L184-T202 HydrophobicContact CD2-CG2 4.23Å; K198-T202 WeakPolarHBondContact O-CB 3.4Å; K198-T202 PolarHBondContact O-N 2.87Å; K198-T202 PolarHBondContact O-OG1 2.93Å; K198-T202 VanDerWaalsContact O-OG1 3.05Å; T202-V205 PolarHBondContact O-N 3.38Å; T202-L206 HydrophobicContact CG2-CD1 4.02Å; T202-L206 WeakPolarHBondContact O-CB 3.34Å; T202-L206 VanDerWaalsContact O-CG 3.28Å; T202-L206 WeakPolarHBondContact O-CG 3.18Å; T202-L206 PolarHBondContact O-N 3.46Å; T202-Y229 HydrophobicContact CG2-CE1 3.98Å
203	S	97.4	Very high	92.5	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.4	-40.1	179.6	-52.2	0	0	0	0	112	H199 R200 N201 L206 G207 A249	H199-S203 WeakPolarHBondContact O-CB 3.28Å; H199-S203 PolarHBondContact O-N 3.45Å; H199-S203 PolarHBondContact O-OG 2.94Å; R200-S203 PolarHBondContact O-N 3Å; N201-S203 VanDerWaalsContact C-N 3.29Å; N201-S203 PolarHBondContact O-N 2.84Å; S203-L206 PolarHBondContact O-N 3.42Å; S203-G207 PolarHBondContact O-N 3.33Å; S203-A249 WeakPolarHBondContact O-CB 3.41Å
204	A	97.3	Very high	93.3	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-47.2	174	0	0	0	0	0	112	I160 R200 N201 L206 G207 C208 F245	I160-A204 HydrophobicContact CD1-CB 3.84Å; I160-A204 HydrophobicContact CG2-CB 4.24Å; R200-A204 WeakPolarHBondContact O-CB 3.45Å; R200-A204 PolarHBondContact O-N 3.23Å; N201-A204 PolarHBondContact O-N 3.11Å; A204-L206 PolarHBondContact O-N 2.98Å; A204-G207 PolarHBondContact O-N 3.22Å; A204-C208 PolarHBondContact O-N 2.97Å; A204-C208 PolarHBondContact O-SG 2.92Å; A204-F245 HydrophobicContact CB-CD1 3.74Å; A204-F245 HydrophobicContact CB-CE1 4.18Å
205	V	97.6	Very high	93.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.5	-51.7	173.9	166.8	0	0	0	0	110.7	V142 L145 I146 I160 L164 N201 T202 G207 C208 L209	V142-V205 HydrophobicContact CG1-CG1 3.75Å; L145-V205 HydrophobicContact CB-CG2 4.48Å; I146-V205 HydrophobicContact CD1-CB 4.44Å; I146-V205 HydrophobicContact CD1-CG1 4.45Å; I146-V205 HydrophobicContact CD1-CG2 4.28Å; I146-V205 HydrophobicContact CG1-CB 4.43Å; I146-V205 HydrophobicContact CG1-CG2 3.83Å; I160-V205 HydrophobicContact CG2-CG2 3.64Å; L164-V205 HydrophobicContact CD1-CB 4.41Å; L164-V205 HydrophobicContact CD1-CG1 4.29Å; L164-V205 HydrophobicContact CD1-CG2 4.17Å; N201-V205 WeakPolarHBondContact O-CG2 3.43Å; N201-V205 PolarHBondContact O-N 3.16Å; T202-V205 PolarHBondContact O-N 3.38Å; V205-G207 VanDerWaalsContact C-N 3.29Å; V205-G207 PolarHBondContact O-N 2.98Å; V205-C208 PolarHBondContact O-N 2.93Å; V205-L209 HydrophobicContact CG1-CD1 3.91Å; V205-L209 HydrophobicContact CG1-CG 4.31Å; V205-L209 WeakPolarHBondContact O-CG 3.43Å; V205-L209 PolarHBondContact O-N 3.13Å
206	L	97.5	Very high	93.7	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-41.2	179.4	-74.1	169.1	0	0	0	112.1	L184 T202 S203 A204 L209 A210 L221 I226 L230 F253	L184-L206 HydrophobicContact CD1-CD1 3.83Å; T202-L206 HydrophobicContact CG2-CD1 4.02Å; T202-L206 WeakPolarHBondContact O-CB 3.34Å; T202-L206 VanDerWaalsContact O-CG 3.28Å; T202-L206 WeakPolarHBondContact O-CG 3.18Å; T202-L206 PolarHBondContact O-N 3.46Å; S203-L206 PolarHBondContact O-N 3.42Å; A204-L206 PolarHBondContact O-N 2.98Å; L206-L209 PolarHBondContact O-N 3.05Å; L206-A210 VanDerWaalsContact O-CB 3.25Å; L206-A210 WeakPolarHBondContact O-CB 3.36Å; L206-A210 PolarHBondContact O-N 2.83Å; L206-L221 HydrophobicContact CD2-CD1 4.46Å; L206-I226 HydrophobicContact CD1-CG2 4.08Å; L206-I226 HydrophobicContact CD2-CD1 4.29Å; L206-I226 HydrophobicContact CD2-CG2 4.27Å; L206-L230 HydrophobicContact CD1-CD2 4.25Å; L206-F253 HydrophobicContact CB-CE2 4.18Å; L206-F253 HydrophobicContact CB-CZ 4.47Å; L206-F253 HydrophobicContact CD2-CZ 4.41Å
207	G	96.3	Very high	93.5	Very high	5 Å²	5	26.2 Å²	26.2	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-44.4	175.3	0	0	0	0	0	113.4	S203 A204 V205 L209 A210 E211 K252	S203-G207 PolarHBondContact O-N 3.33Å; A204-G207 PolarHBondContact O-N 3.22Å; V205-G207 VanDerWaalsContact C-N 3.29Å; V205-G207 PolarHBondContact O-N 2.98Å; G207-L209 PolarHBondContact O-N 3.48Å; G207-A210 PolarHBondContact O-N 2.94Å; G207-E211 PolarHBondContact O-N 3.32Å; G207-E211 VanDerWaalsContact O-N 3.15Å; G207-K252 WeakPolarHBondContact O-CB 3.37Å
208	C	95.4	Very high	93.5	Very high	5 Å²	5	24.9 Å²	24.9	3%	0.034	16%	0.156	C	C	.	.	H	α-helix	trans	-64.4	-38.1	176.4	-66	0	0	0	0	112.4	L164 A204 V205 K212	L164-C208 HydrophobicContact CB-CB 4.45Å; L164-C208 HydrophobicContact CD1-CB 3.83Å; A204-C208 PolarHBondContact O-N 2.97Å; A204-C208 PolarHBondContact O-SG 2.92Å; V205-C208 PolarHBondContact O-N 2.93Å; C208-K212 WeakPolarHBondContact O-CB 3.46Å; C208-K212 WeakPolarHBondContact O-CG 3.3Å; C208-K212 PolarHBondContact O-N 3.06Å
209	L	95.4	Very high	93.3	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-69.8	-40.7	174.5	-62.8	178.5	0	0	0	111.8	W138 L175 L178 V205 L206 G207 E211 K212 L213 L221	W138-L209 HydrophobicContact CH2-CD1 4.2Å; W138-L209 HydrophobicContact CH2-CD2 4.14Å; W138-L209 HydrophobicContact CZ2-CD2 3.72Å; L175-L209 HydrophobicContact CD2-CD1 4.39Å; L178-L209 HydrophobicContact CD2-CD1 3.7Å; V205-L209 HydrophobicContact CG1-CD1 3.91Å; V205-L209 HydrophobicContact CG1-CG 4.31Å; V205-L209 WeakPolarHBondContact O-CG 3.43Å; V205-L209 PolarHBondContact O-N 3.13Å; L206-L209 PolarHBondContact O-N 3.05Å; G207-L209 PolarHBondContact O-N 3.48Å; L209-E211 VanDerWaalsContact C-N 3.29Å; L209-E211 PolarHBondContact O-N 3.38Å; L209-K212 PolarHBondContact O-N 3.5Å; L209-L213 HydrophobicContact CB-CD1 4.35Å; L209-L213 WeakPolarHBondContact O-CB 3.31Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.42Å; L209-L221 HydrophobicContact CB-CD2 3.61Å; L209-L221 HydrophobicContact CD1-CD2 4.27Å
210	A	94.9	Very high	93.2	Very high	2 Å²	2	25.6 Å²	25.6	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-36	179.3	0	0	0	0	0	113.2	L206 G207 S218 K252 F253	L206-A210 VanDerWaalsContact O-CB 3.25Å; L206-A210 WeakPolarHBondContact O-CB 3.36Å; L206-A210 PolarHBondContact O-N 2.83Å; G207-A210 PolarHBondContact O-N 2.94Å; A210-S218 PolarHBondContact O-OG 2.74Å; A210-K252 HydrophobicContact CB-CB 3.93Å; A210-F253 HydrophobicContact CB-CB 4.33Å; A210-F253 HydrophobicContact CB-CD1 3.46Å; A210-F253 VanDerWaalsContact CB-CD1 3.46Å; A210-F253 HydrophobicContact CB-CD2 3.97Å; A210-F253 HydrophobicContact CB-CE1 3.65Å; A210-F253 HydrophobicContact CB-CE2 4.12Å; A210-F253 HydrophobicContact CB-CG 3.64Å; A210-F253 HydrophobicContact CB-CZ 3.97Å
211	E	91.3	Very high	93.2	Very high	58 Å²	58	25.8 Å²	25.8	27%	0.271	18%	0.179	S	C	.	.	H	α-helix	trans	-76	-31.9	176.5	-176.3	152.1	-112.3	0	0	113.3	G207 L209 K252 Q255	G207-E211 PolarHBondContact O-N 3.32Å; G207-E211 VanDerWaalsContact O-N 3.15Å; L209-E211 VanDerWaalsContact C-N 3.29Å; L209-E211 PolarHBondContact O-N 3.38Å; E211-K252 HydrophobicContact CB-CB 4.47Å; E211-K252 HydrophobicContact CB-CD 4.17Å; E211-K252 HydrophobicContact CG-CD 4.42Å; E211-K252 VanDerWaalsContact OE1-CD 3.32Å; E211-K252 WeakPolarHBondContact OE1-CD 3.33Å; E211-K252 IonicContact OE1-NZ 2.99Å; E211-K252 PolarHBondContact OE1-NZ 2.96Å; E211-K252 IonicContact OE2-NZ 3.44Å; E211-K252 PolarHBondContact OE2-NZ 3.06Å; E211-Q255 PolarHBondContact OE1-NE2 2.9Å
212	K	90	Very high	93.2	Very high	55 Å²	55	26.5 Å²	26.5	24%	0.239	18%	0.183	C	C	.	.	H	α-helix	trans	-81.4	-28.2	-179.8	-81.2	174.8	168.9	-82.1	0	114.7	L164 D165 L169 C208 L209	L164-K212 WeakPolarHBondContact O-CE 3.47Å; L164-K212 PolarHBondContact O-NZ 2.98Å; D165-K212 VanDerWaalsContact CA-CE 3.46Å; D165-K212 VanDerWaalsContact CA-NZ 3.26Å; D165-K212 PolarHBondContact O-NZ 2.91Å; D165-K212 WeakPolarHBondContact OD1-CE 3.34Å; D165-K212 IonicContact OD1-NZ 3.55Å; D165-K212 PolarHBondContact OD1-NZ 3.26Å; L169-K212 HydrophobicContact CD2-CB 3.93Å; L169-K212 HydrophobicContact CD2-CD 4.46Å; L169-K212 HydrophobicContact CD2-CG 4.47Å; C208-K212 WeakPolarHBondContact O-CB 3.46Å; C208-K212 WeakPolarHBondContact O-CG 3.3Å; C208-K212 PolarHBondContact O-N 3.06Å; L209-K212 PolarHBondContact O-N 3.5Å
213	L	91.3	Very high	93.1	Very high	16 Å²	16	27.9 Å²	27.9	8%	0.084	19%	0.193	C	C	.	.	S	Bend	trans	-92.1	114.7	-172.7	-66.7	173.9	0	0	0	110.5	L175 L209 A217 S218 L221	L175-L213 HydrophobicContact CD1-CD1 3.65Å; L175-L213 HydrophobicContact CD1-CD2 4.01Å; L175-L213 HydrophobicContact CD2-CD1 3.95Å; L175-L213 HydrophobicContact CG-CD1 4.48Å; L209-L213 HydrophobicContact CB-CD1 4.35Å; L209-L213 WeakPolarHBondContact O-CB 3.31Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.42Å; L213-A217 HydrophobicContact CB-CB 3.94Å; L213-A217 HydrophobicContact CD2-CB 4.06Å; L213-A217 HydrophobicContact CG-CB 4.38Å; L213-S218 WeakPolarHBondContact O-CB 3.29Å; L213-L221 HydrophobicContact CD1-CB 4.46Å; L213-L221 HydrophobicContact CD1-CD2 3.83Å
214	A	81.6	Confident	93	Very high	86 Å²	86	33.3 Å²	33.3	71%	0.711	23%	0.228	S	C	*	.			trans	-76.5	140.1	177.1	0	0	0	0	0	112.2	A217	A214-A217 PolarHBondContact O-N 3.08Å
215	G	85.5	Confident	93	Very high	27 Å²	27	34 Å²	34	28%	0.278	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-123.2	166	0	0	0	0	0	114.3	A217 S218 I219	G215-A217 PolarHBondContact O-N 3.36Å; G215-S218 PolarHBondContact O-N 3.18Å; G215-S218 VanDerWaalsContact O-N 3.15Å; G215-I219 WeakPolarHBondContact O-CG1 3.3Å; G215-I219 PolarHBondContact O-N 2.81Å; G215-I219 VanDerWaalsContact O-N 3.14Å
216	P	87.9	Confident	93	Very high	114 Å²	114	34.2 Å²	34.2	74%	0.74	24%	0.237	S	C	*	.	H	α-helix	trans	-53.5	-24.8	-174.4	-28.8	35.7	0	0	0	116.2	G220	P216-G220 PolarHBondContact O-N 2.61Å
217	A	89.9	Confident	93	Very high	40 Å²	40	35 Å²	35	33%	0.331	24%	0.241	S	C	.	.	H	α-helix	trans	-75.6	-42.2	179.8	0	0	0	0	0	112.8	L213 A214 G215 I219 G220 L221	L213-A217 HydrophobicContact CB-CB 3.94Å; L213-A217 HydrophobicContact CD2-CB 4.06Å; L213-A217 HydrophobicContact CG-CB 4.38Å; A214-A217 PolarHBondContact O-N 3.08Å; G215-A217 PolarHBondContact O-N 3.36Å; A217-I219 VanDerWaalsContact C-N 3.35Å; A217-G220 PolarHBondContact O-N 2.88Å; A217-L221 WeakPolarHBondContact O-CB 3.38Å; A217-L221 PolarHBondContact O-N 3.06Å
218	S	93.1	Very high	93	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72.9	-30.2	174.1	178.5	0	0	0	0	111.7	A210 L213 G215 L221 L222 N259	A210-S218 PolarHBondContact O-OG 2.74Å; L213-S218 WeakPolarHBondContact O-CB 3.29Å; G215-S218 PolarHBondContact O-N 3.18Å; G215-S218 VanDerWaalsContact O-N 3.15Å; S218-L221 PolarHBondContact O-N 2.79Å; S218-L222 PolarHBondContact O-N 3.5Å; S218-N259 PolarHBondContact O-ND2 3.04Å; S218-N259 VanDerWaalsContact O-ND2 3.08Å; S218-N259 PolarHBondContact OG-ND2 3.17Å
219	I	92.5	Very high	93.1	Very high	56 Å²	56	39.8 Å²	39.8	29%	0.287	26%	0.261	S	S	.	.	H	α-helix	trans	-67.2	-44.7	171.5	-60.3	165	0	0	0	110.8	G215 A217 L221 L222 E258 N259	G215-I219 WeakPolarHBondContact O-CG1 3.3Å; G215-I219 PolarHBondContact O-N 2.81Å; G215-I219 VanDerWaalsContact O-N 3.14Å; A217-I219 VanDerWaalsContact C-N 3.35Å; I219-L221 VanDerWaalsContact C-N 3.29Å; I219-L221 PolarHBondContact O-N 3.15Å; I219-L222 PolarHBondContact O-N 3.33Å; I219-E258 HydrophobicContact CD1-CB 3.75Å; I219-E258 HydrophobicContact CD1-CG 3.81Å; I219-E258 HydrophobicContact CG1-CB 4.07Å; I219-N259 WeakPolarHBondContact CA-OD1 3.43Å
220	G	91.7	Very high	93.2	Very high	61 Å²	61	39.6 Å²	39.6	63%	0.629	26%	0.261	S	S	*	.	H	α-helix	trans	-65.8	-27.4	176.1	0	0	0	0	0	114.3	P216 A217	P216-G220 PolarHBondContact O-N 2.61Å; A217-G220 PolarHBondContact O-N 2.88Å
221	L	95.6	Very high	93.3	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-76.4	-29.6	175.8	-177.9	62	0	0	0	112.9	L175 L206 L209 L213 A217 S218 I219 S223 I226 F253	L175-L221 HydrophobicContact CD2-CD1 4.47Å; L206-L221 HydrophobicContact CD2-CD1 4.46Å; L209-L221 HydrophobicContact CB-CD2 3.61Å; L209-L221 HydrophobicContact CD1-CD2 4.27Å; L213-L221 HydrophobicContact CD1-CB 4.46Å; L213-L221 HydrophobicContact CD1-CD2 3.83Å; A217-L221 WeakPolarHBondContact O-CB 3.38Å; A217-L221 PolarHBondContact O-N 3.06Å; S218-L221 PolarHBondContact O-N 2.79Å; I219-L221 VanDerWaalsContact C-N 3.29Å; I219-L221 PolarHBondContact O-N 3.15Å; L221-S223 PolarHBondContact O-N 3.33Å; L221-I226 HydrophobicContact CD1-CD1 4.42Å; L221-I226 WeakPolarHBondContact O-CD1 3.41Å; L221-F253 HydrophobicContact CB-CE1 4.19Å; L221-F253 HydrophobicContact CD2-CE1 4.07Å; L221-F253 HydrophobicContact CD2-CZ 4.08Å; L221-F253 HydrophobicContact CG-CE1 4Å; L221-F253 HydrophobicContact CG-CZ 4.02Å
222	L	96.9	Very high	93.6	Very high	16 Å²	16	38.8 Å²	38.8	8%	0.084	26%	0.257	C	S	.	.			trans	-79.3	67	177.4	-170.3	61.2	0	0	0	111.5	S218 I219 I226 L227 F253 N259 I263	S218-L222 PolarHBondContact O-N 3.5Å; I219-L222 PolarHBondContact O-N 3.33Å; L222-I226 HydrophobicContact CD1-CG2 4.19Å; L222-L227 HydrophobicContact CD1-CB 4.1Å; L222-L227 HydrophobicContact CD1-CD1 4.49Å; L222-F253 HydrophobicContact CB-CD1 3.87Å; L222-F253 HydrophobicContact CB-CE1 3.92Å; L222-F253 HydrophobicContact CB-CG 4.48Å; L222-F253 HydrophobicContact CD1-CD1 4.16Å; L222-F253 HydrophobicContact CD1-CD2 3.92Å; L222-F253 HydrophobicContact CD1-CE1 4.3Å; L222-F253 HydrophobicContact CD1-CE2 4.07Å; L222-F253 HydrophobicContact CD1-CG 3.98Å; L222-F253 HydrophobicContact CD1-CZ 4.26Å; L222-F253 HydrophobicContact CD2-CB 4.25Å; L222-F253 HydrophobicContact CD2-CD1 4.45Å; L222-F253 HydrophobicContact CD2-CG 4.37Å; L222-F253 HydrophobicContact CG-CD1 4.38Å; L222-N259 HydrophobicContact CD2-CB 3.74Å; L222-N259 WeakPolarHBondContact CD2-OD1 3.42Å; L222-I263 HydrophobicContact CD2-CD1 3.82Å; L222-I263 HydrophobicContact CD2-CG1 3.85Å
223	S	95.6	Very high	93.8	Very high	32 Å²	32	36.2 Å²	36.2	22%	0.224	25%	0.246	C	C	.	.			trans	-65.1	154.8	174.7	82	0	0	0	0	111.5	L221 G225 I226 L227	L221-S223 PolarHBondContact O-N 3.33Å; S223-G225 PolarHBondContact O-N 3.27Å; S223-I226 PolarHBondContact O-N 2.87Å; S223-I226 WeakPolarHBondContact OG-CG1 3.21Å; S223-I226 PolarHBondContact OG-N 3.44Å; S223-L227 PolarHBondContact O-N 3.39Å
224	P	96.1	Very high	94	Very high	113 Å²	113	35.7 Å²	35.7	73%	0.734	24%	0.243	S	C	*	.	H	α-helix	trans	-55.7	-34.2	177	-27.8	35.8	0	0	0	113.8	E228	P224-E228 WeakPolarHBondContact O-CB 3.29Å; P224-E228 PolarHBondContact O-N 3.48Å
225	G	96.8	Very high	94.6	Very high	18 Å²	18	35.4 Å²	35.4	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-37.7	175.7	0	0	0	0	0	113.2	L184 N185 S223 E228 Y229	L184-G225 CarbonylContact C-O 3.54Å; L184-G225 CarbonylContact O-C 3.58Å; L184-G225 WeakPolarHBondContact O-CA 3.26Å; N185-G225 WeakPolarHBondContact CA-O 3.43Å; S223-G225 PolarHBondContact O-N 3.27Å; G225-E228 PolarHBondContact O-N 3.06Å; G225-Y229 WeakPolarHBondContact O-CB 3.49Å; G225-Y229 PolarHBondContact O-N 2.9Å
226	I	97.6	Very high	94.8	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-42.8	173.4	-72.6	169.4	0	0	0	110.5	T179 L184 L206 L221 L222 S223 Y229 L230 F253	T179-I226 HydrophobicContact CG2-CD1 4.07Å; L184-I226 HydrophobicContact CB-CG1 4.08Å; L184-I226 HydrophobicContact CD1-CG1 4.17Å; L206-I226 HydrophobicContact CD1-CG2 4.08Å; L206-I226 HydrophobicContact CD2-CD1 4.29Å; L206-I226 HydrophobicContact CD2-CG2 4.27Å; L221-I226 HydrophobicContact CD1-CD1 4.42Å; L221-I226 WeakPolarHBondContact O-CD1 3.41Å; L222-I226 HydrophobicContact CD1-CG2 4.19Å; S223-I226 PolarHBondContact O-N 2.87Å; S223-I226 WeakPolarHBondContact OG-CG1 3.21Å; S223-I226 PolarHBondContact OG-N 3.44Å; I226-Y229 PolarHBondContact O-N 3.14Å; I226-L230 HydrophobicContact CG2-CD1 3.98Å; I226-L230 HydrophobicContact CG2-CG 4.48Å; I226-L230 WeakPolarHBondContact O-CB 3.31Å; I226-L230 VanDerWaalsContact O-CG 3.3Å; I226-L230 WeakPolarHBondContact O-CG 3.19Å; I226-L230 PolarHBondContact O-N 3.04Å; I226-F253 HydrophobicContact CG2-CE2 4.37Å; I226-F253 HydrophobicContact CG2-CZ 4.4Å
227	L	98.1	Very high	94.9	Very high	19 Å²	19	40.6 Å²	40.6	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-46.5	174.9	179.6	57.3	0	0	0	111.7	L222 S223 L230 L231 L250 T262 I263	L222-L227 HydrophobicContact CD1-CB 4.1Å; L222-L227 HydrophobicContact CD1-CD1 4.49Å; S223-L227 PolarHBondContact O-N 3.39Å; L227-L230 PolarHBondContact O-N 2.81Å; L227-L231 HydrophobicContact CD1-CD1 3.82Å; L227-L231 HydrophobicContact CD1-CG 4.02Å; L227-L231 HydrophobicContact CG-CD1 3.88Å; L227-L231 HydrophobicContact CG-CG 4.49Å; L227-L231 WeakPolarHBondContact O-CB 3.18Å; L227-L231 VanDerWaalsContact O-CG 3.23Å; L227-L231 WeakPolarHBondContact O-CG 3.35Å; L227-L231 PolarHBondContact O-N 2.98Å; L227-L250 HydrophobicContact CD1-CD2 3.76Å; L227-T262 HydrophobicContact CD2-CG2 3.88Å; L227-I263 HydrophobicContact CD1-CG1 3.87Å
228	E	96.9	Very high	95	Very high	106 Å²	106	40.1 Å²	40.1	50%	0.495	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-45.9	176.3	-171.3	-173.6	-146.3	0	0	111.8	G186 P224 G225 L231 Q232	G186-E228 WeakPolarHBondContact CA-OE2 3.28Å; G186-E228 PolarHBondContact N-OE2 3.45Å; P224-E228 WeakPolarHBondContact O-CB 3.29Å; P224-E228 PolarHBondContact O-N 3.48Å; G225-E228 PolarHBondContact O-N 3.06Å; E228-L231 PolarHBondContact O-N 2.99Å; E228-Q232 WeakPolarHBondContact O-CB 3.46Å; E228-Q232 PolarHBondContact O-N 3.14Å
229	Y	97.3	Very high	95.1	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-56.2	-50.9	175.9	171.8	-90.4	0	0	0	111.8	L184 V188 A189 H199 T202 G225 I226 Q232 C233	L184-Y229 HydrophobicContact CB-CD1 4.45Å; L184-Y229 HydrophobicContact CB-CD2 4.11Å; L184-Y229 HydrophobicContact CB-CG 3.95Å; L184-Y229 HydrophobicContact CD1-CD1 4.11Å; L184-Y229 HydrophobicContact CD1-CE1 4.15Å; L184-Y229 HydrophobicContact CD1-CG 4.41Å; L184-Y229 HydrophobicContact CD2-CD2 3.93Å; L184-Y229 HydrophobicContact CD2-CE1 4.44Å; L184-Y229 HydrophobicContact CD2-CE2 3.73Å; L184-Y229 HydrophobicContact CD2-CG 4.37Å; L184-Y229 HydrophobicContact CG-CD2 4.46Å; L184-Y229 HydrophobicContact CG-CG 4.47Å; V188-Y229 HydrophobicContact CB-CD2 4.41Å; V188-Y229 HydrophobicContact CG1-CD2 4.38Å; V188-Y229 HydrophobicContact CG1-CE2 4.08Å; A189-Y229 HydrophobicContact CB-CD2 3.65Å; A189-Y229 HydrophobicContact CB-CE2 4.17Å; A189-Y229 HydrophobicContact CB-CG 4.24Å; H199-Y229 AromaticContact CE1-CE2 3.77Å; H199-Y229 AromaticContact ND1-CE2 3.6Å; H199-Y229 AromaticContact ND1-CZ 3.49Å; H199-Y229 PolarHBondContact ND1-OH 3.14Å; T202-Y229 HydrophobicContact CG2-CE1 3.98Å; G225-Y229 WeakPolarHBondContact O-CB 3.49Å; G225-Y229 PolarHBondContact O-N 2.9Å; I226-Y229 PolarHBondContact O-N 3.14Å; Y229-Q232 PolarHBondContact O-N 3.1Å; Y229-C233 PolarHBondContact O-N 3.28Å; Y229-C233 PolarHBondContact O-SG 2.93Å; Y229-C233 VanDerWaalsContact O-SG 3.32Å
230	L	97.7	Very high	95.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-43.3	-179.5	-69.9	172.6	0	0	0	111.8	L206 I226 L227 Q232 C233 A246 A249 L250 F253	L206-L230 HydrophobicContact CD1-CD2 4.25Å; I226-L230 HydrophobicContact CG2-CD1 3.98Å; I226-L230 HydrophobicContact CG2-CG 4.48Å; I226-L230 WeakPolarHBondContact O-CB 3.31Å; I226-L230 VanDerWaalsContact O-CG 3.3Å; I226-L230 WeakPolarHBondContact O-CG 3.19Å; I226-L230 PolarHBondContact O-N 3.04Å; L227-L230 PolarHBondContact O-N 2.81Å; L230-Q232 VanDerWaalsContact C-N 3.34Å; L230-Q232 PolarHBondContact O-N 3.4Å; L230-C233 WeakPolarHBondContact O-CB 3.49Å; L230-C233 PolarHBondContact O-N 2.97Å; L230-A246 HydrophobicContact CD2-CB 4.08Å; L230-A249 HydrophobicContact CD1-CB 4.24Å; L230-A249 HydrophobicContact CD2-CB 4Å; L230-L250 HydrophobicContact CB-CD1 3.98Å; L230-L250 HydrophobicContact CB-CD2 3.95Å; L230-L250 HydrophobicContact CB-CG 3.92Å; L230-L250 HydrophobicContact CD1-CD2 4.02Å; L230-L250 HydrophobicContact CD1-CG 4.16Å; L230-F253 HydrophobicContact CD1-CD2 4.08Å; L230-F253 HydrophobicContact CD1-CE2 3.86Å
231	L	97.1	Very high	95.4	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.068	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-39.2	175.6	-68.5	169.4	0	0	0	111.9	L227 E228 C233 L234 L250 I268 R271	L227-L231 HydrophobicContact CD1-CD1 3.82Å; L227-L231 HydrophobicContact CD1-CG 4.02Å; L227-L231 HydrophobicContact CG-CD1 3.88Å; L227-L231 HydrophobicContact CG-CG 4.49Å; L227-L231 WeakPolarHBondContact O-CB 3.18Å; L227-L231 VanDerWaalsContact O-CG 3.23Å; L227-L231 WeakPolarHBondContact O-CG 3.35Å; L227-L231 PolarHBondContact O-N 2.98Å; E228-L231 PolarHBondContact O-N 2.99Å; L231-C233 VanDerWaalsContact C-N 3.33Å; L231-L234 WeakPolarHBondContact O-CB 3.19Å; L231-L234 PolarHBondContact O-N 3.19Å; L231-L234 VanDerWaalsContact O-N 3.12Å; L231-L250 HydrophobicContact CD2-CD1 4.23Å; L231-I268 HydrophobicContact CD2-CB 3.72Å; L231-I268 HydrophobicContact CD2-CD1 4.45Å; L231-I268 HydrophobicContact CD2-CG1 4.09Å; L231-R271 VanDerWaalsContact C-NH1 3.34Å; L231-R271 PolarHBondContact O-NH1 3.21Å
232	Q	95.7	Very high	95.4	Very high	30 Å²	30	39.7 Å²	39.7	14%	0.14	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-36.8	177.5	-174.6	73.2	-8.7	0	0	111.8	A189 C190 E228 Y229 L230 L234 K235	A189-Q232 HydrophobicContact CB-CB 3.58Å; A189-Q232 HydrophobicContact CB-CG 3.5Å; C190-Q232 PolarHBondContact SG-NE2 3.27Å; E228-Q232 WeakPolarHBondContact O-CB 3.46Å; E228-Q232 PolarHBondContact O-N 3.14Å; Y229-Q232 PolarHBondContact O-N 3.1Å; L230-Q232 VanDerWaalsContact C-N 3.34Å; L230-Q232 PolarHBondContact O-N 3.4Å; Q232-L234 PolarHBondContact O-N 3.12Å; Q232-K235 VanDerWaalsContact CD-NZ 3.29Å; Q232-K235 WeakPolarHBondContact O-CB 3.47Å; Q232-K235 PolarHBondContact O-N 2.93Å
233	C	95.5	Very high	95.4	Very high	1 Å²	1	39 Å²	39	1%	0.007	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.5	171.7	-73.9	0	0	0	0	114.5	Y229 L230 L231 S238 V242 M243 A246	Y229-C233 PolarHBondContact O-N 3.28Å; Y229-C233 PolarHBondContact O-SG 2.93Å; Y229-C233 VanDerWaalsContact O-SG 3.32Å; L230-C233 WeakPolarHBondContact O-CB 3.49Å; L230-C233 PolarHBondContact O-N 2.97Å; L231-C233 VanDerWaalsContact C-N 3.33Å; C233-S238 WeakPolarHBondContact O-CB 3.28Å; C233-S238 PolarHBondContact O-OG 3.08Å; C233-V242 HydrophobicContact CB-CG1 3.85Å; C233-M243 WeakPolarHBondContact O-CA 3.5Å; C233-M243 WeakPolarHBondContact O-CG 3.11Å; C233-A246 HydrophobicContact CB-CB 3.57Å
234	L	95.9	Very high	95.5	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	12	173.1	-57.7	-178.2	0	0	0	114.2	L231 Q232 M243 A246 L247 L250 I268 R271 L272 L275	L231-L234 WeakPolarHBondContact O-CB 3.19Å; L231-L234 PolarHBondContact O-N 3.19Å; L231-L234 VanDerWaalsContact O-N 3.12Å; Q232-L234 PolarHBondContact O-N 3.12Å; L234-M243 HydrophobicContact CD2-CB 4.39Å; L234-M243 VanDerWaalsContact CD2-O 3.27Å; L234-M243 WeakPolarHBondContact CD2-O 3.28Å; L234-A246 HydrophobicContact CD2-CB 4.13Å; L234-L247 HydrophobicContact CD2-CB 3.88Å; L234-L250 HydrophobicContact CD1-CD1 3.8Å; L234-L250 HydrophobicContact CG-CD1 4.45Å; L234-I268 HydrophobicContact CD1-CG1 4.23Å; L234-R271 HydrophobicContact CB-CB 4.35Å; L234-L272 HydrophobicContact CD1-CD2 4.3Å; L234-L275 HydrophobicContact CB-CD1 4.4Å
235	K	92.9	Very high	95.6	Very high	80 Å²	80	32.5 Å²	32.5	35%	0.348	17%	0.165	S	C	.	.	S	Bend	trans	-79.1	147.1	176	-81.6	-177.2	170.2	165.6	0	111.6	Q232 Q237 S238 M243	Q232-K235 VanDerWaalsContact CD-NZ 3.29Å; Q232-K235 WeakPolarHBondContact O-CB 3.47Å; Q232-K235 PolarHBondContact O-N 2.93Å; K235-Q237 PolarHBondContact O-N 3.33Å; K235-S238 WeakPolarHBondContact O-CB 3.23Å; K235-S238 PolarHBondContact O-N 3.37Å; K235-S238 PolarHBondContact O-OG 3.44Å; K235-M243 WeakPolarHBondContact O-CE 3.28Å
236	L	90.6	Very high	95.7	Very high	87 Å²	87	31.6 Å²	31.6	46%	0.455	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-18.5	179.5	-66.7	179.9	0	0	0	115	T274 L275 W278	L236-T274 HydrophobicContact CD1-CG2 3.88Å; L236-T274 HydrophobicContact CD2-CG2 4.01Å; L236-T274 HydrophobicContact CG-CG2 4.2Å; L236-L275 HydrophobicContact CD2-CD2 3.85Å; L236-W278 HydrophobicContact CD2-CH2 3.99Å; L236-W278 HydrophobicContact CD2-CZ2 3.63Å
237	Q	89.4	Confident	95.7	Very high	163 Å²	163	31.4 Å²	31.4	76%	0.762	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.7	177.2	-61.8	78	18	0	0	113.7	K235	K235-Q237 PolarHBondContact O-N 3.33Å
238	S	92.3	Very high	95.7	Very high	31 Å²	31	30.7 Å²	30.7	22%	0.217	15%	0.152	C	C	.	.	S	Bend	trans	-75.2	163.9	178.1	-59.6	0	0	0	0	111.5	C233 K235 M243	C233-S238 WeakPolarHBondContact O-CB 3.28Å; C233-S238 PolarHBondContact O-OG 3.08Å; K235-S238 WeakPolarHBondContact O-CB 3.23Å; K235-S238 PolarHBondContact O-N 3.37Å; K235-S238 PolarHBondContact O-OG 3.44Å; S238-M243 WeakPolarHBondContact O-CE 3.45Å
239	H	94.1	Very high	95.8	Very high	69 Å²	69	25.7 Å²	25.7	32%	0.319	13%	0.128	S	C	.	.			trans	-69.7	137.1	174.3	-165	-94.3	0	0	0	110.5	P196 T241 V242 M243	P196-H239 HydrophobicContact CB-CB 3.79Å; H239-T241 VanDerWaalsContact C-N 3.32Å; H239-T241 PolarHBondContact CE1-OG1 2.97Å; H239-T241 PolarHBondContact ND1-N 3.46Å; H239-T241 PolarHBondContact ND1-OG1 3.28Å; H239-T241 PolarHBondContact O-N 3.08Å; H239-V242 HydrophobicContact CB-CB 4.25Å; H239-V242 HydrophobicContact CB-CG2 3.98Å; H239-V242 WeakPolarHBondContact O-CA 3.33Å; H239-V242 WeakPolarHBondContact O-CB 3.44Å; H239-V242 PolarHBondContact O-N 3.45Å; H239-M243 PolarHBondContact O-N 3.31Å
240	P	95.8	Very high	95.9	Very high	21 Å²	21	25.5 Å²	25.5	14%	0.136	13%	0.127	C	C	.	.	H	α-helix	trans	-53.6	-43.2	-177.6	-30.2	36.9	0	0	0	114	V242 M243 L244 L285 K286 V289	P240-V242 PolarHBondContact O-N 3.01Å; P240-M243 WeakPolarHBondContact O-CB 3.49Å; P240-M243 PolarHBondContact O-N 3.41Å; P240-M243 VanDerWaalsContact O-N 3.12Å; P240-L244 PolarHBondContact O-N 3.26Å; P240-L285 HydrophobicContact CB-CB 3.87Å; P240-K286 HydrophobicContact CB-CG 4.38Å; P240-K286 HydrophobicContact CG-CG 4.08Å; P240-V289 HydrophobicContact CB-CG2 4.24Å; P240-V289 WeakPolarHBondContact O-CG2 3.42Å
241	T	95.1	Very high	95.9	Very high	17 Å²	17	26.1 Å²	26.1	10%	0.104	13%	0.13	C	C	.	.	H	α-helix	trans	-62.8	-28	175.1	-21.3	0	0	0	0	113.3	L151 R200 H239 F245	L151-T241 HydrophobicContact CD1-CG2 4.1Å; R200-T241 HydrophobicContact CG-CG2 4.12Å; H239-T241 VanDerWaalsContact C-N 3.32Å; H239-T241 PolarHBondContact CE1-OG1 2.97Å; H239-T241 PolarHBondContact ND1-N 3.46Å; H239-T241 PolarHBondContact ND1-OG1 3.28Å; H239-T241 PolarHBondContact O-N 3.08Å; T241-F245 HydrophobicContact CG2-CD2 4.21Å; T241-F245 HydrophobicContact CG2-CE2 4.24Å; T241-F245 WeakPolarHBondContact O-CD2 3.41Å; T241-F245 PolarHBondContact O-N 3.47Å
242	V	96.1	Very high	95.8	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.03	13%	0.13	C	C	.	.	H	α-helix	trans	-74.1	-41.9	173.8	171.5	0	0	0	0	110.3	P196 H199 R200 C233 H239 P240 L244 A246	P196-V242 HydrophobicContact CB-CG2 4Å; P196-V242 VanDerWaalsContact O-CG2 3.29Å; P196-V242 WeakPolarHBondContact O-CG2 3.28Å; H199-V242 HydrophobicContact CB-CB 4.32Å; H199-V242 HydrophobicContact CB-CG1 3.71Å; H199-V242 HydrophobicContact CB-CG2 3.6Å; R200-V242 HydrophobicContact CB-CG2 4.35Å; C233-V242 HydrophobicContact CB-CG1 3.85Å; H239-V242 HydrophobicContact CB-CB 4.25Å; H239-V242 HydrophobicContact CB-CG2 3.98Å; H239-V242 WeakPolarHBondContact O-CA 3.33Å; H239-V242 WeakPolarHBondContact O-CB 3.44Å; H239-V242 PolarHBondContact O-N 3.45Å; P240-V242 PolarHBondContact O-N 3.01Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.43Å; V242-A246 WeakPolarHBondContact O-CB 3.47Å; V242-A246 PolarHBondContact O-N 3.25Å
243	M	97.3	Very high	95.9	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-44.5	172.9	-51.4	-173.1	-156.7	0	0	111.3	C233 L234 K235 S238 H239 P240 A246 L247 L275 W278 V289	C233-M243 WeakPolarHBondContact O-CA 3.5Å; C233-M243 WeakPolarHBondContact O-CG 3.11Å; L234-M243 HydrophobicContact CD2-CB 4.39Å; L234-M243 VanDerWaalsContact CD2-O 3.27Å; L234-M243 WeakPolarHBondContact CD2-O 3.28Å; K235-M243 WeakPolarHBondContact O-CE 3.28Å; S238-M243 WeakPolarHBondContact O-CE 3.45Å; H239-M243 PolarHBondContact O-N 3.31Å; P240-M243 WeakPolarHBondContact O-CB 3.49Å; P240-M243 PolarHBondContact O-N 3.41Å; P240-M243 VanDerWaalsContact O-N 3.12Å; M243-A246 PolarHBondContact O-N 3.17Å; M243-L247 WeakPolarHBondContact O-CB 3.19Å; M243-L247 PolarHBondContact O-N 2.75Å; M243-L275 HydrophobicContact SD-CD1 4.43Å; M243-L275 HydrophobicContact SD-CD2 3.71Å; M243-W278 HydrophobicContact CE-CH2 3.7Å; M243-W278 HydrophobicContact CE-CZ3 3.88Å; M243-W278 HydrophobicContact SD-CH2 3.99Å; M243-W278 HydrophobicContact SD-CZ3 3.65Å; M243-V289 HydrophobicContact CB-CG1 4.01Å; M243-V289 HydrophobicContact CB-CG2 4.05Å; M243-V289 HydrophobicContact SD-CG1 4.28Å
244	L	97.9	Very high	96	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-59.1	-53.3	-178.7	-179.2	59.8	0	0	0	111.5	P240 V242 L247 I248 Q288 V289 C292	P240-L244 PolarHBondContact O-N 3.26Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.43Å; L244-L247 PolarHBondContact O-N 3.16Å; L244-I248 HydrophobicContact CD1-CD1 3.95Å; L244-I248 HydrophobicContact CG-CD1 3.91Å; L244-I248 WeakPolarHBondContact O-CD1 3.42Å; L244-I248 VanDerWaalsContact O-CG1 3.28Å; L244-I248 WeakPolarHBondContact O-CG1 3.25Å; L244-I248 PolarHBondContact O-N 2.9Å; L244-Q288 HydrophobicContact CD1-CB 4.11Å; L244-Q288 HydrophobicContact CD2-CB 3.79Å; L244-V289 HydrophobicContact CB-CG2 3.87Å; L244-C292 HydrophobicContact CD1-CB 4.29Å
245	F	98	Very high	95.8	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-74	-28.4	-178.8	-80.7	-89.2	0	0	0	113.1	P157 R200 A204 T241 A249 Y471	P157-F245 HydrophobicContact CB-CE1 3.56Å; P157-F245 HydrophobicContact CB-CE2 4.24Å; P157-F245 HydrophobicContact CB-CZ 3.33Å; P157-F245 HydrophobicContact CG-CE1 4.28Å; P157-F245 HydrophobicContact CG-CE2 4.06Å; P157-F245 HydrophobicContact CG-CZ 3.58Å; R200-F245 HydrophobicContact CG-CB 4.21Å; R200-F245 HydrophobicContact CG-CD2 3.61Å; R200-F245 HydrophobicContact CG-CE2 4.21Å; R200-F245 HydrophobicContact CG-CG 3.92Å; A204-F245 HydrophobicContact CB-CD1 3.74Å; A204-F245 HydrophobicContact CB-CE1 4.18Å; T241-F245 HydrophobicContact CG2-CD2 4.21Å; T241-F245 HydrophobicContact CG2-CE2 4.24Å; T241-F245 WeakPolarHBondContact O-CD2 3.41Å; T241-F245 PolarHBondContact O-N 3.47Å; F245-A249 WeakPolarHBondContact O-CB 3.5Å; F245-A249 PolarHBondContact O-N 3.4Å; F245-Y471 AromaticContact CE1-CD1 3.7Å; F245-Y471 HydrophobicContact CE1-CD1 3.7Å; F245-Y471 AromaticContact CE1-CD2 3.9Å; F245-Y471 HydrophobicContact CE1-CD2 3.9Å; F245-Y471 AromaticContact CE1-CE1 3.72Å; F245-Y471 HydrophobicContact CE1-CE1 3.72Å; F245-Y471 AromaticContact CE1-CE2 3.87Å; F245-Y471 HydrophobicContact CE1-CE2 3.87Å; F245-Y471 AromaticContact CE1-CG 3.79Å; F245-Y471 HydrophobicContact CE1-CG 3.79Å; F245-Y471 AromaticContact CE1-CZ 3.79Å; F245-Y471 AromaticContact CZ-CD1 3.9Å; F245-Y471 HydrophobicContact CZ-CD1 3.9Å; F245-Y471 AromaticContact CZ-CD2 3.9Å; F245-Y471 HydrophobicContact CZ-CD2 3.9Å; F245-Y471 HydrophobicContact CZ-CE1 4.38Å; F245-Y471 HydrophobicContact CZ-CE2 4.34Å; F245-Y471 AromaticContact CZ-CG 3.64Å; F245-Y471 HydrophobicContact CZ-CG 3.64Å
246	A	98.2	Very high	95.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.2	-38.9	170.6	0	0	0	0	0	112	L230 C233 L234 V242 M243 A249 L250	L230-A246 HydrophobicContact CD2-CB 4.08Å; C233-A246 HydrophobicContact CB-CB 3.57Å; L234-A246 HydrophobicContact CD2-CB 4.13Å; V242-A246 WeakPolarHBondContact O-CB 3.47Å; V242-A246 PolarHBondContact O-N 3.25Å; M243-A246 PolarHBondContact O-N 3.17Å; A246-A249 PolarHBondContact O-N 2.97Å; A246-L250 WeakPolarHBondContact O-CD1 3.34Å; A246-L250 WeakPolarHBondContact O-CG 3.41Å; A246-L250 PolarHBondContact O-N 3.01Å; A246-L250 VanDerWaalsContact O-N 3.09Å
247	L	98.6	Very high	95.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.1	-50.4	173.6	177.6	51.1	0	0	0	111	L234 M243 L244 A249 L250 E251 L272 C292 A293	L234-L247 HydrophobicContact CD2-CB 3.88Å; M243-L247 WeakPolarHBondContact O-CB 3.19Å; M243-L247 PolarHBondContact O-N 2.75Å; L244-L247 PolarHBondContact O-N 3.16Å; L247-A249 VanDerWaalsContact C-N 3.27Å; L247-A249 PolarHBondContact O-N 3.34Å; L247-L250 WeakPolarHBondContact O-CB 3.27Å; L247-L250 PolarHBondContact O-N 3.39Å; L247-E251 HydrophobicContact CD1-CG 4.26Å; L247-E251 WeakPolarHBondContact O-CG 3.48Å; L247-E251 PolarHBondContact O-N 3.03Å; L247-L272 HydrophobicContact CD1-CD1 4.11Å; L247-L272 HydrophobicContact CD1-CD2 3.76Å; L247-L272 HydrophobicContact CD2-CD2 3.87Å; L247-L272 HydrophobicContact CG-CD2 4.42Å; L247-C292 HydrophobicContact CD2-CB 3.67Å; L247-C292 HydrophobicContact CG-CB 4.47Å; L247-A293 HydrophobicContact CD2-CB 4.18Å
248	I	98.3	Very high	96.1	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-56.1	-44.4	177	-66.8	160.4	0	0	0	110.2	L244 L250 E251 K252 D343 Y471	L244-I248 HydrophobicContact CD1-CD1 3.95Å; L244-I248 HydrophobicContact CG-CD1 3.91Å; L244-I248 WeakPolarHBondContact O-CD1 3.42Å; L244-I248 VanDerWaalsContact O-CG1 3.28Å; L244-I248 WeakPolarHBondContact O-CG1 3.25Å; L244-I248 PolarHBondContact O-N 2.9Å; I248-L250 VanDerWaalsContact C-N 3.34Å; I248-L250 PolarHBondContact O-N 3.2Å; I248-E251 WeakPolarHBondContact O-CB 3.46Å; I248-E251 PolarHBondContact O-N 3.38Å; I248-E251 VanDerWaalsContact O-N 3.13Å; I248-K252 HydrophobicContact CG2-CG 4.35Å; I248-K252 WeakPolarHBondContact O-CG 3.13Å; I248-K252 PolarHBondContact O-N 3.14Å; I248-D343 VanDerWaalsContact CD1-OD1 3.23Å; I248-D343 WeakPolarHBondContact CD1-OD1 3.24Å; I248-D343 HydrophobicContact CG1-CB 4.49Å; I248-D343 HydrophobicContact CG2-CB 4.39Å; I248-Y471 HydrophobicContact CD1-CD1 4.06Å; I248-Y471 HydrophobicContact CD1-CE1 4.4Å; I248-Y471 HydrophobicContact CG2-CE1 4.22Å
249	A	98.3	Very high	96.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.8	-44.1	175.8	0	0	0	0	0	112.7	S203 L230 F245 A246 L247 E251 K252 F253	S203-A249 WeakPolarHBondContact O-CB 3.41Å; L230-A249 HydrophobicContact CD1-CB 4.24Å; L230-A249 HydrophobicContact CD2-CB 4Å; F245-A249 WeakPolarHBondContact O-CB 3.5Å; F245-A249 PolarHBondContact O-N 3.4Å; A246-A249 PolarHBondContact O-N 2.97Å; L247-A249 VanDerWaalsContact C-N 3.27Å; L247-A249 PolarHBondContact O-N 3.34Å; A249-E251 VanDerWaalsContact C-N 3.35Å; A249-E251 PolarHBondContact O-N 2.71Å; A249-K252 PolarHBondContact O-N 3.07Å; A249-F253 WeakPolarHBondContact O-CD2 3.36Å; A249-F253 PolarHBondContact O-N 3.33Å
250	L	98.6	Very high	96.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.3	-36.8	175.5	-70.6	161.7	0	0	0	112.2	L227 L230 L231 L234 A246 L247 I248 A254 I263 I268	L227-L250 HydrophobicContact CD1-CD2 3.76Å; L230-L250 HydrophobicContact CB-CD1 3.98Å; L230-L250 HydrophobicContact CB-CD2 3.95Å; L230-L250 HydrophobicContact CB-CG 3.92Å; L230-L250 HydrophobicContact CD1-CD2 4.02Å; L230-L250 HydrophobicContact CD1-CG 4.16Å; L231-L250 HydrophobicContact CD2-CD1 4.23Å; L234-L250 HydrophobicContact CD1-CD1 3.8Å; L234-L250 HydrophobicContact CG-CD1 4.45Å; A246-L250 WeakPolarHBondContact O-CD1 3.34Å; A246-L250 WeakPolarHBondContact O-CG 3.41Å; A246-L250 PolarHBondContact O-N 3.01Å; A246-L250 VanDerWaalsContact O-N 3.09Å; L247-L250 WeakPolarHBondContact O-CB 3.27Å; L247-L250 PolarHBondContact O-N 3.39Å; I248-L250 VanDerWaalsContact C-N 3.34Å; I248-L250 PolarHBondContact O-N 3.2Å; L250-A254 VanDerWaalsContact O-CB 3.28Å; L250-A254 WeakPolarHBondContact O-CB 3.44Å; L250-A254 PolarHBondContact O-N 3.21Å; L250-I263 HydrophobicContact CD2-CD1 4.01Å; L250-I263 HydrophobicContact CD2-CG1 4.09Å; L250-I263 HydrophobicContact CD2-CG2 4.2Å; L250-I263 WeakPolarHBondContact O-CD1 3.25Å; L250-I268 HydrophobicContact CB-CD1 4.17Å; L250-I268 HydrophobicContact CD1-CD1 3.94Å
251	E	97.6	Very high	96.4	Very high	13 Å²	13	26.4 Å²	26.4	6%	0.061	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-40.2	172.7	-64.1	-176.3	147.5	0	0	112.5	L247 I248 A249 A254 S296 L300 F301 K332	L247-E251 HydrophobicContact CD1-CG 4.26Å; L247-E251 WeakPolarHBondContact O-CG 3.48Å; L247-E251 PolarHBondContact O-N 3.03Å; I248-E251 WeakPolarHBondContact O-CB 3.46Å; I248-E251 PolarHBondContact O-N 3.38Å; I248-E251 VanDerWaalsContact O-N 3.13Å; A249-E251 VanDerWaalsContact C-N 3.35Å; A249-E251 PolarHBondContact O-N 2.71Å; E251-A254 PolarHBondContact O-N 2.95Å; E251-S296 WeakPolarHBondContact OE1-CB 3.24Å; E251-S296 PolarHBondContact OE1-OG 2.92Å; E251-L300 HydrophobicContact CB-CD1 3.82Å; E251-L300 HydrophobicContact CG-CD1 3.72Å; E251-F301 HydrophobicContact CG-CE2 4.13Å; E251-K332 IonicContact OE1-NZ 2.81Å; E251-K332 PolarHBondContact OE1-NZ 3.09Å; E251-K332 IonicContact OE2-NZ 3.83Å; E251-K332 PolarHBondContact OE2-NZ 3.38Å
252	K	96.6	Very high	96.5	Very high	14 Å²	14	28.9 Å²	28.9	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-44.7	175.8	-60.5	-60.5	179.1	149.6	0	111.6	G207 A210 E211 I248 A249 A254 Q255 D343	G207-K252 WeakPolarHBondContact O-CB 3.37Å; A210-K252 HydrophobicContact CB-CB 3.93Å; E211-K252 HydrophobicContact CB-CB 4.47Å; E211-K252 HydrophobicContact CB-CD 4.17Å; E211-K252 HydrophobicContact CG-CD 4.42Å; E211-K252 VanDerWaalsContact OE1-CD 3.32Å; E211-K252 WeakPolarHBondContact OE1-CD 3.33Å; E211-K252 IonicContact OE1-NZ 2.99Å; E211-K252 PolarHBondContact OE1-NZ 2.96Å; E211-K252 IonicContact OE2-NZ 3.44Å; E211-K252 PolarHBondContact OE2-NZ 3.06Å; I248-K252 HydrophobicContact CG2-CG 4.35Å; I248-K252 WeakPolarHBondContact O-CG 3.13Å; I248-K252 PolarHBondContact O-N 3.14Å; A249-K252 PolarHBondContact O-N 3.07Å; K252-A254 VanDerWaalsContact C-N 3.26Å; K252-A254 PolarHBondContact O-N 2.94Å; K252-Q255 VanDerWaalsContact O-CB 3.25Å; K252-Q255 WeakPolarHBondContact O-CB 3.5Å; K252-Q255 VanDerWaalsContact O-CG 3.27Å; K252-Q255 WeakPolarHBondContact O-CG 3.31Å; K252-Q255 PolarHBondContact O-N 3.16Å; K252-Q255 VanDerWaalsContact O-N 3.09Å; K252-D343 VanDerWaalsContact CE-O 3.23Å; K252-D343 WeakPolarHBondContact CE-O 3.33Å; K252-D343 PolarHBondContact NZ-O 2.92Å
253	F	97.7	Very high	96.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.3	-39.5	172.2	-81.4	-65.6	0	0	0	111.9	L206 A210 L221 L222 I226 L230 A249 Q255 T256 N259 I263	L206-F253 HydrophobicContact CB-CE2 4.18Å; L206-F253 HydrophobicContact CB-CZ 4.47Å; L206-F253 HydrophobicContact CD2-CZ 4.41Å; A210-F253 HydrophobicContact CB-CB 4.33Å; A210-F253 HydrophobicContact CB-CD1 3.46Å; A210-F253 VanDerWaalsContact CB-CD1 3.46Å; A210-F253 HydrophobicContact CB-CD2 3.97Å; A210-F253 HydrophobicContact CB-CE1 3.65Å; A210-F253 HydrophobicContact CB-CE2 4.12Å; A210-F253 HydrophobicContact CB-CG 3.64Å; A210-F253 HydrophobicContact CB-CZ 3.97Å; L221-F253 HydrophobicContact CB-CE1 4.19Å; L221-F253 HydrophobicContact CD2-CE1 4.07Å; L221-F253 HydrophobicContact CD2-CZ 4.08Å; L221-F253 HydrophobicContact CG-CE1 4Å; L221-F253 HydrophobicContact CG-CZ 4.02Å; L222-F253 HydrophobicContact CB-CD1 3.87Å; L222-F253 HydrophobicContact CB-CE1 3.92Å; L222-F253 HydrophobicContact CB-CG 4.48Å; L222-F253 HydrophobicContact CD1-CD1 4.16Å; L222-F253 HydrophobicContact CD1-CD2 3.92Å; L222-F253 HydrophobicContact CD1-CE1 4.3Å; L222-F253 HydrophobicContact CD1-CE2 4.07Å; L222-F253 HydrophobicContact CD1-CG 3.98Å; L222-F253 HydrophobicContact CD1-CZ 4.26Å; L222-F253 HydrophobicContact CD2-CB 4.25Å; L222-F253 HydrophobicContact CD2-CD1 4.45Å; L222-F253 HydrophobicContact CD2-CG 4.37Å; L222-F253 HydrophobicContact CG-CD1 4.38Å; I226-F253 HydrophobicContact CG2-CE2 4.37Å; I226-F253 HydrophobicContact CG2-CZ 4.4Å; L230-F253 HydrophobicContact CD1-CD2 4.08Å; L230-F253 HydrophobicContact CD1-CE2 3.86Å; A249-F253 WeakPolarHBondContact O-CD2 3.36Å; A249-F253 PolarHBondContact O-N 3.33Å; F253-Q255 PolarHBondContact O-N 3.47Å; F253-Q255 VanDerWaalsContact O-N 3.08Å; F253-T256 PolarHBondContact O-N 2.96Å; F253-N259 HydrophobicContact CB-CB 4.42Å; F253-N259 WeakPolarHBondContact O-CB 3.35Å; F253-N259 PolarHBondContact O-ND2 3.41Å; F253-I263 HydrophobicContact CB-CD1 3.73Å
254	A	96.2	Very high	96.5	Very high	6 Å²	6	31 Å²	31	5%	0.05	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	11.5	177	0	0	0	0	0	115.2	L250 E251 K252 K260 I263 F301	L250-A254 VanDerWaalsContact O-CB 3.28Å; L250-A254 WeakPolarHBondContact O-CB 3.44Å; L250-A254 PolarHBondContact O-N 3.21Å; E251-A254 PolarHBondContact O-N 2.95Å; K252-A254 VanDerWaalsContact C-N 3.26Å; K252-A254 PolarHBondContact O-N 2.94Å; A254-K260 HydrophobicContact CB-CB 3.94Å; A254-K260 HydrophobicContact CB-CG 4.15Å; A254-I263 HydrophobicContact CB-CD1 4.25Å; A254-F301 HydrophobicContact CB-CE1 3.62Å; A254-F301 HydrophobicContact CB-CZ 3.56Å
255	Q	91.9	Very high	96.4	Very high	97 Å²	97	38.6 Å²	38.6	45%	0.453	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-30.2	164.3	-67.8	175.7	-7.4	0	0	111.9	E211 K252 F253	E211-Q255 PolarHBondContact OE1-NE2 2.9Å; K252-Q255 VanDerWaalsContact O-CB 3.25Å; K252-Q255 WeakPolarHBondContact O-CB 3.5Å; K252-Q255 VanDerWaalsContact O-CG 3.27Å; K252-Q255 WeakPolarHBondContact O-CG 3.31Å; K252-Q255 PolarHBondContact O-N 3.16Å; K252-Q255 VanDerWaalsContact O-N 3.09Å; F253-Q255 PolarHBondContact O-N 3.47Å; F253-Q255 VanDerWaalsContact O-N 3.08Å
256	T	92.9	Very high	96.3	Very high	22 Å²	22	39.4 Å²	39.4	14%	0.135	21%	0.211	C	C	.	.	S	Bend	trans	-87	146.7	169.4	70.1	0	0	0	0	110.9	F253 E258 N259 K260	F253-T256 PolarHBondContact O-N 2.96Å; T256-E258 PolarHBondContact O-N 3.25Å; T256-N259 VanDerWaalsContact OG1-CB 3.28Å; T256-N259 WeakPolarHBondContact OG1-CB 3.28Å; T256-N259 VanDerWaalsContact OG1-CG 3.31Å; T256-N259 PolarHBondContact OG1-ND2 3.44Å; T256-K260 VanDerWaalsContact O-CB 3.25Å; T256-K260 WeakPolarHBondContact O-CB 3.49Å; T256-K260 PolarHBondContact O-N 3.26Å
257	S	91.5	Very high	96.1	Very high	86 Å²	86	41.6 Å²	41.6	60%	0.601	23%	0.227	S	C	*	.	H	α-helix	trans	-67.7	-38.7	-172.6	-65.9	0	0	0	0	112.1	K260 L261	S257-K260 PolarHBondContact O-N 3.41Å; S257-L261 WeakPolarHBondContact O-CG 3.43Å; S257-L261 PolarHBondContact O-N 2.84Å
258	E	94.9	Very high	96.1	Very high	102 Å²	102	41.7 Å²	41.7	48%	0.477	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-51.8	-178.5	-61.6	86.3	161.7	0	0	110.7	I219 T256 K260 L261 T262	I219-E258 HydrophobicContact CD1-CB 3.75Å; I219-E258 HydrophobicContact CD1-CG 3.81Å; I219-E258 HydrophobicContact CG1-CB 4.07Å; T256-E258 PolarHBondContact O-N 3.25Å; E258-K260 VanDerWaalsContact C-N 3.29Å; E258-K260 PolarHBondContact O-N 2.59Å; E258-L261 WeakPolarHBondContact O-CB 3.49Å; E258-L261 PolarHBondContact O-N 2.71Å; E258-L261 VanDerWaalsContact O-N 3.16Å; E258-T262 PolarHBondContact O-N 2.99Å; E258-T262 PolarHBondContact O-OG1 2.64Å; E258-T262 VanDerWaalsContact O-OG1 3.11Å
259	N	96.9	Very high	96	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-39.8	174.3	-73.9	-13.6	0	0	0	111.2	S218 I219 L222 F253 T256 L261 T262 I263	S218-N259 PolarHBondContact O-ND2 3.04Å; S218-N259 VanDerWaalsContact O-ND2 3.08Å; S218-N259 PolarHBondContact OG-ND2 3.17Å; I219-N259 WeakPolarHBondContact CA-OD1 3.43Å; L222-N259 HydrophobicContact CD2-CB 3.74Å; L222-N259 WeakPolarHBondContact CD2-OD1 3.42Å; F253-N259 HydrophobicContact CB-CB 4.42Å; F253-N259 WeakPolarHBondContact O-CB 3.35Å; F253-N259 PolarHBondContact O-ND2 3.41Å; T256-N259 VanDerWaalsContact OG1-CB 3.28Å; T256-N259 WeakPolarHBondContact OG1-CB 3.28Å; T256-N259 VanDerWaalsContact OG1-CG 3.31Å; T256-N259 PolarHBondContact OG1-ND2 3.44Å; N259-L261 VanDerWaalsContact C-N 3.32Å; N259-L261 PolarHBondContact O-N 3.46Å; N259-T262 PolarHBondContact O-N 3Å; N259-I263 WeakPolarHBondContact O-CB 3.4Å; N259-I263 WeakPolarHBondContact O-CD1 3.34Å; N259-I263 WeakPolarHBondContact O-CG1 3.27Å; N259-I263 PolarHBondContact O-N 2.62Å
260	K	95.9	Very high	95.9	Very high	67 Å²	67	46.2 Å²	46.2	29%	0.291	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-42	175.9	-179.2	167.2	-178.8	170.5	0	112	A254 T256 S257 E258 S264 L300	A254-K260 HydrophobicContact CB-CB 3.94Å; A254-K260 HydrophobicContact CB-CG 4.15Å; T256-K260 VanDerWaalsContact O-CB 3.25Å; T256-K260 WeakPolarHBondContact O-CB 3.49Å; T256-K260 PolarHBondContact O-N 3.26Å; S257-K260 PolarHBondContact O-N 3.41Å; E258-K260 VanDerWaalsContact C-N 3.29Å; E258-K260 PolarHBondContact O-N 2.59Å; K260-S264 WeakPolarHBondContact O-CB 3.5Å; K260-S264 PolarHBondContact O-N 3.39Å; K260-S264 PolarHBondContact O-OG 2.85Å; K260-L300 WeakPolarHBondContact CE-O 3.44Å
261	L	95.7	Very high	95.8	Very high	107 Å²	107	48.9 Å²	48.9	56%	0.56	26%	0.262	S	S	*	.	H	α-helix	trans	-63.1	-54	174.4	-71.9	166.7	0	0	0	110.5	S257 E258 N259 I263 S264 E265	S257-L261 WeakPolarHBondContact O-CG 3.43Å; S257-L261 PolarHBondContact O-N 2.84Å; E258-L261 WeakPolarHBondContact O-CB 3.49Å; E258-L261 PolarHBondContact O-N 2.71Å; E258-L261 VanDerWaalsContact O-N 3.16Å; N259-L261 VanDerWaalsContact C-N 3.32Å; N259-L261 PolarHBondContact O-N 3.46Å; L261-I263 VanDerWaalsContact C-N 3.27Å; L261-I263 PolarHBondContact O-N 2.83Å; L261-S264 PolarHBondContact O-N 2.94Å; L261-E265 WeakPolarHBondContact O-CG 3.41Å; L261-E265 PolarHBondContact O-N 2.8Å
262	T	97.2	Very high	95.8	Very high	69 Å²	69	48.3 Å²	48.3	42%	0.423	26%	0.259	S	S	.	.	H	α-helix	trans	-57.3	-37.6	-179.8	-52.6	0	0	0	0	113	L227 E258 N259	L227-T262 HydrophobicContact CD2-CG2 3.88Å; E258-T262 PolarHBondContact O-N 2.99Å; E258-T262 PolarHBondContact O-OG1 2.64Å; E258-T262 VanDerWaalsContact O-OG1 3.11Å; N259-T262 PolarHBondContact O-N 3Å
263	I	98.1	Very high	95.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-72.6	-40.9	175.1	-65.2	164.5	0	0	0	110.8	L222 L227 L250 F253 A254 N259 L261 S266 I268 F301	L222-I263 HydrophobicContact CD2-CD1 3.82Å; L222-I263 HydrophobicContact CD2-CG1 3.85Å; L227-I263 HydrophobicContact CD1-CG1 3.87Å; L250-I263 HydrophobicContact CD2-CD1 4.01Å; L250-I263 HydrophobicContact CD2-CG1 4.09Å; L250-I263 HydrophobicContact CD2-CG2 4.2Å; L250-I263 WeakPolarHBondContact O-CD1 3.25Å; F253-I263 HydrophobicContact CB-CD1 3.73Å; A254-I263 HydrophobicContact CB-CD1 4.25Å; N259-I263 WeakPolarHBondContact O-CB 3.4Å; N259-I263 WeakPolarHBondContact O-CD1 3.34Å; N259-I263 WeakPolarHBondContact O-CG1 3.27Å; N259-I263 PolarHBondContact O-N 2.62Å; L261-I263 VanDerWaalsContact C-N 3.27Å; L261-I263 PolarHBondContact O-N 2.83Å; I263-S266 VanDerWaalsContact O-CB 3.27Å; I263-S266 WeakPolarHBondContact O-CB 3.37Å; I263-S266 PolarHBondContact O-N 2.73Å; I263-S266 VanDerWaalsContact O-N 3.13Å; I263-S266 PolarHBondContact O-OG 3.13Å; I263-I268 HydrophobicContact CG2-CB 4.41Å; I263-I268 HydrophobicContact CG2-CD1 3.48Å; I263-I268 VanDerWaalsContact CG2-CD1 3.48Å; I263-I268 HydrophobicContact CG2-CG2 4.13Å; I263-I268 WeakPolarHBondContact O-CG2 3.45Å; I263-F301 HydrophobicContact CB-CE1 3.99Å; I263-F301 HydrophobicContact CG2-CD1 3.93Å; I263-F301 HydrophobicContact CG2-CE1 3.35Å; I263-F301 HydrophobicContact CG2-CZ 3.74Å
264	S	96.4	Very high	95.8	Very high	50 Å²	50	53.6 Å²	53.6	35%	0.35	29%	0.293	S	S	.	.	H	α-helix	trans	-70.3	-30.1	-178.6	-58.1	0	0	0	0	113.5	K260 L261 S266	K260-S264 WeakPolarHBondContact O-CB 3.5Å; K260-S264 PolarHBondContact O-N 3.39Å; K260-S264 PolarHBondContact O-OG 2.85Å; L261-S264 PolarHBondContact O-N 2.94Å; S264-S266 PolarHBondContact O-N 2.7Å
265	E	95.8	Very high	95.8	Very high	162 Å²	162	53.3 Å²	53.3	76%	0.757	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-9.9	172.4	-70	175	171.9	0	0	112.7	L261	L261-E265 WeakPolarHBondContact O-CG 3.41Å; L261-E265 PolarHBondContact O-N 2.8Å
266	S	96	Very high	96.1	Very high	25 Å²	25	50 Å²	50	18%	0.175	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	171.3	177.8	87.7	0	0	0	0	113.2	I263 S264 I268	I263-S266 VanDerWaalsContact O-CB 3.27Å; I263-S266 WeakPolarHBondContact O-CB 3.37Å; I263-S266 PolarHBondContact O-N 2.73Å; I263-S266 VanDerWaalsContact O-N 3.13Å; I263-S266 PolarHBondContact O-OG 3.13Å; S264-S266 PolarHBondContact O-N 2.7Å; S266-I268 PolarHBondContact O-N 3.47Å; S266-I268 PolarHBondContact OG-N 2.92Å
267	S	93.3	Very high	96.2	Very high	46 Å²	46	53.1 Å²	53.1	32%	0.322	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	16.3	173.7	65.8	0	0	0	0	116.1	R271	S267-R271 WeakPolarHBondContact O-CG 3.41Å; S267-R271 PolarHBondContact O-N 2.58Å; S267-R271 PolarHBondContact OG-NE 2.98Å; S267-R271 PolarHBondContact OG-NH2 3.42Å
268	I	97.6	Very high	96.5	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-47.1	-177.2	-167.6	168.7	0	0	0	112.1	L231 L234 L250 I263 S266 D270 R271 L272 F301	L231-I268 HydrophobicContact CD2-CB 3.72Å; L231-I268 HydrophobicContact CD2-CD1 4.45Å; L231-I268 HydrophobicContact CD2-CG1 4.09Å; L234-I268 HydrophobicContact CD1-CG1 4.23Å; L250-I268 HydrophobicContact CB-CD1 4.17Å; L250-I268 HydrophobicContact CD1-CD1 3.94Å; I263-I268 HydrophobicContact CG2-CB 4.41Å; I263-I268 HydrophobicContact CG2-CD1 3.48Å; I263-I268 VanDerWaalsContact CG2-CD1 3.48Å; I263-I268 HydrophobicContact CG2-CG2 4.13Å; I263-I268 WeakPolarHBondContact O-CG2 3.45Å; S266-I268 PolarHBondContact O-N 3.47Å; S266-I268 PolarHBondContact OG-N 2.92Å; I268-D270 VanDerWaalsContact C-N 3.33Å; I268-D270 PolarHBondContact O-N 2.83Å; I268-R271 WeakPolarHBondContact O-CB 3.3Å; I268-R271 PolarHBondContact O-N 3.49Å; I268-R271 VanDerWaalsContact O-N 3.08Å; I268-L272 HydrophobicContact CG1-CD1 4.1Å; I268-L272 HydrophobicContact CG1-CG 4.12Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 2.97Å; I268-F301 HydrophobicContact CD1-CD1 4.28Å; I268-F301 HydrophobicContact CD1-CD2 3.62Å; I268-F301 HydrophobicContact CD1-CE1 4.29Å; I268-F301 HydrophobicContact CD1-CE2 3.63Å; I268-F301 HydrophobicContact CD1-CG 3.96Å; I268-F301 HydrophobicContact CD1-CZ 3.98Å; I268-F301 HydrophobicContact CG1-CD2 4.4Å; I268-F301 HydrophobicContact CG2-CB 4.09Å; I268-F301 HydrophobicContact CG2-CD1 4.28Å; I268-F301 HydrophobicContact CG2-CG 4.16Å
269	S	97.3	Very high	96.6	Very high	13 Å²	13	46.5 Å²	46.5	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-36.4	-172.6	59.3	0	0	0	0	112.4	L272 V273 K303	S269-L272 PolarHBondContact O-N 2.84Å; S269-V273 WeakPolarHBondContact O-CG2 3.21Å; S269-V273 PolarHBondContact O-N 2.86Å; S269-K303 VanDerWaalsContact OG-CD 3.31Å; S269-K303 WeakPolarHBondContact OG-CD 3.45Å
270	D	95.6	Very high	96.4	Very high	86 Å²	86	52.1 Å²	52.1	46%	0.46	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-36.7	174.1	-63.8	-63.5	0	0	0	113	I268 T274 K303	I268-D270 VanDerWaalsContact C-N 3.33Å; I268-D270 PolarHBondContact O-N 2.83Å; D270-T274 PolarHBondContact O-N 2.94Å; D270-T274 PolarHBondContact O-OG1 3.15Å; D270-K303 VanDerWaalsContact CG-NZ 3.28Å; D270-K303 WeakPolarHBondContact OD1-CE 3.27Å; D270-K303 IonicContact OD1-NZ 2.83Å; D270-K303 PolarHBondContact OD1-NZ 2.69Å; D270-K303 IonicContact OD2-NZ 3.82Å; D270-K303 PolarHBondContact OD2-NZ 2.7Å
271	R	96.1	Very high	96.5	Very high	57 Å²	57	50.5 Å²	50.5	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-46.1	174.8	-63.1	169.9	-162.1	-116	-1.2	110.2	L231 L234 S267 I268 V273 T274 L275	L231-R271 VanDerWaalsContact C-NH1 3.34Å; L231-R271 PolarHBondContact O-NH1 3.21Å; L234-R271 HydrophobicContact CB-CB 4.35Å; S267-R271 WeakPolarHBondContact O-CG 3.41Å; S267-R271 PolarHBondContact O-N 2.58Å; S267-R271 PolarHBondContact OG-NE 2.98Å; S267-R271 PolarHBondContact OG-NH2 3.42Å; I268-R271 WeakPolarHBondContact O-CB 3.3Å; I268-R271 PolarHBondContact O-N 3.49Å; I268-R271 VanDerWaalsContact O-N 3.08Å; R271-V273 PolarHBondContact O-N 2.93Å; R271-T274 WeakPolarHBondContact O-CB 3.35Å; R271-T274 PolarHBondContact O-N 3.11Å; R271-T274 VanDerWaalsContact O-N 3.09Å; R271-L275 WeakPolarHBondContact O-CG 3.37Å; R271-L275 PolarHBondContact O-N 3.26Å; R271-L275 VanDerWaalsContact O-N 3.09Å
272	L	98.1	Very high	96.5	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-35.8	179.6	-60.9	-171.9	0	0	0	113.1	L234 L247 I268 S269 T274 L275 E276 A293 L297 F301	L234-L272 HydrophobicContact CD1-CD2 4.3Å; L247-L272 HydrophobicContact CD1-CD1 4.11Å; L247-L272 HydrophobicContact CD1-CD2 3.76Å; L247-L272 HydrophobicContact CD2-CD2 3.87Å; L247-L272 HydrophobicContact CG-CD2 4.42Å; I268-L272 HydrophobicContact CG1-CD1 4.1Å; I268-L272 HydrophobicContact CG1-CG 4.12Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 2.97Å; S269-L272 PolarHBondContact O-N 2.84Å; L272-T274 PolarHBondContact O-N 2.93Å; L272-L275 HydrophobicContact CD2-CD1 4.32Å; L272-L275 CarbonylContact O-C 3.55Å; L272-L275 PolarHBondContact O-N 2.81Å; L272-E276 PolarHBondContact O-N 2.96Å; L272-A293 HydrophobicContact CB-CB 4.24Å; L272-A293 HydrophobicContact CD2-CB 3.89Å; L272-L297 HydrophobicContact CB-CD1 3.84Å; L272-L297 HydrophobicContact CB-CD2 3.97Å; L272-L297 HydrophobicContact CB-CG 3.7Å; L272-L297 HydrophobicContact CD1-CG 4.36Å; L272-F301 HydrophobicContact CD1-CB 4.35Å; L272-F301 HydrophobicContact CD1-CD2 3.95Å
273	V	97.3	Very high	96.5	Very high	60 Å²	60	50.6 Å²	50.6	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-28.6	174.2	165.3	0	0	0	0	111.8	S269 R271 L297 K303	S269-V273 WeakPolarHBondContact O-CG2 3.21Å; S269-V273 PolarHBondContact O-N 2.86Å; R271-V273 PolarHBondContact O-N 2.93Å; V273-L297 HydrophobicContact CG2-CD1 4.08Å; V273-L297 HydrophobicContact CG2-CD2 3.96Å; V273-K303 HydrophobicContact CG2-CB 4.26Å; V273-K303 HydrophobicContact CG2-CG 4.13Å
274	T	96.3	Very high	96.5	Very high	66 Å²	66	53.8 Å²	53.8	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-74.4	-42.9	171.8	-47.6	0	0	0	0	110.9	L236 D270 R271 L272 S277	L236-T274 HydrophobicContact CD1-CG2 3.88Å; L236-T274 HydrophobicContact CD2-CG2 4.01Å; L236-T274 HydrophobicContact CG-CG2 4.2Å; D270-T274 PolarHBondContact O-N 2.94Å; D270-T274 PolarHBondContact O-OG1 3.15Å; R271-T274 WeakPolarHBondContact O-CB 3.35Å; R271-T274 PolarHBondContact O-N 3.11Å; R271-T274 VanDerWaalsContact O-N 3.09Å; L272-T274 PolarHBondContact O-N 2.93Å; T274-S277 WeakPolarHBondContact O-CB 3.48Å; T274-S277 PolarHBondContact O-OG 3.47Å
275	L	97.6	Very high	96.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-75.3	-28.8	-176	-64.7	176.2	0	0	0	114.3	L234 L236 M243 R271 L272 S277 W278 V289 G290 A293	L234-L275 HydrophobicContact CB-CD1 4.4Å; L236-L275 HydrophobicContact CD2-CD2 3.85Å; M243-L275 HydrophobicContact SD-CD1 4.43Å; M243-L275 HydrophobicContact SD-CD2 3.71Å; R271-L275 WeakPolarHBondContact O-CG 3.37Å; R271-L275 PolarHBondContact O-N 3.26Å; R271-L275 VanDerWaalsContact O-N 3.09Å; L272-L275 HydrophobicContact CD2-CD1 4.32Å; L272-L275 CarbonylContact O-C 3.55Å; L272-L275 PolarHBondContact O-N 2.81Å; L275-S277 PolarHBondContact O-N 3.33Å; L275-W278 HydrophobicContact CD2-CD2 4.44Å; L275-W278 HydrophobicContact CD2-CE3 4Å; L275-W278 HydrophobicContact CD2-CH2 4.18Å; L275-W278 HydrophobicContact CD2-CZ3 3.86Å; L275-W278 WeakPolarHBondContact O-CB 3.35Å; L275-W278 PolarHBondContact O-N 3.33Å; L275-V289 HydrophobicContact CB-CG1 4.23Å; L275-V289 HydrophobicContact CD1-CG1 3.96Å; L275-V289 HydrophobicContact CD2-CG1 4.03Å; L275-V289 HydrophobicContact CG-CG1 4.29Å; L275-G290 WeakPolarHBondContact O-CA 3.45Å; L275-A293 HydrophobicContact CB-CB 3.7Å
276	E	97.1	Very high	96.5	Very high	28 Å²	28	49 Å²	49	13%	0.131	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60.9	-21.1	178.1	75	168	122.4	0	0	112.8	L272 W278 A279 Q294 L297 R306 K312	L272-E276 PolarHBondContact O-N 2.96Å; E276-W278 PolarHBondContact O-N 3.08Å; E276-A279 VanDerWaalsContact O-CB 3.3Å; E276-A279 WeakPolarHBondContact O-CB 3.14Å; E276-A279 PolarHBondContact O-N 3.09Å; E276-A279 VanDerWaalsContact O-N 3.14Å; E276-Q294 HydrophobicContact CB-CB 4.04Å; E276-L297 HydrophobicContact CB-CD1 4.03Å; E276-L297 HydrophobicContact CG-CD1 4.13Å; E276-L297 WeakPolarHBondContact OE1-CD1 3.43Å; E276-R306 IonicContact OE1-CZ 2.92Å; E276-R306 IonicContact OE1-NE 3.23Å; E276-R306 PolarHBondContact OE1-NE 3.5Å; E276-R306 IonicContact OE1-NH2 3.49Å; E276-R306 IonicContact OE2-CZ 3.13Å; E276-R306 IonicContact OE2-NE 3.47Å; E276-R306 IonicContact OE2-NH2 3.44Å; E276-R306 PolarHBondContact OE2-NH2 2.73Å; E276-K312 IonicContact OE2-NZ 2.7Å; E276-K312 PolarHBondContact OE2-NZ 2.65Å
277	S	96.1	Very high	96.6	Very high	86 Å²	86	48.9 Å²	48.9	60%	0.601	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-60.1	-24.1	173	70.2	0	0	0	0	113.1	T274 L275 A279	T274-S277 WeakPolarHBondContact O-CB 3.48Å; T274-S277 PolarHBondContact O-OG 3.47Å; L275-S277 PolarHBondContact O-N 3.33Å; S277-A279 VanDerWaalsContact C-N 3.33Å
278	W	97.8	Very high	96.8	Very high	44 Å²	44	47.3 Å²	47.3	17%	0.167	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-83.8	-1	178.5	-64.1	-6.1	0	0	0	114.1	L236 M243 L275 E276 N280 D281 K286 R287 V289	L236-W278 HydrophobicContact CD2-CH2 3.99Å; L236-W278 HydrophobicContact CD2-CZ2 3.63Å; M243-W278 HydrophobicContact CE-CH2 3.7Å; M243-W278 HydrophobicContact CE-CZ3 3.88Å; M243-W278 HydrophobicContact SD-CH2 3.99Å; M243-W278 HydrophobicContact SD-CZ3 3.65Å; L275-W278 HydrophobicContact CD2-CD2 4.44Å; L275-W278 HydrophobicContact CD2-CE3 4Å; L275-W278 HydrophobicContact CD2-CH2 4.18Å; L275-W278 HydrophobicContact CD2-CZ3 3.86Å; L275-W278 WeakPolarHBondContact O-CB 3.35Å; L275-W278 PolarHBondContact O-N 3.33Å; E276-W278 PolarHBondContact O-N 3.08Å; W278-N280 PolarHBondContact O-N 3.34Å; W278-D281 HydrophobicContact CB-CB 4.2Å; W278-D281 WeakPolarHBondContact O-CB 3.26Å; W278-D281 PolarHBondContact O-N 3.48Å; W278-K286 HydrophobicContact CB-CB 4.14Å; W278-K286 WeakPolarHBondContact CB-O 3.47Å; W278-K286 HydrophobicContact CD2-CB 3.91Å; W278-K286 HydrophobicContact CD2-CD 3.76Å; W278-K286 HydrophobicContact CD2-CG 4.05Å; W278-K286 HydrophobicContact CE3-CB 3.66Å; W278-K286 HydrophobicContact CE3-CD 3.87Å; W278-K286 HydrophobicContact CE3-CG 3.7Å; W278-K286 HydrophobicContact CG-CB 4.15Å; W278-K286 HydrophobicContact CG-CD 4.35Å; W278-K286 HydrophobicContact CH2-CD 3.97Å; W278-K286 HydrophobicContact CH2-CG 4.29Å; W278-K286 HydrophobicContact CZ2-CD 3.87Å; W278-K286 HydrophobicContact CZ3-CB 4.3Å; W278-K286 HydrophobicContact CZ3-CD 3.98Å; W278-K286 HydrophobicContact CZ3-CG 3.83Å; W278-R287 WeakPolarHBondContact O-CA 3.38Å; W278-V289 HydrophobicContact CE3-CB 4.15Å; W278-V289 HydrophobicContact CE3-CG1 4.04Å; W278-V289 HydrophobicContact CZ3-CG1 4.27Å
279	A	96.2	Very high	96.9	Very high	5 Å²	5	47.2 Å²	47.2	4%	0.041	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.2	-14.1	-176.9	0	0	0	0	0	114.5	E276 S277	E276-A279 VanDerWaalsContact O-CB 3.3Å; E276-A279 WeakPolarHBondContact O-CB 3.14Å; E276-A279 PolarHBondContact O-N 3.09Å; E276-A279 VanDerWaalsContact O-N 3.14Å; S277-A279 VanDerWaalsContact C-N 3.33Å
280	N	93.9	Very high	96.9	Very high	123 Å²	123	46.6 Å²	46.6	66%	0.658	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-129.9	24.8	173.2	-64.7	-95.7	0	0	0	112.2	W278	W278-N280 PolarHBondContact O-N 3.34Å
281	D	97.3	Very high	97.1	Very high	32 Å²	32	43 Å²	43	17%	0.171	23%	0.23	C	C	.	.			trans	-66.2	138.8	175.8	-163.7	-62.1	0	0	0	110	W278 D283 K286	W278-D281 HydrophobicContact CB-CB 4.2Å; W278-D281 WeakPolarHBondContact O-CB 3.26Å; W278-D281 PolarHBondContact O-N 3.48Å; D281-D283 PolarHBondContact O-N 3.4Å; D281-D283 WeakPolarHBondContact OD1-CB 3.48Å; D281-D283 PolarHBondContact OD1-N 2.89Å; D281-K286 HydrophobicContact CB-CB 3.95Å; D281-K286 IonicContact OD1-NZ 3.35Å; D281-K286 PolarHBondContact OD1-NZ 3.3Å; D281-K286 IonicContact OD2-NZ 2.65Å; D281-K286 PolarHBondContact OD2-NZ 2.84Å
282	P	96.1	Very high	97.2	Very high	119 Å²	119	40.2 Å²	40.2	77%	0.773	22%	0.22	S	C	*	.	S	Bend	trans	-66.4	-15.4	175.5	27.2	-36.4	0	0	0	113.9	Y284	P282-Y284 PolarHBondContact O-N 3.23Å
283	D	97.1	Very high	97.2	Very high	59 Å²	59	40.2 Å²	40.2	32%	0.316	22%	0.22	S	C	.	.	S	Bend	trans	-77	111.2	167.6	-178.2	-43.7	0	0	0	109.9	D281 L285 K286 R287	D281-D283 PolarHBondContact O-N 3.4Å; D281-D283 WeakPolarHBondContact OD1-CB 3.48Å; D281-D283 PolarHBondContact OD1-N 2.89Å; D283-L285 PolarHBondContact O-N 2.86Å; D283-L285 WeakPolarHBondContact OD1-CA 3.46Å; D283-L285 WeakPolarHBondContact OD1-CB 3.37Å; D283-L285 PolarHBondContact OD1-N 2.93Å; D283-K286 HydrophobicContact CB-CB 4.07Å; D283-K286 HydrophobicContact CB-CD 4.34Å; D283-K286 HydrophobicContact CB-CG 4.04Å; D283-K286 PolarHBondContact O-N 2.72Å; D283-K286 VanDerWaalsContact O-N 3.11Å; D283-K286 PolarHBondContact OD1-N 3.38Å; D283-K286 WeakPolarHBondContact OD2-CE 3.41Å; D283-K286 IonicContact OD2-NZ 3.1Å; D283-R287 PolarHBondContact O-N 3.03Å
284	Y	96.8	Very high	97.3	Very high	68 Å²	68	38.8 Å²	38.8	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-21.9	-177.3	-66.8	-70.6	0	0	0	114.4	P282 Q288 T366 V368 E424 G425	P282-Y284 PolarHBondContact O-N 3.23Å; Y284-Q288 VanDerWaalsContact O-CG 3.28Å; Y284-Q288 WeakPolarHBondContact O-CG 3.25Å; Y284-Q288 PolarHBondContact O-N 3.43Å; Y284-Q288 PolarHBondContact O-NE2 2.68Å; Y284-T366 HydrophobicContact CE1-CG2 4.42Å; Y284-V368 HydrophobicContact CD1-CB 4.29Å; Y284-V368 HydrophobicContact CD1-CG1 4.09Å; Y284-V368 HydrophobicContact CD1-CG2 4.04Å; Y284-V368 HydrophobicContact CE1-CG2 4.27Å; Y284-E424 HydrophobicContact CD2-CB 3.9Å; Y284-E424 HydrophobicContact CG-CB 4.22Å; Y284-G425 VanDerWaalsContact CE2-CA 3.47Å; Y284-G425 VanDerWaalsContact CZ-CA 3.45Å; Y284-G425 VanDerWaalsContact OH-CA 3.29Å; Y284-G425 WeakPolarHBondContact OH-CA 3.34Å
285	L	95.4	Very high	97.3	Very high	62 Å²	62	38.8 Å²	38.8	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-76.7	-41.1	173.3	-60.4	176.7	0	0	0	110.5	P240 D283 Q288 V289	P240-L285 HydrophobicContact CB-CB 3.87Å; D283-L285 PolarHBondContact O-N 2.86Å; D283-L285 WeakPolarHBondContact OD1-CA 3.46Å; D283-L285 WeakPolarHBondContact OD1-CB 3.37Å; D283-L285 PolarHBondContact OD1-N 2.93Å; L285-Q288 PolarHBondContact O-N 2.75Å; L285-V289 WeakPolarHBondContact O-CG2 3.47Å; L285-V289 PolarHBondContact O-N 3.35Å
286	K	97.7	Very high	97.4	Very high	49 Å²	49	38.8 Å²	38.8	21%	0.213	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-37.8	172.3	-65.4	-164.6	-118.8	116.6	0	112.4	P240 W278 D281 D283 Q288 V289 G290	P240-K286 HydrophobicContact CB-CG 4.38Å; P240-K286 HydrophobicContact CG-CG 4.08Å; W278-K286 HydrophobicContact CB-CB 4.14Å; W278-K286 WeakPolarHBondContact CB-O 3.47Å; W278-K286 HydrophobicContact CD2-CB 3.91Å; W278-K286 HydrophobicContact CD2-CD 3.76Å; W278-K286 HydrophobicContact CD2-CG 4.05Å; W278-K286 HydrophobicContact CE3-CB 3.66Å; W278-K286 HydrophobicContact CE3-CD 3.87Å; W278-K286 HydrophobicContact CE3-CG 3.7Å; W278-K286 HydrophobicContact CG-CB 4.15Å; W278-K286 HydrophobicContact CG-CD 4.35Å; W278-K286 HydrophobicContact CH2-CD 3.97Å; W278-K286 HydrophobicContact CH2-CG 4.29Å; W278-K286 HydrophobicContact CZ2-CD 3.87Å; W278-K286 HydrophobicContact CZ3-CB 4.3Å; W278-K286 HydrophobicContact CZ3-CD 3.98Å; W278-K286 HydrophobicContact CZ3-CG 3.83Å; D281-K286 HydrophobicContact CB-CB 3.95Å; D281-K286 IonicContact OD1-NZ 3.35Å; D281-K286 PolarHBondContact OD1-NZ 3.3Å; D281-K286 IonicContact OD2-NZ 2.65Å; D281-K286 PolarHBondContact OD2-NZ 2.84Å; D283-K286 HydrophobicContact CB-CB 4.07Å; D283-K286 HydrophobicContact CB-CD 4.34Å; D283-K286 HydrophobicContact CB-CG 4.04Å; D283-K286 PolarHBondContact O-N 2.72Å; D283-K286 VanDerWaalsContact O-N 3.11Å; D283-K286 PolarHBondContact OD1-N 3.38Å; D283-K286 WeakPolarHBondContact OD2-CE 3.41Å; D283-K286 IonicContact OD2-NZ 3.1Å; K286-Q288 VanDerWaalsContact C-N 3.3Å; K286-Q288 PolarHBondContact O-N 2.97Å; K286-V289 WeakPolarHBondContact O-CB 3.43Å; K286-V289 PolarHBondContact O-N 3.41Å; K286-V289 VanDerWaalsContact O-N 3.11Å; K286-G290 PolarHBondContact O-N 3.31Å
287	R	98.3	Very high	97.4	Very high	23 Å²	23	37.5 Å²	37.5	9%	0.087	20%	0.195	C	C	.	.	H	α-helix	trans	-56.7	-43.4	176.3	-169.7	176.2	174.7	164.5	3.5	111.9	W278 D283 G290 F291 E339 E475	W278-R287 WeakPolarHBondContact O-CA 3.38Å; D283-R287 PolarHBondContact O-N 3.03Å; R287-G290 PolarHBondContact O-N 3.15Å; R287-F291 WeakPolarHBondContact O-CB 3.33Å; R287-F291 PolarHBondContact O-N 3.2Å; R287-E339 IonicContact CZ-OE1 2.69Å; R287-E339 IonicContact CZ-OE2 2.65Å; R287-E339 VanDerWaalsContact CZ-OE2 3.31Å; R287-E339 IonicContact NE-OE1 2.7Å; R287-E339 PolarHBondContact NE-OE1 2.83Å; R287-E339 IonicContact NE-OE2 2.68Å; R287-E339 PolarHBondContact NE-OE2 2.87Å; R287-E339 VanDerWaalsContact NE-OE2 3.13Å; R287-E339 IonicContact NH2-OE1 3.18Å; R287-E339 PolarHBondContact NH2-OE1 3.38Å; R287-E339 IonicContact NH2-OE2 2.68Å; R287-E339 PolarHBondContact NH2-OE2 2.92Å; R287-E475 IonicContact CZ-OE2 2.96Å; R287-E475 VanDerWaalsContact CZ-OE2 3.29Å; R287-E475 IonicContact NH1-OE2 2.81Å; R287-E475 PolarHBondContact NH1-OE2 2.64Å; R287-E475 VanDerWaalsContact NH2-CD 3.26Å; R287-E475 IonicContact NH2-OE2 2.73Å; R287-E475 PolarHBondContact NH2-OE2 3.12Å
288	Q	98.4	Very high	97.4	Very high	12 Å²	12	33.7 Å²	33.7	6%	0.056	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-45.7	174.1	-66.8	171.5	70.1	0	0	112.2	L244 Y284 L285 K286 G290 C292 V368 T369	L244-Q288 HydrophobicContact CD1-CB 4.11Å; L244-Q288 HydrophobicContact CD2-CB 3.79Å; Y284-Q288 VanDerWaalsContact O-CG 3.28Å; Y284-Q288 WeakPolarHBondContact O-CG 3.25Å; Y284-Q288 PolarHBondContact O-N 3.43Å; Y284-Q288 PolarHBondContact O-NE2 2.68Å; L285-Q288 PolarHBondContact O-N 2.75Å; K286-Q288 VanDerWaalsContact C-N 3.3Å; K286-Q288 PolarHBondContact O-N 2.97Å; Q288-G290 PolarHBondContact O-N 2.98Å; Q288-C292 WeakPolarHBondContact O-CB 3.44Å; Q288-C292 PolarHBondContact O-N 2.68Å; Q288-V368 HydrophobicContact CG-CG1 3.86Å; Q288-T369 VanDerWaalsContact CD-CG2 3.43Å; Q288-T369 HydrophobicContact CG-CG2 4.35Å
289	V	98.6	Very high	97.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.9	-46.9	177	175.9	0	0	0	0	111.3	P240 M243 L244 L275 W278 L285 K286 C292 A293	P240-V289 HydrophobicContact CB-CG2 4.24Å; P240-V289 WeakPolarHBondContact O-CG2 3.42Å; M243-V289 HydrophobicContact CB-CG1 4.01Å; M243-V289 HydrophobicContact CB-CG2 4.05Å; M243-V289 HydrophobicContact SD-CG1 4.28Å; L244-V289 HydrophobicContact CB-CG2 3.87Å; L275-V289 HydrophobicContact CB-CG1 4.23Å; L275-V289 HydrophobicContact CD1-CG1 3.96Å; L275-V289 HydrophobicContact CD2-CG1 4.03Å; L275-V289 HydrophobicContact CG-CG1 4.29Å; W278-V289 HydrophobicContact CE3-CB 4.15Å; W278-V289 HydrophobicContact CE3-CG1 4.04Å; W278-V289 HydrophobicContact CZ3-CG1 4.27Å; L285-V289 WeakPolarHBondContact O-CG2 3.47Å; L285-V289 PolarHBondContact O-N 3.35Å; K286-V289 WeakPolarHBondContact O-CB 3.43Å; K286-V289 PolarHBondContact O-N 3.41Å; K286-V289 VanDerWaalsContact O-N 3.11Å; V289-C292 PolarHBondContact O-N 3.23Å; V289-A293 VanDerWaalsContact O-CB 3.31Å; V289-A293 WeakPolarHBondContact O-CB 3.32Å; V289-A293 PolarHBondContact O-N 3.36Å
290	G	98.5	Very high	97.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-71.1	-37.6	-178.6	0	0	0	0	0	113.8	L275 K286 R287 Q288 A293 Q294	L275-G290 WeakPolarHBondContact O-CA 3.45Å; K286-G290 PolarHBondContact O-N 3.31Å; R287-G290 PolarHBondContact O-N 3.15Å; Q288-G290 PolarHBondContact O-N 2.98Å; G290-A293 PolarHBondContact O-N 3.44Å; G290-Q294 VanDerWaalsContact O-CB 3.29Å; G290-Q294 WeakPolarHBondContact O-CB 3.38Å; G290-Q294 PolarHBondContact O-N 2.94Å
291	F	98.6	Very high	97.3	Very high	9 Å²	9	28.2 Å²	28.2	4%	0.039	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-50.9	171.1	177.4	-78.6	0	0	0	110.5	R287 W295 K332 E339 R341	R287-F291 WeakPolarHBondContact O-CB 3.33Å; R287-F291 PolarHBondContact O-N 3.2Å; F291-W295 WeakPolarHBondContact O-CB 3.12Å; F291-W295 PolarHBondContact O-N 3.02Å; F291-K332 HydrophobicContact CE1-CB 3.76Å; F291-K332 HydrophobicContact CE1-CD 4.36Å; F291-K332 HydrophobicContact CZ-CB 4.15Å; F291-E339 HydrophobicContact CD2-CB 4.49Å; F291-E339 HydrophobicContact CD2-CG 3.94Å; F291-E339 HydrophobicContact CE2-CB 4.05Å; F291-E339 HydrophobicContact CE2-CG 3.74Å; F291-R341 HydrophobicContact CD1-CB 4.12Å; F291-R341 HydrophobicContact CE1-CB 3.5Å; F291-R341 HydrophobicContact CE1-CG 4.45Å; F291-R341 HydrophobicContact CZ-CB 3.95Å
292	C	98.6	Very high	97.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-50.5	176.8	-75.9	0	0	0	0	111.3	L244 L247 Q288 V289 Q294 W295 S296 R341	L244-C292 HydrophobicContact CD1-CB 4.29Å; L247-C292 HydrophobicContact CD2-CB 3.67Å; L247-C292 HydrophobicContact CG-CB 4.47Å; Q288-C292 WeakPolarHBondContact O-CB 3.44Å; Q288-C292 PolarHBondContact O-N 2.68Å; V289-C292 PolarHBondContact O-N 3.23Å; C292-Q294 VanDerWaalsContact C-N 3.3Å; C292-Q294 PolarHBondContact O-N 2.66Å; C292-W295 CarbonylContact O-C 3.55Å; C292-W295 WeakPolarHBondContact O-CA 3.32Å; C292-W295 WeakPolarHBondContact O-CB 3.45Å; C292-W295 PolarHBondContact O-N 3.3Å; C292-S296 PolarHBondContact O-N 3.04Å; C292-S296 PolarHBondContact O-OG 3.39Å; C292-R341 VanDerWaalsContact SG-CD 3.5Å; C292-R341 PolarHBondContact SG-NE 2.95Å
293	A	98.5	Very high	97.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.9	-41.5	-179	0	0	0	0	0	112.9	L247 L272 L275 V289 G290 L297	L247-A293 HydrophobicContact CD2-CB 4.18Å; L272-A293 HydrophobicContact CB-CB 4.24Å; L272-A293 HydrophobicContact CD2-CB 3.89Å; L275-A293 HydrophobicContact CB-CB 3.7Å; V289-A293 VanDerWaalsContact O-CB 3.31Å; V289-A293 WeakPolarHBondContact O-CB 3.32Å; V289-A293 PolarHBondContact O-N 3.36Å; G290-A293 PolarHBondContact O-N 3.44Å; A293-L297 WeakPolarHBondContact O-CB 3.31Å; A293-L297 WeakPolarHBondContact O-CD1 3.39Å; A293-L297 VanDerWaalsContact O-CG 3.26Å; A293-L297 WeakPolarHBondContact O-CG 3.37Å; A293-L297 PolarHBondContact O-N 2.94Å
294	Q	98.1	Very high	97	Very high	29 Å²	29	34.7 Å²	34.7	14%	0.136	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-46.1	173.5	-174.4	176	104.5	0	0	111.7	E276 G290 C292 L297 D298 T309	E276-Q294 HydrophobicContact CB-CB 4.04Å; G290-Q294 VanDerWaalsContact O-CB 3.29Å; G290-Q294 WeakPolarHBondContact O-CB 3.38Å; G290-Q294 PolarHBondContact O-N 2.94Å; C292-Q294 VanDerWaalsContact C-N 3.3Å; C292-Q294 PolarHBondContact O-N 2.66Å; Q294-L297 PolarHBondContact O-N 3.26Å; Q294-D298 PolarHBondContact O-N 3.22Å; Q294-D298 VanDerWaalsContact O-N 3.17Å; Q294-T309 HydrophobicContact CG-CG2 4.12Å; Q294-T309 WeakPolarHBondContact CG-OG1 3.48Å
295	W	97.6	Very high	96.8	Very high	66 Å²	66	35.5 Å²	35.5	25%	0.25	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-43	178.6	-174.9	95	0	0	0	112.4	F291 C292 D298 N299 L300 K332	F291-W295 WeakPolarHBondContact O-CB 3.12Å; F291-W295 PolarHBondContact O-N 3.02Å; C292-W295 CarbonylContact O-C 3.55Å; C292-W295 WeakPolarHBondContact O-CA 3.32Å; C292-W295 WeakPolarHBondContact O-CB 3.45Å; C292-W295 PolarHBondContact O-N 3.3Å; W295-D298 PolarHBondContact O-N 2.9Å; W295-N299 HydrophobicContact CD2-CB 4.36Å; W295-N299 HydrophobicContact CE3-CB 4.38Å; W295-N299 HydrophobicContact CH2-CB 4.12Å; W295-N299 HydrophobicContact CZ2-CB 4.08Å; W295-N299 HydrophobicContact CZ3-CB 4.27Å; W295-N299 PolarHBondContact NE1-ND2 3.03Å; W295-N299 WeakPolarHBondContact O-CB 3.22Å; W295-N299 PolarHBondContact O-N 3.46Å; W295-N299 PolarHBondContact O-ND2 3.36Å; W295-L300 HydrophobicContact CH2-CD1 4.42Å; W295-L300 HydrophobicContact CZ3-CD1 3.77Å; W295-L300 HydrophobicContact CZ3-CG 4.15Å; W295-K332 HydrophobicContact CD2-CD 3.87Å; W295-K332 HydrophobicContact CD2-CG 3.94Å; W295-K332 HydrophobicContact CE3-CD 4.08Å; W295-K332 HydrophobicContact CE3-CG 4.47Å; W295-K332 HydrophobicContact CG-CB 4.33Å; W295-K332 HydrophobicContact CG-CD 4.11Å; W295-K332 HydrophobicContact CG-CG 4.21Å; W295-K332 HydrophobicContact CZ2-CG 4.17Å
296	S	97.9	Very high	96.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.9	-35.6	178	-22	0	0	0	0	111.7	E251 C292 D298 N299 L300 F301	E251-S296 WeakPolarHBondContact OE1-CB 3.24Å; E251-S296 PolarHBondContact OE1-OG 2.92Å; C292-S296 PolarHBondContact O-N 3.04Å; C292-S296 PolarHBondContact O-OG 3.39Å; S296-D298 VanDerWaalsContact C-N 3.29Å; S296-D298 PolarHBondContact O-N 2.86Å; S296-N299 PolarHBondContact O-N 2.78Å; S296-L300 CarbonylContact O-C 3.09Å; S296-L300 WeakPolarHBondContact O-CA 3.07Å; S296-L300 PolarHBondContact O-N 3.5Å; S296-F301 PolarHBondContact O-N 3.42Å
297	L	97.6	Very high	96.7	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-28.5	174.1	-79.6	166.1	0	0	0	113.5	L272 V273 E276 A293 Q294 L302 K303	L272-L297 HydrophobicContact CB-CD1 3.84Å; L272-L297 HydrophobicContact CB-CD2 3.97Å; L272-L297 HydrophobicContact CB-CG 3.7Å; L272-L297 HydrophobicContact CD1-CG 4.36Å; V273-L297 HydrophobicContact CG2-CD1 4.08Å; V273-L297 HydrophobicContact CG2-CD2 3.96Å; E276-L297 HydrophobicContact CB-CD1 4.03Å; E276-L297 HydrophobicContact CG-CD1 4.13Å; E276-L297 WeakPolarHBondContact OE1-CD1 3.43Å; A293-L297 WeakPolarHBondContact O-CB 3.31Å; A293-L297 WeakPolarHBondContact O-CD1 3.39Å; A293-L297 VanDerWaalsContact O-CG 3.26Å; A293-L297 WeakPolarHBondContact O-CG 3.37Å; A293-L297 PolarHBondContact O-N 2.94Å; Q294-L297 PolarHBondContact O-N 3.26Å; L297-L302 WeakPolarHBondContact O-CD2 3.45Å; L297-K303 HydrophobicContact CD2-CB 4.13Å
298	D	96.6	Very high	96.5	Very high	6 Å²	6	36.3 Å²	36.3	3%	0.032	19%	0.191	C	C	.	.	H	α-helix	trans	-86	-28.9	175.8	-74.2	-26.3	0	0	0	112.8	Q294 W295 S296 R306 L308 T309 P509 H511	Q294-D298 PolarHBondContact O-N 3.22Å; Q294-D298 VanDerWaalsContact O-N 3.17Å; W295-D298 PolarHBondContact O-N 2.9Å; S296-D298 VanDerWaalsContact C-N 3.29Å; S296-D298 PolarHBondContact O-N 2.86Å; D298-R306 IonicContact OD1-CZ 2.78Å; D298-R306 IonicContact OD1-NH1 3.94Å; D298-R306 PolarHBondContact OD1-NH1 2.82Å; D298-R306 IonicContact OD1-NH2 2.83Å; D298-L308 HydrophobicContact CB-CD2 4.38Å; D298-L308 WeakPolarHBondContact OD1-CA 3.2Å; D298-L308 WeakPolarHBondContact OD1-CD2 3.32Å; D298-T309 VanDerWaalsContact CG-OG1 3.3Å; D298-T309 PolarHBondContact OD1-N 2.65Å; D298-T309 PolarHBondContact OD1-OG1 3.45Å; D298-T309 WeakPolarHBondContact OD2-CB 3.33Å; D298-T309 PolarHBondContact OD2-N 3.36Å; D298-T309 PolarHBondContact OD2-OG1 3.38Å; D298-P509 HydrophobicContact CB-CB 4.47Å; D298-P509 HydrophobicContact CB-CG 4.01Å; D298-P509 VanDerWaalsContact O-CB 3.27Å; D298-P509 WeakPolarHBondContact O-CB 3.23Å; D298-H511 PolarHBondContact O-CE1 3.46Å; D298-H511 PolarHBondContact O-ND1 2.78Å; D298-H511 VanDerWaalsContact O-ND1 3.17Å
299	N	95.1	Very high	96.4	Very high	22 Å²	22	36.1 Å²	36.1	12%	0.118	19%	0.191	C	C	.	.	H	α-helix	trans	-113.2	-33.9	-169.2	-71.1	-82.1	0	0	0	116	W295 S296 P509 R510	W295-N299 HydrophobicContact CD2-CB 4.36Å; W295-N299 HydrophobicContact CE3-CB 4.38Å; W295-N299 HydrophobicContact CH2-CB 4.12Å; W295-N299 HydrophobicContact CZ2-CB 4.08Å; W295-N299 HydrophobicContact CZ3-CB 4.27Å; W295-N299 PolarHBondContact NE1-ND2 3.03Å; W295-N299 WeakPolarHBondContact O-CB 3.22Å; W295-N299 PolarHBondContact O-N 3.46Å; W295-N299 PolarHBondContact O-ND2 3.36Å; S296-N299 PolarHBondContact O-N 2.78Å; N299-P509 VanDerWaalsContact OD1-CA 3.24Å; N299-P509 WeakPolarHBondContact OD1-CA 3.05Å; N299-P509 WeakPolarHBondContact OD1-CB 3.37Å; N299-R510 PolarHBondContact OD1-N 3.22Å
300	L	94.7	Very high	96.2	Very high	33 Å²	33	38.1 Å²	38.1	17%	0.173	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-58.3	-167.5	-67.5	178	0	0	0	113.4	E251 K260 W295 S296	E251-L300 HydrophobicContact CB-CD1 3.82Å; E251-L300 HydrophobicContact CG-CD1 3.72Å; K260-L300 WeakPolarHBondContact CE-O 3.44Å; W295-L300 HydrophobicContact CH2-CD1 4.42Å; W295-L300 HydrophobicContact CZ3-CD1 3.77Å; W295-L300 HydrophobicContact CZ3-CG 4.15Å; S296-L300 CarbonylContact O-C 3.09Å; S296-L300 WeakPolarHBondContact O-CA 3.07Å; S296-L300 PolarHBondContact O-N 3.5Å
301	F	96.6	Very high	96	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.013	22%	0.217	C	C	.	.	S	Bend	trans	-111.9	65.9	-168.2	-52.3	-57.2	0	0	0	110.4	E251 A254 I263 I268 L272 S296 K303	E251-F301 HydrophobicContact CG-CE2 4.13Å; A254-F301 HydrophobicContact CB-CE1 3.62Å; A254-F301 HydrophobicContact CB-CZ 3.56Å; I263-F301 HydrophobicContact CB-CE1 3.99Å; I263-F301 HydrophobicContact CG2-CD1 3.93Å; I263-F301 HydrophobicContact CG2-CE1 3.35Å; I263-F301 HydrophobicContact CG2-CZ 3.74Å; I268-F301 HydrophobicContact CD1-CD1 4.28Å; I268-F301 HydrophobicContact CD1-CD2 3.62Å; I268-F301 HydrophobicContact CD1-CE1 4.29Å; I268-F301 HydrophobicContact CD1-CE2 3.63Å; I268-F301 HydrophobicContact CD1-CG 3.96Å; I268-F301 HydrophobicContact CD1-CZ 3.98Å; I268-F301 HydrophobicContact CG1-CD2 4.4Å; I268-F301 HydrophobicContact CG2-CB 4.09Å; I268-F301 HydrophobicContact CG2-CD1 4.28Å; I268-F301 HydrophobicContact CG2-CG 4.16Å; L272-F301 HydrophobicContact CD1-CB 4.35Å; L272-F301 HydrophobicContact CD1-CD2 3.95Å; S296-F301 PolarHBondContact O-N 3.42Å; F301-K303 PolarHBondContact O-N 2.86Å
302	L	94.4	Very high	95.8	Very high	91 Å²	91	46.4 Å²	46.4	48%	0.476	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-59.7	134.4	-172.8	-52.6	-176.8	0	0	0	111.4	L297	L297-L302 WeakPolarHBondContact O-CD2 3.45Å
303	K	95.3	Very high	95.6	Very high	67 Å²	67	48.2 Å²	48.2	29%	0.291	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-97.4	125.5	171.7	-174.8	73.3	-163.4	-178.5	0	110.1	S269 D270 V273 L297 F301 G305 R306	S269-K303 VanDerWaalsContact OG-CD 3.31Å; S269-K303 WeakPolarHBondContact OG-CD 3.45Å; D270-K303 VanDerWaalsContact CG-NZ 3.28Å; D270-K303 WeakPolarHBondContact OD1-CE 3.27Å; D270-K303 IonicContact OD1-NZ 2.83Å; D270-K303 PolarHBondContact OD1-NZ 2.69Å; D270-K303 IonicContact OD2-NZ 3.82Å; D270-K303 PolarHBondContact OD2-NZ 2.7Å; V273-K303 HydrophobicContact CG2-CB 4.26Å; V273-K303 HydrophobicContact CG2-CG 4.13Å; L297-K303 HydrophobicContact CD2-CB 4.13Å; F301-K303 PolarHBondContact O-N 2.86Å; K303-G305 PolarHBondContact O-N 3.1Å; K303-R306 HydrophobicContact CB-CB 3.88Å; K303-R306 HydrophobicContact CG-CB 4.31Å; K303-R306 WeakPolarHBondContact O-CB 3.48Å; K303-R306 PolarHBondContact O-N 3.15Å; K303-R306 VanDerWaalsContact O-N 3.16Å
304	E	93.3	Very high	95.3	Very high	188 Å²	188	53.7 Å²	53.7	88%	0.879	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	136.4	173.2	-172.1	176.4	-167.7	0	0	111.2	R306	E304-R306 PolarHBondContact O-N 2.81Å
305	G	92.9	Very high	95.2	Very high	84 Å²	84	53.6 Å²	53.6	87%	0.866	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-7.8	-177.2	0	0	0	0	0	115.8	K303	K303-G305 PolarHBondContact O-N 3.1Å
306	R	95.4	Very high	95	Very high	37 Å²	37	54.8 Å²	54.8	14%	0.14	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-80.3	124.5	174.8	-177.4	-175.5	173.2	-82.4	-1.9	110.8	E276 D298 K303 E304 T309	E276-R306 IonicContact OE1-CZ 2.92Å; E276-R306 IonicContact OE1-NE 3.23Å; E276-R306 PolarHBondContact OE1-NE 3.5Å; E276-R306 IonicContact OE1-NH2 3.49Å; E276-R306 IonicContact OE2-CZ 3.13Å; E276-R306 IonicContact OE2-NE 3.47Å; E276-R306 IonicContact OE2-NH2 3.44Å; E276-R306 PolarHBondContact OE2-NH2 2.73Å; D298-R306 IonicContact OD1-CZ 2.78Å; D298-R306 IonicContact OD1-NH1 3.94Å; D298-R306 PolarHBondContact OD1-NH1 2.82Å; D298-R306 IonicContact OD1-NH2 2.83Å; K303-R306 HydrophobicContact CB-CB 3.88Å; K303-R306 HydrophobicContact CG-CB 4.31Å; K303-R306 WeakPolarHBondContact O-CB 3.48Å; K303-R306 PolarHBondContact O-N 3.15Å; K303-R306 VanDerWaalsContact O-N 3.16Å; E304-R306 PolarHBondContact O-N 2.81Å; R306-T309 PolarHBondContact NH2-OG1 3.09Å
307	Q	95.1	Very high	94.8	Very high	103 Å²	103	57.6 Å²	57.6	48%	0.481	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.9	135.2	169.7	-169.4	-175.6	13.6	0	0	111.1	E311	Q307-E311 HydrophobicContact CG-CB 3.87Å; Q307-E311 VanDerWaalsContact CG-OE2 3.3Å; Q307-E311 WeakPolarHBondContact CG-OE2 3.48Å; Q307-E311 PolarHBondContact NE2-O 3Å
308	L	95.8	Very high	94.8	Very high	12 Å²	12	58 Å²	58	6%	0.063	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-71.9	147.5	-177.6	-63.3	172.3	0	0	0	110.6	D298 Y310 E311 R512	D298-L308 HydrophobicContact CB-CD2 4.38Å; D298-L308 WeakPolarHBondContact OD1-CA 3.2Å; D298-L308 WeakPolarHBondContact OD1-CD2 3.32Å; L308-Y310 VanDerWaalsContact C-N 3.34Å; L308-Y310 HydrophobicContact CB-CD1 3.94Å; L308-Y310 HydrophobicContact CB-CE1 3.6Å; L308-Y310 HydrophobicContact CD1-CE1 3.74Å; L308-Y310 HydrophobicContact CG-CE1 4.3Å; L308-Y310 PolarHBondContact O-N 3.14Å; L308-E311 HydrophobicContact CB-CG 4.2Å; L308-E311 PolarHBondContact N-OE2 3.18Å; L308-E311 WeakPolarHBondContact O-CB 3.45Å; L308-E311 PolarHBondContact O-N 3.21Å; L308-R512 HydrophobicContact CD1-CG 4.25Å
309	T	95.8	Very high	94.9	Very high	8 Å²	8	62.4 Å²	62.4	5%	0.049	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-69.2	-30.9	-164.6	-39.3	0	0	0	0	113.7	Q294 D298 R306 E311 K312 V313 P335	Q294-T309 HydrophobicContact CG-CG2 4.12Å; Q294-T309 WeakPolarHBondContact CG-OG1 3.48Å; D298-T309 VanDerWaalsContact CG-OG1 3.3Å; D298-T309 PolarHBondContact OD1-N 2.65Å; D298-T309 PolarHBondContact OD1-OG1 3.45Å; D298-T309 WeakPolarHBondContact OD2-CB 3.33Å; D298-T309 PolarHBondContact OD2-N 3.36Å; D298-T309 PolarHBondContact OD2-OG1 3.38Å; R306-T309 PolarHBondContact NH2-OG1 3.09Å; T309-E311 PolarHBondContact O-N 3.21Å; T309-K312 HydrophobicContact CG2-CG 4.38Å; T309-K312 PolarHBondContact O-N 3.29Å; T309-V313 WeakPolarHBondContact O-CB 3.35Å; T309-V313 WeakPolarHBondContact O-CG1 3.19Å; T309-V313 PolarHBondContact O-N 3.04Å; T309-V313 VanDerWaalsContact O-N 3.09Å; T309-P335 HydrophobicContact CG2-CB 4.13Å; T309-P335 HydrophobicContact CG2-CG 3.69Å
310	Y	94.1	Very high	95	Very high	41 Å²	41	61.3 Å²	61.3	16%	0.161	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-62.9	-19.5	173.4	75.5	-93.6	0	0	0	113.4	L308 I506 L508 P509 R512	L308-Y310 VanDerWaalsContact C-N 3.34Å; L308-Y310 HydrophobicContact CB-CD1 3.94Å; L308-Y310 HydrophobicContact CB-CE1 3.6Å; L308-Y310 HydrophobicContact CD1-CE1 3.74Å; L308-Y310 HydrophobicContact CG-CE1 4.3Å; L308-Y310 PolarHBondContact O-N 3.14Å; Y310-I506 HydrophobicContact CD2-CG2 3.6Å; Y310-I506 HydrophobicContact CE2-CG2 4.3Å; Y310-I506 HydrophobicContact CG-CG2 4.09Å; Y310-L508 HydrophobicContact CD2-CD2 4.42Å; Y310-L508 HydrophobicContact CE1-CD2 4.48Å; Y310-L508 HydrophobicContact CE2-CD2 4.11Å; Y310-P509 HydrophobicContact CD1-CG 3.77Å; Y310-P509 VanDerWaalsContact CE1-CD 3.44Å; Y310-P509 HydrophobicContact CE1-CG 3.85Å; Y310-R512 HydrophobicContact CE1-CG 4.45Å
311	E	94.5	Very high	95.2	Very high	84 Å²	84	59.9 Å²	59.9	39%	0.393	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-87	-13.8	-178.7	-53.7	173.9	148.5	0	0	112.6	Q307 L308 T309	Q307-E311 HydrophobicContact CG-CB 3.87Å; Q307-E311 VanDerWaalsContact CG-OE2 3.3Å; Q307-E311 WeakPolarHBondContact CG-OE2 3.48Å; Q307-E311 PolarHBondContact NE2-O 3Å; L308-E311 HydrophobicContact CB-CG 4.2Å; L308-E311 PolarHBondContact N-OE2 3.18Å; L308-E311 WeakPolarHBondContact O-CB 3.45Å; L308-E311 PolarHBondContact O-N 3.21Å; T309-E311 PolarHBondContact O-N 3.21Å
312	K	93.6	Very high	95.3	Very high	99 Å²	99	59.8 Å²	59.8	43%	0.43	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-9.9	-175.6	70.1	-169.8	-175.8	-165.7	0	114.6	E276 T309	E276-K312 IonicContact OE2-NZ 2.7Å; E276-K312 PolarHBondContact OE2-NZ 2.65Å; T309-K312 HydrophobicContact CG2-CG 4.38Å; T309-K312 PolarHBondContact O-N 3.29Å
313	V	94.2	Very high	95.4	Very high	38 Å²	38	56.9 Å²	56.9	23%	0.23	30%	0.304	C	S	.	.			trans	-76.4	137	-179.6	65.1	0	0	0	0	111.5	T309 L315 P335 H336	T309-V313 WeakPolarHBondContact O-CB 3.35Å; T309-V313 WeakPolarHBondContact O-CG1 3.19Å; T309-V313 PolarHBondContact O-N 3.04Å; T309-V313 VanDerWaalsContact O-N 3.09Å; V313-L315 HydrophobicContact CB-CD2 4.44Å; V313-L315 HydrophobicContact CG1-CD1 4.08Å; V313-L315 HydrophobicContact CG1-CD2 3.87Å; V313-L315 HydrophobicContact CG1-CG 3.97Å; V313-L315 HydrophobicContact CG2-CD2 3.81Å; V313-P335 HydrophobicContact CB-CB 4.39Å; V313-P335 HydrophobicContact CG1-CB 4.12Å; V313-H336 HydrophobicContact CG2-CB 3.93Å
314	N	93.6	Very high	95.3	Very high	116 Å²	116	54.9 Å²	54.9	62%	0.62	30%	0.299	S	S	*	.			trans	-87.9	116	176.8	-177.3	11.9	0	0	0	111.2	S316	N314-S316 PolarHBondContact ND2-OG 2.97Å; N314-S316 VanDerWaalsContact OD1-CB 3.27Å; N314-S316 WeakPolarHBondContact OD1-CB 3.3Å; N314-S316 PolarHBondContact OD1-N 3.11Å; N314-S316 PolarHBondContact OD1-OG 3.46Å; N314-S316 VanDerWaalsContact OD1-OG 3.11Å
315	L	95.8	Very high	95.2	Very high	27 Å²	27	52.1 Å²	52.1	14%	0.141	29%	0.29	C	S	.	.			trans	-111.2	17.9	-178.4	-49.4	177.7	0	0	0	112.7	V313 I318 H336 K505	V313-L315 HydrophobicContact CB-CD2 4.44Å; V313-L315 HydrophobicContact CG1-CD1 4.08Å; V313-L315 HydrophobicContact CG1-CD2 3.87Å; V313-L315 HydrophobicContact CG1-CG 3.97Å; V313-L315 HydrophobicContact CG2-CD2 3.81Å; L315-I318 HydrophobicContact CD2-CG1 4.26Å; L315-I318 PolarHBondContact O-N 3.46Å; L315-H336 HydrophobicContact CD2-CB 3.84Å; L315-K505 HydrophobicContact CB-CD 4.09Å; L315-K505 HydrophobicContact CD1-CB 3.8Å; L315-K505 WeakPolarHBondContact CD1-O 3.35Å; L315-K505 PolarHBondContact O-NZ 3.31Å
316	S	93.4	Very high	95.2	Very high	91 Å²	91	49.4 Å²	49.4	64%	0.636	26%	0.256	S	S	*	.	S	Bend	trans	-67.8	-34.7	-176.7	71.4	0	0	0	0	113.6	N314	N314-S316 PolarHBondContact ND2-OG 2.97Å; N314-S316 VanDerWaalsContact OD1-CB 3.27Å; N314-S316 WeakPolarHBondContact OD1-CB 3.3Å; N314-S316 PolarHBondContact OD1-N 3.11Å; N314-S316 PolarHBondContact OD1-OG 3.46Å; N314-S316 VanDerWaalsContact OD1-OG 3.11Å
317	S	93.8	Very high	95.1	Very high	59 Å²	59	49.8 Å²	49.8	41%	0.413	26%	0.262	S	S	.	.	S	Bend	trans	-85.4	-16.4	177.1	50.3	0	0	0	0	113.6	N495	S317-N495 PolarHBondContact O-ND2 3.14Å; S317-N495 PolarHBondContact O-OD1 2.83Å
318	I	97.1	Very high	95	Very high	9 Å²	9	45.7 Å²	45.7	5%	0.046	25%	0.245	C	C	.	.			trans	-80.9	125	-177	-51.7	-56.2	0	0	0	109.7	L315 M321 L338 A480 K505	L315-I318 HydrophobicContact CD2-CG1 4.26Å; L315-I318 PolarHBondContact O-N 3.46Å; I318-M321 HydrophobicContact CG2-CB 4.08Å; I318-M321 HydrophobicContact CG2-SD 4.13Å; I318-L338 HydrophobicContact CD1-CD1 3.73Å; I318-L338 HydrophobicContact CD1-CG 4.18Å; I318-A480 HydrophobicContact CD1-CB 3.98Å; I318-K505 WeakPolarHBondContact O-CE 3.23Å; I318-K505 PolarHBondContact O-NZ 3.3Å
319	R	97.9	Very high	94.7	Very high	98 Å²	98	50.9 Å²	50.9	37%	0.37	27%	0.269	S	S	.	.	S	Bend	trans	-130.6	-18.9	176.8	-63.6	-176.4	56	135.3	1.7	113.5	N495 A498 L500	R319-N495 WeakPolarHBondContact CB-O 3.4Å; R319-N495 WeakPolarHBondContact CB-OD1 3.38Å; R319-N495 WeakPolarHBondContact CD-O 3.44Å; R319-N495 PolarHBondContact N-OD1 3.29Å; R319-N495 PolarHBondContact NE-O 3.3Å; R319-A498 VanDerWaalsContact CZ-O 3.24Å; R319-A498 PolarHBondContact NE-O 3.05Å; R319-A498 PolarHBondContact NH2-O 2.89Å; R319-A498 WeakPolarHBondContact O-CB 3.42Å; R319-L500 WeakPolarHBondContact O-CD1 3.16Å; R319-L500 WeakPolarHBondContact O-CG 3.04Å
320	A	98.1	Very high	94.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-132.6	147.5	163	0	0	0	0	0	109.3	F354 F478 F494 A498	A320-F354 HydrophobicContact CB-CB 4.27Å; A320-F478 HydrophobicContact CB-CB 4.12Å; A320-F478 HydrophobicContact CB-CG 4.35Å; A320-F478 WeakPolarHBondContact O-CD2 3.47Å; A320-F494 HydrophobicContact CB-CB 3.73Å; A320-A498 HydrophobicContact CB-CB 3.86Å
321	M	98.2	Very high	94.6	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	28%	0.28	C	S	.	.			trans	-154.9	175.1	-176.5	60.4	-160.2	-86.1	0	0	110.9	I318 G337 L338 C352 T353 L500 K505 I507	I318-M321 HydrophobicContact CG2-CB 4.08Å; I318-M321 HydrophobicContact CG2-SD 4.13Å; M321-G337 WeakPolarHBondContact CB-O 3.2Å; M321-L338 HydrophobicContact CB-CD2 4.49Å; M321-C352 CarbonylContact O-C 3.55Å; M321-C352 WeakPolarHBondContact O-CA 3.44Å; M321-C352 WeakPolarHBondContact O-CB 3.47Å; M321-T353 HydrophobicContact CG-CG2 3.76Å; M321-T353 PolarHBondContact N-OG1 2.92Å; M321-T353 PolarHBondContact O-N 3.42Å; M321-T353 PolarHBondContact O-OG1 3.45Å; M321-L500 HydrophobicContact CG-CD1 3.74Å; M321-L500 HydrophobicContact SD-CD1 3.62Å; M321-K505 WeakPolarHBondContact CE-O 3.09Å; M321-K505 HydrophobicContact SD-CB 4.25Å; M321-K505 HydrophobicContact SD-CG 4.16Å; M321-I507 HydrophobicContact CE-CD1 3.7Å; M321-I507 HydrophobicContact CE-CG1 3.82Å
322	L	98.5	Very high	94.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135.6	167.5	-62.6	177.9	0	0	0	110.1	S324 I333 G337 A340 V350 F476 F478	L322-S324 PolarHBondContact O-N 3.45Å; L322-I333 HydrophobicContact CB-CD1 4.2Å; L322-I333 HydrophobicContact CB-CG2 4.2Å; L322-I333 HydrophobicContact CD1-CG2 4.29Å; L322-G337 WeakPolarHBondContact CB-O 3.49Å; L322-G337 WeakPolarHBondContact CG-O 3.47Å; L322-G337 PolarHBondContact N-O 3.23Å; L322-A340 HydrophobicContact CD1-CB 3.53Å; L322-V350 HydrophobicContact CB-CG2 4.05Å; L322-V350 HydrophobicContact CD2-CG1 4.04Å; L322-V350 HydrophobicContact CD2-CG2 4.24Å; L322-F476 HydrophobicContact CD1-CD2 3.75Å; L322-F476 HydrophobicContact CD1-CE2 3.77Å; L322-F476 HydrophobicContact CD2-CD1 4.27Å; L322-F476 HydrophobicContact CD2-CD2 3.95Å; L322-F476 HydrophobicContact CD2-CE1 4.26Å; L322-F476 HydrophobicContact CD2-CE2 3.96Å; L322-F476 HydrophobicContact CD2-CG 4.15Å; L322-F476 HydrophobicContact CD2-CZ 4.12Å; L322-F476 HydrophobicContact CG-CD2 4.1Å; L322-F476 HydrophobicContact CG-CE2 4.35Å; L322-F478 HydrophobicContact CD2-CE2 4.4Å; L322-F478 HydrophobicContact CD2-CZ 4.08Å
323	N	96.6	Very high	95	Very high	30 Å²	30	45.9 Å²	45.9	16%	0.16	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	106.7	-171.2	-174.6	-2.3	0	0	0	111.5	N325 D326 R351 T353	N323-N325 PolarHBondContact O-N 2.85Å; N323-N325 WeakPolarHBondContact OD1-CB 3.3Å; N323-N325 PolarHBondContact OD1-N 3.12Å; N323-D326 HydrophobicContact CB-CB 4.02Å; N323-D326 VanDerWaalsContact ND2-CB 3.3Å; N323-D326 WeakPolarHBondContact ND2-CB 3.34Å; N323-D326 CarbonylContact O-C 3.51Å; N323-D326 PolarHBondContact O-N 2.77Å; N323-R351 WeakPolarHBondContact CB-O 3.31Å; N323-R351 PolarHBondContact N-O 3.17Å; N323-T353 HydrophobicContact CB-CG2 3.77Å
324	S	93.1	Very high	95.1	Very high	26 Å²	26	44.2 Å²	44.2	18%	0.182	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	1	177.5	60.5	0	0	0	0	115.1	L322	L322-S324 PolarHBondContact O-N 3.45Å
325	N	91.4	Very high	95.2	Very high	130 Å²	130	39.4 Å²	39.4	70%	0.695	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	-0.2	172.7	-54.6	-46.9	0	0	0	112.9	N323	N323-N325 PolarHBondContact O-N 2.85Å; N323-N325 WeakPolarHBondContact OD1-CB 3.3Å; N323-N325 PolarHBondContact OD1-N 3.12Å
326	D	93.4	Very high	95.1	Very high	27 Å²	27	39.9 Å²	39.9	14%	0.144	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	61.6	178.6	-168.1	6.4	0	0	0	109.2	N323 R351	N323-D326 HydrophobicContact CB-CB 4.02Å; N323-D326 VanDerWaalsContact ND2-CB 3.3Å; N323-D326 WeakPolarHBondContact ND2-CB 3.34Å; N323-D326 CarbonylContact O-C 3.51Å; N323-D326 PolarHBondContact O-N 2.77Å; D326-R351 PolarHBondContact O-N 3.31Å; D326-R351 VanDerWaalsContact O-N 3.13Å; D326-R351 IonicContact OD1-CZ 2.69Å; D326-R351 IonicContact OD1-NE 3.99Å; D326-R351 PolarHBondContact OD1-NE 2.76Å; D326-R351 IonicContact OD1-NH2 2.7Å; D326-R351 PolarHBondContact OD1-NH2 2.71Å; D326-R351 IonicContact OD2-CZ 3.25Å; D326-R351 IonicContact OD2-NE 3.11Å; D326-R351 PolarHBondContact OD2-NE 2.77Å; D326-R351 IonicContact OD2-NH2 3.41Å
327	V	93.9	Very high	95.3	Very high	45 Å²	45	35.6 Å²	35.6	27%	0.273	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	148.4	-169.7	61.9	0	0	0	0	111.1	L331 I333 S349 V350	V327-L331 HydrophobicContact CG2-CB 3.63Å; V327-L331 HydrophobicContact CG2-CD2 3.65Å; V327-L331 HydrophobicContact CG2-CG 4.26Å; V327-I333 HydrophobicContact CG1-CD1 4.49Å; V327-I333 HydrophobicContact CG2-CD1 4.24Å; V327-S349 CarbonylContact C-O 3.51Å; V327-S349 VanDerWaalsContact CA-O 3.3Å; V327-S349 WeakPolarHBondContact CA-O 3.46Å; V327-V350 HydrophobicContact CB-CB 4.14Å; V327-V350 HydrophobicContact CB-CG2 3.92Å; V327-V350 HydrophobicContact CG2-CB 3.81Å; V327-V350 HydrophobicContact CG2-CG2 3.96Å
328	S	93.5	Very high	95.5	Very high	17 Å²	17	33.3 Å²	33.3	12%	0.119	17%	0.165	C	C	.	.			trans	-65.9	153.5	170.4	-54	0	0	0	0	112.4	Y330 L331 E348 S349	S328-Y330 VanDerWaalsContact C-N 3.35Å; S328-Y330 PolarHBondContact O-N 3.13Å; S328-L331 PolarHBondContact O-N 3.31Å; S328-E348 VanDerWaalsContact CB-CD 3.45Å; S328-E348 WeakPolarHBondContact CB-OE2 3.32Å; S328-S349 PolarHBondContact N-O 3.26Å; S328-S349 PolarHBondContact OG-N 3Å; S328-S349 PolarHBondContact OG-O 2.85Å
329	E	88	Confident	95.6	Very high	121 Å²	121	33 Å²	33	57%	0.565	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.7	-159.9	70.2	167	157	0	0	116.6	E348	E329-E348 PolarHBondContact N-OE2 3.11Å
330	Y	92.5	Very high	95.6	Very high	90 Å²	90	28.3 Å²	28.3	35%	0.353	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-4.6	-177.7	-57.5	-70.2	0	0	0	114.1	S328 K332 A344 E348	S328-Y330 VanDerWaalsContact C-N 3.35Å; S328-Y330 PolarHBondContact O-N 3.13Å; Y330-K332 PolarHBondContact O-N 2.85Å; Y330-A344 HydrophobicContact CD2-CB 4.21Å; Y330-A344 HydrophobicContact CG-CB 4.09Å; Y330-E348 WeakPolarHBondContact CA-OE2 3.44Å; Y330-E348 WeakPolarHBondContact CB-OE2 3.06Å; Y330-E348 PolarHBondContact N-OE2 2.88Å
331	L	96.4	Very high	95.6	Very high	16 Å²	16	28.3 Å²	28.3	8%	0.084	15%	0.146	C	C	.	.			trans	-66.5	118.1	178.4	-162.4	72.2	0	0	0	110.7	V327 S328 I333 A340 C342 E348 V350 F468	V327-L331 HydrophobicContact CG2-CB 3.63Å; V327-L331 HydrophobicContact CG2-CD2 3.65Å; V327-L331 HydrophobicContact CG2-CG 4.26Å; S328-L331 PolarHBondContact O-N 3.31Å; L331-I333 HydrophobicContact CD2-CG1 4.47Å; L331-I333 PolarHBondContact O-N 3.08Å; L331-A340 HydrophobicContact CD2-CB 4.04Å; L331-A340 HydrophobicContact CG-CB 4.28Å; L331-C342 HydrophobicContact CD1-CB 4.01Å; L331-E348 HydrophobicContact CB-CB 4.06Å; L331-E348 HydrophobicContact CD1-CB 3.84Å; L331-E348 PolarHBondContact N-OE2 2.73Å; L331-V350 HydrophobicContact CD2-CB 3.7Å; L331-V350 HydrophobicContact CD2-CG1 3.57Å; L331-V350 HydrophobicContact CD2-CG2 4.47Å; L331-F468 HydrophobicContact CD1-CB 4.19Å; L331-F468 HydrophobicContact CD1-CD2 3.61Å; L331-F468 HydrophobicContact CD1-CE2 4.12Å; L331-F468 HydrophobicContact CD1-CG 3.94Å; L331-F468 HydrophobicContact CD2-CD2 4.24Å; L331-F468 HydrophobicContact CD2-CE2 4.11Å
332	K	97.6	Very high	95.6	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.3	173.2	-59.9	178.7	177.3	171	0	108.3	E251 F291 W295 Y330 A340 R341 D343	E251-K332 IonicContact OE1-NZ 2.81Å; E251-K332 PolarHBondContact OE1-NZ 3.09Å; E251-K332 IonicContact OE2-NZ 3.83Å; E251-K332 PolarHBondContact OE2-NZ 3.38Å; F291-K332 HydrophobicContact CE1-CB 3.76Å; F291-K332 HydrophobicContact CE1-CD 4.36Å; F291-K332 HydrophobicContact CZ-CB 4.15Å; W295-K332 HydrophobicContact CD2-CD 3.87Å; W295-K332 HydrophobicContact CD2-CG 3.94Å; W295-K332 HydrophobicContact CE3-CD 4.08Å; W295-K332 HydrophobicContact CE3-CG 4.47Å; W295-K332 HydrophobicContact CG-CB 4.33Å; W295-K332 HydrophobicContact CG-CD 4.11Å; W295-K332 HydrophobicContact CG-CG 4.21Å; W295-K332 HydrophobicContact CZ2-CG 4.17Å; Y330-K332 PolarHBondContact O-N 2.85Å; K332-A340 CarbonylContact O-C 3.52Å; K332-A340 VanDerWaalsContact O-CA 3.23Å; K332-A340 WeakPolarHBondContact O-CA 3.24Å; K332-R341 HydrophobicContact CB-CB 4.41Å; K332-R341 WeakPolarHBondContact CB-O 3.24Å; K332-R341 PolarHBondContact N-O 2.97Å; K332-R341 PolarHBondContact O-N 2.87Å; K332-D343 WeakPolarHBondContact CE-OD2 3.38Å; K332-D343 IonicContact NZ-OD2 3.24Å; K332-D343 PolarHBondContact NZ-OD2 3.35Å
333	I	97.7	Very high	95.4	Very high	12 Å²	12	28.5 Å²	28.5	6%	0.062	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136	170.7	-48.1	179	0	0	0	109.3	L322 V327 L331 V350 I507	L322-I333 HydrophobicContact CB-CD1 4.2Å; L322-I333 HydrophobicContact CB-CG2 4.2Å; L322-I333 HydrophobicContact CD1-CG2 4.29Å; V327-I333 HydrophobicContact CG1-CD1 4.49Å; V327-I333 HydrophobicContact CG2-CD1 4.24Å; L331-I333 HydrophobicContact CD2-CG1 4.47Å; L331-I333 PolarHBondContact O-N 3.08Å; I333-V350 HydrophobicContact CD1-CG2 4.41Å; I333-I507 HydrophobicContact CB-CD1 4.11Å; I333-I507 HydrophobicContact CG2-CD1 3.57Å
334	S	96.9	Very high	95.2	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.028	14%	0.14	C	C	.	.			trans	-55.1	152.3	170.7	49.3	0	0	0	0	113.2	H336 G337 L338 E339 I507	S334-H336 PolarHBondContact O-N 2.87Å; S334-H336 PolarHBondContact OG-CE1 3.3Å; S334-H336 VanDerWaalsContact OG-CE1 3.29Å; S334-G337 PolarHBondContact O-N 2.81Å; S334-G337 PolarHBondContact OG-N 2.83Å; S334-L338 PolarHBondContact OG-N 2.85Å; S334-E339 WeakPolarHBondContact CB-O 3.37Å; S334-E339 PolarHBondContact N-O 2.82Å; S334-E339 WeakPolarHBondContact OG-CA 3.33Å; S334-E339 PolarHBondContact OG-N 2.86Å; S334-E339 PolarHBondContact OG-O 2.86Å; S334-I507 WeakPolarHBondContact O-CD1 3.43Å
335	P	95.2	Very high	95	Very high	15 Å²	15	28.7 Å²	28.7	10%	0.097	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.8	177.6	-25.9	35.9	0	0	0	115.7	T309 V313	T309-P335 HydrophobicContact CG2-CB 4.13Å; T309-P335 HydrophobicContact CG2-CG 3.69Å; V313-P335 HydrophobicContact CB-CB 4.39Å; V313-P335 HydrophobicContact CG1-CB 4.12Å
336	H	95	Very high	94.9	Very high	37 Å²	37	22.9 Å²	22.9	17%	0.171	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	1.6	173.5	56.4	78	0	0	0	113.8	V313 L315 S334 L338	V313-H336 HydrophobicContact CG2-CB 3.93Å; L315-H336 HydrophobicContact CD2-CB 3.84Å; S334-H336 PolarHBondContact O-N 2.87Å; S334-H336 PolarHBondContact OG-CE1 3.3Å; S334-H336 VanDerWaalsContact OG-CE1 3.29Å; H336-L338 WeakPolarHBondContact ND1-CB 3.49Å; H336-L338 PolarHBondContact ND1-N 3.22Å; H336-L338 PolarHBondContact O-N 3.19Å
337	G	97.3	Very high	94.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	65.5	17.7	174.5	0	0	0	0	0	116	M321 L322 S334	M321-G337 WeakPolarHBondContact CB-O 3.2Å; L322-G337 WeakPolarHBondContact CB-O 3.49Å; L322-G337 WeakPolarHBondContact CG-O 3.47Å; L322-G337 PolarHBondContact N-O 3.23Å; S334-G337 PolarHBondContact O-N 2.81Å; S334-G337 PolarHBondContact OG-N 2.83Å
338	L	97.9	Very high	95	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.063	10%	0.104	C	C	.	.	S	Bend	trans	-109.6	-16.9	179.3	-60.3	-172.5	0	0	0	113.7	I318 M321 S334 H336 E475 F476 F478 A480	I318-L338 HydrophobicContact CD1-CD1 3.73Å; I318-L338 HydrophobicContact CD1-CG 4.18Å; M321-L338 HydrophobicContact CB-CD2 4.49Å; S334-L338 PolarHBondContact OG-N 2.85Å; H336-L338 WeakPolarHBondContact ND1-CB 3.49Å; H336-L338 PolarHBondContact ND1-N 3.22Å; H336-L338 PolarHBondContact O-N 3.19Å; L338-E475 CarbonylContact O-C 3.59Å; L338-E475 WeakPolarHBondContact O-CA 3.3Å; L338-F476 WeakPolarHBondContact CB-O 3.4Å; L338-F476 WeakPolarHBondContact O-CD2 3.41Å; L338-F476 PolarHBondContact O-N 3.01Å; L338-F478 HydrophobicContact CD2-CD2 3.56Å; L338-F478 HydrophobicContact CD2-CE2 4.01Å; L338-A480 HydrophobicContact CD1-CB 4.37Å
339	E	98.3	Very high	95.2	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.009	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.9	175.5	-172.8	170.5	-164.2	0	0	110.2	R287 F291 S334 Q473 C474 E475	R287-E339 IonicContact CZ-OE1 2.69Å; R287-E339 IonicContact CZ-OE2 2.65Å; R287-E339 VanDerWaalsContact CZ-OE2 3.31Å; R287-E339 IonicContact NE-OE1 2.7Å; R287-E339 PolarHBondContact NE-OE1 2.83Å; R287-E339 IonicContact NE-OE2 2.68Å; R287-E339 PolarHBondContact NE-OE2 2.87Å; R287-E339 VanDerWaalsContact NE-OE2 3.13Å; R287-E339 IonicContact NH2-OE1 3.18Å; R287-E339 PolarHBondContact NH2-OE1 3.38Å; R287-E339 IonicContact NH2-OE2 2.68Å; R287-E339 PolarHBondContact NH2-OE2 2.92Å; F291-E339 HydrophobicContact CD2-CB 4.49Å; F291-E339 HydrophobicContact CD2-CG 3.94Å; F291-E339 HydrophobicContact CE2-CB 4.05Å; F291-E339 HydrophobicContact CE2-CG 3.74Å; S334-E339 WeakPolarHBondContact CB-O 3.37Å; S334-E339 PolarHBondContact N-O 2.82Å; S334-E339 WeakPolarHBondContact OG-CA 3.33Å; S334-E339 PolarHBondContact OG-N 2.86Å; S334-E339 PolarHBondContact OG-O 2.86Å; E339-Q473 HydrophobicContact CG-CG 4.29Å; E339-Q473 PolarHBondContact OE1-NE2 3.36Å; E339-C474 WeakPolarHBondContact CA-O 3.41Å; E339-E475 HydrophobicContact CB-CB 4.35Å; E339-E475 HydrophobicContact CB-CG 4.27Å; E339-E475 HydrophobicContact CG-CB 4.35Å
340	A	98.4	Very high	95.6	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.6	177.8	0	0	0	0	0	112.2	L322 L331 K332 F468 Q473 C474	L322-A340 HydrophobicContact CD1-CB 3.53Å; L331-A340 HydrophobicContact CD2-CB 4.04Å; L331-A340 HydrophobicContact CG-CB 4.28Å; K332-A340 CarbonylContact O-C 3.52Å; K332-A340 VanDerWaalsContact O-CA 3.23Å; K332-A340 WeakPolarHBondContact O-CA 3.24Å; A340-F468 HydrophobicContact CB-CE2 4.42Å; A340-F468 HydrophobicContact CB-CZ 4.04Å; A340-Q473 VanDerWaalsContact O-CA 3.32Å; A340-Q473 WeakPolarHBondContact O-CA 3.44Å; A340-Q473 WeakPolarHBondContact O-CG 3.34Å; A340-C474 PolarHBondContact N-O 3.23Å; A340-C474 VanDerWaalsContact N-O 3.13Å; A340-C474 PolarHBondContact O-N 2.86Å; A340-C474 VanDerWaalsContact O-N 3.15Å
341	R	98.2	Very high	95.9	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	137.5	-178.9	-176.9	-174.1	-179.4	71.7	21.2	111.3	F291 C292 K332 D343 Y471 Q472 Q473	F291-R341 HydrophobicContact CD1-CB 4.12Å; F291-R341 HydrophobicContact CE1-CB 3.5Å; F291-R341 HydrophobicContact CE1-CG 4.45Å; F291-R341 HydrophobicContact CZ-CB 3.95Å; C292-R341 VanDerWaalsContact SG-CD 3.5Å; C292-R341 PolarHBondContact SG-NE 2.95Å; K332-R341 HydrophobicContact CB-CB 4.41Å; K332-R341 WeakPolarHBondContact CB-O 3.24Å; K332-R341 PolarHBondContact N-O 2.97Å; K332-R341 PolarHBondContact O-N 2.87Å; R341-D343 VanDerWaalsContact CD-OD2 3.31Å; R341-D343 WeakPolarHBondContact CD-OD2 3.3Å; R341-D343 IonicContact CZ-OD1 2.67Å; R341-D343 VanDerWaalsContact CZ-OD1 3.23Å; R341-D343 IonicContact NE-OD1 3.58Å; R341-D343 PolarHBondContact NE-OD1 3.12Å; R341-D343 IonicContact NE-OD2 2.66Å; R341-D343 PolarHBondContact NE-OD2 3.3Å; R341-D343 IonicContact NH2-OD1 3.97Å; R341-D343 PolarHBondContact NH2-OD1 3.3Å; R341-Y471 PolarHBondContact NH1-O 3.1Å; R341-Y471 PolarHBondContact NH2-O 2.97Å; R341-Q472 CarbonylContact C-O 3.59Å; R341-Q472 VanDerWaalsContact CA-O 3.26Å; R341-Q472 WeakPolarHBondContact CA-O 3.27Å; R341-Q473 HydrophobicContact CB-CB 4.16Å; R341-Q473 HydrophobicContact CB-CG 4.02Å; R341-Q473 VanDerWaalsContact CD-OE1 3.24Å; R341-Q473 HydrophobicContact CG-CB 4.11Å; R341-Q473 HydrophobicContact CG-CG 4.38Å
342	C	97.4	Very high	96	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.055	C	C	.	.			trans	-100.1	136.2	164.8	-179.6	0	0	0	0	110.5	L331 A344 E348 F468 Y471 Q472	L331-C342 HydrophobicContact CD1-CB 4.01Å; C342-A344 PolarHBondContact SG-N 2.85Å; C342-A344 VanDerWaalsContact SG-N 3.38Å; C342-E348 HydrophobicContact CB-CB 4.36Å; C342-E348 HydrophobicContact CB-CG 4.45Å; C342-E348 VanDerWaalsContact SG-CG 3.58Å; C342-F468 HydrophobicContact CB-CB 3.55Å; C342-F468 HydrophobicContact CB-CG 4.49Å; C342-Y471 CarbonylContact O-C 3.54Å; C342-Y471 WeakPolarHBondContact O-CA 3.3Å; C342-Y471 PolarHBondContact O-N 2.71Å; C342-Q472 PolarHBondContact N-O 3.28Å; C342-Q472 PolarHBondContact O-N 3.36Å
343	D	95.8	Very high	96	Very high	6 Å²	6	11.1 Å²	11.1	3%	0.032	6%	0.064	C	C	.	.			trans	-129	17	167	-66.9	-56.4	0	0	0	111.8	I248 K252 K332 R341 Y471	I248-D343 VanDerWaalsContact CD1-OD1 3.23Å; I248-D343 WeakPolarHBondContact CD1-OD1 3.24Å; I248-D343 HydrophobicContact CG1-CB 4.49Å; I248-D343 HydrophobicContact CG2-CB 4.39Å; K252-D343 VanDerWaalsContact CE-O 3.23Å; K252-D343 WeakPolarHBondContact CE-O 3.33Å; K252-D343 PolarHBondContact NZ-O 2.92Å; K332-D343 WeakPolarHBondContact CE-OD2 3.38Å; K332-D343 IonicContact NZ-OD2 3.24Å; K332-D343 PolarHBondContact NZ-OD2 3.35Å; R341-D343 VanDerWaalsContact CD-OD2 3.31Å; R341-D343 WeakPolarHBondContact CD-OD2 3.3Å; R341-D343 IonicContact CZ-OD1 2.67Å; R341-D343 VanDerWaalsContact CZ-OD1 3.23Å; R341-D343 IonicContact NE-OD1 3.58Å; R341-D343 PolarHBondContact NE-OD1 3.12Å; R341-D343 IonicContact NE-OD2 2.66Å; R341-D343 PolarHBondContact NE-OD2 3.3Å; R341-D343 IonicContact NH2-OD1 3.97Å; R341-D343 PolarHBondContact NH2-OD1 3.3Å; D343-Y471 HydrophobicContact CB-CD1 4.39Å; D343-Y471 WeakPolarHBondContact OD1-CD1 3.11Å
344	A	91.9	Very high	96	Very high	4 Å²	4	12.9 Å²	12.9	3%	0.033	7%	0.071	C	C	.	.	S	Bend	trans	-92.9	167.6	173.7	0	0	0	0	0	111.7	Y330 C342 E348 S470	Y330-A344 HydrophobicContact CD2-CB 4.21Å; Y330-A344 HydrophobicContact CG-CB 4.09Å; C342-A344 PolarHBondContact SG-N 2.85Å; C342-A344 VanDerWaalsContact SG-N 3.38Å; A344-E348 HydrophobicContact CB-CG 4.33Å; A344-S470 WeakPolarHBondContact O-CA 3.33Å; A344-S470 WeakPolarHBondContact O-CB 3.34Å; A344-S470 PolarHBondContact O-OG 3.11Å
345	S	88.3	Confident	96.1	Very high	56 Å²	56	14.6 Å²	14.6	39%	0.392	8%	0.083	S	C	.	.	S	Bend	trans	-76.6	-25.3	168.8	58	0	0	0	0	112.8	D165 S470	D165-S345 WeakPolarHBondContact OD2-CB 3.48Å; D165-S345 PolarHBondContact OD2-OG 2.74Å; S345-S470 WeakPolarHBondContact CA-OG 3.16Å
346	S	90	Very high	96.2	Very high	9 Å²	9	14 Å²	14	6%	0.063	8%	0.078	C	C	.	.	S	Bend	trans	-72.3	155.7	177.5	49.3	0	0	0	0	113.7	E348 N386	S346-E348 VanDerWaalsContact CB-OE1 3.31Å; S346-E348 WeakPolarHBondContact CB-OE1 3.5Å; S346-E348 PolarHBondContact O-N 3.26Å; S346-E348 VanDerWaalsContact O-N 3.1Å; S346-E348 PolarHBondContact OG-OE1 3.37Å; S346-N386 WeakPolarHBondContact CB-O 3.27Å
347	F	92	Very high	96.2	Very high	20 Å²	20	16.3 Å²	16.3	9%	0.088	9%	0.092	C	C	.	.			trans	-87.9	73.9	-177.5	-165.2	-134.1	0	0	0	111.2	S349 Q374 N386 G389 F468 M469	F347-S349 PolarHBondContact O-N 3.39Å; F347-S349 PolarHBondContact O-OG 2.89Å; F347-Q374 HydrophobicContact CZ-CB 4.22Å; F347-Q374 HydrophobicContact CZ-CG 4.06Å; F347-N386 PolarHBondContact N-O 2.98Å; F347-N386 WeakPolarHBondContact O-CB 3.42Å; F347-G389 VanDerWaalsContact CD1-O 3.24Å; F347-G389 WeakPolarHBondContact CD1-O 3.44Å; F347-F468 VanDerWaalsContact CD2-C 3.41Å; F347-F468 WeakPolarHBondContact CD2-O 3.38Å; F347-M469 HydrophobicContact CD2-CB 4.43Å; F347-M469 HydrophobicContact CE2-CB 4.49Å
348	E	96.4	Very high	96.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	131.1	-172.5	-61.2	-60.7	104.7	0	0	112.3	S328 E329 Y330 L331 C342 A344 S346 N386 S467 F468	S328-E348 VanDerWaalsContact CB-CD 3.45Å; S328-E348 WeakPolarHBondContact CB-OE2 3.32Å; E329-E348 PolarHBondContact N-OE2 3.11Å; Y330-E348 WeakPolarHBondContact CA-OE2 3.44Å; Y330-E348 WeakPolarHBondContact CB-OE2 3.06Å; Y330-E348 PolarHBondContact N-OE2 2.88Å; L331-E348 HydrophobicContact CB-CB 4.06Å; L331-E348 HydrophobicContact CD1-CB 3.84Å; L331-E348 PolarHBondContact N-OE2 2.73Å; C342-E348 HydrophobicContact CB-CB 4.36Å; C342-E348 HydrophobicContact CB-CG 4.45Å; C342-E348 VanDerWaalsContact SG-CG 3.58Å; A344-E348 HydrophobicContact CB-CG 4.33Å; S346-E348 VanDerWaalsContact CB-OE1 3.31Å; S346-E348 WeakPolarHBondContact CB-OE1 3.5Å; S346-E348 PolarHBondContact O-N 3.26Å; S346-E348 VanDerWaalsContact O-N 3.1Å; S346-E348 PolarHBondContact OG-OE1 3.37Å; E348-N386 WeakPolarHBondContact OE1-CB 3.32Å; E348-N386 PolarHBondContact OE1-ND2 2.73Å; E348-S467 CarbonylContact O-C 3.48Å; E348-S467 WeakPolarHBondContact O-CA 3.39Å; E348-F468 PolarHBondContact N-O 3.29Å; E348-F468 PolarHBondContact O-N 3.05Å
349	S	97.3	Very high	96.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.8	-172.9	-60.4	0	0	0	0	113	V327 S328 F347 F384 A466 S467	V327-S349 CarbonylContact C-O 3.51Å; V327-S349 VanDerWaalsContact CA-O 3.3Å; V327-S349 WeakPolarHBondContact CA-O 3.46Å; S328-S349 PolarHBondContact N-O 3.26Å; S328-S349 PolarHBondContact OG-N 3Å; S328-S349 PolarHBondContact OG-O 2.85Å; F347-S349 PolarHBondContact O-N 3.39Å; F347-S349 PolarHBondContact O-OG 2.89Å; S349-F384 VanDerWaalsContact CB-CG 3.49Å; S349-A466 CarbonylContact C-O 3.55Å; S349-A466 WeakPolarHBondContact CA-O 3.37Å; S349-S467 WeakPolarHBondContact CB-OG 3.44Å; S349-S467 VanDerWaalsContact OG-CB 3.31Å; S349-S467 WeakPolarHBondContact OG-CB 3.47Å; S349-S467 PolarHBondContact OG-OG 3.38Å
350	V	98.2	Very high	96.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	143.7	-178.5	60.5	0	0	0	0	112.8	L322 V327 L331 I333 A465 A466 F468	L322-V350 HydrophobicContact CB-CG2 4.05Å; L322-V350 HydrophobicContact CD2-CG1 4.04Å; L322-V350 HydrophobicContact CD2-CG2 4.24Å; V327-V350 HydrophobicContact CB-CB 4.14Å; V327-V350 HydrophobicContact CB-CG2 3.92Å; V327-V350 HydrophobicContact CG2-CB 3.81Å; V327-V350 HydrophobicContact CG2-CG2 3.96Å; L331-V350 HydrophobicContact CD2-CB 3.7Å; L331-V350 HydrophobicContact CD2-CG1 3.57Å; L331-V350 HydrophobicContact CD2-CG2 4.47Å; I333-V350 HydrophobicContact CD1-CG2 4.41Å; V350-A465 CarbonylContact O-C 3.57Å; V350-A465 WeakPolarHBondContact O-CA 3.31Å; V350-A465 WeakPolarHBondContact O-CB 3.2Å; V350-A466 PolarHBondContact N-O 3.18Å; V350-A466 PolarHBondContact O-N 3.09Å; V350-F468 HydrophobicContact CG1-CE2 4.07Å
351	R	98.2	Very high	96.3	Very high	20 Å²	20	22 Å²	22	8%	0.075	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	153.9	165.1	-79.2	177.6	-73.9	-113.4	-12.3	111.2	N323 D326 T379 S382 F384 F463 A465	N323-R351 WeakPolarHBondContact CB-O 3.31Å; N323-R351 PolarHBondContact N-O 3.17Å; D326-R351 PolarHBondContact O-N 3.31Å; D326-R351 VanDerWaalsContact O-N 3.13Å; D326-R351 IonicContact OD1-CZ 2.69Å; D326-R351 IonicContact OD1-NE 3.99Å; D326-R351 PolarHBondContact OD1-NE 2.76Å; D326-R351 IonicContact OD1-NH2 2.7Å; D326-R351 PolarHBondContact OD1-NH2 2.71Å; D326-R351 IonicContact OD2-CZ 3.25Å; D326-R351 IonicContact OD2-NE 3.11Å; D326-R351 PolarHBondContact OD2-NE 2.77Å; D326-R351 IonicContact OD2-NH2 3.41Å; R351-T379 WeakPolarHBondContact CD-O 3.42Å; R351-T379 PolarHBondContact NH1-O 2.87Å; R351-S382 PolarHBondContact NH1-O 2.98Å; R351-F384 HydrophobicContact CG-CE2 4.03Å; R351-F384 HydrophobicContact CG-CZ 3.94Å; R351-F384 VanDerWaalsContact CZ-CE2 3.42Å; R351-F463 HydrophobicContact CB-CB 4.14Å; R351-F463 HydrophobicContact CB-CG 4.49Å; R351-F463 HydrophobicContact CG-CB 4.08Å; R351-A465 HydrophobicContact CG-CB 3.97Å
352	C	98.4	Very high	96.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	169.5	169.9	78.2	0	0	0	0	112	M321 F354 F463 A464 F478	M321-C352 CarbonylContact O-C 3.55Å; M321-C352 WeakPolarHBondContact O-CA 3.44Å; M321-C352 WeakPolarHBondContact O-CB 3.47Å; C352-F354 VanDerWaalsContact C-N 3.34Å; C352-F354 PolarHBondContact O-N 3.19Å; C352-F354 PolarHBondContact SG-O 3.05Å; C352-F463 VanDerWaalsContact O-CD1 3.29Å; C352-F463 WeakPolarHBondContact O-CD1 3.21Å; C352-A464 HydrophobicContact CB-CB 4.23Å; C352-A464 WeakPolarHBondContact CB-O 3.49Å; C352-A464 PolarHBondContact N-O 3.03Å; C352-A464 PolarHBondContact SG-N 3.29Å; C352-A464 VanDerWaalsContact SG-N 3.44Å; C352-F478 HydrophobicContact CB-CE1 4.08Å; C352-F478 HydrophobicContact CB-CE2 4.4Å; C352-F478 HydrophobicContact CB-CZ 3.8Å
353	T	98	Very high	96.4	Very high	37 Å²	37	22.1 Å²	22.1	23%	0.227	14%	0.138	C	C	.	.	S	Bend	trans	-78.1	-9.9	-177.4	54.9	0	0	0	0	115.1	M321 N323 L500	M321-T353 HydrophobicContact CG-CG2 3.76Å; M321-T353 PolarHBondContact N-OG1 2.92Å; M321-T353 PolarHBondContact O-N 3.42Å; M321-T353 PolarHBondContact O-OG1 3.45Å; N323-T353 HydrophobicContact CB-CG2 3.77Å; T353-L500 HydrophobicContact CG2-CD1 4.5Å; T353-L500 HydrophobicContact CG2-CD2 4.19Å
354	F	97.9	Very high	96.5	Very high	48 Å²	48	22.1 Å²	22.1	21%	0.211	14%	0.137	C	C	.	.			trans	-123	133	-169.3	-178.5	-97.2	0	0	0	113.3	A320 C352 V356 W361 F463 F494 A498	A320-F354 HydrophobicContact CB-CB 4.27Å; C352-F354 VanDerWaalsContact C-N 3.34Å; C352-F354 PolarHBondContact O-N 3.19Å; C352-F354 PolarHBondContact SG-O 3.05Å; F354-V356 HydrophobicContact CD1-CG2 4.16Å; F354-V356 HydrophobicContact CE1-CG2 4.11Å; F354-W361 HydrophobicContact CE1-CE3 4.42Å; F354-W361 AromaticContact CE1-CH2 3.62Å; F354-W361 HydrophobicContact CE1-CH2 3.62Å; F354-W361 HydrophobicContact CE1-CZ2 4.37Å; F354-W361 AromaticContact CE1-CZ3 3.66Å; F354-W361 HydrophobicContact CE1-CZ3 3.66Å; F354-W361 AromaticContact CZ-CH2 3.95Å; F354-W361 HydrophobicContact CZ-CH2 3.95Å; F354-W361 HydrophobicContact CZ-CZ3 4.34Å; F354-F463 VanDerWaalsContact O-CD1 3.22Å; F354-F463 WeakPolarHBondContact O-CD1 3.45Å; F354-F494 HydrophobicContact CB-CD1 4.19Å; F354-F494 AromaticContact CD1-CD1 3.75Å; F354-F494 HydrophobicContact CD1-CD1 3.75Å; F354-F494 HydrophobicContact CD1-CE1 4.4Å; F354-F494 HydrophobicContact CD1-CG 4.45Å; F354-F494 HydrophobicContact CG-CD1 4.43Å; F354-A498 HydrophobicContact CB-CB 3.93Å; F354-A498 HydrophobicContact CD1-CB 4.39Å; F354-A498 HydrophobicContact CD2-CB 3.39Å; F354-A498 HydrophobicContact CE2-CB 3.94Å; F354-A498 HydrophobicContact CG-CB 3.64Å
355	C	97.7	Very high	96.8	Very high	41 Å²	41	21.9 Å²	21.9	28%	0.277	14%	0.136	S	C	.	.			trans	-92.6	140.5	-176.2	-165.6	0	0	0	0	111.7	D357 F463	C355-D357 PolarHBondContact SG-OD2 3.07Å; C355-F463 HydrophobicContact CB-CE1 3.77Å; C355-F463 HydrophobicContact CB-CE2 4.05Å; C355-F463 HydrophobicContact CB-CZ 3.44Å; C355-F463 VanDerWaalsContact CB-CZ 3.44Å; C355-F463 VanDerWaalsContact SG-CZ 3.6Å
356	V	97.1	Very high	97.3	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.006	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-120.4	112.4	-178.2	172.2	0	0	0	0	110.3	F354 W361 L432 L434 G461 F462 F494	F354-V356 HydrophobicContact CD1-CG2 4.16Å; F354-V356 HydrophobicContact CE1-CG2 4.11Å; V356-W361 HydrophobicContact CG1-CB 4.28Å; V356-W361 HydrophobicContact CG1-CD2 4.04Å; V356-W361 HydrophobicContact CG1-CG 3.6Å; V356-W361 HydrophobicContact CG2-CD2 3.88Å; V356-W361 HydrophobicContact CG2-CE3 4.15Å; V356-W361 HydrophobicContact CG2-CG 4.05Å; V356-L432 HydrophobicContact CB-CD2 4.4Å; V356-L432 HydrophobicContact CG1-CD2 3.79Å; V356-L434 HydrophobicContact CG1-CD1 3.92Å; V356-G461 PolarHBondContact O-N 2.99Å; V356-F462 WeakPolarHBondContact CB-O 3.26Å; V356-F462 PolarHBondContact N-O 3.13Å; V356-F462 PolarHBondContact O-N 2.87Å; V356-F494 HydrophobicContact CG2-CE1 3.95Å; V356-F494 HydrophobicContact CG2-CZ 4.18Å
357	D	96.6	Very high	97.7	Very high	87 Å²	87	19.7 Å²	19.7	47%	0.465	12%	0.12	S	C	.	.			trans	-117.3	-17.8	-172.3	-73.9	-74.8	0	0	0	115.6	C355 S460 G461	C355-D357 PolarHBondContact SG-OD2 3.07Å; D357-S460 WeakPolarHBondContact OD1-CB 3.23Å; D357-S460 PolarHBondContact OD1-OG 3.07Å; D357-G461 WeakPolarHBondContact OD1-CA 3.27Å; D357-G461 PolarHBondContact OD1-N 3.5Å
358	A	97.3	Very high	98	Very high	71 Å²	71	18.7 Å²	18.7	59%	0.587	12%	0.115	S	C	*	.	S	Bend	trans	-155	156.7	175.8	0	0	0	0	0	112.4	W361	A358-W361 PolarHBondContact O-NE1 3.13Å
359	G	97.7	Very high	98.1	Very high	22 Å²	22	19.2 Å²	19.2	23%	0.227	12%	0.118	C	C	.	.	S	Bend	trans	91.2	-159.1	174.5	0	0	0	0	0	114.8	L434	G359-L434 PolarHBondContact O-N 2.97Å
360	V	98.5	Very high	97.9	Very high	22 Å²	22	19.9 Å²	19.9	13%	0.133	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.7	178.6	-171.4	0	0	0	0	109.4	L431 L432 D433 N435 M489 F491 S492	V360-L431 HydrophobicContact CG1-CD1 3.98Å; V360-L431 HydrophobicContact CG1-CD2 4.09Å; V360-L431 HydrophobicContact CG1-CG 4.05Å; V360-L432 CarbonylContact C-O 3.59Å; V360-L432 VanDerWaalsContact CA-O 3.29Å; V360-L432 WeakPolarHBondContact CA-O 3.25Å; V360-D433 HydrophobicContact CG1-CB 4.24Å; V360-D433 HydrophobicContact CG2-CB 4.18Å; V360-N435 VanDerWaalsContact CG2-ND2 3.29Å; V360-N435 WeakPolarHBondContact CG2-ND2 3.48Å; V360-M489 HydrophobicContact CG1-CE 3.99Å; V360-M489 HydrophobicContact CG2-CE 4.41Å; V360-F491 HydrophobicContact CG1-CB 4.11Å; V360-F491 CarbonylContact O-C 2.99Å; V360-F491 WeakPolarHBondContact O-CA 3.29Å; V360-S492 PolarHBondContact O-N 3.21Å
361	W	98.7	Very high	97.7	Very high	19 Å²	19	19.9 Å²	19.9	7%	0.072	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	148.5	-174.3	-64.3	77.6	0	0	0	111.6	F354 V356 A358 W377 L431 L432 S492 T493 Y497	F354-W361 HydrophobicContact CE1-CE3 4.42Å; F354-W361 AromaticContact CE1-CH2 3.62Å; F354-W361 HydrophobicContact CE1-CH2 3.62Å; F354-W361 HydrophobicContact CE1-CZ2 4.37Å; F354-W361 AromaticContact CE1-CZ3 3.66Å; F354-W361 HydrophobicContact CE1-CZ3 3.66Å; F354-W361 AromaticContact CZ-CH2 3.95Å; F354-W361 HydrophobicContact CZ-CH2 3.95Å; F354-W361 HydrophobicContact CZ-CZ3 4.34Å; V356-W361 HydrophobicContact CG1-CB 4.28Å; V356-W361 HydrophobicContact CG1-CD2 4.04Å; V356-W361 HydrophobicContact CG1-CG 3.6Å; V356-W361 HydrophobicContact CG2-CD2 3.88Å; V356-W361 HydrophobicContact CG2-CE3 4.15Å; V356-W361 HydrophobicContact CG2-CG 4.05Å; A358-W361 PolarHBondContact O-NE1 3.13Å; W361-W377 HydrophobicContact CB-CH2 4.24Å; W361-L431 WeakPolarHBondContact O-CA 3.07Å; W361-L432 PolarHBondContact N-O 3.4Å; W361-L432 PolarHBondContact O-N 3.45Å; W361-S492 WeakPolarHBondContact CA-O 3.36Å; W361-T493 WeakPolarHBondContact CZ3-O 3.29Å; W361-Y497 HydrophobicContact CH2-CD1 4.32Å; W361-Y497 AromaticContact CH2-CD2 3.72Å; W361-Y497 HydrophobicContact CH2-CD2 3.72Å; W361-Y497 HydrophobicContact CH2-CE2 4.48Å; W361-Y497 AromaticContact CH2-CG 3.63Å; W361-Y497 HydrophobicContact CH2-CG 3.63Å; W361-Y497 AromaticContact CZ3-CD2 3.89Å; W361-Y497 HydrophobicContact CZ3-CD2 3.89Å; W361-Y497 HydrophobicContact CZ3-CG 4.15Å
362	Y	98.8	Very high	97.5	Very high	1 Å²	1	19.4 Å²	19.4	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.8	179.1	-169.7	-110.8	0	0	0	112.3	E364 G429 F430 L431 F442 F483 Y485 P487 F491 S492	Y362-E364 HydrophobicContact CE1-CG 3.69Å; Y362-G429 WeakPolarHBondContact OH-CA 3.48Å; Y362-F430 WeakPolarHBondContact CA-O 3.36Å; Y362-F430 VanDerWaalsContact CD2-O 3.32Å; Y362-F430 WeakPolarHBondContact CD2-O 3.29Å; Y362-L431 HydrophobicContact CD2-CB 3.93Å; Y362-L431 HydrophobicContact CD2-CD1 4.27Å; Y362-L431 HydrophobicContact CE2-CB 4.49Å; Y362-F442 HydrophobicContact CE2-CD2 4.09Å; Y362-F442 HydrophobicContact CE2-CE2 4.27Å; Y362-F483 HydrophobicContact CD1-CD1 4.15Å; Y362-F483 HydrophobicContact CD1-CD2 4.08Å; Y362-F483 HydrophobicContact CD1-CE1 4.1Å; Y362-F483 HydrophobicContact CD1-CE2 4.03Å; Y362-F483 HydrophobicContact CD1-CG 4.14Å; Y362-F483 HydrophobicContact CD1-CZ 4.04Å; Y362-F483 HydrophobicContact CE1-CB 4.47Å; Y362-F483 HydrophobicContact CE1-CD1 4.07Å; Y362-F483 HydrophobicContact CE1-CD2 4.43Å; Y362-F483 HydrophobicContact CE1-CE1 4.41Å; Y362-F483 HydrophobicContact CE1-CG 4.08Å; Y362-Y485 PolarHBondContact OH-O 3.16Å; Y362-Y485 VanDerWaalsContact OH-O 3.08Å; Y362-P487 HydrophobicContact CD1-CG 4.5Å; Y362-P487 HydrophobicContact CD2-CG 3.91Å; Y362-P487 HydrophobicContact CE2-CG 3.98Å; Y362-P487 HydrophobicContact CG-CG 4.17Å; Y362-F491 HydrophobicContact CD1-CE2 4.32Å; Y362-F491 HydrophobicContact CD1-CZ 4.42Å; Y362-F491 HydrophobicContact CG-CD2 4.45Å; Y362-S492 PolarHBondContact N-O 3.04Å; Y362-S492 VanDerWaalsContact N-O 3.1Å
363	Y	98.9	Very high	97.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	163	164	75.1	-85.1	0	0	0	110.7	V365 G376 W377 F430 A464 F476 N477 F478 F494	Y363-V365 HydrophobicContact CD2-CG2 3.99Å; Y363-V365 HydrophobicContact CE2-CG2 3.63Å; Y363-G376 WeakPolarHBondContact OH-CA 3.21Å; Y363-G376 PolarHBondContact OH-O 2.81Å; Y363-W377 AromaticContact CD1-CH2 3.88Å; Y363-W377 HydrophobicContact CD1-CH2 3.88Å; Y363-W377 AromaticContact CD1-CZ2 3.74Å; Y363-W377 HydrophobicContact CD1-CZ2 3.74Å; Y363-W377 HydrophobicContact CE1-CD2 4.33Å; Y363-W377 AromaticContact CE1-CE2 3.8Å; Y363-W377 AromaticContact CE1-CH2 3.94Å; Y363-W377 HydrophobicContact CE1-CH2 3.94Å; Y363-W377 AromaticContact CE1-CZ2 3.57Å; Y363-W377 HydrophobicContact CE1-CZ2 3.57Å; Y363-W377 HydrophobicContact CE1-CZ3 4.43Å; Y363-F430 HydrophobicContact CD1-CB 3.59Å; Y363-F430 HydrophobicContact CD1-CG 4.38Å; Y363-F430 HydrophobicContact CD2-CB 4.32Å; Y363-F430 AromaticContact CD2-CD2 3.91Å; Y363-F430 HydrophobicContact CD2-CD2 3.91Å; Y363-F430 HydrophobicContact CD2-CG 4.39Å; Y363-F430 HydrophobicContact CE1-CB 3.25Å; Y363-F430 HydrophobicContact CE1-CD1 4.5Å; Y363-F430 HydrophobicContact CE1-CD2 4.25Å; Y363-F430 AromaticContact CE1-CG 3.78Å; Y363-F430 HydrophobicContact CE1-CG 3.78Å; Y363-F430 HydrophobicContact CE2-CB 4.03Å; Y363-F430 AromaticContact CE2-CD2 3.42Å; Y363-F430 HydrophobicContact CE2-CD2 3.42Å; Y363-F430 VanDerWaalsContact CE2-CD2 3.42Å; Y363-F430 HydrophobicContact CE2-CE2 4.04Å; Y363-F430 AromaticContact CE2-CG 3.77Å; Y363-F430 HydrophobicContact CE2-CG 3.77Å; Y363-F430 HydrophobicContact CG-CB 4.11Å; Y363-F430 HydrophobicContact CG-CD2 4.49Å; Y363-F430 VanDerWaalsContact CZ-CB 3.47Å; Y363-F430 AromaticContact CZ-CD2 3.6Å; Y363-F430 AromaticContact CZ-CG 3.4Å; Y363-F430 VanDerWaalsContact CZ-CG 3.4Å; Y363-F430 PolarHBondContact N-O 3.28Å; Y363-F430 VanDerWaalsContact N-O 3.11Å; Y363-F430 PolarHBondContact O-N 3.44Å; Y363-F430 WeakPolarHBondContact OH-CG 3.37Å; Y363-A464 HydrophobicContact CD1-CB 3.77Å; Y363-A464 HydrophobicContact CD2-CB 4.39Å; Y363-A464 HydrophobicContact CE1-CB 3.36Å; Y363-A464 HydrophobicContact CE2-CB 4.05Å; Y363-A464 HydrophobicContact CG-CB 4.27Å; Y363-F476 HydrophobicContact CD2-CD1 4.37Å; Y363-F476 HydrophobicContact CE2-CD1 4.03Å; Y363-F476 HydrophobicContact CE2-CE1 4.31Å; Y363-N477 WeakPolarHBondContact CB-O 3.2Å; Y363-F478 HydrophobicContact CD2-CD1 4.5Å; Y363-F478 HydrophobicContact CD2-CE1 4.18Å; Y363-F478 HydrophobicContact CG-CD1 4.4Å; Y363-F478 HydrophobicContact CG-CE1 4.4Å; Y363-F494 AromaticContact CD1-CE2 3.75Å; Y363-F494 HydrophobicContact CD1-CE2 3.75Å; Y363-F494 HydrophobicContact CD1-CZ 4.06Å; Y363-F494 HydrophobicContact CG-CE2 4.19Å
364	E	98.9	Very high	97.5	Very high	6 Å²	6	17.7 Å²	17.7	3%	0.028	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	157.1	173.5	-75.2	179.9	156.5	0	0	110.8	Y362 T427 V428 N477 F483 K484 Y485	Y362-E364 HydrophobicContact CE1-CG 3.69Å; E364-T427 HydrophobicContact CB-CG2 3.94Å; E364-T427 HydrophobicContact CG-CG2 4.01Å; E364-V428 CarbonylContact C-O 3.59Å; E364-V428 WeakPolarHBondContact CA-O 3.41Å; E364-N477 HydrophobicContact CB-CB 4.27Å; E364-N477 PolarHBondContact N-O 3.29Å; E364-N477 VanDerWaalsContact N-O 3.13Å; E364-N477 PolarHBondContact O-N 3.45Å; E364-F483 HydrophobicContact CB-CD1 4.02Å; E364-F483 HydrophobicContact CB-CE1 4.42Å; E364-F483 HydrophobicContact CG-CB 4.47Å; E364-F483 HydrophobicContact CG-CD1 3.61Å; E364-F483 HydrophobicContact CG-CE1 4.3Å; E364-F483 HydrophobicContact CG-CG 4.4Å; E364-F483 VanDerWaalsContact OE2-CA 3.24Å; E364-F483 WeakPolarHBondContact OE2-CA 3.33Å; E364-K484 PolarHBondContact OE1-N 2.82Å; E364-K484 VanDerWaalsContact OE1-N 3.12Å; E364-K484 PolarHBondContact OE2-N 2.72Å; E364-Y485 WeakPolarHBondContact OE1-CA 3.3Å; E364-Y485 PolarHBondContact OE1-N 3.36Å
365	V	98.9	Very high	97.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.8	166.9	-178.3	0	0	0	0	109.5	Y363 I375 T427 V428 F430 C474 E475 F476	Y363-V365 HydrophobicContact CD2-CG2 3.99Å; Y363-V365 HydrophobicContact CE2-CG2 3.63Å; V365-I375 HydrophobicContact CG1-CD1 4.15Å; V365-I375 HydrophobicContact CG2-CG2 4.07Å; V365-T427 CarbonylContact O-C 3.52Å; V365-T427 WeakPolarHBondContact O-CA 3.48Å; V365-V428 PolarHBondContact N-O 3.3Å; V365-V428 PolarHBondContact O-N 3.03Å; V365-F430 HydrophobicContact CB-CE2 3.95Å; V365-F430 HydrophobicContact CG2-CD2 4.14Å; V365-F430 HydrophobicContact CG2-CE2 3.64Å; V365-C474 HydrophobicContact CG1-CB 3.57Å; V365-C474 VanDerWaalsContact CG1-SG 3.56Å; V365-E475 CarbonylContact C-O 3.57Å; V365-E475 WeakPolarHBondContact CA-O 3.31Å; V365-F476 HydrophobicContact CG2-CD1 3.5Å; V365-F476 VanDerWaalsContact CG2-CD1 3.5Å; V365-F476 HydrophobicContact CG2-CE1 3.68Å; V365-F476 HydrophobicContact CG2-CG 4.09Å; V365-F476 HydrophobicContact CG2-CZ 4.39Å
366	T	98.7	Very high	97.6	Very high	18 Å²	18	13.5 Å²	13.5	11%	0.11	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.8	169.9	-53.8	0	0	0	0	109.1	Y284 D426 C474 E475	Y284-T366 HydrophobicContact CE1-CG2 4.42Å; T366-D426 WeakPolarHBondContact CA-O 3.36Å; T366-C474 WeakPolarHBondContact O-CA 3.25Å; T366-C474 WeakPolarHBondContact O-CB 3.21Å; T366-E475 PolarHBondContact N-O 2.8Å; T366-E475 PolarHBondContact O-N 3.4Å
367	V	98.4	Very high	97.6	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.8	178.4	179.2	0	0	0	0	109	T369 M373 W422 K423 G425 D426 V428	V367-T369 WeakPolarHBondContact CG1-O 3.34Å; V367-M373 HydrophobicContact CG1-CE 4.44Å; V367-W422 HydrophobicContact CG1-CD2 4.38Å; V367-W422 HydrophobicContact CG1-CG 4.33Å; V367-W422 HydrophobicContact CG2-CB 4.44Å; V367-W422 HydrophobicContact CG2-CD2 4.01Å; V367-W422 HydrophobicContact CG2-CE3 3.74Å; V367-W422 HydrophobicContact CG2-CG 4.33Å; V367-W422 HydrophobicContact CG2-CZ3 4.43Å; V367-K423 WeakPolarHBondContact CB-O 3.14Å; V367-K423 WeakPolarHBondContact CG1-O 3.27Å; V367-G425 PolarHBondContact O-N 3.01Å; V367-D426 HydrophobicContact CG2-CB 4.36Å; V367-D426 PolarHBondContact N-O 3.44Å; V367-V428 HydrophobicContact CG2-CG2 4.02Å
368	V	98.2	Very high	97.7	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	7%	0.066	C	C	.	.	S	Bend	trans	-102.1	-21.8	175.4	175.6	0	0	0	0	111.4	Y284 Q288 E424 Q473	Y284-V368 HydrophobicContact CD1-CB 4.29Å; Y284-V368 HydrophobicContact CD1-CG1 4.09Å; Y284-V368 HydrophobicContact CD1-CG2 4.04Å; Y284-V368 HydrophobicContact CE1-CG2 4.27Å; Q288-V368 HydrophobicContact CG-CG1 3.86Å; V368-E424 WeakPolarHBondContact O-CG 3.49Å; V368-Q473 HydrophobicContact CB-CB 4.05Å; V368-Q473 HydrophobicContact CB-CG 3.94Å; V368-Q473 WeakPolarHBondContact CB-O 3.34Å; V368-Q473 HydrophobicContact CG1-CB 4.09Å; V368-Q473 HydrophobicContact CG1-CG 3.85Å; V368-Q473 HydrophobicContact CG2-CG 4.47Å; V368-Q473 PolarHBondContact N-O 3.11Å; V368-Q473 VanDerWaalsContact N-O 3.11Å
369	T	97	Very high	97.7	Very high	10 Å²	10	6 Å²	6	6%	0.061	4%	0.039	C	C	.	.			trans	-138.4	140.2	171	58.8	0	0	0	0	111.4	Q288 V367 G371 M373 Q472 Q473	Q288-T369 VanDerWaalsContact CD-CG2 3.43Å; Q288-T369 HydrophobicContact CG-CG2 4.35Å; V367-T369 WeakPolarHBondContact CG1-O 3.34Å; T369-G371 VanDerWaalsContact C-N 3.34Å; T369-G371 PolarHBondContact O-N 2.87Å; T369-M373 WeakPolarHBondContact O-CE 3.29Å; T369-Q472 VanDerWaalsContact CB-OE1 3.25Å; T369-Q472 VanDerWaalsContact OG1-CA 3.24Å; T369-Q472 WeakPolarHBondContact OG1-CA 3.21Å; T369-Q472 PolarHBondContact OG1-OE1 2.89Å; T369-Q473 HydrophobicContact CG2-CB 4.25Å; T369-Q473 PolarHBondContact N-O 2.77Å; T369-Q473 PolarHBondContact OG1-N 3.45Å
370	S	94.4	Very high	97.5	Very high	14 Å²	14	12.7 Å²	12.7	10%	0.098	6%	0.057	C	C	.	.			trans	-82.8	7.2	-176.6	52.6	0	0	0	0	116.4	P154 W422 E424	P154-S370 WeakPolarHBondContact CB-OG 3.43Å; S370-W422 WeakPolarHBondContact CB-O 3.24Å; S370-W422 PolarHBondContact O-NE1 3.47Å; S370-E424 WeakPolarHBondContact CB-OE1 3.42Å; S370-E424 PolarHBondContact N-OE1 3.02Å; S370-E424 PolarHBondContact OG-OE1 3.01Å
371	G	93.8	Very high	97.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.076	C	C	.	.	S	Bend	trans	-79.5	-167.7	178.6	0	0	0	0	0	114.6	T369 M373 C404 W422	T369-G371 VanDerWaalsContact C-N 3.34Å; T369-G371 PolarHBondContact O-N 2.87Å; G371-M373 PolarHBondContact O-N 3.36Å; G371-C404 VanDerWaalsContact O-CB 3.27Å; G371-C404 WeakPolarHBondContact O-CB 3.48Å; G371-W422 WeakPolarHBondContact O-CZ2 3.43Å; G371-W422 PolarHBondContact O-NE1 3.46Å
372	V	94.6	Very high	97	Very high	10 Å²	10	15.6 Å²	15.6	6%	0.061	7%	0.074	C	C	.	.			trans	-75	117.1	-170.1	-179.6	0	0	0	0	112.4	L155 C404 R405 M469 Q472	L155-V372 HydrophobicContact CD2-CG2 4Å; V372-C404 HydrophobicContact CG2-CB 4.21Å; V372-R405 HydrophobicContact CG2-CG 4.25Å; V372-M469 HydrophobicContact CB-CB 4.01Å; V372-M469 HydrophobicContact CB-SD 3.9Å; V372-M469 HydrophobicContact CG1-CB 4.47Å; V372-M469 HydrophobicContact CG2-SD 4.15Å; V372-M469 WeakPolarHBondContact O-CB 3.44Å; V372-M469 PolarHBondContact O-N 3.23Å; V372-M469 VanDerWaalsContact O-N 3.12Å; V372-Q472 WeakPolarHBondContact O-CG 3.46Å
373	M	97.1	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.9	168	-64.5	172.6	-78.1	0	0	108.1	V367 T369 G371 I375 D402 W422 S467 F468 Q472 C474	V367-M373 HydrophobicContact CG1-CE 4.44Å; T369-M373 WeakPolarHBondContact O-CE 3.29Å; G371-M373 PolarHBondContact O-N 3.36Å; M373-I375 HydrophobicContact CB-CD1 4.27Å; M373-I375 HydrophobicContact CB-CG1 4.11Å; M373-I375 HydrophobicContact SD-CD1 4.5Å; M373-D402 WeakPolarHBondContact O-CA 3.27Å; M373-W422 HydrophobicContact CB-CH2 3.89Å; M373-W422 HydrophobicContact CB-CZ2 3.94Å; M373-W422 HydrophobicContact CE-CH2 4.19Å; M373-W422 HydrophobicContact CE-CZ2 3.8Å; M373-W422 WeakPolarHBondContact O-CH2 3.45Å; M373-S467 CarbonylContact C-O 3.58Å; M373-S467 VanDerWaalsContact CA-O 3.29Å; M373-S467 WeakPolarHBondContact CA-O 3.3Å; M373-F468 HydrophobicContact CG-CD1 3.84Å; M373-F468 HydrophobicContact CG-CE1 4.4Å; M373-F468 HydrophobicContact CG-CG 4.45Å; M373-F468 HydrophobicContact SD-CD1 3.61Å; M373-F468 HydrophobicContact SD-CE1 3.68Å; M373-Q472 HydrophobicContact CE-CB 4.49Å; M373-Q472 HydrophobicContact CG-CB 3.63Å; M373-Q472 HydrophobicContact CG-CG 4.18Å; M373-Q472 HydrophobicContact SD-CB 3.87Å; M373-C474 HydrophobicContact CE-CB 4.49Å; M373-C474 HydrophobicContact SD-CB 4.13Å
374	Q	97.9	Very high	95.7	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121	167	-80.1	169.5	-15.3	0	0	107.4	F347 I392 D394 A400 W409 A466 S467	F347-Q374 HydrophobicContact CZ-CB 4.22Å; F347-Q374 HydrophobicContact CZ-CG 4.06Å; Q374-I392 PolarHBondContact OE1-O 2.91Å; Q374-D394 PolarHBondContact NE2-OD1 2.78Å; Q374-D394 PolarHBondContact NE2-OD2 2.87Å; Q374-D394 PolarHBondContact OE1-OD2 2.94Å; Q374-A400 HydrophobicContact CB-CB 3.7Å; Q374-A400 HydrophobicContact CG-CB 4.2Å; Q374-W409 HydrophobicContact CG-CG 4.18Å; Q374-A466 CarbonylContact O-C 3.55Å; Q374-A466 VanDerWaalsContact O-CA 3.31Å; Q374-A466 WeakPolarHBondContact O-CA 3.38Å; Q374-S467 PolarHBondContact N-O 3.43Å; Q374-S467 PolarHBondContact O-N 3.14Å
375	I	98.8	Very high	95	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.2	-176.8	-50.9	-178.5	0	0	0	109.2	V365 M373 A400 Y401 W422 F430 A466 F476	V365-I375 HydrophobicContact CG1-CD1 4.15Å; V365-I375 HydrophobicContact CG2-CG2 4.07Å; M373-I375 HydrophobicContact CB-CD1 4.27Å; M373-I375 HydrophobicContact CB-CG1 4.11Å; M373-I375 HydrophobicContact SD-CD1 4.5Å; I375-A400 CarbonylContact O-C 3.58Å; I375-A400 WeakPolarHBondContact O-CA 3.35Å; I375-Y401 PolarHBondContact N-O 3.11Å; I375-Y401 PolarHBondContact O-N 3.05Å; I375-W422 HydrophobicContact CD1-CH2 4.08Å; I375-W422 HydrophobicContact CD1-CZ3 4.16Å; I375-W422 HydrophobicContact CG1-CH2 4.41Å; I375-F430 HydrophobicContact CB-CE1 4.07Å; I375-F430 HydrophobicContact CB-CZ 3.7Å; I375-F430 HydrophobicContact CG2-CE1 3.8Å; I375-F430 HydrophobicContact CG2-CE2 3.79Å; I375-F430 HydrophobicContact CG2-CZ 3.3Å; I375-F430 VanDerWaalsContact O-CE1 3.27Å; I375-F430 WeakPolarHBondContact O-CE1 3.39Å; I375-A466 HydrophobicContact CB-CB 4.4Å; I375-A466 HydrophobicContact CG1-CB 4.01Å; I375-A466 HydrophobicContact CG2-CB 4.23Å; I375-F476 HydrophobicContact CG2-CE1 4.31Å
376	G	98.5	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.4	-130.5	179.2	0	0	0	0	0	113.4	Y363 A465	Y363-G376 WeakPolarHBondContact OH-CA 3.21Å; Y363-G376 PolarHBondContact OH-O 2.81Å; G376-A465 PolarHBondContact N-O 3.46Å; G376-A465 PolarHBondContact O-N 3.11Å
377	W	98.6	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138	-168.8	-58.9	94.5	0	0	0	111.1	W361 Y363 S398 C399 F430 L432 M439 F462 F463 F494	W361-W377 HydrophobicContact CB-CH2 4.24Å; Y363-W377 AromaticContact CD1-CH2 3.88Å; Y363-W377 HydrophobicContact CD1-CH2 3.88Å; Y363-W377 AromaticContact CD1-CZ2 3.74Å; Y363-W377 HydrophobicContact CD1-CZ2 3.74Å; Y363-W377 HydrophobicContact CE1-CD2 4.33Å; Y363-W377 AromaticContact CE1-CE2 3.8Å; Y363-W377 AromaticContact CE1-CH2 3.94Å; Y363-W377 HydrophobicContact CE1-CH2 3.94Å; Y363-W377 AromaticContact CE1-CZ2 3.57Å; Y363-W377 HydrophobicContact CE1-CZ2 3.57Å; Y363-W377 HydrophobicContact CE1-CZ3 4.43Å; W377-S398 CarbonylContact O-C 3.54Å; W377-S398 WeakPolarHBondContact O-CA 3.4Å; W377-S398 WeakPolarHBondContact O-CB 3.4Å; W377-C399 PolarHBondContact N-O 2.9Å; W377-C399 PolarHBondContact O-N 2.87Å; W377-F430 HydrophobicContact CZ2-CB 4.33Å; W377-L432 HydrophobicContact CD2-CB 4.04Å; W377-L432 HydrophobicContact CD2-CD2 4Å; W377-L432 HydrophobicContact CE3-CB 4.26Å; W377-L432 HydrophobicContact CE3-CD2 3.59Å; W377-L432 HydrophobicContact CH2-CB 3.59Å; W377-L432 HydrophobicContact CH2-CD2 4.01Å; W377-L432 HydrophobicContact CH2-CG 4.46Å; W377-L432 HydrophobicContact CZ2-CB 3.36Å; W377-L432 HydrophobicContact CZ2-CD2 4.43Å; W377-L432 HydrophobicContact CZ3-CB 4.03Å; W377-L432 HydrophobicContact CZ3-CD2 3.56Å; W377-L432 HydrophobicContact CZ3-CG 4.45Å; W377-M439 HydrophobicContact CB-CE 3.47Å; W377-M439 VanDerWaalsContact CB-CE 3.47Å; W377-M439 HydrophobicContact CB-SD 3.92Å; W377-M439 HydrophobicContact CG-CE 3.88Å; W377-M439 HydrophobicContact CG-CG 4.5Å; W377-M439 HydrophobicContact CG-SD 4.02Å; W377-F462 HydrophobicContact CB-CD1 4.05Å; W377-F462 HydrophobicContact CE3-CB 4.14Å; W377-F463 WeakPolarHBondContact CA-O 3.2Å; W377-F494 AromaticContact CH2-CE2 3.84Å; W377-F494 HydrophobicContact CH2-CE2 3.84Å; W377-F494 AromaticContact CH2-CZ 3.57Å; W377-F494 HydrophobicContact CH2-CZ 3.57Å; W377-F494 HydrophobicContact CZ3-CE1 4.44Å; W377-F494 HydrophobicContact CZ3-CE2 4.28Å; W377-F494 AromaticContact CZ3-CZ 3.53Å; W377-F494 HydrophobicContact CZ3-CZ 3.53Å
378	A	98	Very high	92.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.7	176.4	0	0	0	0	0	110.4	F384 I392 F463 A465	A378-F384 HydrophobicContact CB-CE1 4.49Å; A378-F384 HydrophobicContact CB-CZ 4.28Å; A378-I392 HydrophobicContact CB-CG1 4.46Å; A378-I392 HydrophobicContact CB-CG2 4.4Å; A378-F463 PolarHBondContact N-O 3.04Å; A378-F463 VanDerWaalsContact N-O 3.11Å; A378-F463 PolarHBondContact O-N 3.22Å; A378-A465 HydrophobicContact CB-CB 4.02Å
379	T	97.5	Very high	91.9	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	20%	0.202	C	C	.	.			trans	-89.9	-174	167.7	76.8	0	0	0	0	111.3	R351 D381 Y397 T458 G461 F462	R351-T379 WeakPolarHBondContact CD-O 3.42Å; R351-T379 PolarHBondContact NH1-O 2.87Å; T379-D381 VanDerWaalsContact C-N 3.26Å; T379-D381 WeakPolarHBondContact OG1-CB 3.49Å; T379-D381 PolarHBondContact OG1-N 3.01Å; T379-D381 PolarHBondContact OG1-OD2 3.49Å; T379-Y397 PolarHBondContact N-O 2.82Å; T379-T458 HydrophobicContact CG2-CG2 3.77Å; T379-G461 VanDerWaalsContact CA-O 3.3Å; T379-G461 WeakPolarHBondContact CA-O 3.32Å; T379-G461 WeakPolarHBondContact CB-O 3.41Å; T379-F462 HydrophobicContact CG2-CD1 3.98Å; T379-F462 HydrophobicContact CG2-CE1 4.09Å; T379-F462 HydrophobicContact CG2-CG 4.42Å
380	R	94	Very high	91.4	Very high	163 Å²	163	45.3 Å²	45.3	62%	0.615	22%	0.216	S	C	*	.	S	Bend	trans	-69.8	-22.6	168.9	-70.2	-177.8	174.4	-78.3	-0.4	113.4	S382 F463	R380-S382 VanDerWaalsContact C-N 3.29Å; R380-F463 HydrophobicContact CG-CE2 3.76Å; R380-F463 HydrophobicContact CG-CZ 4.18Å
381	D	93.1	Very high	91.2	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	21%	0.211	S	C	.	.	S	Bend	trans	-78.9	-17.4	-178.5	-42.4	-79.4	0	0	0	112	T379 Y397	T379-D381 VanDerWaalsContact C-N 3.26Å; T379-D381 WeakPolarHBondContact OG1-CB 3.49Å; T379-D381 PolarHBondContact OG1-N 3.01Å; T379-D381 PolarHBondContact OG1-OD2 3.49Å; D381-Y397 HydrophobicContact CB-CD1 3.94Å; D381-Y397 HydrophobicContact CB-CD2 4.1Å; D381-Y397 HydrophobicContact CB-CE1 4.33Å; D381-Y397 HydrophobicContact CB-CE2 4.49Å; D381-Y397 HydrophobicContact CB-CG 3.85Å
382	S	92	Very high	91.3	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	21%	0.211	C	C	.	.			trans	-63.8	135.7	172.8	-72	0	0	0	0	112.5	R351 R380 D395 Y397 S398	R351-S382 PolarHBondContact NH1-O 2.98Å; R380-S382 VanDerWaalsContact C-N 3.29Å; S382-D395 WeakPolarHBondContact CA-OD2 3.41Å; S382-D395 WeakPolarHBondContact CB-OD2 3.28Å; S382-D395 PolarHBondContact OG-OD1 2.67Å; S382-D395 PolarHBondContact OG-OD2 2.85Å; S382-Y397 VanDerWaalsContact OG-C 3.28Å; S382-Y397 VanDerWaalsContact OG-CB 3.31Å; S382-Y397 WeakPolarHBondContact OG-CB 3.5Å; S382-Y397 PolarHBondContact OG-O 3.1Å; S382-S398 WeakPolarHBondContact OG-CB 3.42Å
383	K	84.9	Confident	91.3	Very high	152 Å²	152	44.1 Å²	44.1	66%	0.661	21%	0.208	S	C	*	.			trans	-111.6	115.4	-171.1	-62.8	179	-174.7	173.2	0	110.5	D395	K383-D395 PolarHBondContact N-OD2 3.2Å
384	F	86	Confident	91.1	Very high	35 Å²	35	45 Å²	45	15%	0.154	21%	0.212	C	C	.	.			trans	-95.8	114.5	175.1	-47.9	-37.5	0	0	0	109.2	S349 R351 A378 I392	S349-F384 VanDerWaalsContact CB-CG 3.49Å; R351-F384 HydrophobicContact CG-CE2 4.03Å; R351-F384 HydrophobicContact CG-CZ 3.94Å; R351-F384 VanDerWaalsContact CZ-CE2 3.42Å; A378-F384 HydrophobicContact CB-CE1 4.49Å; A378-F384 HydrophobicContact CB-CZ 4.28Å; F384-I392 HydrophobicContact CD1-CG1 4.33Å; F384-I392 HydrophobicContact CE1-CD1 4.42Å; F384-I392 HydrophobicContact CE1-CG1 3.58Å; F384-I392 HydrophobicContact CZ-CG1 4.1Å
385	L	84.6	Confident	90.9	Very high	73 Å²	73	45.9 Å²	45.9	38%	0.382	22%	0.217	S	C	.	.	B	Isolated β-bridge	trans	-115.9	75.6	175.1	-51.8	173.2	0	0	0	107.2	H387 E388 G389 Y390	L385-H387 PolarHBondContact O-N 3.23Å; L385-H387 VanDerWaalsContact O-N 3.16Å; L385-E388 HydrophobicContact CB-CB 3.97Å; L385-E388 HydrophobicContact CB-CG 4.28Å; L385-E388 CarbonylContact O-C 3.49Å; L385-E388 WeakPolarHBondContact O-CA 3.34Å; L385-E388 PolarHBondContact O-N 2.78Å; L385-G389 PolarHBondContact O-N 2.8Å; L385-G389 VanDerWaalsContact O-N 3.1Å; L385-Y390 PolarHBondContact N-O 2.7Å; L385-Y390 PolarHBondContact O-N 3.17Å; L385-Y390 VanDerWaalsContact O-N 3.15Å
386	N	82.6	Confident	90.8	Very high	24 Å²	24	49.1 Å²	49.1	13%	0.128	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-36.2	-174.5	65.1	-37.1	0	0	0	113.6	S346 F347 E348	S346-N386 WeakPolarHBondContact CB-O 3.27Å; F347-N386 PolarHBondContact N-O 2.98Å; F347-N386 WeakPolarHBondContact O-CB 3.42Å; E348-N386 WeakPolarHBondContact OE1-CB 3.32Å; E348-N386 PolarHBondContact OE1-ND2 2.73Å
387	H	83.9	Confident	90.7	Very high	129 Å²	129	52.4 Å²	52.4	60%	0.597	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-14.5	177.1	-60.1	-69.7	0	0	0	114.3	L385	L385-H387 PolarHBondContact O-N 3.23Å; L385-H387 VanDerWaalsContact O-N 3.16Å
388	E	81.4	Confident	90.6	Very high	124 Å²	124	52.4 Å²	52.4	58%	0.579	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101	1.5	174	-61.3	-179.1	-150.6	0	0	112	N117 L385 Y390	N117-E388 PolarHBondContact ND2-O 2.59Å; L385-E388 HydrophobicContact CB-CB 3.97Å; L385-E388 HydrophobicContact CB-CG 4.28Å; L385-E388 CarbonylContact O-C 3.49Å; L385-E388 WeakPolarHBondContact O-CA 3.34Å; L385-E388 PolarHBondContact O-N 2.78Å; E388-Y390 VanDerWaalsContact C-N 3.31Å; E388-Y390 HydrophobicContact CB-CD2 4.18Å; E388-Y390 PolarHBondContact O-N 2.86Å
389	G	81.2	Confident	90.6	Very high	32 Å²	32	52.4 Å²	52.4	33%	0.33	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	6.9	-178.5	0	0	0	0	0	115.3	F347 L385	F347-G389 VanDerWaalsContact CD1-O 3.24Å; F347-G389 WeakPolarHBondContact CD1-O 3.44Å; L385-G389 PolarHBondContact O-N 2.8Å; L385-G389 VanDerWaalsContact O-N 3.1Å
390	Y	85.9	Confident	90.7	Very high	89 Å²	89	52.3 Å²	52.3	35%	0.349	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-83.8	117.7	179.3	-84.1	-107.6	0	0	0	111.6	L385 E388 D394 A412	L385-Y390 PolarHBondContact N-O 2.7Å; L385-Y390 PolarHBondContact O-N 3.17Å; L385-Y390 VanDerWaalsContact O-N 3.15Å; E388-Y390 VanDerWaalsContact C-N 3.31Å; E388-Y390 HydrophobicContact CB-CD2 4.18Å; E388-Y390 PolarHBondContact O-N 2.86Å; Y390-D394 HydrophobicContact CD1-CB 3.56Å; Y390-D394 WeakPolarHBondContact CD1-O 3.27Å; Y390-D394 HydrophobicContact CE1-CB 4.17Å; Y390-D394 WeakPolarHBondContact CE1-O 3.49Å; Y390-D394 HydrophobicContact CG-CB 4.18Å; Y390-A412 HydrophobicContact CE1-CB 4.32Å
391	G	91.4	Very high	90.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.			trans	-121.6	-140	173.4	0	0	0	0	0	112.7	D394 S467	G391-D394 PolarHBondContact N-OD2 3.01Å; G391-D394 PolarHBondContact O-N 3.32Å; G391-S467 VanDerWaalsContact CA-OG 3.29Å; G391-S467 WeakPolarHBondContact CA-OG 3.48Å
392	I	95.3	Very high	91.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	125.7	-170.4	-64	154.3	0	0	0	109.9	Q374 A378 F384 A400 A465 S467	Q374-I392 PolarHBondContact OE1-O 2.91Å; A378-I392 HydrophobicContact CB-CG1 4.46Å; A378-I392 HydrophobicContact CB-CG2 4.4Å; F384-I392 HydrophobicContact CD1-CG1 4.33Å; F384-I392 HydrophobicContact CE1-CD1 4.42Å; F384-I392 HydrophobicContact CE1-CG1 3.58Å; F384-I392 HydrophobicContact CZ-CG1 4.1Å; I392-A400 HydrophobicContact CB-CB 4.3Å; I392-A400 HydrophobicContact CG2-CB 3.91Å; I392-A400 WeakPolarHBondContact O-CB 3.41Å; I392-A465 VanDerWaalsContact CD1-C 3.44Å; I392-A465 HydrophobicContact CD1-CB 3.4Å; I392-A465 VanDerWaalsContact CD1-CB 3.4Å; I392-A465 HydrophobicContact CG1-CB 4.23Å; I392-S467 WeakPolarHBondContact CD1-OG 3.36Å; I392-S467 WeakPolarHBondContact CG1-OG 3.34Å; I392-S467 PolarHBondContact N-OG 2.99Å
393	G	94.6	Very high	91.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	-2.6	-166.2	0	0	0	0	0	112.9	D395 S398 Y410 N411 A412	G393-D395 VanDerWaalsContact C-N 3.34Å; G393-S398 PolarHBondContact N-OG 3.3Å; G393-Y410 CarbonylContact O-C 3.59Å; G393-Y410 WeakPolarHBondContact O-CA 3.37Å; G393-Y410 PolarHBondContact O-N 3.42Å; G393-Y410 VanDerWaalsContact O-N 3.15Å; G393-N411 PolarHBondContact O-N 3.3Å; G393-A412 PolarHBondContact O-N 3.16Å; G393-A412 VanDerWaalsContact O-N 3.12Å
394	D	92.9	Very high	91.8	Very high	17 Å²	17	32.4 Å²	32.4	9%	0.091	16%	0.158	C	C	.	.	S	Bend	trans	-92.9	4	174.8	-54.7	-39.7	0	0	0	112.7	Q374 Y390 G391	Q374-D394 PolarHBondContact NE2-OD1 2.78Å; Q374-D394 PolarHBondContact NE2-OD2 2.87Å; Q374-D394 PolarHBondContact OE1-OD2 2.94Å; Y390-D394 HydrophobicContact CD1-CB 3.56Å; Y390-D394 WeakPolarHBondContact CD1-O 3.27Å; Y390-D394 HydrophobicContact CE1-CB 4.17Å; Y390-D394 WeakPolarHBondContact CE1-O 3.49Å; Y390-D394 HydrophobicContact CG-CB 4.18Å; G391-D394 PolarHBondContact N-OD2 3.01Å; G391-D394 PolarHBondContact O-N 3.32Å
395	D	94.2	Very high	92.2	Very high	21 Å²	21	32.9 Å²	32.9	11%	0.112	16%	0.158	C	C	.	.	S	Bend	trans	-132	174.4	168.1	63.7	47.6	0	0	0	112.7	S382 K383 G393 Y397 S398 N411	S382-D395 WeakPolarHBondContact CA-OD2 3.41Å; S382-D395 WeakPolarHBondContact CB-OD2 3.28Å; S382-D395 PolarHBondContact OG-OD1 2.67Å; S382-D395 PolarHBondContact OG-OD2 2.85Å; K383-D395 PolarHBondContact N-OD2 3.2Å; G393-D395 VanDerWaalsContact C-N 3.34Å; D395-Y397 VanDerWaalsContact C-N 3.28Å; D395-Y397 PolarHBondContact O-N 3.29Å; D395-Y397 WeakPolarHBondContact OD1-CA 3.42Å; D395-Y397 PolarHBondContact OD1-N 2.94Å; D395-S398 VanDerWaalsContact CG-OG 3.31Å; D395-S398 WeakPolarHBondContact OD1-CB 3.44Å; D395-S398 PolarHBondContact OD1-N 3.47Å; D395-S398 PolarHBondContact OD1-OG 3.32Å; D395-N411 VanDerWaalsContact O-CA 3.32Å; D395-N411 WeakPolarHBondContact O-CA 3.47Å; D395-N411 PolarHBondContact O-N 3.23Å
396	E	95.4	Very high	92.8	Very high	68 Å²	68	32.7 Å²	32.7	32%	0.318	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.1	-179.2	68.7	176.3	146.1	0	0	114.4	Y410 S457	E396-Y410 WeakPolarHBondContact O-CE2 3.42Å; E396-S457 VanDerWaalsContact OE2-CB 3.27Å; E396-S457 WeakPolarHBondContact OE2-CB 3.48Å; E396-S457 PolarHBondContact OE2-OG 3.15Å
397	Y	97.1	Very high	93.5	Very high	69 Å²	69	32.3 Å²	32.3	27%	0.271	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-0.7	-175.6	-56.6	-77	0	0	0	112.6	T379 D381 S382 D395 T458	T379-Y397 PolarHBondContact N-O 2.82Å; D381-Y397 HydrophobicContact CB-CD1 3.94Å; D381-Y397 HydrophobicContact CB-CD2 4.1Å; D381-Y397 HydrophobicContact CB-CE1 4.33Å; D381-Y397 HydrophobicContact CB-CE2 4.49Å; D381-Y397 HydrophobicContact CB-CG 3.85Å; S382-Y397 VanDerWaalsContact OG-C 3.28Å; S382-Y397 VanDerWaalsContact OG-CB 3.31Å; S382-Y397 WeakPolarHBondContact OG-CB 3.5Å; S382-Y397 PolarHBondContact OG-O 3.1Å; D395-Y397 VanDerWaalsContact C-N 3.28Å; D395-Y397 PolarHBondContact O-N 3.29Å; D395-Y397 WeakPolarHBondContact OD1-CA 3.42Å; D395-Y397 PolarHBondContact OD1-N 2.94Å; Y397-T458 HydrophobicContact CD1-CG2 4.29Å
398	S	97.4	Very high	94.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.7	-176.6	55.2	0	0	0	0	113.5	W377 S382 G393 D395 Y410	W377-S398 CarbonylContact O-C 3.54Å; W377-S398 WeakPolarHBondContact O-CA 3.4Å; W377-S398 WeakPolarHBondContact O-CB 3.4Å; S382-S398 WeakPolarHBondContact OG-CB 3.42Å; G393-S398 PolarHBondContact N-OG 3.3Å; D395-S398 VanDerWaalsContact CG-OG 3.31Å; D395-S398 WeakPolarHBondContact OD1-CB 3.44Å; D395-S398 PolarHBondContact OD1-N 3.47Å; D395-S398 PolarHBondContact OD1-OG 3.32Å; S398-Y410 WeakPolarHBondContact O-CD2 3.44Å
399	C	98.1	Very high	94.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.4	172.5	-175.7	0	0	0	0	110.6	W377 W409 M439 V454	W377-C399 PolarHBondContact N-O 2.9Å; W377-C399 PolarHBondContact O-N 2.87Å; C399-W409 WeakPolarHBondContact CA-O 3.32Å; C399-W409 PolarHBondContact SG-O 3.49Å; C399-M439 HydrophobicContact CB-SD 3.92Å; C399-V454 HydrophobicContact CB-CB 4.38Å; C399-V454 HydrophobicContact CB-CG1 4.44Å
400	A	98.2	Very high	95.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	157.1	-176.2	0	0	0	0	0	114.4	Q374 I375 I392 I408 W409	Q374-A400 HydrophobicContact CB-CB 3.7Å; Q374-A400 HydrophobicContact CG-CB 4.2Å; I375-A400 CarbonylContact O-C 3.58Å; I375-A400 WeakPolarHBondContact O-CA 3.35Å; I392-A400 HydrophobicContact CB-CB 4.3Å; I392-A400 HydrophobicContact CG2-CB 3.91Å; I392-A400 WeakPolarHBondContact O-CB 3.41Å; A400-I408 CarbonylContact O-C 3.45Å; A400-I408 WeakPolarHBondContact O-CA 3.47Å; A400-W409 HydrophobicContact CB-CB 4.36Å; A400-W409 PolarHBondContact N-O 3.12Å; A400-W409 VanDerWaalsContact N-O 3.09Å; A400-W409 PolarHBondContact O-N 3.12Å
401	Y	98.7	Very high	96	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.1	166.9	178.5	-84.2	0	0	0	109.4	I375 I408 H417 H419 W422 V428 F441 L448	I375-Y401 PolarHBondContact N-O 3.11Å; I375-Y401 PolarHBondContact O-N 3.05Å; Y401-I408 HydrophobicContact CD2-CD1 3.78Å; Y401-I408 HydrophobicContact CG-CD1 4.42Å; Y401-H417 AromaticContact CD2-CD2 3.85Å; Y401-H417 AromaticContact CD2-NE2 3.78Å; Y401-H417 AromaticContact CE2-CD2 3.57Å; Y401-H417 AromaticContact CE2-CE1 3.97Å; Y401-H417 AromaticContact CE2-NE2 3.21Å; Y401-H417 WeakPolarHBondContact CE2-NE2 3.45Å; Y401-H417 AromaticContact CZ-CE1 3.97Å; Y401-H417 AromaticContact CZ-NE2 3.4Å; Y401-H419 AromaticContact CE2-ND1 3.6Å; Y401-H419 AromaticContact CZ-ND1 3.84Å; Y401-H419 WeakPolarHBondContact OH-CB 3.29Å; Y401-H419 PolarHBondContact OH-ND1 3.38Å; Y401-W422 HydrophobicContact CD1-CE3 4.37Å; Y401-W422 AromaticContact CD1-CZ3 3.94Å; Y401-W422 HydrophobicContact CD1-CZ3 3.94Å; Y401-W422 AromaticContact CE1-CE3 3.91Å; Y401-W422 HydrophobicContact CE1-CE3 3.91Å; Y401-W422 AromaticContact CE1-CZ3 3.95Å; Y401-W422 HydrophobicContact CE1-CZ3 3.95Å; Y401-V428 HydrophobicContact CD1-CG1 3.87Å; Y401-V428 HydrophobicContact CE1-CG1 3.92Å; Y401-V428 HydrophobicContact CE1-CG2 4.23Å; Y401-V428 HydrophobicContact CG-CG1 4.34Å; Y401-F441 HydrophobicContact CD2-CB 3.69Å; Y401-F441 HydrophobicContact CD2-CD2 4.47Å; Y401-F441 HydrophobicContact CD2-CG 4.01Å; Y401-F441 HydrophobicContact CE2-CB 4.31Å; Y401-F441 HydrophobicContact CG-CB 4.39Å; Y401-F441 HydrophobicContact CG-CD1 4.5Å; Y401-F441 HydrophobicContact CG-CG 4.41Å; Y401-L448 HydrophobicContact CD2-CD1 4.11Å; Y401-L448 HydrophobicContact CE2-CD1 3.91Å
402	D	97.8	Very high	96	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	98.4	174.6	177.2	-21.8	0	0	0	109	M373 C404 R405 Q406 L407 W409	M373-D402 WeakPolarHBondContact O-CA 3.27Å; D402-C404 VanDerWaalsContact C-N 3.28Å; D402-C404 PolarHBondContact O-N 3.11Å; D402-C404 PolarHBondContact OD1-N 3.43Å; D402-R405 PolarHBondContact OD1-N 2.94Å; D402-R405 IonicContact OD2-CZ 2.62Å; D402-R405 VanDerWaalsContact OD2-CZ 3.24Å; D402-R405 IonicContact OD2-NE 3.65Å; D402-R405 PolarHBondContact OD2-NE 2.73Å; D402-R405 IonicContact OD2-NH2 3.62Å; D402-R405 PolarHBondContact OD2-NH2 3.04Å; D402-Q406 CarbonylContact O-C 3.59Å; D402-Q406 VanDerWaalsContact O-CA 3.23Å; D402-Q406 WeakPolarHBondContact O-CA 3.32Å; D402-Q406 PolarHBondContact O-N 3.4Å; D402-L407 HydrophobicContact CB-CB 4.35Å; D402-L407 PolarHBondContact N-O 2.83Å; D402-L407 PolarHBondContact O-N 3.25Å; D402-W409 PolarHBondContact OD2-NE1 3.3Å
403	G	97.1	Very high	95.9	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.1	-177.3	0	0	0	0	0	114.6	C421 W422	G403-C421 CarbonylContact O-C 3.58Å; G403-C421 VanDerWaalsContact O-CA 3.24Å; G403-C421 WeakPolarHBondContact O-CA 3.31Å; G403-W422 VanDerWaalsContact CA-CD2 3.42Å; G403-W422 PolarHBondContact O-N 2.8Å
404	C	94.9	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-43.6	177	176	0	0	0	0	111.6	R112 G371 V372 D402 W422	R112-C404 VanDerWaalsContact CD-O 3.31Å; R112-C404 WeakPolarHBondContact CD-O 3.39Å; R112-C404 PolarHBondContact NE-O 3.38Å; R112-C404 VanDerWaalsContact NE-O 3.12Å; G371-C404 VanDerWaalsContact O-CB 3.27Å; G371-C404 WeakPolarHBondContact O-CB 3.48Å; V372-C404 HydrophobicContact CG2-CB 4.21Å; D402-C404 VanDerWaalsContact C-N 3.28Å; D402-C404 PolarHBondContact O-N 3.11Å; D402-C404 PolarHBondContact OD1-N 3.43Å; C404-W422 HydrophobicContact CB-CZ2 4.47Å
405	R	94.4	Very high	95.9	Very high	45 Å²	45	36.2 Å²	36.2	17%	0.17	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.9	175.4	-62.7	-175.5	-73.3	-175.9	-0.1	112.3	R112 L114 V372 D402 L407 W409	R112-R405 HydrophobicContact CG-CG 4.1Å; R112-R405 WeakPolarHBondContact O-CD 3.34Å; R112-R405 WeakPolarHBondContact O-CG 3.49Å; L114-R405 PolarHBondContact O-NH1 3.24Å; V372-R405 HydrophobicContact CG2-CG 4.25Å; D402-R405 PolarHBondContact OD1-N 2.94Å; D402-R405 IonicContact OD2-CZ 2.62Å; D402-R405 VanDerWaalsContact OD2-CZ 3.24Å; D402-R405 IonicContact OD2-NE 3.65Å; D402-R405 PolarHBondContact OD2-NE 2.73Å; D402-R405 IonicContact OD2-NH2 3.62Å; D402-R405 PolarHBondContact OD2-NH2 3.04Å; R405-L407 HydrophobicContact CB-CD1 3.6Å; R405-L407 HydrophobicContact CB-CG 3.85Å; R405-W409 VanDerWaalsContact CZ-CZ2 3.49Å; R405-W409 VanDerWaalsContact NH2-CZ2 3.27Å
406	Q	96.7	Very high	96	Very high	69 Å²	69	40.7 Å²	40.7	32%	0.322	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	46.1	-178.4	-59.7	173.4	-113.7	0	0	112.8	D402 P416 H417 H419 C421	D402-Q406 CarbonylContact O-C 3.59Å; D402-Q406 VanDerWaalsContact O-CA 3.23Å; D402-Q406 WeakPolarHBondContact O-CA 3.32Å; D402-Q406 PolarHBondContact O-N 3.4Å; Q406-P416 WeakPolarHBondContact O-CA 2.96Å; Q406-H417 WeakPolarHBondContact CA-CE1 3.31Å; Q406-H417 PolarHBondContact O-N 2.59Å; Q406-H419 PolarHBondContact NE2-O 3.1Å; Q406-C421 VanDerWaalsContact CD-N 3.33Å; Q406-C421 HydrophobicContact CG-CB 4.16Å
407	L	96.8	Very high	96.1	Very high	16 Å²	16	38.5 Å²	38.5	8%	0.084	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.2	-171.4	-61.5	173.8	0	0	0	112.4	V115 D402 R405 W409 K415	V115-L407 HydrophobicContact CG1-CD1 4.04Å; V115-L407 HydrophobicContact CG2-CD1 3.91Å; D402-L407 HydrophobicContact CB-CB 4.35Å; D402-L407 PolarHBondContact N-O 2.83Å; D402-L407 PolarHBondContact O-N 3.25Å; R405-L407 HydrophobicContact CB-CD1 3.6Å; R405-L407 HydrophobicContact CB-CG 3.85Å; L407-W409 HydrophobicContact CD1-CZ2 3.58Å; L407-K415 CarbonylContact C-O 3.51Å; L407-K415 WeakPolarHBondContact CA-O 3.49Å
408	I	98.1	Very high	96.2	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132	158.5	-59.4	-56.3	0	0	0	108.4	A400 Y401 S414 K415 H417 F441 L448 E451	A400-I408 CarbonylContact O-C 3.45Å; A400-I408 WeakPolarHBondContact O-CA 3.47Å; Y401-I408 HydrophobicContact CD2-CD1 3.78Å; Y401-I408 HydrophobicContact CG-CD1 4.42Å; I408-S414 CarbonylContact O-C 3.51Å; I408-S414 VanDerWaalsContact O-CA 3.27Å; I408-S414 WeakPolarHBondContact O-CA 3.31Å; I408-K415 HydrophobicContact CB-CG 4.06Å; I408-K415 PolarHBondContact N-O 3.44Å; I408-K415 PolarHBondContact O-N 3.34Å; I408-H417 HydrophobicContact CG1-CB 4.29Å; I408-F441 HydrophobicContact CD1-CD2 3.57Å; I408-F441 HydrophobicContact CD1-CE2 3.8Å; I408-F441 HydrophobicContact CD1-CG 4.39Å; I408-F441 HydrophobicContact CG2-CE2 4.34Å; I408-L448 HydrophobicContact CD1-CD1 3.93Å; I408-L448 HydrophobicContact CG1-CD1 4.41Å; I408-E451 HydrophobicContact CG2-CG 4.08Å
409	W	96.9	Very high	96.2	Very high	8 Å²	8	42.6 Å²	42.6	3%	0.03	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.7	-177.2	-69.8	91.3	0	0	0	111.8	V115 Q374 C399 A400 D402 R405 L407 R413	V115-W409 HydrophobicContact CB-CH2 4.38Å; V115-W409 HydrophobicContact CG1-CH2 3.42Å; V115-W409 VanDerWaalsContact CG1-CH2 3.42Å; V115-W409 HydrophobicContact CG1-CZ2 3.8Å; V115-W409 HydrophobicContact CG1-CZ3 4.37Å; V115-W409 WeakPolarHBondContact O-CH2 3.06Å; Q374-W409 HydrophobicContact CG-CG 4.18Å; C399-W409 WeakPolarHBondContact CA-O 3.32Å; C399-W409 PolarHBondContact SG-O 3.49Å; A400-W409 HydrophobicContact CB-CB 4.36Å; A400-W409 PolarHBondContact N-O 3.12Å; A400-W409 VanDerWaalsContact N-O 3.09Å; A400-W409 PolarHBondContact O-N 3.12Å; D402-W409 PolarHBondContact OD2-NE1 3.3Å; R405-W409 VanDerWaalsContact CZ-CZ2 3.49Å; R405-W409 VanDerWaalsContact NH2-CZ2 3.27Å; L407-W409 HydrophobicContact CD1-CZ2 3.58Å; W409-R413 WeakPolarHBondContact CA-O 3.38Å
410	Y	95.9	Very high	96.2	Very high	33 Å²	33	46.6 Å²	46.6	13%	0.129	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	132.6	172.8	168.1	-104.5	0	0	0	110.9	G393 E396 S398 A412 R413 Q453 V454 S456	G393-Y410 CarbonylContact O-C 3.59Å; G393-Y410 WeakPolarHBondContact O-CA 3.37Å; G393-Y410 PolarHBondContact O-N 3.42Å; G393-Y410 VanDerWaalsContact O-N 3.15Å; E396-Y410 WeakPolarHBondContact O-CE2 3.42Å; S398-Y410 WeakPolarHBondContact O-CD2 3.44Å; Y410-A412 PolarHBondContact O-N 2.93Å; Y410-R413 PolarHBondContact N-O 3.35Å; Y410-R413 PolarHBondContact O-N 3.15Å; Y410-R413 VanDerWaalsContact O-N 3.14Å; Y410-Q453 HydrophobicContact CD1-CB 3.95Å; Y410-Q453 HydrophobicContact CD1-CG 3.35Å; Y410-Q453 HydrophobicContact CD2-CG 4.23Å; Y410-Q453 HydrophobicContact CE1-CB 3.86Å; Y410-Q453 HydrophobicContact CE1-CG 3.8Å; Y410-Q453 HydrophobicContact CG-CG 3.59Å; Y410-V454 HydrophobicContact CD2-CB 3.98Å; Y410-V454 HydrophobicContact CD2-CG2 4.42Å; Y410-V454 VanDerWaalsContact CE2-CA 3.45Å; Y410-V454 HydrophobicContact CE2-CB 3.82Å; Y410-V454 HydrophobicContact CE2-CG2 4.13Å; Y410-S456 PolarHBondContact OH-OG 2.85Å
411	N	94.3	Very high	96.1	Very high	69 Å²	69	48.4 Å²	48.4	37%	0.369	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	52.2	176	-164.4	1.5	0	0	0	113.6	G393 D395 R413	G393-N411 PolarHBondContact O-N 3.3Å; D395-N411 VanDerWaalsContact O-CA 3.32Å; D395-N411 WeakPolarHBondContact O-CA 3.47Å; D395-N411 PolarHBondContact O-N 3.23Å; N411-R413 PolarHBondContact O-N 3.07Å
412	A	91.1	Very high	96	Very high	43 Å²	43	48.5 Å²	48.5	36%	0.355	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	33	-178.4	0	0	0	0	0	113.6	Y390 G393 Y410	Y390-A412 HydrophobicContact CE1-CB 4.32Å; G393-A412 PolarHBondContact O-N 3.16Å; G393-A412 VanDerWaalsContact O-N 3.12Å; Y410-A412 PolarHBondContact O-N 2.93Å
413	R	92.3	Very high	96	Very high	189 Å²	189	54.9 Å²	54.9	71%	0.713	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	145.9	177.8	-65.1	176	-171.4	177.4	4.2	110.2	W409 Y410 N411	W409-R413 WeakPolarHBondContact CA-O 3.38Å; Y410-R413 PolarHBondContact N-O 3.35Å; Y410-R413 PolarHBondContact O-N 3.15Å; Y410-R413 VanDerWaalsContact O-N 3.14Å; N411-R413 PolarHBondContact O-N 3.07Å
414	S	93.7	Very high	95.9	Very high	42 Å²	42	58.9 Å²	58.9	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	158.7	177.6	68.2	0	0	0	0	112.7	V115 I408	V115-S414 VanDerWaalsContact CG1-OG 3.27Å; V115-S414 WeakPolarHBondContact CG1-OG 3.47Å; I408-S414 CarbonylContact O-C 3.51Å; I408-S414 VanDerWaalsContact O-CA 3.27Å; I408-S414 WeakPolarHBondContact O-CA 3.31Å
415	K	94.8	Very high	96.1	Very high	86 Å²	86	59.5 Å²	59.5	37%	0.374	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.6	164.2	69.8	178.7	-165.1	178.9	0	110.5	L407 I408 E451	L407-K415 CarbonylContact C-O 3.51Å; L407-K415 WeakPolarHBondContact CA-O 3.49Å; I408-K415 HydrophobicContact CB-CG 4.06Å; I408-K415 PolarHBondContact N-O 3.44Å; I408-K415 PolarHBondContact O-N 3.34Å; K415-E451 WeakPolarHBondContact CE-OE1 3.49Å; K415-E451 VanDerWaalsContact CE-OE2 3.3Å; K415-E451 WeakPolarHBondContact CE-OE2 3.3Å; K415-E451 IonicContact NZ-OE1 2.82Å; K415-E451 PolarHBondContact NZ-OE1 3.38Å; K415-E451 IonicContact NZ-OE2 2.72Å; K415-E451 PolarHBondContact NZ-OE2 3.04Å
416	P	96.9	Very high	96.3	Very high	115 Å²	115	58.8 Å²	58.8	75%	0.747	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	148.8	179.3	29.4	-35.4	0	0	0	112.7	Q406	Q406-P416 WeakPolarHBondContact O-CA 2.96Å
417	H	97.7	Very high	96.4	Very high	21 Å²	21	55.6 Å²	55.6	10%	0.097	29%	0.29	C	S	.	.			trans	-122.5	160.4	176.3	70	39.8	0	0	0	113.2	Y401 Q406 I408 H419 L448	Y401-H417 AromaticContact CD2-CD2 3.85Å; Y401-H417 AromaticContact CD2-NE2 3.78Å; Y401-H417 AromaticContact CE2-CD2 3.57Å; Y401-H417 AromaticContact CE2-CE1 3.97Å; Y401-H417 AromaticContact CE2-NE2 3.21Å; Y401-H417 WeakPolarHBondContact CE2-NE2 3.45Å; Y401-H417 AromaticContact CZ-CE1 3.97Å; Y401-H417 AromaticContact CZ-NE2 3.4Å; Q406-H417 WeakPolarHBondContact CA-CE1 3.31Å; Q406-H417 PolarHBondContact O-N 2.59Å; I408-H417 HydrophobicContact CG1-CB 4.29Å; H417-H419 PolarHBondContact CE1-O 3.25Å; H417-H419 PolarHBondContact ND1-N 2.98Å; H417-H419 PolarHBondContact ND1-O 2.79Å; H417-H419 PolarHBondContact O-N 3.42Å; H417-L448 HydrophobicContact CB-CD1 3.67Å; H417-L448 HydrophobicContact CB-CD2 4.11Å
418	I	97.9	Very high	96.5	Very high	145 Å²	145	54.8 Å²	54.8	74%	0.744	29%	0.286	S	S	*	.	S	Bend	trans	-82.2	-10.3	-173.4	63.3	167.6	0	0	0	115.5	L448	I418-L448 HydrophobicContact CG1-CD2 3.63Å
419	H	98.4	Very high	96.5	Very high	10 Å²	10	54.7 Å²	54.7	5%	0.046	29%	0.286	C	S	.	.	S	Bend	trans	-65.6	143.9	174.1	-73.1	171.4	0	0	0	110.9	Y401 Q406 H417 L443 N446	Y401-H419 AromaticContact CE2-ND1 3.6Å; Y401-H419 AromaticContact CZ-ND1 3.84Å; Y401-H419 WeakPolarHBondContact OH-CB 3.29Å; Y401-H419 PolarHBondContact OH-ND1 3.38Å; Q406-H419 PolarHBondContact NE2-O 3.1Å; H417-H419 PolarHBondContact CE1-O 3.25Å; H417-H419 PolarHBondContact ND1-N 2.98Å; H417-H419 PolarHBondContact ND1-O 2.79Å; H417-H419 PolarHBondContact O-N 3.42Å; H419-L443 HydrophobicContact CB-CB 4.43Å; H419-L443 HydrophobicContact CB-CD2 4Å; H419-L443 PolarHBondContact CE1-N 3.37Å; H419-L443 VanDerWaalsContact ND1-CB 3.32Å; H419-L443 WeakPolarHBondContact ND1-CB 3.14Å; H419-N446 PolarHBondContact CE1-O 3.22Å; H419-N446 VanDerWaalsContact CE1-O 3.3Å; H419-N446 PolarHBondContact NE2-O 3.09Å
420	P	97.6	Very high	96.6	Very high	85 Å²	85	54.3 Å²	54.3	55%	0.552	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-62.9	163.2	171.5	30	-36.9	0	0	0	111.4	W422 L443	P420-W422 PolarHBondContact O-N 2.92Å; P420-L443 HydrophobicContact CG-CD2 3.93Å
421	C	96.3	Very high	96.7	Very high	37 Å²	37	52.8 Å²	52.8	25%	0.25	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-58.6	132.7	169.4	-176.5	0	0	0	0	110.5	G403 Q406	G403-C421 CarbonylContact O-C 3.58Å; G403-C421 VanDerWaalsContact O-CA 3.24Å; G403-C421 WeakPolarHBondContact O-CA 3.31Å; Q406-C421 VanDerWaalsContact CD-N 3.33Å; Q406-C421 HydrophobicContact CG-CB 4.16Å
422	W	97	Very high	96.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.008	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-71.9	162.6	-174.6	62	13	0	0	0	113.4	V367 S370 G371 M373 I375 Y401 G403 C404 P420 D426 V428	V367-W422 HydrophobicContact CG1-CD2 4.38Å; V367-W422 HydrophobicContact CG1-CG 4.33Å; V367-W422 HydrophobicContact CG2-CB 4.44Å; V367-W422 HydrophobicContact CG2-CD2 4.01Å; V367-W422 HydrophobicContact CG2-CE3 3.74Å; V367-W422 HydrophobicContact CG2-CG 4.33Å; V367-W422 HydrophobicContact CG2-CZ3 4.43Å; S370-W422 WeakPolarHBondContact CB-O 3.24Å; S370-W422 PolarHBondContact O-NE1 3.47Å; G371-W422 WeakPolarHBondContact O-CZ2 3.43Å; G371-W422 PolarHBondContact O-NE1 3.46Å; M373-W422 HydrophobicContact CB-CH2 3.89Å; M373-W422 HydrophobicContact CB-CZ2 3.94Å; M373-W422 HydrophobicContact CE-CH2 4.19Å; M373-W422 HydrophobicContact CE-CZ2 3.8Å; M373-W422 WeakPolarHBondContact O-CH2 3.45Å; I375-W422 HydrophobicContact CD1-CH2 4.08Å; I375-W422 HydrophobicContact CD1-CZ3 4.16Å; I375-W422 HydrophobicContact CG1-CH2 4.41Å; Y401-W422 HydrophobicContact CD1-CE3 4.37Å; Y401-W422 AromaticContact CD1-CZ3 3.94Å; Y401-W422 HydrophobicContact CD1-CZ3 3.94Å; Y401-W422 AromaticContact CE1-CE3 3.91Å; Y401-W422 HydrophobicContact CE1-CE3 3.91Å; Y401-W422 AromaticContact CE1-CZ3 3.95Å; Y401-W422 HydrophobicContact CE1-CZ3 3.95Å; G403-W422 VanDerWaalsContact CA-CD2 3.42Å; G403-W422 PolarHBondContact O-N 2.8Å; C404-W422 HydrophobicContact CB-CZ2 4.47Å; P420-W422 PolarHBondContact O-N 2.92Å; W422-D426 WeakPolarHBondContact CA-OD2 3.21Å; W422-V428 HydrophobicContact CE3-CG2 3.77Å; W422-V428 HydrophobicContact CZ3-CG2 4.08Å
423	K	96.5	Very high	97.3	Very high	135 Å²	135	47.8 Å²	47.8	59%	0.587	25%	0.246	S	C	*	.			trans	-137	163.3	-178.4	-60.2	-172.6	-178.5	-175.5	0	112.2	V367 G425 D426	V367-K423 WeakPolarHBondContact CB-O 3.14Å; V367-K423 WeakPolarHBondContact CG1-O 3.27Å; K423-G425 PolarHBondContact O-N 3.28Å; K423-D426 PolarHBondContact N-OD2 3.13Å; K423-D426 VanDerWaalsContact O-CB 3.27Å; K423-D426 WeakPolarHBondContact O-CB 3.46Å; K423-D426 PolarHBondContact O-N 2.81Å
424	E	96.5	Very high	97.6	Very high	83 Å²	83	39.6 Å²	39.6	39%	0.388	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	119.8	173.7	-62.6	69.7	-153.6	0	0	110.2	Y284 V368 S370	Y284-E424 HydrophobicContact CD2-CB 3.9Å; Y284-E424 HydrophobicContact CG-CB 4.22Å; V368-E424 WeakPolarHBondContact O-CG 3.49Å; S370-E424 WeakPolarHBondContact CB-OE1 3.42Å; S370-E424 PolarHBondContact N-OE1 3.02Å; S370-E424 PolarHBondContact OG-OE1 3.01Å
425	G	97.6	Very high	97.7	Very high	14 Å²	14	42.5 Å²	42.5	14%	0.144	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	-1.7	-176.2	0	0	0	0	0	116.5	Y284 V367 K423 K484	Y284-G425 VanDerWaalsContact CE2-CA 3.47Å; Y284-G425 VanDerWaalsContact CZ-CA 3.45Å; Y284-G425 VanDerWaalsContact OH-CA 3.29Å; Y284-G425 WeakPolarHBondContact OH-CA 3.34Å; V367-G425 PolarHBondContact O-N 3.01Å; K423-G425 PolarHBondContact O-N 3.28Å; G425-K484 PolarHBondContact O-NZ 2.94Å
426	D	98.6	Very high	97.8	Very high	29 Å²	29	44 Å²	44	16%	0.155	24%	0.237	C	C	.	.			trans	-62.4	153.5	164	-80.6	-23.1	0	0	0	110.7	T366 V367 W422 K423 L443 N444	T366-D426 WeakPolarHBondContact CA-O 3.36Å; V367-D426 HydrophobicContact CG2-CB 4.36Å; V367-D426 PolarHBondContact N-O 3.44Å; W422-D426 WeakPolarHBondContact CA-OD2 3.21Å; K423-D426 PolarHBondContact N-OD2 3.13Å; K423-D426 VanDerWaalsContact O-CB 3.27Å; K423-D426 WeakPolarHBondContact O-CB 3.46Å; K423-D426 PolarHBondContact O-N 2.81Å; D426-L443 HydrophobicContact CB-CD1 3.95Å; D426-N444 PolarHBondContact OD1-ND2 3.21Å
427	T	98.8	Very high	97.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.9	-179.7	-52.7	0	0	0	0	109.8	E364 V365 N444 K484 Y485	E364-T427 HydrophobicContact CB-CG2 3.94Å; E364-T427 HydrophobicContact CG-CG2 4.01Å; V365-T427 CarbonylContact O-C 3.52Å; V365-T427 WeakPolarHBondContact O-CA 3.48Å; T427-N444 PolarHBondContact N-OD1 2.9Å; T427-N444 PolarHBondContact O-N 3.26Å; T427-K484 HydrophobicContact CG2-CB 4.44Å; T427-K484 HydrophobicContact CG2-CD 4.36Å; T427-K484 VanDerWaalsContact OG1-CD 3.26Å; T427-K484 WeakPolarHBondContact OG1-CD 3.46Å; T427-K484 PolarHBondContact OG1-NZ 3.25Å; T427-Y485 HydrophobicContact CG2-CD2 4.24Å
428	V	98.9	Very high	97.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.6	177.3	-166.7	0	0	0	0	108.3	E364 V365 V367 Y401 W422 F430 F442 L443	E364-V428 CarbonylContact C-O 3.59Å; E364-V428 WeakPolarHBondContact CA-O 3.41Å; V365-V428 PolarHBondContact N-O 3.3Å; V365-V428 PolarHBondContact O-N 3.03Å; V367-V428 HydrophobicContact CG2-CG2 4.02Å; Y401-V428 HydrophobicContact CD1-CG1 3.87Å; Y401-V428 HydrophobicContact CE1-CG1 3.92Å; Y401-V428 HydrophobicContact CE1-CG2 4.23Å; Y401-V428 HydrophobicContact CG-CG1 4.34Å; W422-V428 HydrophobicContact CE3-CG2 3.77Å; W422-V428 HydrophobicContact CZ3-CG2 4.08Å; V428-F430 HydrophobicContact CB-CE2 3.65Å; V428-F430 HydrophobicContact CB-CZ 3.8Å; V428-F430 HydrophobicContact CG1-CD2 4.43Å; V428-F430 HydrophobicContact CG1-CE1 4.01Å; V428-F430 HydrophobicContact CG1-CE2 3.56Å; V428-F430 HydrophobicContact CG1-CZ 3.29Å; V428-F430 WeakPolarHBondContact O-CE2 3.09Å; V428-F442 CarbonylContact C-O 3.58Å; V428-F442 WeakPolarHBondContact CA-O 3.37Å; V428-F442 VanDerWaalsContact CG1-O 3.25Å; V428-F442 WeakPolarHBondContact CG1-O 3.46Å; V428-L443 HydrophobicContact CG2-CD1 4.06Å
429	G	98.8	Very high	97.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	142.7	177.6	0	0	0	0	0	111.4	Y362 F441 F442	Y362-G429 WeakPolarHBondContact OH-CA 3.48Å; G429-F441 CarbonylContact O-C 3.42Å; G429-F441 WeakPolarHBondContact O-CA 3.07Å; G429-F442 PolarHBondContact N-O 3.15Å; G429-F442 PolarHBondContact O-N 3.31Å
430	F	98.8	Very high	97.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	104.8	-173.3	-63.4	-87.4	0	0	0	109.6	Y362 Y363 V365 I375 W377 V428 F441	Y362-F430 WeakPolarHBondContact CA-O 3.36Å; Y362-F430 VanDerWaalsContact CD2-O 3.32Å; Y362-F430 WeakPolarHBondContact CD2-O 3.29Å; Y363-F430 HydrophobicContact CD1-CB 3.59Å; Y363-F430 HydrophobicContact CD1-CG 4.38Å; Y363-F430 HydrophobicContact CD2-CB 4.32Å; Y363-F430 AromaticContact CD2-CD2 3.91Å; Y363-F430 HydrophobicContact CD2-CD2 3.91Å; Y363-F430 HydrophobicContact CD2-CG 4.39Å; Y363-F430 HydrophobicContact CE1-CB 3.25Å; Y363-F430 HydrophobicContact CE1-CD1 4.5Å; Y363-F430 HydrophobicContact CE1-CD2 4.25Å; Y363-F430 AromaticContact CE1-CG 3.78Å; Y363-F430 HydrophobicContact CE1-CG 3.78Å; Y363-F430 HydrophobicContact CE2-CB 4.03Å; Y363-F430 AromaticContact CE2-CD2 3.42Å; Y363-F430 HydrophobicContact CE2-CD2 3.42Å; Y363-F430 VanDerWaalsContact CE2-CD2 3.42Å; Y363-F430 HydrophobicContact CE2-CE2 4.04Å; Y363-F430 AromaticContact CE2-CG 3.77Å; Y363-F430 HydrophobicContact CE2-CG 3.77Å; Y363-F430 HydrophobicContact CG-CB 4.11Å; Y363-F430 HydrophobicContact CG-CD2 4.49Å; Y363-F430 VanDerWaalsContact CZ-CB 3.47Å; Y363-F430 AromaticContact CZ-CD2 3.6Å; Y363-F430 AromaticContact CZ-CG 3.4Å; Y363-F430 VanDerWaalsContact CZ-CG 3.4Å; Y363-F430 PolarHBondContact N-O 3.28Å; Y363-F430 VanDerWaalsContact N-O 3.11Å; Y363-F430 PolarHBondContact O-N 3.44Å; Y363-F430 WeakPolarHBondContact OH-CG 3.37Å; V365-F430 HydrophobicContact CB-CE2 3.95Å; V365-F430 HydrophobicContact CG2-CD2 4.14Å; V365-F430 HydrophobicContact CG2-CE2 3.64Å; I375-F430 HydrophobicContact CB-CE1 4.07Å; I375-F430 HydrophobicContact CB-CZ 3.7Å; I375-F430 HydrophobicContact CG2-CE1 3.8Å; I375-F430 HydrophobicContact CG2-CE2 3.79Å; I375-F430 HydrophobicContact CG2-CZ 3.3Å; I375-F430 VanDerWaalsContact O-CE1 3.27Å; I375-F430 WeakPolarHBondContact O-CE1 3.39Å; W377-F430 HydrophobicContact CZ2-CB 4.33Å; V428-F430 HydrophobicContact CB-CE2 3.65Å; V428-F430 HydrophobicContact CB-CZ 3.8Å; V428-F430 HydrophobicContact CG1-CD2 4.43Å; V428-F430 HydrophobicContact CG1-CE1 4.01Å; V428-F430 HydrophobicContact CG1-CE2 3.56Å; V428-F430 HydrophobicContact CG1-CZ 3.29Å; V428-F430 WeakPolarHBondContact O-CE2 3.09Å; F430-F441 AromaticContact CD1-CD1 3.53Å; F430-F441 HydrophobicContact CD1-CD1 3.53Å; F430-F441 AromaticContact CD1-CE1 3.69Å; F430-F441 HydrophobicContact CD1-CE1 3.69Å; F430-F441 AromaticContact CE1-CD1 3.71Å; F430-F441 HydrophobicContact CE1-CD1 3.71Å; F430-F441 AromaticContact CE1-CE1 3.93Å; F430-F441 HydrophobicContact CE1-CE1 3.93Å
431	L	98.8	Very high	97.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.8	174.5	-170.6	128.8	0	0	0	110.8	V360 W361 Y362 D433 M439 I440 F442 P487 M489	V360-L431 HydrophobicContact CG1-CD1 3.98Å; V360-L431 HydrophobicContact CG1-CD2 4.09Å; V360-L431 HydrophobicContact CG1-CG 4.05Å; W361-L431 WeakPolarHBondContact O-CA 3.07Å; Y362-L431 HydrophobicContact CD2-CB 3.93Å; Y362-L431 HydrophobicContact CD2-CD1 4.27Å; Y362-L431 HydrophobicContact CE2-CB 4.49Å; L431-D433 HydrophobicContact CD2-CB 4.1Å; L431-M439 CarbonylContact O-C 3.48Å; L431-M439 VanDerWaalsContact O-CA 3.31Å; L431-M439 WeakPolarHBondContact O-CA 3.35Å; L431-I440 HydrophobicContact CB-CB 4.29Å; L431-I440 HydrophobicContact CD2-CB 4.41Å; L431-I440 HydrophobicContact CD2-CD1 4.22Å; L431-I440 HydrophobicContact CD2-CG1 4.27Å; L431-I440 PolarHBondContact N-O 3.49Å; L431-I440 PolarHBondContact O-N 3.33Å; L431-F442 HydrophobicContact CB-CE2 3.82Å; L431-P487 HydrophobicContact CD1-CB 4.45Å; L431-P487 HydrophobicContact CD1-CG 3.83Å; L431-M489 HydrophobicContact CD1-CG 3.93Å; L431-M489 HydrophobicContact CD1-SD 3.56Å; L431-M489 VanDerWaalsContact CD1-SD 3.56Å; L431-M489 HydrophobicContact CD2-CE 4.42Å; L431-M489 HydrophobicContact CD2-SD 3.84Å; L431-M489 HydrophobicContact CG-SD 4.37Å
432	L	98.7	Very high	98	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	119.5	170.7	174.1	63.6	0	0	0	108.6	V356 V360 W361 W377 L434 M439 F455 F462	V356-L432 HydrophobicContact CB-CD2 4.4Å; V356-L432 HydrophobicContact CG1-CD2 3.79Å; V360-L432 CarbonylContact C-O 3.59Å; V360-L432 VanDerWaalsContact CA-O 3.29Å; V360-L432 WeakPolarHBondContact CA-O 3.25Å; W361-L432 PolarHBondContact N-O 3.4Å; W361-L432 PolarHBondContact O-N 3.45Å; W377-L432 HydrophobicContact CD2-CB 4.04Å; W377-L432 HydrophobicContact CD2-CD2 4Å; W377-L432 HydrophobicContact CE3-CB 4.26Å; W377-L432 HydrophobicContact CE3-CD2 3.59Å; W377-L432 HydrophobicContact CH2-CB 3.59Å; W377-L432 HydrophobicContact CH2-CD2 4.01Å; W377-L432 HydrophobicContact CH2-CG 4.46Å; W377-L432 HydrophobicContact CZ2-CB 3.36Å; W377-L432 HydrophobicContact CZ2-CD2 4.43Å; W377-L432 HydrophobicContact CZ3-CB 4.03Å; W377-L432 HydrophobicContact CZ3-CD2 3.56Å; W377-L432 HydrophobicContact CZ3-CG 4.45Å; L432-L434 HydrophobicContact CD1-CD2 3.65Å; L432-L434 HydrophobicContact CD1-CG 4.34Å; L432-L434 HydrophobicContact CD2-CD1 4.45Å; L432-L434 HydrophobicContact CD2-CD2 4.02Å; L432-L434 HydrophobicContact CD2-CG 4.21Å; L432-L434 HydrophobicContact CG-CD2 3.84Å; L432-L434 HydrophobicContact CG-CG 4.01Å; L432-M439 HydrophobicContact CD1-CE 3.77Å; L432-M439 HydrophobicContact CD1-CG 3.71Å; L432-F455 HydrophobicContact CD1-CE1 4.44Å; L432-F455 HydrophobicContact CD1-CZ 3.73Å; L432-F462 HydrophobicContact CD1-CD2 4.43Å; L432-F462 HydrophobicContact CD2-CB 3.67Å; L432-F462 HydrophobicContact CD2-CD2 3.99Å; L432-F462 HydrophobicContact CD2-CG 3.99Å
433	D	98.3	Very high	98.1	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.043	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	103.5	174.3	-177.4	-11.7	0	0	0	108.9	V360 L431 N435 E436 K437 Q438	V360-D433 HydrophobicContact CG1-CB 4.24Å; V360-D433 HydrophobicContact CG2-CB 4.18Å; L431-D433 HydrophobicContact CD2-CB 4.1Å; D433-N435 VanDerWaalsContact C-N 3.31Å; D433-N435 WeakPolarHBondContact OD1-CB 3.26Å; D433-N435 PolarHBondContact OD1-N 3.11Å; D433-N435 PolarHBondContact OD1-ND2 3.4Å; D433-E436 PolarHBondContact OD1-N 2.96Å; D433-K437 VanDerWaalsContact O-CA 3.3Å; D433-K437 WeakPolarHBondContact O-CA 3.37Å; D433-K437 PolarHBondContact O-N 2.9Å; D433-Q438 HydrophobicContact CB-CG 3.87Å; D433-Q438 PolarHBondContact N-O 2.9Å; D433-Q438 PolarHBondContact O-N 2.84Å
434	L	98.1	Very high	98.2	Very high	16 Å²	16	27.2 Å²	27.2	8%	0.084	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.7	-179.5	-63	-178.2	0	0	0	113.1	V356 G359 L432 F455 F462	V356-L434 HydrophobicContact CG1-CD1 3.92Å; G359-L434 PolarHBondContact O-N 2.97Å; L432-L434 HydrophobicContact CD1-CD2 3.65Å; L432-L434 HydrophobicContact CD1-CG 4.34Å; L432-L434 HydrophobicContact CD2-CD1 4.45Å; L432-L434 HydrophobicContact CD2-CD2 4.02Å; L432-L434 HydrophobicContact CD2-CG 4.21Å; L432-L434 HydrophobicContact CG-CD2 3.84Å; L432-L434 HydrophobicContact CG-CG 4.01Å; L434-F455 HydrophobicContact CD2-CE1 3.67Å; L434-F455 HydrophobicContact CD2-CZ 4.17Å; L434-F462 HydrophobicContact CD2-CD2 3.81Å; L434-F462 HydrophobicContact CD2-CE2 3.86Å
435	N	96.7	Very high	98.3	Very high	104 Å²	104	25 Å²	25	56%	0.556	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-50.2	175.3	-35.8	-82.7	0	0	0	109.4	V360 D433 K437	V360-N435 VanDerWaalsContact CG2-ND2 3.29Å; V360-N435 WeakPolarHBondContact CG2-ND2 3.48Å; D433-N435 VanDerWaalsContact C-N 3.31Å; D433-N435 WeakPolarHBondContact OD1-CB 3.26Å; D433-N435 PolarHBondContact OD1-N 3.11Å; D433-N435 PolarHBondContact OD1-ND2 3.4Å; N435-K437 VanDerWaalsContact C-N 3.3Å
436	E	97.1	Very high	98.4	Very high	118 Å²	118	29.4 Å²	29.4	55%	0.551	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	2.2	177.2	-66.9	-61.3	144.9	0	0	113.4	D433 Q438 K452	D433-E436 PolarHBondContact OD1-N 2.96Å; E436-Q438 HydrophobicContact CB-CG 3.99Å; E436-K452 PolarHBondContact O-NZ 3.12Å
437	K	97.9	Very high	98.3	Very high	96 Å²	96	34 Å²	34	42%	0.417	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	63.1	-179.8	-65.6	-171.4	176.7	-170.5	0	112.3	D433 N435 K452 F455 V459	D433-K437 VanDerWaalsContact O-CA 3.3Å; D433-K437 WeakPolarHBondContact O-CA 3.37Å; D433-K437 PolarHBondContact O-N 2.9Å; N435-K437 VanDerWaalsContact C-N 3.3Å; K437-K452 WeakPolarHBondContact O-CD 3.4Å; K437-K452 WeakPolarHBondContact O-CG 3.37Å; K437-F455 VanDerWaalsContact C-CD2 3.47Å; K437-F455 HydrophobicContact CB-CB 4.06Å; K437-F455 HydrophobicContact CB-CD1 3.81Å; K437-F455 HydrophobicContact CB-CD2 4.21Å; K437-F455 HydrophobicContact CB-CE1 4.3Å; K437-F455 HydrophobicContact CB-CG 3.75Å; K437-F455 HydrophobicContact CD-CB 4.42Å; K437-F455 HydrophobicContact CD-CD1 4.46Å; K437-F455 HydrophobicContact CG-CD1 4.08Å; K437-F455 HydrophobicContact CG-CG 4.44Å; K437-F455 VanDerWaalsContact O-CD2 3.26Å; K437-F455 WeakPolarHBondContact O-CD2 3.41Å; K437-V459 HydrophobicContact CD-CG1 4.49Å
438	Q	97.6	Very high	98.3	Very high	28 Å²	28	34.2 Å²	34.2	13%	0.131	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	146.7	-176.4	63.5	-168.9	6.9	0	0	113.2	D433 E436 P450 E451 K452 F455	D433-Q438 HydrophobicContact CB-CG 3.87Å; D433-Q438 PolarHBondContact N-O 2.9Å; D433-Q438 PolarHBondContact O-N 2.84Å; E436-Q438 HydrophobicContact CB-CG 3.99Å; Q438-P450 HydrophobicContact CB-CB 3.96Å; Q438-P450 HydrophobicContact CG-CB 4.43Å; Q438-E451 WeakPolarHBondContact CA-O 3.29Å; Q438-K452 HydrophobicContact CB-CD 4.21Å; Q438-K452 HydrophobicContact CB-CG 3.97Å; Q438-F455 VanDerWaalsContact N-CE2 3.35Å
439	M	98.2	Very high	98.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141.7	167.1	-67.7	168	-174.6	0	0	109	W377 C399 L431 L432 P450 E451 V454 F455 F462	W377-M439 HydrophobicContact CB-CE 3.47Å; W377-M439 VanDerWaalsContact CB-CE 3.47Å; W377-M439 HydrophobicContact CB-SD 3.92Å; W377-M439 HydrophobicContact CG-CE 3.88Å; W377-M439 HydrophobicContact CG-CG 4.5Å; W377-M439 HydrophobicContact CG-SD 4.02Å; C399-M439 HydrophobicContact CB-SD 3.92Å; L431-M439 CarbonylContact O-C 3.48Å; L431-M439 VanDerWaalsContact O-CA 3.31Å; L431-M439 WeakPolarHBondContact O-CA 3.35Å; L432-M439 HydrophobicContact CD1-CE 3.77Å; L432-M439 HydrophobicContact CD1-CG 3.71Å; M439-P450 CarbonylContact O-C 3.5Å; M439-P450 WeakPolarHBondContact O-CA 3.34Å; M439-E451 HydrophobicContact CB-CB 4.45Å; M439-E451 PolarHBondContact N-O 3.05Å; M439-E451 PolarHBondContact O-N 2.84Å; M439-V454 HydrophobicContact CE-CG1 3.63Å; M439-V454 HydrophobicContact SD-CG1 3.92Å; M439-F455 HydrophobicContact CE-CE2 4.4Å; M439-F455 HydrophobicContact CE-CZ 4.18Å; M439-F455 HydrophobicContact CG-CE2 4.24Å; M439-F455 HydrophobicContact CG-CZ 4.39Å; M439-F462 HydrophobicContact CE-CD1 3.81Å; M439-F462 HydrophobicContact CE-CE1 3.39Å; M439-F462 HydrophobicContact CE-CE2 4.37Å; M439-F462 HydrophobicContact CE-CG 4.45Å; M439-F462 HydrophobicContact CE-CZ 3.68Å
440	I	98.6	Very high	98.2	Very high	16 Å²	16	41 Å²	41	8%	0.082	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.9	176.2	-51.1	-178.9	0	0	0	108.6	L431 F442 Q447 P450	L431-I440 HydrophobicContact CB-CB 4.29Å; L431-I440 HydrophobicContact CD2-CB 4.41Å; L431-I440 HydrophobicContact CD2-CD1 4.22Å; L431-I440 HydrophobicContact CD2-CG1 4.27Å; L431-I440 PolarHBondContact N-O 3.49Å; L431-I440 PolarHBondContact O-N 3.33Å; I440-F442 HydrophobicContact CB-CE2 3.87Å; I440-F442 HydrophobicContact CB-CZ 4.31Å; I440-F442 HydrophobicContact CG2-CD2 4.25Å; I440-F442 HydrophobicContact CG2-CE2 3.56Å; I440-F442 HydrophobicContact CG2-CZ 3.73Å; I440-F442 WeakPolarHBondContact O-CE2 3.5Å; I440-Q447 HydrophobicContact CG2-CB 4.24Å; I440-P450 HydrophobicContact CD1-CB 4.32Å; I440-P450 HydrophobicContact CD1-CG 4.02Å; I440-P450 HydrophobicContact CG1-CB 3.93Å; I440-P450 HydrophobicContact CG1-CG 4.11Å
441	F	98.8	Very high	98.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140	177.9	-55.9	-71.4	0	0	0	110.6	Y401 I408 G429 F430 L448 E451	Y401-F441 HydrophobicContact CD2-CB 3.69Å; Y401-F441 HydrophobicContact CD2-CD2 4.47Å; Y401-F441 HydrophobicContact CD2-CG 4.01Å; Y401-F441 HydrophobicContact CE2-CB 4.31Å; Y401-F441 HydrophobicContact CG-CB 4.39Å; Y401-F441 HydrophobicContact CG-CD1 4.5Å; Y401-F441 HydrophobicContact CG-CG 4.41Å; I408-F441 HydrophobicContact CD1-CD2 3.57Å; I408-F441 HydrophobicContact CD1-CE2 3.8Å; I408-F441 HydrophobicContact CD1-CG 4.39Å; I408-F441 HydrophobicContact CG2-CE2 4.34Å; G429-F441 CarbonylContact O-C 3.42Å; G429-F441 WeakPolarHBondContact O-CA 3.07Å; F430-F441 AromaticContact CD1-CD1 3.53Å; F430-F441 HydrophobicContact CD1-CD1 3.53Å; F430-F441 AromaticContact CD1-CE1 3.69Å; F430-F441 HydrophobicContact CD1-CE1 3.69Å; F430-F441 AromaticContact CE1-CD1 3.71Å; F430-F441 HydrophobicContact CE1-CD1 3.71Å; F430-F441 AromaticContact CE1-CE1 3.93Å; F430-F441 HydrophobicContact CE1-CE1 3.93Å; F441-L448 HydrophobicContact CB-CD1 4.28Å; F441-L448 PolarHBondContact O-N 3.48Å; F441-E451 HydrophobicContact CD2-CG 4.22Å; F441-E451 HydrophobicContact CE2-CG 3.89Å
442	F	98.8	Very high	98.1	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.035	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.8	-178	-59.7	-107.9	0	0	0	110.7	Y362 V428 G429 L431 I440 N446 Q447 P487	Y362-F442 HydrophobicContact CE2-CD2 4.09Å; Y362-F442 HydrophobicContact CE2-CE2 4.27Å; V428-F442 CarbonylContact C-O 3.58Å; V428-F442 WeakPolarHBondContact CA-O 3.37Å; V428-F442 VanDerWaalsContact CG1-O 3.25Å; V428-F442 WeakPolarHBondContact CG1-O 3.46Å; G429-F442 PolarHBondContact N-O 3.15Å; G429-F442 PolarHBondContact O-N 3.31Å; L431-F442 HydrophobicContact CB-CE2 3.82Å; I440-F442 HydrophobicContact CB-CE2 3.87Å; I440-F442 HydrophobicContact CB-CZ 4.31Å; I440-F442 HydrophobicContact CG2-CD2 4.25Å; I440-F442 HydrophobicContact CG2-CE2 3.56Å; I440-F442 HydrophobicContact CG2-CZ 3.73Å; I440-F442 WeakPolarHBondContact O-CE2 3.5Å; F442-N446 CarbonylContact C-O 3.57Å; F442-N446 WeakPolarHBondContact CA-O 3.47Å; F442-N446 WeakPolarHBondContact CB-O 3.49Å; F442-Q447 HydrophobicContact CD1-CB 3.59Å; F442-Q447 HydrophobicContact CE1-CB 3.46Å; F442-Q447 VanDerWaalsContact CE1-CB 3.46Å; F442-Q447 HydrophobicContact CG-CB 4.37Å; F442-Q447 HydrophobicContact CZ-CB 4.13Å; F442-P487 HydrophobicContact CE1-CB 4.09Å; F442-P487 HydrophobicContact CZ-CB 3.9Å
443	L	98.8	Very high	97.9	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	114.4	168.4	-177.9	68.2	0	0	0	109.2	H419 P420 D426 V428 G445 N446	H419-L443 HydrophobicContact CB-CB 4.43Å; H419-L443 HydrophobicContact CB-CD2 4Å; H419-L443 PolarHBondContact CE1-N 3.37Å; H419-L443 VanDerWaalsContact ND1-CB 3.32Å; H419-L443 WeakPolarHBondContact ND1-CB 3.14Å; P420-L443 HydrophobicContact CG-CD2 3.93Å; D426-L443 HydrophobicContact CB-CD1 3.95Å; V428-L443 HydrophobicContact CG2-CD1 4.06Å; L443-G445 PolarHBondContact O-N 2.83Å; L443-N446 PolarHBondContact N-O 2.87Å; L443-N446 WeakPolarHBondContact O-CB 3.44Å; L443-N446 PolarHBondContact O-N 3.22Å; L443-N446 PolarHBondContact O-ND2 2.86Å
444	N	98.6	Very high	97.7	Very high	42 Å²	42	48.6 Å²	48.6	23%	0.225	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	41.2	-173.4	-60.3	-41.4	0	0	0	113.1	D426 T427 N446 Y485	D426-N444 PolarHBondContact OD1-ND2 3.21Å; T427-N444 PolarHBondContact N-OD1 2.9Å; T427-N444 PolarHBondContact O-N 3.26Å; N444-N446 VanDerWaalsContact C-N 3.32Å; N444-N446 PolarHBondContact O-N 2.98Å; N444-N446 PolarHBondContact O-ND2 2.65Å; N444-Y485 HydrophobicContact CB-CD2 4.38Å; N444-Y485 HydrophobicContact CB-CE1 4.39Å; N444-Y485 HydrophobicContact CB-CE2 3.81Å; N444-Y485 WeakPolarHBondContact OD1-CE2 3.29Å
445	G	98.3	Very high	97.7	Very high	36 Å²	36	48.9 Å²	48.9	37%	0.371	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-9.8	-178.6	0	0	0	0	0	116.3	L443	L443-G445 PolarHBondContact O-N 2.83Å
446	N	98.4	Very high	97.6	Very high	107 Å²	107	48.5 Å²	48.5	57%	0.572	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	135	171.4	-53.7	-84.9	0	0	0	109	H419 F442 L443 N444	H419-N446 PolarHBondContact CE1-O 3.22Å; H419-N446 VanDerWaalsContact CE1-O 3.3Å; H419-N446 PolarHBondContact NE2-O 3.09Å; F442-N446 CarbonylContact C-O 3.57Å; F442-N446 WeakPolarHBondContact CA-O 3.47Å; F442-N446 WeakPolarHBondContact CB-O 3.49Å; L443-N446 PolarHBondContact N-O 2.87Å; L443-N446 WeakPolarHBondContact O-CB 3.44Å; L443-N446 PolarHBondContact O-N 3.22Å; L443-N446 PolarHBondContact O-ND2 2.86Å; N444-N446 VanDerWaalsContact C-N 3.32Å; N444-N446 PolarHBondContact O-N 2.98Å; N444-N446 PolarHBondContact O-ND2 2.65Å
447	Q	98.1	Very high	97.4	Very high	127 Å²	127	44.9 Å²	44.9	59%	0.593	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104	143.6	-174.5	77	-174.2	15.9	0	0	113	I440 F442	I440-Q447 HydrophobicContact CG2-CB 4.24Å; F442-Q447 HydrophobicContact CD1-CB 3.59Å; F442-Q447 HydrophobicContact CE1-CB 3.46Å; F442-Q447 VanDerWaalsContact CE1-CB 3.46Å; F442-Q447 HydrophobicContact CG-CB 4.37Å; F442-Q447 HydrophobicContact CZ-CB 4.13Å
448	L	98.6	Very high	97.1	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.031	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-81.6	166	164	-71.1	-174.1	0	0	0	112.1	Y401 I408 H417 I418 F441	Y401-L448 HydrophobicContact CD2-CD1 4.11Å; Y401-L448 HydrophobicContact CE2-CD1 3.91Å; I408-L448 HydrophobicContact CD1-CD1 3.93Å; I408-L448 HydrophobicContact CG1-CD1 4.41Å; H417-L448 HydrophobicContact CB-CD1 3.67Å; H417-L448 HydrophobicContact CB-CD2 4.11Å; I418-L448 HydrophobicContact CG1-CD2 3.63Å; F441-L448 HydrophobicContact CB-CD1 4.28Å; F441-L448 PolarHBondContact O-N 3.48Å
449	P	98	Very high	96.9	Very high	83 Å²	83	43.3 Å²	43.3	54%	0.539	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-56.5	150.7	163.4	-23.3	35.1	0	0	0	112
450	P	97.9	Very high	96.7	Very high	61 Å²	61	45.5 Å²	45.5	40%	0.396	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-71.2	137.4	-179.5	-17.1	30.9	0	0	0	113.4	Q438 M439 I440	Q438-P450 HydrophobicContact CB-CB 3.96Å; Q438-P450 HydrophobicContact CG-CB 4.43Å; M439-P450 CarbonylContact O-C 3.5Å; M439-P450 WeakPolarHBondContact O-CA 3.34Å; I440-P450 HydrophobicContact CD1-CB 4.32Å; I440-P450 HydrophobicContact CD1-CG 4.02Å; I440-P450 HydrophobicContact CG1-CB 3.93Å; I440-P450 HydrophobicContact CG1-CG 4.11Å
451	E	97.8	Very high	96.6	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.033	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-93.8	131.1	175.2	-59.9	-57.3	149.9	0	0	110.4	I408 K415 Q438 M439 F441 Q453	I408-E451 HydrophobicContact CG2-CG 4.08Å; K415-E451 WeakPolarHBondContact CE-OE1 3.49Å; K415-E451 VanDerWaalsContact CE-OE2 3.3Å; K415-E451 WeakPolarHBondContact CE-OE2 3.3Å; K415-E451 IonicContact NZ-OE1 2.82Å; K415-E451 PolarHBondContact NZ-OE1 3.38Å; K415-E451 IonicContact NZ-OE2 2.72Å; K415-E451 PolarHBondContact NZ-OE2 3.04Å; Q438-E451 WeakPolarHBondContact CA-O 3.29Å; M439-E451 HydrophobicContact CB-CB 4.45Å; M439-E451 PolarHBondContact N-O 3.05Å; M439-E451 PolarHBondContact O-N 2.84Å; F441-E451 HydrophobicContact CD2-CG 4.22Å; F441-E451 HydrophobicContact CE2-CG 3.89Å; E451-Q453 PolarHBondContact OE2-NE2 3.39Å; E451-Q453 PolarHBondContact OE2-OE1 2.74Å
452	K	97.3	Very high	96.6	Very high	93 Å²	93	45.5 Å²	45.5	40%	0.404	27%	0.269	S	S	.	.			trans	-129.5	-9.5	-174.2	-57.5	-155.2	-178.3	-135	0	115.1	E436 K437 Q438 V454 F455	E436-K452 PolarHBondContact O-NZ 3.12Å; K437-K452 WeakPolarHBondContact O-CD 3.4Å; K437-K452 WeakPolarHBondContact O-CG 3.37Å; Q438-K452 HydrophobicContact CB-CD 4.21Å; Q438-K452 HydrophobicContact CB-CG 3.97Å; K452-V454 PolarHBondContact O-N 3.02Å; K452-F455 WeakPolarHBondContact O-CB 3.48Å; K452-F455 PolarHBondContact O-N 3.17Å; K452-F455 VanDerWaalsContact O-N 3.13Å
453	Q	94.6	Very high	96.6	Very high	65 Å²	65	45.2 Å²	45.2	30%	0.304	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-64	-36.7	-171.9	53.3	-78.9	2.1	0	0	114.2	Y410 E451 F455 S456	Y410-Q453 HydrophobicContact CD1-CB 3.95Å; Y410-Q453 HydrophobicContact CD1-CG 3.35Å; Y410-Q453 HydrophobicContact CD2-CG 4.23Å; Y410-Q453 HydrophobicContact CE1-CB 3.86Å; Y410-Q453 HydrophobicContact CE1-CG 3.8Å; Y410-Q453 HydrophobicContact CG-CG 3.59Å; E451-Q453 PolarHBondContact OE2-NE2 3.39Å; E451-Q453 PolarHBondContact OE2-OE1 2.74Å; Q453-F455 PolarHBondContact O-N 3.15Å; Q453-F455 VanDerWaalsContact O-N 3.07Å; Q453-S456 PolarHBondContact O-N 3.24Å; Q453-S456 PolarHBondContact O-OG 2.62Å
454	V	94.6	Very high	96.6	Very high	1 Å²	1	45 Å²	45	1%	0.006	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-57.8	-24.7	175.4	66.9	0	0	0	0	113.3	C399 Y410 M439 K452 S456 S457 T458 F462	C399-V454 HydrophobicContact CB-CB 4.38Å; C399-V454 HydrophobicContact CB-CG1 4.44Å; Y410-V454 HydrophobicContact CD2-CB 3.98Å; Y410-V454 HydrophobicContact CD2-CG2 4.42Å; Y410-V454 VanDerWaalsContact CE2-CA 3.45Å; Y410-V454 HydrophobicContact CE2-CB 3.82Å; Y410-V454 HydrophobicContact CE2-CG2 4.13Å; M439-V454 HydrophobicContact CE-CG1 3.63Å; M439-V454 HydrophobicContact SD-CG1 3.92Å; K452-V454 PolarHBondContact O-N 3.02Å; V454-S456 PolarHBondContact O-N 2.89Å; V454-S456 VanDerWaalsContact O-N 3.16Å; V454-S457 PolarHBondContact O-N 2.98Å; V454-S457 VanDerWaalsContact O-N 3.15Å; V454-T458 HydrophobicContact CG2-CG2 4.04Å; V454-T458 PolarHBondContact O-N 2.93Å; V454-F462 HydrophobicContact CG1-CZ 4.43Å; V454-F462 HydrophobicContact CG2-CE1 4.11Å; V454-F462 HydrophobicContact CG2-CZ 4.26Å
455	F	96.7	Very high	96.6	Very high	23 Å²	23	43 Å²	43	10%	0.101	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-75.3	4.9	177.2	-59.7	-83.7	0	0	0	115	L432 L434 K437 Q438 M439 K452 Q453 T458 F462	L432-F455 HydrophobicContact CD1-CE1 4.44Å; L432-F455 HydrophobicContact CD1-CZ 3.73Å; L434-F455 HydrophobicContact CD2-CE1 3.67Å; L434-F455 HydrophobicContact CD2-CZ 4.17Å; K437-F455 VanDerWaalsContact C-CD2 3.47Å; K437-F455 HydrophobicContact CB-CB 4.06Å; K437-F455 HydrophobicContact CB-CD1 3.81Å; K437-F455 HydrophobicContact CB-CD2 4.21Å; K437-F455 HydrophobicContact CB-CE1 4.3Å; K437-F455 HydrophobicContact CB-CG 3.75Å; K437-F455 HydrophobicContact CD-CB 4.42Å; K437-F455 HydrophobicContact CD-CD1 4.46Å; K437-F455 HydrophobicContact CG-CD1 4.08Å; K437-F455 HydrophobicContact CG-CG 4.44Å; K437-F455 VanDerWaalsContact O-CD2 3.26Å; K437-F455 WeakPolarHBondContact O-CD2 3.41Å; Q438-F455 VanDerWaalsContact N-CE2 3.35Å; M439-F455 HydrophobicContact CE-CE2 4.4Å; M439-F455 HydrophobicContact CE-CZ 4.18Å; M439-F455 HydrophobicContact CG-CE2 4.24Å; M439-F455 HydrophobicContact CG-CZ 4.39Å; K452-F455 WeakPolarHBondContact O-CB 3.48Å; K452-F455 PolarHBondContact O-N 3.17Å; K452-F455 VanDerWaalsContact O-N 3.13Å; Q453-F455 PolarHBondContact O-N 3.15Å; Q453-F455 VanDerWaalsContact O-N 3.07Å; F455-T458 WeakPolarHBondContact CA-O 3.41Å; F455-F462 HydrophobicContact CD1-CE2 4.49Å; F455-F462 AromaticContact CE1-CE2 3.78Å; F455-F462 HydrophobicContact CE1-CE2 3.78Å; F455-F462 HydrophobicContact CE1-CZ 4.09Å; F455-F462 HydrophobicContact CZ-CE2 4.32Å; F455-F462 HydrophobicContact CZ-CZ 4.41Å
456	S	94.3	Very high	96.6	Very high	96 Å²	96	41.2 Å²	41.2	67%	0.671	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-77.3	-32.2	163.4	65	0	0	0	0	113.1	Y410 Q453 V454	Y410-S456 PolarHBondContact OH-OG 2.85Å; Q453-S456 PolarHBondContact O-N 3.24Å; Q453-S456 PolarHBondContact O-OG 2.62Å; V454-S456 PolarHBondContact O-N 2.89Å; V454-S456 VanDerWaalsContact O-N 3.16Å
457	S	93.6	Very high	96.6	Very high	42 Å²	42	36.1 Å²	36.1	29%	0.294	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-29.2	-171	-58	0	0	0	0	113	E396 V454	E396-S457 VanDerWaalsContact OE2-CB 3.27Å; E396-S457 WeakPolarHBondContact OE2-CB 3.48Å; E396-S457 PolarHBondContact OE2-OG 3.15Å; V454-S457 PolarHBondContact O-N 2.98Å; V454-S457 VanDerWaalsContact O-N 3.15Å
458	T	91.6	Very high	96.5	Very high	19 Å²	19	30.1 Å²	30.1	12%	0.117	18%	0.182	C	C	.	.			trans	-145.2	150.8	175.2	178.2	0	0	0	0	112.8	T379 Y397 V454 F455 S460 F462	T379-T458 HydrophobicContact CG2-CG2 3.77Å; Y397-T458 HydrophobicContact CD1-CG2 4.29Å; V454-T458 HydrophobicContact CG2-CG2 4.04Å; V454-T458 PolarHBondContact O-N 2.93Å; F455-T458 WeakPolarHBondContact CA-O 3.41Å; T458-S460 PolarHBondContact OG1-O 3.12Å; T458-F462 HydrophobicContact CG2-CE1 3.97Å; T458-F462 HydrophobicContact CG2-CZ 3.71Å
459	V	92.8	Very high	96.3	Very high	72 Å²	72	32.4 Å²	32.4	44%	0.436	19%	0.193	S	C	.	.	S	Bend	trans	-130.1	-1.8	-173.9	-62	0	0	0	0	114.7	K437	K437-V459 HydrophobicContact CD-CG1 4.49Å
460	S	94.8	Very high	96.1	Very high	45 Å²	45	28.6 Å²	28.6	32%	0.315	17%	0.169	S	C	.	.	S	Bend	trans	-158.7	-168.7	179.9	74	0	0	0	0	109.3	D357 T458 F462	D357-S460 WeakPolarHBondContact OD1-CB 3.23Å; D357-S460 PolarHBondContact OD1-OG 3.07Å; T458-S460 PolarHBondContact OG1-O 3.12Å; S460-F462 VanDerWaalsContact C-N 3.32Å; S460-F462 PolarHBondContact O-N 3.15Å
461	G	96.5	Very high	96	Very high	16 Å²	16	26.3 Å²	26.3	17%	0.165	15%	0.152	C	C	.	.			trans	71.9	20.4	174.5	0	0	0	0	0	115	V356 D357 T379 F463	V356-G461 PolarHBondContact O-N 2.99Å; D357-G461 WeakPolarHBondContact OD1-CA 3.27Å; D357-G461 PolarHBondContact OD1-N 3.5Å; T379-G461 VanDerWaalsContact CA-O 3.3Å; T379-G461 WeakPolarHBondContact CA-O 3.32Å; T379-G461 WeakPolarHBondContact CB-O 3.41Å; G461-F463 WeakPolarHBondContact O-CD2 3.36Å; G461-F463 WeakPolarHBondContact O-CE2 3.3Å
462	F	98.4	Very high	96	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-84.5	145.2	-172.9	-72.5	-77.2	0	0	0	112.9	V356 W377 T379 L432 L434 M439 V454 F455 T458 S460	V356-F462 WeakPolarHBondContact CB-O 3.26Å; V356-F462 PolarHBondContact N-O 3.13Å; V356-F462 PolarHBondContact O-N 2.87Å; W377-F462 HydrophobicContact CB-CD1 4.05Å; W377-F462 HydrophobicContact CE3-CB 4.14Å; T379-F462 HydrophobicContact CG2-CD1 3.98Å; T379-F462 HydrophobicContact CG2-CE1 4.09Å; T379-F462 HydrophobicContact CG2-CG 4.42Å; L432-F462 HydrophobicContact CD1-CD2 4.43Å; L432-F462 HydrophobicContact CD2-CB 3.67Å; L432-F462 HydrophobicContact CD2-CD2 3.99Å; L432-F462 HydrophobicContact CD2-CG 3.99Å; L434-F462 HydrophobicContact CD2-CD2 3.81Å; L434-F462 HydrophobicContact CD2-CE2 3.86Å; M439-F462 HydrophobicContact CE-CD1 3.81Å; M439-F462 HydrophobicContact CE-CE1 3.39Å; M439-F462 HydrophobicContact CE-CE2 4.37Å; M439-F462 HydrophobicContact CE-CG 4.45Å; M439-F462 HydrophobicContact CE-CZ 3.68Å; V454-F462 HydrophobicContact CG1-CZ 4.43Å; V454-F462 HydrophobicContact CG2-CE1 4.11Å; V454-F462 HydrophobicContact CG2-CZ 4.26Å; F455-F462 HydrophobicContact CD1-CE2 4.49Å; F455-F462 AromaticContact CE1-CE2 3.78Å; F455-F462 HydrophobicContact CE1-CE2 3.78Å; F455-F462 HydrophobicContact CE1-CZ 4.09Å; F455-F462 HydrophobicContact CZ-CE2 4.32Å; F455-F462 HydrophobicContact CZ-CZ 4.41Å; T458-F462 HydrophobicContact CG2-CE1 3.97Å; T458-F462 HydrophobicContact CG2-CZ 3.71Å; S460-F462 VanDerWaalsContact C-N 3.32Å; S460-F462 PolarHBondContact O-N 3.15Å
463	F	98.7	Very high	96	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.013	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.2	172.7	-63.7	-101.3	0	0	0	108.4	R351 C352 F354 C355 W377 A378 R380 G461	R351-F463 HydrophobicContact CB-CB 4.14Å; R351-F463 HydrophobicContact CB-CG 4.49Å; R351-F463 HydrophobicContact CG-CB 4.08Å; C352-F463 VanDerWaalsContact O-CD1 3.29Å; C352-F463 WeakPolarHBondContact O-CD1 3.21Å; F354-F463 VanDerWaalsContact O-CD1 3.22Å; F354-F463 WeakPolarHBondContact O-CD1 3.45Å; C355-F463 HydrophobicContact CB-CE1 3.77Å; C355-F463 HydrophobicContact CB-CE2 4.05Å; C355-F463 HydrophobicContact CB-CZ 3.44Å; C355-F463 VanDerWaalsContact CB-CZ 3.44Å; C355-F463 VanDerWaalsContact SG-CZ 3.6Å; W377-F463 WeakPolarHBondContact CA-O 3.2Å; A378-F463 PolarHBondContact N-O 3.04Å; A378-F463 VanDerWaalsContact N-O 3.11Å; A378-F463 PolarHBondContact O-N 3.22Å; R380-F463 HydrophobicContact CG-CE2 3.76Å; R380-F463 HydrophobicContact CG-CZ 4.18Å; G461-F463 WeakPolarHBondContact O-CD2 3.36Å; G461-F463 WeakPolarHBondContact O-CE2 3.3Å
464	A	98.7	Very high	96.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.9	160.4	0	0	0	0	0	109	C352 Y363 F478 F494	C352-A464 HydrophobicContact CB-CB 4.23Å; C352-A464 WeakPolarHBondContact CB-O 3.49Å; C352-A464 PolarHBondContact N-O 3.03Å; C352-A464 PolarHBondContact SG-N 3.29Å; C352-A464 VanDerWaalsContact SG-N 3.44Å; Y363-A464 HydrophobicContact CD1-CB 3.77Å; Y363-A464 HydrophobicContact CD2-CB 4.39Å; Y363-A464 HydrophobicContact CE1-CB 3.36Å; Y363-A464 HydrophobicContact CE2-CB 4.05Å; Y363-A464 HydrophobicContact CG-CB 4.27Å; A464-F478 HydrophobicContact CB-CE1 3.68Å; A464-F478 HydrophobicContact CB-CZ 4.49Å; A464-F494 HydrophobicContact CB-CE1 4.03Å; A464-F494 HydrophobicContact CB-CZ 3.72Å
465	A	98.5	Very high	96.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.6	-169.9	0	0	0	0	0	112.2	V350 R351 G376 A378 I392	V350-A465 CarbonylContact O-C 3.57Å; V350-A465 WeakPolarHBondContact O-CA 3.31Å; V350-A465 WeakPolarHBondContact O-CB 3.2Å; R351-A465 HydrophobicContact CG-CB 3.97Å; G376-A465 PolarHBondContact N-O 3.46Å; G376-A465 PolarHBondContact O-N 3.11Å; A378-A465 HydrophobicContact CB-CB 4.02Å; I392-A465 VanDerWaalsContact CD1-C 3.44Å; I392-A465 HydrophobicContact CD1-CB 3.4Å; I392-A465 VanDerWaalsContact CD1-CB 3.4Å; I392-A465 HydrophobicContact CG1-CB 4.23Å
466	A	98.6	Very high	96.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.9	172.1	0	0	0	0	0	114.1	S349 V350 Q374 I375 F468 F476	S349-A466 CarbonylContact C-O 3.55Å; S349-A466 WeakPolarHBondContact CA-O 3.37Å; V350-A466 PolarHBondContact N-O 3.18Å; V350-A466 PolarHBondContact O-N 3.09Å; Q374-A466 CarbonylContact O-C 3.55Å; Q374-A466 VanDerWaalsContact O-CA 3.31Å; Q374-A466 WeakPolarHBondContact O-CA 3.38Å; I375-A466 HydrophobicContact CB-CB 4.4Å; I375-A466 HydrophobicContact CG1-CB 4.01Å; I375-A466 HydrophobicContact CG2-CB 4.23Å; A466-F468 HydrophobicContact CB-CD2 4.34Å; A466-F468 HydrophobicContact CB-CE2 3.55Å; A466-F468 HydrophobicContact CB-CZ 3.87Å; A466-F476 HydrophobicContact CB-CE1 4.16Å; A466-F476 HydrophobicContact CB-CZ 3.57Å
467	S	98.3	Very high	96.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.3	175.2	-56	0	0	0	0	109.8	E348 S349 M373 Q374 G391 I392	E348-S467 CarbonylContact O-C 3.48Å; E348-S467 WeakPolarHBondContact O-CA 3.39Å; S349-S467 WeakPolarHBondContact CB-OG 3.44Å; S349-S467 VanDerWaalsContact OG-CB 3.31Å; S349-S467 WeakPolarHBondContact OG-CB 3.47Å; S349-S467 PolarHBondContact OG-OG 3.38Å; M373-S467 CarbonylContact C-O 3.58Å; M373-S467 VanDerWaalsContact CA-O 3.29Å; M373-S467 WeakPolarHBondContact CA-O 3.3Å; Q374-S467 PolarHBondContact N-O 3.43Å; Q374-S467 PolarHBondContact O-N 3.14Å; G391-S467 VanDerWaalsContact CA-OG 3.29Å; G391-S467 WeakPolarHBondContact CA-OG 3.48Å; I392-S467 WeakPolarHBondContact CD1-OG 3.36Å; I392-S467 WeakPolarHBondContact CG1-OG 3.34Å; I392-S467 PolarHBondContact N-OG 2.99Å
468	F	97.4	Very high	97	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124	-165.1	-64.3	-101.1	0	0	0	111.5	L331 A340 C342 F347 E348 V350 M373 A466 Q472 C474 F476	L331-F468 HydrophobicContact CD1-CB 4.19Å; L331-F468 HydrophobicContact CD1-CD2 3.61Å; L331-F468 HydrophobicContact CD1-CE2 4.12Å; L331-F468 HydrophobicContact CD1-CG 3.94Å; L331-F468 HydrophobicContact CD2-CD2 4.24Å; L331-F468 HydrophobicContact CD2-CE2 4.11Å; A340-F468 HydrophobicContact CB-CE2 4.42Å; A340-F468 HydrophobicContact CB-CZ 4.04Å; C342-F468 HydrophobicContact CB-CB 3.55Å; C342-F468 HydrophobicContact CB-CG 4.49Å; F347-F468 VanDerWaalsContact CD2-C 3.41Å; F347-F468 WeakPolarHBondContact CD2-O 3.38Å; E348-F468 PolarHBondContact N-O 3.29Å; E348-F468 PolarHBondContact O-N 3.05Å; V350-F468 HydrophobicContact CG1-CE2 4.07Å; M373-F468 HydrophobicContact CG-CD1 3.84Å; M373-F468 HydrophobicContact CG-CE1 4.4Å; M373-F468 HydrophobicContact CG-CG 4.45Å; M373-F468 HydrophobicContact SD-CD1 3.61Å; M373-F468 HydrophobicContact SD-CE1 3.68Å; A466-F468 HydrophobicContact CB-CD2 4.34Å; A466-F468 HydrophobicContact CB-CE2 3.55Å; A466-F468 HydrophobicContact CB-CZ 3.87Å; F468-Q472 HydrophobicContact CD1-CB 4.39Å; F468-C474 WeakPolarHBondContact CE1-SG 3.3Å; F468-C474 VanDerWaalsContact CZ-SG 3.59Å; F468-F476 HydrophobicContact CZ-CE2 4.2Å; F468-F476 HydrophobicContact CZ-CZ 4.29Å
469	M	94	Very high	97.3	Very high	54 Å²	54	12.1 Å²	12.1	27%	0.266	8%	0.077	S	C	.	.			trans	-71.7	166.9	164.7	-158.7	-177.1	-172.4	0	0	110.1	A158 F347 V372 Y471 Q472	A158-M469 HydrophobicContact CB-CE 4.17Å; A158-M469 HydrophobicContact CB-SD 4.37Å; F347-M469 HydrophobicContact CD2-CB 4.43Å; F347-M469 HydrophobicContact CE2-CB 4.49Å; V372-M469 HydrophobicContact CB-CB 4.01Å; V372-M469 HydrophobicContact CB-SD 3.9Å; V372-M469 HydrophobicContact CG1-CB 4.47Å; V372-M469 HydrophobicContact CG2-SD 4.15Å; V372-M469 WeakPolarHBondContact O-CB 3.44Å; V372-M469 PolarHBondContact O-N 3.23Å; V372-M469 VanDerWaalsContact O-N 3.12Å; M469-Y471 PolarHBondContact O-N 3.18Å; M469-Q472 HydrophobicContact CB-CG 4.27Å; M469-Q472 WeakPolarHBondContact O-CB 3.5Å; M469-Q472 WeakPolarHBondContact O-CG 3.35Å; M469-Q472 PolarHBondContact O-N 3.44Å
470	S	93	Very high	97.4	Very high	4 Å²	4	10 Å²	10	3%	0.028	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	134.1	174.2	-45.8	0	0	0	0	113.5	A344 S345 Q472	A344-S470 WeakPolarHBondContact O-CA 3.33Å; A344-S470 WeakPolarHBondContact O-CB 3.34Å; A344-S470 PolarHBondContact O-OG 3.11Å; S345-S470 WeakPolarHBondContact CA-OG 3.16Å; S470-Q472 PolarHBondContact O-N 3.07Å; S470-Q472 PolarHBondContact O-NE2 3.49Å
471	Y	96.1	Very high	97.5	Very high	12 Å²	12	11.7 Å²	11.7	5%	0.047	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	10.2	174.7	-41.4	-59.3	0	0	0	116	P157 T161 F245 I248 R341 C342 D343 M469	P157-Y471 HydrophobicContact CB-CD2 3.7Å; P157-Y471 HydrophobicContact CB-CE2 3.89Å; T161-Y471 VanDerWaalsContact OG1-CE2 3.25Å; T161-Y471 WeakPolarHBondContact OG1-CE2 3.43Å; T161-Y471 PolarHBondContact OG1-OH 2.92Å; F245-Y471 AromaticContact CE1-CD1 3.7Å; F245-Y471 HydrophobicContact CE1-CD1 3.7Å; F245-Y471 AromaticContact CE1-CD2 3.9Å; F245-Y471 HydrophobicContact CE1-CD2 3.9Å; F245-Y471 AromaticContact CE1-CE1 3.72Å; F245-Y471 HydrophobicContact CE1-CE1 3.72Å; F245-Y471 AromaticContact CE1-CE2 3.87Å; F245-Y471 HydrophobicContact CE1-CE2 3.87Å; F245-Y471 AromaticContact CE1-CG 3.79Å; F245-Y471 HydrophobicContact CE1-CG 3.79Å; F245-Y471 AromaticContact CE1-CZ 3.79Å; F245-Y471 AromaticContact CZ-CD1 3.9Å; F245-Y471 HydrophobicContact CZ-CD1 3.9Å; F245-Y471 AromaticContact CZ-CD2 3.9Å; F245-Y471 HydrophobicContact CZ-CD2 3.9Å; F245-Y471 HydrophobicContact CZ-CE1 4.38Å; F245-Y471 HydrophobicContact CZ-CE2 4.34Å; F245-Y471 AromaticContact CZ-CG 3.64Å; F245-Y471 HydrophobicContact CZ-CG 3.64Å; I248-Y471 HydrophobicContact CD1-CD1 4.06Å; I248-Y471 HydrophobicContact CD1-CE1 4.4Å; I248-Y471 HydrophobicContact CG2-CE1 4.22Å; R341-Y471 PolarHBondContact NH1-O 3.1Å; R341-Y471 PolarHBondContact NH2-O 2.97Å; C342-Y471 CarbonylContact O-C 3.54Å; C342-Y471 WeakPolarHBondContact O-CA 3.3Å; C342-Y471 PolarHBondContact O-N 2.71Å; D343-Y471 HydrophobicContact CB-CD1 4.39Å; D343-Y471 WeakPolarHBondContact OD1-CD1 3.11Å; M469-Y471 PolarHBondContact O-N 3.18Å
472	Q	97.3	Very high	97.5	Very high	4 Å²	4	16.8 Å²	16.8	2%	0.019	10%	0.099	C	C	.	.			trans	-92.3	148.9	-177.3	-53	-46.5	-51.6	0	0	114	R341 C342 T369 V372 M373 F468 M469 S470	R341-Q472 CarbonylContact C-O 3.59Å; R341-Q472 VanDerWaalsContact CA-O 3.26Å; R341-Q472 WeakPolarHBondContact CA-O 3.27Å; C342-Q472 PolarHBondContact N-O 3.28Å; C342-Q472 PolarHBondContact O-N 3.36Å; T369-Q472 VanDerWaalsContact CB-OE1 3.25Å; T369-Q472 VanDerWaalsContact OG1-CA 3.24Å; T369-Q472 WeakPolarHBondContact OG1-CA 3.21Å; T369-Q472 PolarHBondContact OG1-OE1 2.89Å; V372-Q472 WeakPolarHBondContact O-CG 3.46Å; M373-Q472 HydrophobicContact CE-CB 4.49Å; M373-Q472 HydrophobicContact CG-CB 3.63Å; M373-Q472 HydrophobicContact CG-CG 4.18Å; M373-Q472 HydrophobicContact SD-CB 3.87Å; F468-Q472 HydrophobicContact CD1-CB 4.39Å; M469-Q472 HydrophobicContact CB-CG 4.27Å; M469-Q472 WeakPolarHBondContact O-CB 3.5Å; M469-Q472 WeakPolarHBondContact O-CG 3.35Å; M469-Q472 PolarHBondContact O-N 3.44Å; S470-Q472 PolarHBondContact O-N 3.07Å; S470-Q472 PolarHBondContact O-NE2 3.49Å
473	Q	98.5	Very high	97.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	142.5	-172.9	-173.1	167.3	-26.8	0	0	112.4	E339 A340 R341 V368 T369	E339-Q473 HydrophobicContact CG-CG 4.29Å; E339-Q473 PolarHBondContact OE1-NE2 3.36Å; A340-Q473 VanDerWaalsContact O-CA 3.32Å; A340-Q473 WeakPolarHBondContact O-CA 3.44Å; A340-Q473 WeakPolarHBondContact O-CG 3.34Å; R341-Q473 HydrophobicContact CB-CB 4.16Å; R341-Q473 HydrophobicContact CB-CG 4.02Å; R341-Q473 VanDerWaalsContact CD-OE1 3.24Å; R341-Q473 HydrophobicContact CG-CB 4.11Å; R341-Q473 HydrophobicContact CG-CG 4.38Å; V368-Q473 HydrophobicContact CB-CB 4.05Å; V368-Q473 HydrophobicContact CB-CG 3.94Å; V368-Q473 WeakPolarHBondContact CB-O 3.34Å; V368-Q473 HydrophobicContact CG1-CB 4.09Å; V368-Q473 HydrophobicContact CG1-CG 3.85Å; V368-Q473 HydrophobicContact CG2-CG 4.47Å; V368-Q473 PolarHBondContact N-O 3.11Å; V368-Q473 VanDerWaalsContact N-O 3.11Å; T369-Q473 HydrophobicContact CG2-CB 4.25Å; T369-Q473 PolarHBondContact N-O 2.77Å; T369-Q473 PolarHBondContact OG1-N 3.45Å
474	C	98.6	Very high	97.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	159.5	172.2	72.5	0	0	0	0	113.5	E339 A340 V365 T366 M373 F468 F476	E339-C474 WeakPolarHBondContact CA-O 3.41Å; A340-C474 PolarHBondContact N-O 3.23Å; A340-C474 VanDerWaalsContact N-O 3.13Å; A340-C474 PolarHBondContact O-N 2.86Å; A340-C474 VanDerWaalsContact O-N 3.15Å; V365-C474 HydrophobicContact CG1-CB 3.57Å; V365-C474 VanDerWaalsContact CG1-SG 3.56Å; T366-C474 WeakPolarHBondContact O-CA 3.25Å; T366-C474 WeakPolarHBondContact O-CB 3.21Å; M373-C474 HydrophobicContact CE-CB 4.49Å; M373-C474 HydrophobicContact SD-CB 4.13Å; F468-C474 WeakPolarHBondContact CE1-SG 3.3Å; F468-C474 VanDerWaalsContact CZ-SG 3.59Å; C474-F476 WeakPolarHBondContact SG-CE2 3.44Å
475	E	98.7	Very high	97.5	Very high	24 Å²	24	27.1 Å²	27.1	11%	0.112	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.7	-179.3	-171.7	-160.1	159.7	0	0	112.1	R287 L338 E339 V365 T366 K481	R287-E475 IonicContact CZ-OE2 2.96Å; R287-E475 VanDerWaalsContact CZ-OE2 3.29Å; R287-E475 IonicContact NH1-OE2 2.81Å; R287-E475 PolarHBondContact NH1-OE2 2.64Å; R287-E475 VanDerWaalsContact NH2-CD 3.26Å; R287-E475 IonicContact NH2-OE2 2.73Å; R287-E475 PolarHBondContact NH2-OE2 3.12Å; L338-E475 CarbonylContact O-C 3.59Å; L338-E475 WeakPolarHBondContact O-CA 3.3Å; E339-E475 HydrophobicContact CB-CB 4.35Å; E339-E475 HydrophobicContact CB-CG 4.27Å; E339-E475 HydrophobicContact CG-CB 4.35Å; V365-E475 CarbonylContact C-O 3.57Å; V365-E475 WeakPolarHBondContact CA-O 3.31Å; T366-E475 PolarHBondContact N-O 2.8Å; T366-E475 PolarHBondContact O-N 3.4Å; E475-K481 IonicContact OE1-NZ 2.64Å; E475-K481 PolarHBondContact OE1-NZ 2.92Å; E475-K481 IonicContact OE2-NZ 3.24Å; E475-K481 PolarHBondContact OE2-NZ 2.8Å
476	F	98.8	Very high	97.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	136.9	177.4	-61.2	-102	0	0	0	111.9	L322 L338 Y363 V365 I375 A466 F468 C474 F478	L322-F476 HydrophobicContact CD1-CD2 3.75Å; L322-F476 HydrophobicContact CD1-CE2 3.77Å; L322-F476 HydrophobicContact CD2-CD1 4.27Å; L322-F476 HydrophobicContact CD2-CD2 3.95Å; L322-F476 HydrophobicContact CD2-CE1 4.26Å; L322-F476 HydrophobicContact CD2-CE2 3.96Å; L322-F476 HydrophobicContact CD2-CG 4.15Å; L322-F476 HydrophobicContact CD2-CZ 4.12Å; L322-F476 HydrophobicContact CG-CD2 4.1Å; L322-F476 HydrophobicContact CG-CE2 4.35Å; L338-F476 WeakPolarHBondContact CB-O 3.4Å; L338-F476 WeakPolarHBondContact O-CD2 3.41Å; L338-F476 PolarHBondContact O-N 3.01Å; Y363-F476 HydrophobicContact CD2-CD1 4.37Å; Y363-F476 HydrophobicContact CE2-CD1 4.03Å; Y363-F476 HydrophobicContact CE2-CE1 4.31Å; V365-F476 HydrophobicContact CG2-CD1 3.5Å; V365-F476 VanDerWaalsContact CG2-CD1 3.5Å; V365-F476 HydrophobicContact CG2-CE1 3.68Å; V365-F476 HydrophobicContact CG2-CG 4.09Å; V365-F476 HydrophobicContact CG2-CZ 4.39Å; I375-F476 HydrophobicContact CG2-CE1 4.31Å; A466-F476 HydrophobicContact CB-CE1 4.16Å; A466-F476 HydrophobicContact CB-CZ 3.57Å; F468-F476 HydrophobicContact CZ-CE2 4.2Å; F468-F476 HydrophobicContact CZ-CZ 4.29Å; C474-F476 WeakPolarHBondContact SG-CE2 3.44Å; F476-F478 HydrophobicContact CB-CD2 4.31Å; F476-F478 HydrophobicContact CB-CE1 4.19Å; F476-F478 HydrophobicContact CB-CE2 3.69Å; F476-F478 HydrophobicContact CB-CZ 3.61Å; F476-F478 HydrophobicContact CD1-CE1 4.08Å; F476-F478 AromaticContact CD1-CZ 3.71Å; F476-F478 HydrophobicContact CD1-CZ 3.71Å; F476-F478 HydrophobicContact CG-CE2 4.27Å; F476-F478 AromaticContact CG-CZ 3.83Å; F476-F478 HydrophobicContact CG-CZ 3.83Å
477	N	98.7	Very high	97.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	105	165.3	-179.1	16.5	0	0	0	109.4	Y363 E364 G479 A480 K481 F483	Y363-N477 WeakPolarHBondContact CB-O 3.2Å; E364-N477 HydrophobicContact CB-CB 4.27Å; E364-N477 PolarHBondContact N-O 3.29Å; E364-N477 VanDerWaalsContact N-O 3.13Å; E364-N477 PolarHBondContact O-N 3.45Å; N477-G479 PolarHBondContact O-N 2.89Å; N477-G479 PolarHBondContact OD1-N 3.44Å; N477-A480 PolarHBondContact OD1-N 3.31Å; N477-K481 HydrophobicContact CB-CG 4.28Å; N477-K481 VanDerWaalsContact CG-CG 3.49Å; N477-K481 WeakPolarHBondContact ND2-CG 3.44Å; N477-K481 PolarHBondContact ND2-O 2.83Å; N477-K481 WeakPolarHBondContact OD1-CG 3.41Å; N477-K481 PolarHBondContact OD1-N 3.45Å; N477-K481 PolarHBondContact OD1-O 2.79Å; N477-F483 HydrophobicContact CB-CE1 4.45Å; N477-F483 VanDerWaalsContact ND2-CD1 3.3Å; N477-F483 WeakPolarHBondContact ND2-CD1 3.4Å; N477-F483 WeakPolarHBondContact O-CE1 3.22Å
478	F	98.7	Very high	97.1	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-84.4	8.8	176.2	-66.3	-52.8	0	0	0	113.7	A320 L322 L338 C352 Y363 A464 F476 F494 N495	A320-F478 HydrophobicContact CB-CB 4.12Å; A320-F478 HydrophobicContact CB-CG 4.35Å; A320-F478 WeakPolarHBondContact O-CD2 3.47Å; L322-F478 HydrophobicContact CD2-CE2 4.4Å; L322-F478 HydrophobicContact CD2-CZ 4.08Å; L338-F478 HydrophobicContact CD2-CD2 3.56Å; L338-F478 HydrophobicContact CD2-CE2 4.01Å; C352-F478 HydrophobicContact CB-CE1 4.08Å; C352-F478 HydrophobicContact CB-CE2 4.4Å; C352-F478 HydrophobicContact CB-CZ 3.8Å; Y363-F478 HydrophobicContact CD2-CD1 4.5Å; Y363-F478 HydrophobicContact CD2-CE1 4.18Å; Y363-F478 HydrophobicContact CG-CD1 4.4Å; Y363-F478 HydrophobicContact CG-CE1 4.4Å; A464-F478 HydrophobicContact CB-CE1 3.68Å; A464-F478 HydrophobicContact CB-CZ 4.49Å; F476-F478 HydrophobicContact CB-CD2 4.31Å; F476-F478 HydrophobicContact CB-CE1 4.19Å; F476-F478 HydrophobicContact CB-CE2 3.69Å; F476-F478 HydrophobicContact CB-CZ 3.61Å; F476-F478 HydrophobicContact CD1-CE1 4.08Å; F476-F478 AromaticContact CD1-CZ 3.71Å; F476-F478 HydrophobicContact CD1-CZ 3.71Å; F476-F478 HydrophobicContact CG-CE2 4.27Å; F476-F478 AromaticContact CG-CZ 3.83Å; F476-F478 HydrophobicContact CG-CZ 3.83Å; F478-F494 HydrophobicContact CB-CB 3.99Å; F478-F494 HydrophobicContact CD1-CD1 4.49Å; F478-F494 HydrophobicContact CD1-CD2 4.31Å; F478-F494 HydrophobicContact CD1-CG 4.24Å; F478-F494 WeakPolarHBondContact O-CB 3.3Å; F478-F494 PolarHBondContact O-N 2.93Å; F478-N495 WeakPolarHBondContact O-CB 3.44Å; F478-N495 PolarHBondContact O-N 2.76Å
479	G	97.9	Very high	97	Very high	20 Å²	20	41.2 Å²	41.2	21%	0.206	23%	0.232	C	C	.	.	S	Bend	trans	103.7	3.9	-171.7	0	0	0	0	0	113.9	N477 K481	N477-G479 PolarHBondContact O-N 2.89Å; N477-G479 PolarHBondContact OD1-N 3.44Å; G479-K481 VanDerWaalsContact C-N 3.27Å; G479-K481 PolarHBondContact O-N 3.47Å
480	A	95.8	Very high	97.1	Very high	27 Å²	27	48 Å²	48	22%	0.223	26%	0.26	C	S	.	.	S	Bend	trans	-72.7	-19.2	177	0	0	0	0	0	113.3	I318 L338 N477	I318-A480 HydrophobicContact CD1-CB 3.98Å; L338-A480 HydrophobicContact CD1-CB 4.37Å; N477-A480 PolarHBondContact OD1-N 3.31Å
481	K	95.6	Very high	97.3	Very high	80 Å²	80	50.6 Å²	50.6	35%	0.348	27%	0.271	S	S	.	.	S	Bend	trans	-129.7	156	167.5	63.8	-175	-177.8	-177.3	0	109.4	E475 N477 G479 F483	E475-K481 IonicContact OE1-NZ 2.64Å; E475-K481 PolarHBondContact OE1-NZ 2.92Å; E475-K481 IonicContact OE2-NZ 3.24Å; E475-K481 PolarHBondContact OE2-NZ 2.8Å; N477-K481 HydrophobicContact CB-CG 4.28Å; N477-K481 VanDerWaalsContact CG-CG 3.49Å; N477-K481 WeakPolarHBondContact ND2-CG 3.44Å; N477-K481 PolarHBondContact ND2-O 2.83Å; N477-K481 WeakPolarHBondContact OD1-CG 3.41Å; N477-K481 PolarHBondContact OD1-N 3.45Å; N477-K481 PolarHBondContact OD1-O 2.79Å; G479-K481 VanDerWaalsContact C-N 3.27Å; G479-K481 PolarHBondContact O-N 3.47Å; K481-F483 PolarHBondContact O-N 2.78Å
482	P	97.4	Very high	97.4	Very high	124 Å²	124	51.3 Å²	51.3	81%	0.805	28%	0.277	S	S	*	.			trans	-55.3	139.2	176.6	-25.6	35	0	0	0	112.1
483	F	98.6	Very high	97.5	Very high	32 Å²	32	51.8 Å²	51.8	14%	0.14	28%	0.28	C	S	.	.			trans	-68	144.9	174.3	-63	-61.9	0	0	0	111.4	Y362 E364 N477 K481 P486 F491 T493	Y362-F483 HydrophobicContact CD1-CD1 4.15Å; Y362-F483 HydrophobicContact CD1-CD2 4.08Å; Y362-F483 HydrophobicContact CD1-CE1 4.1Å; Y362-F483 HydrophobicContact CD1-CE2 4.03Å; Y362-F483 HydrophobicContact CD1-CG 4.14Å; Y362-F483 HydrophobicContact CD1-CZ 4.04Å; Y362-F483 HydrophobicContact CE1-CB 4.47Å; Y362-F483 HydrophobicContact CE1-CD1 4.07Å; Y362-F483 HydrophobicContact CE1-CD2 4.43Å; Y362-F483 HydrophobicContact CE1-CE1 4.41Å; Y362-F483 HydrophobicContact CE1-CG 4.08Å; E364-F483 HydrophobicContact CB-CD1 4.02Å; E364-F483 HydrophobicContact CB-CE1 4.42Å; E364-F483 HydrophobicContact CG-CB 4.47Å; E364-F483 HydrophobicContact CG-CD1 3.61Å; E364-F483 HydrophobicContact CG-CE1 4.3Å; E364-F483 HydrophobicContact CG-CG 4.4Å; E364-F483 VanDerWaalsContact OE2-CA 3.24Å; E364-F483 WeakPolarHBondContact OE2-CA 3.33Å; N477-F483 HydrophobicContact CB-CE1 4.45Å; N477-F483 VanDerWaalsContact ND2-CD1 3.3Å; N477-F483 WeakPolarHBondContact ND2-CD1 3.4Å; N477-F483 WeakPolarHBondContact O-CE1 3.22Å; K481-F483 PolarHBondContact O-N 2.78Å; F483-P486 HydrophobicContact CB-CB 4.08Å; F483-P486 HydrophobicContact CB-CG 4.39Å; F483-F491 HydrophobicContact CD2-CE2 4.06Å; F483-F491 HydrophobicContact CD2-CZ 4.26Å; F483-F491 AromaticContact CE2-CE2 3.78Å; F483-F491 HydrophobicContact CE2-CE2 3.78Å; F483-F491 HydrophobicContact CE2-CZ 4.44Å; F483-T493 HydrophobicContact CE2-CG2 3.61Å; F483-T493 HydrophobicContact CZ-CG2 4.1Å
484	K	98.4	Very high	97.4	Very high	107 Å²	107	51.8 Å²	51.8	47%	0.465	28%	0.28	S	S	.	.	S	Bend	trans	-82.6	-33.4	-179.1	-170.9	-175.8	167.5	-164.1	0	111.7	E364 G425 T427	E364-K484 PolarHBondContact OE1-N 2.82Å; E364-K484 VanDerWaalsContact OE1-N 3.12Å; E364-K484 PolarHBondContact OE2-N 2.72Å; G425-K484 PolarHBondContact O-NZ 2.94Å; T427-K484 HydrophobicContact CG2-CB 4.44Å; T427-K484 HydrophobicContact CG2-CD 4.36Å; T427-K484 VanDerWaalsContact OG1-CD 3.26Å; T427-K484 WeakPolarHBondContact OG1-CD 3.46Å; T427-K484 PolarHBondContact OG1-NZ 3.25Å
485	Y	98.4	Very high	97.4	Very high	80 Å²	80	52.6 Å²	52.6	31%	0.314	29%	0.285	S	S	.	.	S	Bend	trans	-138.7	59.8	-179.4	-55.3	-75.3	0	0	0	112	Y362 E364 T427 N444	Y362-Y485 PolarHBondContact OH-O 3.16Å; Y362-Y485 VanDerWaalsContact OH-O 3.08Å; E364-Y485 WeakPolarHBondContact OE1-CA 3.3Å; E364-Y485 PolarHBondContact OE1-N 3.36Å; T427-Y485 HydrophobicContact CG2-CD2 4.24Å; N444-Y485 HydrophobicContact CB-CD2 4.38Å; N444-Y485 HydrophobicContact CB-CE1 4.39Å; N444-Y485 HydrophobicContact CB-CE2 3.81Å; N444-Y485 WeakPolarHBondContact OD1-CE2 3.29Å
486	P	97.7	Very high	97.2	Very high	73 Å²	73	56.7 Å²	56.7	47%	0.474	31%	0.307	S	S	.	.			trans	-61.6	138.7	178.6	26.5	-34.1	0	0	0	111.7	F483 F491	F483-P486 HydrophobicContact CB-CB 4.08Å; F483-P486 HydrophobicContact CB-CG 4.39Å; P486-F491 HydrophobicContact CB-CE1 4.26Å; P486-F491 HydrophobicContact CB-CZ 3.94Å
487	P	96.6	Very high	97.2	Very high	20 Å²	20	63.6 Å²	63.6	13%	0.13	34%	0.335	C	S	.	.			trans	-69.6	159.8	178.2	28.7	-34.9	0	0	0	111.6	Y362 L431 F442 M489 F491	Y362-P487 HydrophobicContact CD1-CG 4.5Å; Y362-P487 HydrophobicContact CD2-CG 3.91Å; Y362-P487 HydrophobicContact CE2-CG 3.98Å; Y362-P487 HydrophobicContact CG-CG 4.17Å; L431-P487 HydrophobicContact CD1-CB 4.45Å; L431-P487 HydrophobicContact CD1-CG 3.83Å; F442-P487 HydrophobicContact CE1-CB 4.09Å; F442-P487 HydrophobicContact CZ-CB 3.9Å; P487-M489 VanDerWaalsContact C-N 3.31Å; P487-M489 PolarHBondContact O-N 3Å; P487-F491 HydrophobicContact CG-CD1 3.7Å; P487-F491 HydrophobicContact CG-CE1 3.72Å
488	S	94.1	Very high	97.1	Very high	136 Å²	136	63.6 Å²	63.6	95%	0.951	34%	0.335	S	S	*	.	S	Bend	trans	-77.2	-11.3	-175.5	56	0	0	0	0	114.9
489	M	93.7	Very high	97	Very high	68 Å²	68	70.5 Å²	70.5	34%	0.335	37%	0.365	S	S	.	.	S	Bend	trans	-85.4	166.2	174.3	70.8	-170.1	-64.6	0	0	111.7	V360 L431 P487 F491	V360-M489 HydrophobicContact CG1-CE 3.99Å; V360-M489 HydrophobicContact CG2-CE 4.41Å; L431-M489 HydrophobicContact CD1-CG 3.93Å; L431-M489 HydrophobicContact CD1-SD 3.56Å; L431-M489 VanDerWaalsContact CD1-SD 3.56Å; L431-M489 HydrophobicContact CD2-CE 4.42Å; L431-M489 HydrophobicContact CD2-SD 3.84Å; L431-M489 HydrophobicContact CG-SD 4.37Å; P487-M489 VanDerWaalsContact C-N 3.31Å; P487-M489 PolarHBondContact O-N 3Å; M489-F491 VanDerWaalsContact O-CD1 3.3Å; M489-F491 WeakPolarHBondContact O-CD1 3.42Å
490	K	96.8	Very high	96.9	Very high	196 Å²	196	70.2 Å²	70.2	85%	0.852	36%	0.359	S	S	*	.			trans	-78.2	138.2	173.1	-65.8	-174.7	178.9	-177	0	110.6
491	F	97.9	Very high	96.9	Very high	58 Å²	58	71.3 Å²	71.3	25%	0.254	36%	0.363	S	S	.	.			trans	-146	159.4	176.9	55.2	-93.8	0	0	0	110.1	V360 Y362 F483 P486 P487 M489 T493	V360-F491 HydrophobicContact CG1-CB 4.11Å; V360-F491 CarbonylContact O-C 2.99Å; V360-F491 WeakPolarHBondContact O-CA 3.29Å; Y362-F491 HydrophobicContact CD1-CE2 4.32Å; Y362-F491 HydrophobicContact CD1-CZ 4.42Å; Y362-F491 HydrophobicContact CG-CD2 4.45Å; F483-F491 HydrophobicContact CD2-CE2 4.06Å; F483-F491 HydrophobicContact CD2-CZ 4.26Å; F483-F491 AromaticContact CE2-CE2 3.78Å; F483-F491 HydrophobicContact CE2-CE2 3.78Å; F483-F491 HydrophobicContact CE2-CZ 4.44Å; P486-F491 HydrophobicContact CB-CE1 4.26Å; P486-F491 HydrophobicContact CB-CZ 3.94Å; P487-F491 HydrophobicContact CG-CD1 3.7Å; P487-F491 HydrophobicContact CG-CE1 3.72Å; M489-F491 VanDerWaalsContact O-CD1 3.3Å; M489-F491 WeakPolarHBondContact O-CD1 3.42Å; F491-T493 HydrophobicContact CD2-CG2 4.39Å; F491-T493 HydrophobicContact CE2-CG2 4.16Å
492	S	98.3	Very high	96.8	Very high	27 Å²	27	70.7 Å²	70.7	19%	0.189	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	151.5	165.1	-67.3	0	0	0	0	110.5	V360 W361 Y362 Y497	V360-S492 PolarHBondContact O-N 3.21Å; W361-S492 WeakPolarHBondContact CA-O 3.36Å; Y362-S492 PolarHBondContact N-O 3.04Å; Y362-S492 VanDerWaalsContact N-O 3.1Å; S492-Y497 WeakPolarHBondContact OG-CE2 3.42Å
493	T	97.6	Very high	96.5	Very high	14 Å²	14	71.3 Å²	71.3	9%	0.086	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	148.4	168.3	90.3	0	0	0	0	109.7	W361 F483 F491 N495 D496 Y497	W361-T493 WeakPolarHBondContact CZ3-O 3.29Å; F483-T493 HydrophobicContact CE2-CG2 3.61Å; F483-T493 HydrophobicContact CZ-CG2 4.1Å; F491-T493 HydrophobicContact CD2-CG2 4.39Å; F491-T493 HydrophobicContact CE2-CG2 4.16Å; T493-N495 PolarHBondContact O-N 2.93Å; T493-N495 PolarHBondContact OG1-N 2.98Å; T493-D496 WeakPolarHBondContact CB-OD2 3.45Å; T493-D496 VanDerWaalsContact CG2-OD2 3.26Å; T493-D496 WeakPolarHBondContact CG2-OD2 3.26Å; T493-D496 PolarHBondContact O-N 2.83Å; T493-D496 PolarHBondContact OG1-N 2.87Å; T493-D496 PolarHBondContact OG1-OD2 2.72Å; T493-Y497 WeakPolarHBondContact O-CD2 3.39Å
494	F	98.1	Very high	96.2	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.5	-41.1	176	-67.7	-113.6	0	0	0	110.5	A320 F354 V356 Y363 W377 A464 F478 D496 Y497 A498	A320-F494 HydrophobicContact CB-CB 3.73Å; F354-F494 HydrophobicContact CB-CD1 4.19Å; F354-F494 AromaticContact CD1-CD1 3.75Å; F354-F494 HydrophobicContact CD1-CD1 3.75Å; F354-F494 HydrophobicContact CD1-CE1 4.4Å; F354-F494 HydrophobicContact CD1-CG 4.45Å; F354-F494 HydrophobicContact CG-CD1 4.43Å; V356-F494 HydrophobicContact CG2-CE1 3.95Å; V356-F494 HydrophobicContact CG2-CZ 4.18Å; Y363-F494 AromaticContact CD1-CE2 3.75Å; Y363-F494 HydrophobicContact CD1-CE2 3.75Å; Y363-F494 HydrophobicContact CD1-CZ 4.06Å; Y363-F494 HydrophobicContact CG-CE2 4.19Å; W377-F494 AromaticContact CH2-CE2 3.84Å; W377-F494 HydrophobicContact CH2-CE2 3.84Å; W377-F494 AromaticContact CH2-CZ 3.57Å; W377-F494 HydrophobicContact CH2-CZ 3.57Å; W377-F494 HydrophobicContact CZ3-CE1 4.44Å; W377-F494 HydrophobicContact CZ3-CE2 4.28Å; W377-F494 AromaticContact CZ3-CZ 3.53Å; W377-F494 HydrophobicContact CZ3-CZ 3.53Å; A464-F494 HydrophobicContact CB-CE1 4.03Å; A464-F494 HydrophobicContact CB-CZ 3.72Å; F478-F494 HydrophobicContact CB-CB 3.99Å; F478-F494 HydrophobicContact CD1-CD1 4.49Å; F478-F494 HydrophobicContact CD1-CD2 4.31Å; F478-F494 HydrophobicContact CD1-CG 4.24Å; F478-F494 WeakPolarHBondContact O-CB 3.3Å; F478-F494 PolarHBondContact O-N 2.93Å; F494-D496 VanDerWaalsContact C-N 3.32Å; F494-D496 PolarHBondContact O-N 3.48Å; F494-Y497 PolarHBondContact O-N 2.98Å; F494-A498 WeakPolarHBondContact O-CB 3.3Å; F494-A498 PolarHBondContact O-N 3.28Å
495	N	96.8	Very high	96	Very high	18 Å²	18	71.1 Å²	71.1	10%	0.096	37%	0.365	C	S	.	.	H	α-helix	trans	-68.4	-26.5	-173.7	-152.5	72.4	0	0	0	113.9	S317 R319 F478 T493	S317-N495 PolarHBondContact O-ND2 3.14Å; S317-N495 PolarHBondContact O-OD1 2.83Å; R319-N495 WeakPolarHBondContact CB-O 3.4Å; R319-N495 WeakPolarHBondContact CB-OD1 3.38Å; R319-N495 WeakPolarHBondContact CD-O 3.44Å; R319-N495 PolarHBondContact N-OD1 3.29Å; R319-N495 PolarHBondContact NE-O 3.3Å; F478-N495 WeakPolarHBondContact O-CB 3.44Å; F478-N495 PolarHBondContact O-N 2.76Å; T493-N495 PolarHBondContact O-N 2.93Å; T493-N495 PolarHBondContact OG1-N 2.98Å
496	D	96.3	Very high	95.7	Very high	109 Å²	109	70.6 Å²	70.6	58%	0.583	37%	0.367	S	S	*	.	H	α-helix	trans	-72.3	-34	176.6	-64.6	-52.7	0	0	0	112.9	T493 F494	T493-D496 WeakPolarHBondContact CB-OD2 3.45Å; T493-D496 VanDerWaalsContact CG2-OD2 3.26Å; T493-D496 WeakPolarHBondContact CG2-OD2 3.26Å; T493-D496 PolarHBondContact O-N 2.83Å; T493-D496 PolarHBondContact OG1-N 2.87Å; T493-D496 PolarHBondContact OG1-OD2 2.72Å; F494-D496 VanDerWaalsContact C-N 3.32Å; F494-D496 PolarHBondContact O-N 3.48Å
497	Y	97.4	Very high	95.5	Very high	146 Å²	146	68.3 Å²	68.3	57%	0.573	35%	0.351	S	S	*	.	H	α-helix	trans	-105.4	-33.6	-170.8	-72.1	-92.5	0	0	0	113.8	W361 S492 T493 F494	W361-Y497 HydrophobicContact CH2-CD1 4.32Å; W361-Y497 AromaticContact CH2-CD2 3.72Å; W361-Y497 HydrophobicContact CH2-CD2 3.72Å; W361-Y497 HydrophobicContact CH2-CE2 4.48Å; W361-Y497 AromaticContact CH2-CG 3.63Å; W361-Y497 HydrophobicContact CH2-CG 3.63Å; W361-Y497 AromaticContact CZ3-CD2 3.89Å; W361-Y497 HydrophobicContact CZ3-CD2 3.89Å; W361-Y497 HydrophobicContact CZ3-CG 4.15Å; S492-Y497 WeakPolarHBondContact OG-CE2 3.42Å; T493-Y497 WeakPolarHBondContact O-CD2 3.39Å; F494-Y497 PolarHBondContact O-N 2.98Å
498	A	97.1	Very high	95.3	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.008	36%	0.358	C	S	.	.			trans	-66.5	158.4	-178.4	0	0	0	0	0	112.3	R319 A320 F354 F494	R319-A498 VanDerWaalsContact CZ-O 3.24Å; R319-A498 PolarHBondContact NE-O 3.05Å; R319-A498 PolarHBondContact NH2-O 2.89Å; R319-A498 WeakPolarHBondContact O-CB 3.42Å; A320-A498 HydrophobicContact CB-CB 3.86Å; F354-A498 HydrophobicContact CB-CB 3.93Å; F354-A498 HydrophobicContact CD1-CB 4.39Å; F354-A498 HydrophobicContact CD2-CB 3.39Å; F354-A498 HydrophobicContact CE2-CB 3.94Å; F354-A498 HydrophobicContact CG-CB 3.64Å; F494-A498 WeakPolarHBondContact O-CB 3.3Å; F494-A498 PolarHBondContact O-N 3.28Å
499	F	96	Very high	95.2	Very high	144 Å²	144	63.7 Å²	63.7	63%	0.632	31%	0.314	S	S	*	.			trans	-139.9	141.8	172.2	176.7	-92.5	0	0	0	108.7	T501	F499-T501 HydrophobicContact CE1-CG2 4.01Å
500	L	96.4	Very high	94.8	Very high	15 Å²	15	68.1 Å²	68.1	8%	0.079	33%	0.327	C	S	.	.			trans	-138.9	136.9	171.3	-64.4	167.6	0	0	0	107	R319 M321 T353 E504 K505	R319-L500 WeakPolarHBondContact O-CD1 3.16Å; R319-L500 WeakPolarHBondContact O-CG 3.04Å; M321-L500 HydrophobicContact CG-CD1 3.74Å; M321-L500 HydrophobicContact SD-CD1 3.62Å; T353-L500 HydrophobicContact CG2-CD1 4.5Å; T353-L500 HydrophobicContact CG2-CD2 4.19Å; L500-E504 HydrophobicContact CB-CB 4.27Å; L500-E504 HydrophobicContact CD2-CB 4.02Å; L500-K505 HydrophobicContact CB-CD 4.38Å; L500-K505 HydrophobicContact CB-CG 3.77Å; L500-K505 HydrophobicContact CD1-CG 4.14Å; L500-K505 WeakPolarHBondContact O-CE 3.48Å
501	T	95.7	Very high	94.3	Very high	50 Å²	50	61.7 Å²	61.7	31%	0.307	30%	0.3	S	S	.	.			trans	-60.3	176	168.8	55.7	0	0	0	0	111.6	F499 E503 E504 K505	F499-T501 HydrophobicContact CE1-CG2 4.01Å; T501-E503 WeakPolarHBondContact CB-OE2 3.42Å; T501-E504 VanDerWaalsContact CB-OE2 3.31Å; T501-E504 WeakPolarHBondContact CB-OE2 3.34Å; T501-E504 VanDerWaalsContact CG2-OE2 3.3Å; T501-E504 WeakPolarHBondContact CG2-OE2 3.43Å; T501-E504 PolarHBondContact N-OE2 3.4Å; T501-E504 WeakPolarHBondContact OG1-CB 3.39Å; T501-E504 VanDerWaalsContact OG1-CD 3.27Å; T501-E504 WeakPolarHBondContact OG1-CG 3.39Å; T501-E504 PolarHBondContact OG1-N 3.02Å; T501-E504 VanDerWaalsContact OG1-N 3.12Å; T501-E504 PolarHBondContact OG1-OE2 3.27Å; T501-K505 WeakPolarHBondContact O-CD 3.31Å; T501-K505 VanDerWaalsContact O-CG 3.29Å; T501-K505 WeakPolarHBondContact O-CG 2.98Å
502	A	92.8	Very high	94	Very high	66 Å²	66	64 Å²	64	55%	0.545	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.8	173.8	0	0	0	0	0	110.4	I506	A502-I506 WeakPolarHBondContact O-CG1 3.32Å
503	E	91	Very high	93.4	Very high	138 Å²	138	69 Å²	69	65%	0.645	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-46.5	-174.7	-63.8	67.6	-153.8	0	0	112	T501 K505 I506	T501-E503 WeakPolarHBondContact CB-OE2 3.42Å; E503-K505 PolarHBondContact O-N 2.83Å; E503-K505 VanDerWaalsContact O-N 3.11Å; E503-I506 PolarHBondContact O-N 2.95Å
504	E	92.8	Very high	92.8	Very high	106 Å²	106	72.5 Å²	72.5	50%	0.495	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.6	177.4	-73.2	163.7	127.1	0	0	113.6	L500 T501	L500-E504 HydrophobicContact CB-CB 4.27Å; L500-E504 HydrophobicContact CD2-CB 4.02Å; T501-E504 VanDerWaalsContact CB-OE2 3.31Å; T501-E504 WeakPolarHBondContact CB-OE2 3.34Å; T501-E504 VanDerWaalsContact CG2-OE2 3.3Å; T501-E504 WeakPolarHBondContact CG2-OE2 3.43Å; T501-E504 PolarHBondContact N-OE2 3.4Å; T501-E504 WeakPolarHBondContact OG1-CB 3.39Å; T501-E504 VanDerWaalsContact OG1-CD 3.27Å; T501-E504 WeakPolarHBondContact OG1-CG 3.39Å; T501-E504 PolarHBondContact OG1-N 3.02Å; T501-E504 VanDerWaalsContact OG1-N 3.12Å; T501-E504 PolarHBondContact OG1-OE2 3.27Å
505	K	94.5	Very high	92.2	Very high	28 Å²	28	74.5 Å²	74.5	12%	0.122	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11.8	176.4	-66.3	172.2	175.8	-164.8	0	113.6	L315 I318 M321 L500 T501 E503 I507	L315-K505 HydrophobicContact CB-CD 4.09Å; L315-K505 HydrophobicContact CD1-CB 3.8Å; L315-K505 WeakPolarHBondContact CD1-O 3.35Å; L315-K505 PolarHBondContact O-NZ 3.31Å; I318-K505 WeakPolarHBondContact O-CE 3.23Å; I318-K505 PolarHBondContact O-NZ 3.3Å; M321-K505 WeakPolarHBondContact CE-O 3.09Å; M321-K505 HydrophobicContact SD-CB 4.25Å; M321-K505 HydrophobicContact SD-CG 4.16Å; L500-K505 HydrophobicContact CB-CD 4.38Å; L500-K505 HydrophobicContact CB-CG 3.77Å; L500-K505 HydrophobicContact CD1-CG 4.14Å; L500-K505 WeakPolarHBondContact O-CE 3.48Å; T501-K505 WeakPolarHBondContact O-CD 3.31Å; T501-K505 VanDerWaalsContact O-CG 3.29Å; T501-K505 WeakPolarHBondContact O-CG 2.98Å; E503-K505 PolarHBondContact O-N 2.83Å; E503-K505 VanDerWaalsContact O-N 3.11Å; K505-I507 PolarHBondContact O-N 2.86Å
506	I	93.2	Very high	91.7	Very high	69 Å²	69	77.7 Å²	77.7	35%	0.354	37%	0.373	S	S	.	.			trans	-88	100.4	-173.3	-52.6	176.4	0	0	0	110.5	Y310 A502 E503 L508	Y310-I506 HydrophobicContact CD2-CG2 3.6Å; Y310-I506 HydrophobicContact CE2-CG2 4.3Å; Y310-I506 HydrophobicContact CG-CG2 4.09Å; A502-I506 WeakPolarHBondContact O-CG1 3.32Å; E503-I506 PolarHBondContact O-N 2.95Å; I506-L508 HydrophobicContact CG2-CD2 3.63Å; I506-L508 HydrophobicContact CG2-CG 3.83Å; I506-L508 PolarHBondContact O-N 2.76Å
507	I	93.3	Very high	90.9	Very high	25 Å²	25	77.5 Å²	77.5	13%	0.128	37%	0.371	C	S	.	.			trans	-76.3	94.1	167.5	-60.7	180	0	0	0	108.3	M321 I333 S334 K505	M321-I507 HydrophobicContact CE-CD1 3.7Å; M321-I507 HydrophobicContact CE-CG1 3.82Å; I333-I507 HydrophobicContact CB-CD1 4.11Å; I333-I507 HydrophobicContact CG2-CD1 3.57Å; S334-I507 WeakPolarHBondContact O-CD1 3.43Å; K505-I507 PolarHBondContact O-N 2.86Å
508	L	91.3	Very high	89.9	Confident	54 Å²	54	79.4 Å²	79.4	28%	0.283	38%	0.383	S	S	.	.			trans	-74.7	132.1	-178	-74.1	172.7	0	0	0	112.4	Y310 I506 R512 R513 L516	Y310-L508 HydrophobicContact CD2-CD2 4.42Å; Y310-L508 HydrophobicContact CE1-CD2 4.48Å; Y310-L508 HydrophobicContact CE2-CD2 4.11Å; I506-L508 HydrophobicContact CG2-CD2 3.63Å; I506-L508 HydrophobicContact CG2-CG 3.83Å; I506-L508 PolarHBondContact O-N 2.76Å; L508-R512 HydrophobicContact CD2-CB 4.3Å; L508-R513 HydrophobicContact CB-CB 4.43Å; L508-L516 HydrophobicContact CD1-CD1 3.58Å
509	P	91.9	Very high	88.8	Confident	6 Å²	6	86.3 Å²	86.3	4%	0.039	42%	0.415	C	S	.	.			trans	-57.3	146.9	170.6	-25.8	35.2	0	0	0	112.4	D298 N299 Y310 H511 R512 R513	D298-P509 HydrophobicContact CB-CB 4.47Å; D298-P509 HydrophobicContact CB-CG 4.01Å; D298-P509 VanDerWaalsContact O-CB 3.27Å; D298-P509 WeakPolarHBondContact O-CB 3.23Å; N299-P509 VanDerWaalsContact OD1-CA 3.24Å; N299-P509 WeakPolarHBondContact OD1-CA 3.05Å; N299-P509 WeakPolarHBondContact OD1-CB 3.37Å; Y310-P509 HydrophobicContact CD1-CG 3.77Å; Y310-P509 VanDerWaalsContact CE1-CD 3.44Å; Y310-P509 HydrophobicContact CE1-CG 3.85Å; P509-H511 PolarHBondContact O-N 3.13Å; P509-R512 WeakPolarHBondContact O-CA 3.35Å; P509-R512 PolarHBondContact O-N 3.4Å; P509-R513 PolarHBondContact O-N 3Å
510	R	85	Confident	87.4	Confident	161 Å²	161	84.2 Å²	84.2	61%	0.608	41%	0.413	S	S	*	.	H	α-helix	trans	-52.4	-39.8	-172.1	-174.2	174.3	178.1	163.7	0.8	112.7	N299 R512 R513 L514	N299-R510 PolarHBondContact OD1-N 3.22Å; R510-R512 PolarHBondContact O-N 3.01Å; R510-R513 PolarHBondContact O-N 3.04Å; R510-L514 HydrophobicContact CG-CD1 4.03Å; R510-L514 HydrophobicContact CG-CG 4.49Å; R510-L514 WeakPolarHBondContact O-CB 3.45Å; R510-L514 VanDerWaalsContact O-CG 3.28Å; R510-L514 WeakPolarHBondContact O-CG 3.21Å; R510-L514 PolarHBondContact O-N 3.07Å
511	H	87.7	Confident	85.6	Confident	60 Å²	60	88.4 Å²	88.4	28%	0.278	44%	0.444	S	S	.	.	H	α-helix	trans	-66.6	-34.8	178.6	79.5	-94.9	0	0	0	113.2	D298 P509 A515	D298-H511 PolarHBondContact O-CE1 3.46Å; D298-H511 PolarHBondContact O-ND1 2.78Å; D298-H511 VanDerWaalsContact O-ND1 3.17Å; P509-H511 PolarHBondContact O-N 3.13Å; H511-A515 WeakPolarHBondContact O-CB 3.46Å; H511-A515 PolarHBondContact O-N 3.4Å; H511-A515 VanDerWaalsContact O-N 3.07Å
512	R	90.6	Very high	83.9	Confident	106 Å²	106	91 Å²	91	40%	0.4	46%	0.455	S	S	.	.	H	α-helix	trans	-74.3	-43	174.4	-64.2	-58.7	-178	144.8	9	111.5	L308 Y310 L508 P509 R510 L514 A515 L516	L308-R512 HydrophobicContact CD1-CG 4.25Å; Y310-R512 HydrophobicContact CE1-CG 4.45Å; L508-R512 HydrophobicContact CD2-CB 4.3Å; P509-R512 WeakPolarHBondContact O-CA 3.35Å; P509-R512 PolarHBondContact O-N 3.4Å; R510-R512 PolarHBondContact O-N 3.01Å; R512-L514 VanDerWaalsContact C-N 3.32Å; R512-L514 PolarHBondContact O-N 2.83Å; R512-A515 PolarHBondContact O-N 3.32Å; R512-A515 VanDerWaalsContact O-N 3.15Å; R512-L516 PolarHBondContact O-N 3.07Å
513	R	86.4	Confident	82.5	Confident	134 Å²	134	96.9 Å²	96.9	51%	0.506	46%	0.463	S	S	.	.	H	α-helix	trans	-57.9	-45.6	175.3	-163.5	172.7	99.2	172.7	2.9	111.2	L508 P509 R510 L516 L517	L508-R513 HydrophobicContact CB-CB 4.43Å; P509-R513 PolarHBondContact O-N 3Å; R510-R513 PolarHBondContact O-N 3.04Å; R513-L516 PolarHBondContact O-N 3.38Å; R513-L517 HydrophobicContact CG-CD1 4.28Å; R513-L517 WeakPolarHBondContact O-CB 3.34Å; R513-L517 VanDerWaalsContact O-CG 3.29Å; R513-L517 WeakPolarHBondContact O-CG 3.34Å; R513-L517 PolarHBondContact O-N 2.95Å
514	L	84.4	Confident	81.3	Confident	86 Å²	86	99.8 Å²	99.8	45%	0.45	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-36.3	175.3	-71	171.3	0	0	0	113.2	R510 R512 K518	R510-L514 HydrophobicContact CG-CD1 4.03Å; R510-L514 HydrophobicContact CG-CG 4.49Å; R510-L514 WeakPolarHBondContact O-CB 3.45Å; R510-L514 VanDerWaalsContact O-CG 3.28Å; R510-L514 WeakPolarHBondContact O-CG 3.21Å; R510-L514 PolarHBondContact O-N 3.07Å; R512-L514 VanDerWaalsContact C-N 3.32Å; R512-L514 PolarHBondContact O-N 2.83Å; L514-K518 WeakPolarHBondContact O-CG 3.41Å; L514-K518 PolarHBondContact O-N 3.18Å; L514-K518 VanDerWaalsContact O-N 3.07Å
515	A	86.6	Confident	80.6	Confident	42 Å²	42	100.2 Å²	100.2	35%	0.347	48%	0.482	S	S	.	.	H	α-helix	trans	-66.8	-41.2	176	0	0	0	0	0	112.4	H511 R512 K518 Q519	H511-A515 WeakPolarHBondContact O-CB 3.46Å; H511-A515 PolarHBondContact O-N 3.4Å; H511-A515 VanDerWaalsContact O-N 3.07Å; R512-A515 PolarHBondContact O-N 3.32Å; R512-A515 VanDerWaalsContact O-N 3.15Å; A515-K518 PolarHBondContact O-N 2.79Å; A515-Q519 WeakPolarHBondContact O-CG 3.4Å; A515-Q519 PolarHBondContact O-N 3.3Å
516	L	84.7	Confident	80.2	Confident	86 Å²	86	99.8 Å²	99.8	45%	0.45	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-43.7	174.6	-68	178.7	0	0	0	111.8	L508 R512 R513 K518 Q519 V520	L508-L516 HydrophobicContact CD1-CD1 3.58Å; R512-L516 PolarHBondContact O-N 3.07Å; R513-L516 PolarHBondContact O-N 3.38Å; L516-K518 PolarHBondContact O-N 3.16Å; L516-Q519 CarbonylContact O-C 3.58Å; L516-Q519 WeakPolarHBondContact O-CA 3.32Å; L516-Q519 WeakPolarHBondContact O-CB 3.27Å; L516-Q519 PolarHBondContact O-N 2.74Å; L516-V520 PolarHBondContact O-N 3.19Å
517	L	79.8	Confident	79.9	Confident	105 Å²	105	96.5 Å²	96.5	55%	0.55	47%	0.466	S	S	.	.	H	α-helix	trans	-59.1	-35.3	175.5	-72.8	167.8	0	0	0	112.3	R513 Q519 V520	R513-L517 HydrophobicContact CG-CD1 4.28Å; R513-L517 WeakPolarHBondContact O-CB 3.34Å; R513-L517 VanDerWaalsContact O-CG 3.29Å; R513-L517 WeakPolarHBondContact O-CG 3.34Å; R513-L517 PolarHBondContact O-N 2.95Å; L517-Q519 VanDerWaalsContact C-N 3.28Å; L517-Q519 PolarHBondContact O-N 3.07Å; L517-V520 PolarHBondContact O-N 3.15Å
518	K	77.1	Confident	79.6	Confident	186 Å²	186	98.2 Å²	98.2	81%	0.809	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13.9	172.3	-73.2	178.5	177.6	-172.3	0	114.5	L514 A515 L516	L514-K518 WeakPolarHBondContact O-CG 3.41Å; L514-K518 PolarHBondContact O-N 3.18Å; L514-K518 VanDerWaalsContact O-N 3.07Å; A515-K518 PolarHBondContact O-N 2.79Å; L516-K518 PolarHBondContact O-N 3.16Å
519	Q	72.6	Confident	79.2	Confident	146 Å²	146	99.9 Å²	99.9	68%	0.682	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-17.4	174.8	-70.9	170.9	4.6	0	0	112.6	A515 L516 L517 S521	A515-Q519 WeakPolarHBondContact O-CG 3.4Å; A515-Q519 PolarHBondContact O-N 3.3Å; L516-Q519 CarbonylContact O-C 3.58Å; L516-Q519 WeakPolarHBondContact O-CA 3.32Å; L516-Q519 WeakPolarHBondContact O-CB 3.27Å; L516-Q519 PolarHBondContact O-N 2.74Å; L517-Q519 VanDerWaalsContact C-N 3.28Å; L517-Q519 PolarHBondContact O-N 3.07Å; Q519-S521 PolarHBondContact O-N 3.16Å
520	V	67.9	Low	78.9	Confident	99 Å²	99	102.2 Å²	102.2	60%	0.6	50%	0.504	S	S	*	.	S	Bend	trans	-70	98	167.8	178.3	0	0	0	0	108.2	L516 L517 I522	L516-V520 PolarHBondContact O-N 3.19Å; L517-V520 PolarHBondContact O-N 3.15Å; V520-I522 PolarHBondContact O-N 3.26Å
521	S	58.3	Low	78.6	Confident	104 Å²	104	97.5 Å²	97.5	73%	0.727	50%	0.495	S	S	*	.			trans	-67.4	95.8	168.1	59.4	0	0	0	0	109.2	Q519 R523	Q519-S521 PolarHBondContact O-N 3.16Å; S521-R523 PolarHBondContact O-N 2.64Å
522	I	60.2	Low	78.3	Confident	104 Å²	104	100.4 Å²	100.4	53%	0.533	51%	0.513	S	S	.	.			trans	-51.5	126.8	157.8	-56.9	175.1	0	0	0	105.9	V520 E524 C526	V520-I522 PolarHBondContact O-N 3.26Å; I522-E524 PolarHBondContact O-N 2.91Å; I522-C526 HydrophobicContact CG2-CB 3.74Å
523	R	63.5	Low	78.1	Confident	190 Å²	190	100.2 Å²	100.2	72%	0.717	52%	0.516	S	S	*	.			trans	-64.6	138.9	179.6	-54.4	172.5	177.5	154.4	-0.4	107.2	S521 N525 C526	S521-R523 PolarHBondContact O-N 2.64Å; R523-N525 PolarHBondContact O-N 3.46Å; R523-C526 WeakPolarHBondContact O-CB 3.38Å; R523-C526 PolarHBondContact O-N 2.86Å
524	E	65.1	Low	78.1	Confident	199 Å²	199	96.9 Å²	96.9	93%	0.93	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-21.4	-175.9	-61.4	-179	149.6	0	0	113.3	I522	I522-E524 PolarHBondContact O-N 2.91Å
525	N	79.4	Confident	78.4	Confident	115 Å²	115	94.1 Å²	94.1	62%	0.615	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	14.8	178.4	-55.8	-7.5	0	0	0	113.8	R523 V534 A535	R523-N525 PolarHBondContact O-N 3.46Å; N525-V534 CarbonylContact O-C 3.53Å; N525-V534 WeakPolarHBondContact O-CA 3.21Å; N525-V534 WeakPolarHBondContact O-CG1 3.46Å; N525-A535 PolarHBondContact O-N 3.05Å
526	C	86.1	Confident	78.7	Confident	19 Å²	19	93 Å²	93	13%	0.128	49%	0.489	C	S	.	.	B	Isolated β-bridge	trans	-79.2	150.9	175.5	-80	0	0	0	0	112.1	I522 R523 S528 D532 E533	I522-C526 HydrophobicContact CG2-CB 3.74Å; R523-C526 WeakPolarHBondContact O-CB 3.38Å; R523-C526 PolarHBondContact O-N 2.86Å; C526-S528 PolarHBondContact O-N 2.84Å; C526-D532 PolarHBondContact SG-O 3.34Å; C526-E533 CarbonylContact C-O 3.4Å
527	C	86.7	Confident	79.1	Confident	0 Å²	0	88.9 Å²	88.9	0%	0	47%	0.467	C	S	.	.			trans	-60.7	126.9	172.4	169.9	0	0	0	0	111.2	L529 C531 E533 C548	C527-L529 PolarHBondContact O-N 3.02Å; C527-L529 PolarHBondContact SG-N 3.25Å; C527-L529 VanDerWaalsContact SG-N 3.44Å; C527-C531 WeakPolarHBondContact O-CA 3.48Å; C527-C531 PolarHBondContact O-N 2.74Å; C527-E533 WeakPolarHBondContact CB-O 3.35Å; C527-E533 PolarHBondContact N-O 2.98Å; C527-C548 HydrophobicContact CB-CB 3.9Å; C527-C548 PolarHBondContact SG-N 3.44Å
528	S	85.4	Confident	79.8	Confident	60 Å²	60	85.9 Å²	85.9	42%	0.42	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	1	179.9	58.2	0	0	0	0	116	C526 D546 L547	C526-S528 PolarHBondContact O-N 2.84Å; S528-D546 WeakPolarHBondContact CB-O 3.37Å; S528-D546 PolarHBondContact N-O 2.69Å; S528-D546 PolarHBondContact OG-O 2.83Å; S528-L547 WeakPolarHBondContact OG-CD2 3.21Å
529	L	84.6	Confident	80.7	Confident	90 Å²	90	77.1 Å²	77.1	47%	0.471	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-43.9	175.7	-75.2	-179.4	0	0	0	114.3	C527 L547 C551 L555	C527-L529 PolarHBondContact O-N 3.02Å; C527-L529 PolarHBondContact SG-N 3.25Å; C527-L529 VanDerWaalsContact SG-N 3.44Å; L529-L547 HydrophobicContact CB-CD2 4.07Å; L529-L547 HydrophobicContact CD1-CD2 3.7Å; L529-L547 HydrophobicContact CG-CD2 3.63Å; L529-C551 HydrophobicContact CB-CB 4.19Å; L529-C551 HydrophobicContact CD1-CB 4.32Å; L529-L555 HydrophobicContact CD1-CD1 3.65Å; L529-L555 HydrophobicContact CD1-CD2 4.17Å; L529-L555 HydrophobicContact CD1-CG 4.35Å
530	C	85.4	Confident	81.7	Confident	54 Å²	54	73.4 Å²	73.4	37%	0.365	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-17.4	175.1	65.2	0	0	0	0	113.8	D532	C530-D532 HydrophobicContact CB-CB 4.5Å; C530-D532 PolarHBondContact O-N 3.48Å
531	C	78.6	Confident	82.8	Confident	63 Å²	63	73 Å²	73	43%	0.426	39%	0.394	S	S	.	.	S	Bend	trans	56	14.6	-175.7	-61.3	0	0	0	0	115.5	C527	C527-C531 WeakPolarHBondContact O-CA 3.48Å; C527-C531 PolarHBondContact O-N 2.74Å
532	D	81.6	Confident	84.5	Confident	121 Å²	121	69.4 Å²	69.4	65%	0.647	37%	0.368	S	S	*	.	S	Bend	trans	-116.1	-72.4	-171.4	-173.4	23	0	0	0	110.3	C526 C530	C526-D532 PolarHBondContact SG-O 3.34Å; C530-D532 HydrophobicContact CB-CB 4.5Å; C530-D532 PolarHBondContact O-N 3.48Å
533	E	85.3	Confident	86	Confident	101 Å²	101	65.7 Å²	65.7	47%	0.472	36%	0.356	S	S	.	.	S	Bend	trans	-66.1	158.9	175.9	-80.5	-62.7	162.7	0	0	113.9	C526 C527 C548	C526-E533 CarbonylContact C-O 3.4Å; C527-E533 WeakPolarHBondContact CB-O 3.35Å; C527-E533 PolarHBondContact N-O 2.98Å; E533-C548 HydrophobicContact CB-CB 3.73Å
534	V	87.5	Confident	87.4	Confident	65 Å²	65	59.7 Å²	59.7	39%	0.394	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-70.1	137.7	-178.5	177.9	0	0	0	0	111.6	N525 D536 C548	N525-V534 CarbonylContact O-C 3.53Å; N525-V534 WeakPolarHBondContact O-CA 3.21Å; N525-V534 WeakPolarHBondContact O-CG1 3.46Å; V534-D536 HydrophobicContact CG1-CB 4.42Å; V534-D536 PolarHBondContact O-N 3.48Å; V534-C548 VanDerWaalsContact O-CA 3.31Å; V534-C548 WeakPolarHBondContact O-CA 3.35Å; V534-C548 WeakPolarHBondContact O-CB 3.23Å
535	A	90.6	Very high	88.7	Confident	28 Å²	28	52 Å²	52	23%	0.231	30%	0.304	C	S	.	.			trans	-65.9	92	167.9	0	0	0	0	0	109.9	N525 L547	N525-A535 PolarHBondContact O-N 3.05Å; A535-L547 CarbonylContact C-O 3.57Å
536	D	92.4	Very high	89.1	Confident	18 Å²	18	49.8 Å²	49.8	10%	0.096	29%	0.292	C	S	.	.			trans	-124.5	6.2	-167.7	77.7	-2	0	0	0	113.9	V534 L547 C548 M549 R570 Q571	V534-D536 HydrophobicContact CG1-CB 4.42Å; V534-D536 PolarHBondContact O-N 3.48Å; D536-L547 PolarHBondContact N-O 2.79Å; D536-C548 WeakPolarHBondContact OD1-CA 3.33Å; D536-M549 PolarHBondContact OD1-N 2.95Å; D536-R570 CarbonylContact O-C 3.46Å; D536-R570 WeakPolarHBondContact O-CA 3.43Å; D536-R570 IonicContact OD1-NE 3.52Å; D536-R570 IonicContact OD2-CZ 2.74Å; D536-R570 IonicContact OD2-NE 3.56Å; D536-R570 PolarHBondContact OD2-NE 2.69Å; D536-R570 IonicContact OD2-NH2 3.5Å; D536-R570 PolarHBondContact OD2-NH2 3.26Å; D536-Q571 PolarHBondContact O-N 2.71Å
537	T	93.1	Very high	89.3	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	111.7	-168.3	-69.4	0	0	0	0	112.7	S545 L547 M549 A552 R568 I569	T537-S545 WeakPolarHBondContact O-CA 3.46Å; T537-L547 WeakPolarHBondContact CB-O 3.21Å; T537-L547 PolarHBondContact N-O 3.48Å; T537-M549 HydrophobicContact CG2-CE 3.72Å; T537-M549 HydrophobicContact CG2-SD 3.99Å; T537-M549 WeakPolarHBondContact OG1-CA 3.42Å; T537-M549 WeakPolarHBondContact OG1-CB 3.49Å; T537-M549 WeakPolarHBondContact OG1-CE 3.35Å; T537-M549 PolarHBondContact OG1-N 2.96Å; T537-M549 VanDerWaalsContact OG1-N 3.15Å; T537-A552 HydrophobicContact CG2-CB 3.61Å; T537-R568 HydrophobicContact CG2-CB 3.93Å; T537-I569 WeakPolarHBondContact CA-O 3.45Å
538	Q	94.7	Very high	89.6	Confident	41 Å²	41	49.2 Å²	49.2	19%	0.192	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.8	175.3	179.8	166	80.9	0	0	111.9	G543 H544 I569 Q571	Q538-G543 WeakPolarHBondContact CG-O 3.16Å; Q538-G543 PolarHBondContact NE2-O 3Å; Q538-H544 CarbonylContact C-O 3.5Å; Q538-H544 WeakPolarHBondContact CA-O 3.42Å; Q538-I569 PolarHBondContact N-O 2.7Å; Q538-I569 PolarHBondContact O-N 3.01Å; Q538-Q571 HydrophobicContact CB-CG 4.02Å
539	L	94.9	Very high	90	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	138.4	174.4	-55.7	-177.6	0	0	0	111.1	G543 H544 L547 A552 C558 I565 R568	L539-G543 WeakPolarHBondContact O-CA 3.47Å; L539-G543 PolarHBondContact O-N 2.78Å; L539-H544 PolarHBondContact N-O 3.17Å; L539-L547 HydrophobicContact CD1-CD1 3.95Å; L539-L547 HydrophobicContact CD2-CD1 4.46Å; L539-L547 HydrophobicContact CG-CD1 4.48Å; L539-A552 HydrophobicContact CD2-CB 3.97Å; L539-C558 HydrophobicContact CD1-CB 3.82Å; L539-I565 HydrophobicContact CD1-CD1 3.85Å; L539-I565 HydrophobicContact CD1-CG1 4.15Å; L539-I565 HydrophobicContact CD2-CD1 4Å; L539-I565 HydrophobicContact CD2-CG1 4.35Å; L539-I565 HydrophobicContact CD2-CG2 3.92Å; L539-I565 HydrophobicContact CG-CD1 4.49Å; L539-R568 HydrophobicContact CD2-CG 4.02Å
540	K	94.4	Very high	90.4	Very high	68 Å²	68	48.1 Å²	48.1	30%	0.296	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143	172.5	-62.4	-63.9	178.5	-175.4	0	110.9	V566 S567 I569	K540-V566 PolarHBondContact O-N 3.42Å; K540-S567 WeakPolarHBondContact CB-OG 3.4Å; K540-S567 PolarHBondContact N-O 3.41Å; K540-S567 PolarHBondContact O-N 3.32Å; K540-I569 HydrophobicContact CD-CD1 4.48Å; K540-I569 HydrophobicContact CG-CD1 3.86Å; K540-I569 HydrophobicContact CG-CG1 4.44Å
541	P	90.6	Very high	90.7	Very high	92 Å²	92	46.5 Å²	46.5	60%	0.597	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.3	-3.8	7.3	34.6	-36.3	0	0	0	115	G543 E564	P541-G543 PolarHBondContact O-N 2.91Å; P541-E564 WeakPolarHBondContact CD-O 3.49Å
542	C	93.6	Very high	91.3	Very high	27 Å²	27	43.5 Å²	43.5	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-28	-166.9	62.9	0	0	0	0	116.3	C558 C561 K563	C542-C558 VanDerWaalsContact SG-SG 3.6Å; C542-C561 WeakPolarHBondContact CB-SG 3.47Å; C542-K563 HydrophobicContact CB-CB 4.39Å; C542-K563 HydrophobicContact CB-CD 4.13Å
543	G	91.4	Very high	91.9	Very high	27 Å²	27	42.8 Å²	42.8	28%	0.278	24%	0.241	S	C	.	.			trans	93.6	-16.1	173.9	0	0	0	0	0	116.3	Q538 L539 P541	Q538-G543 WeakPolarHBondContact CG-O 3.16Å; Q538-G543 PolarHBondContact NE2-O 3Å; L539-G543 WeakPolarHBondContact O-CA 3.47Å; L539-G543 PolarHBondContact O-N 2.78Å; P541-G543 PolarHBondContact O-N 2.91Å
544	H	93.4	Very high	92.2	Very high	63 Å²	63	45.7 Å²	45.7	29%	0.292	26%	0.255	S	S	.	.			trans	-56.9	146.4	174.9	-57.7	104.5	0	0	0	112	Q538 L539 L560 C561	Q538-H544 CarbonylContact C-O 3.5Å; Q538-H544 WeakPolarHBondContact CA-O 3.42Å; L539-H544 PolarHBondContact N-O 3.17Å; H544-L560 HydrophobicContact CB-CD1 3.76Å; H544-C561 VanDerWaalsContact CE1-SG 3.59Å
545	S	92.6	Very high	92.4	Very high	39 Å²	39	44.4 Å²	44.4	27%	0.273	25%	0.246	S	C	.	.			trans	-131	5.7	-171	43.5	0	0	0	0	113.6	T537 L547	T537-S545 WeakPolarHBondContact O-CA 3.46Å; S545-L547 PolarHBondContact O-N 3.29Å
546	D	88.5	Confident	92.5	Very high	68 Å²	68	51 Å²	51	36%	0.364	27%	0.272	S	S	.	.			trans	-81.3	26.1	-162.8	-39.4	-83.9	0	0	0	112.9	S528 L560	S528-D546 WeakPolarHBondContact CB-O 3.37Å; S528-D546 PolarHBondContact N-O 2.69Å; S528-D546 PolarHBondContact OG-O 2.83Å; D546-L560 HydrophobicContact CB-CD1 4.08Å; D546-L560 VanDerWaalsContact OD2-CD1 3.23Å; D546-L560 WeakPolarHBondContact OD2-CD1 3.31Å
547	L	90.3	Very high	92.5	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.016	29%	0.289	C	S	.	.	S	Bend	trans	-136.2	145.9	-173.7	-63	179.9	0	0	0	111.5	S528 L529 A535 D536 T537 L539 S545 A552 L555 P559	S528-L547 WeakPolarHBondContact OG-CD2 3.21Å; L529-L547 HydrophobicContact CB-CD2 4.07Å; L529-L547 HydrophobicContact CD1-CD2 3.7Å; L529-L547 HydrophobicContact CG-CD2 3.63Å; A535-L547 CarbonylContact C-O 3.57Å; D536-L547 PolarHBondContact N-O 2.79Å; T537-L547 WeakPolarHBondContact CB-O 3.21Å; T537-L547 PolarHBondContact N-O 3.48Å; L539-L547 HydrophobicContact CD1-CD1 3.95Å; L539-L547 HydrophobicContact CD2-CD1 4.46Å; L539-L547 HydrophobicContact CG-CD1 4.48Å; S545-L547 PolarHBondContact O-N 3.29Å; L547-A552 HydrophobicContact CB-CB 4.3Å; L547-A552 HydrophobicContact CD1-CB 4.31Å; L547-L555 HydrophobicContact CD1-CD1 3.58Å; L547-P559 HydrophobicContact CD1-CG 4.44Å
548	C	92.9	Very high	92.4	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.027	29%	0.289	C	S	.	.			trans	-76	160.3	163.2	70.4	0	0	0	0	110.3	C527 E533 V534 D536 D550 C551 A552	C527-C548 HydrophobicContact CB-CB 3.9Å; C527-C548 PolarHBondContact SG-N 3.44Å; E533-C548 HydrophobicContact CB-CB 3.73Å; V534-C548 VanDerWaalsContact O-CA 3.31Å; V534-C548 WeakPolarHBondContact O-CA 3.35Å; V534-C548 WeakPolarHBondContact O-CB 3.23Å; D536-C548 WeakPolarHBondContact OD1-CA 3.33Å; C548-D550 VanDerWaalsContact C-N 3.31Å; C548-D550 PolarHBondContact O-N 3.43Å; C548-C551 PolarHBondContact O-N 3.48Å; C548-C551 VanDerWaalsContact SG-SG 3.66Å; C548-A552 WeakPolarHBondContact O-CB 3.36Å; C548-A552 PolarHBondContact O-N 2.8Å
549	M	93.1	Very high	92.1	Very high	32 Å²	32	54.5 Å²	54.5	16%	0.158	30%	0.298	C	S	.	.	H	α-helix	trans	-55.4	-43	-180	-175.9	56.8	71.6	0	0	113.1	D536 T537 C551 A552 L553 R568 R570	D536-M549 PolarHBondContact OD1-N 2.95Å; T537-M549 HydrophobicContact CG2-CE 3.72Å; T537-M549 HydrophobicContact CG2-SD 3.99Å; T537-M549 WeakPolarHBondContact OG1-CA 3.42Å; T537-M549 WeakPolarHBondContact OG1-CB 3.49Å; T537-M549 WeakPolarHBondContact OG1-CE 3.35Å; T537-M549 PolarHBondContact OG1-N 2.96Å; T537-M549 VanDerWaalsContact OG1-N 3.15Å; M549-C551 PolarHBondContact O-N 3.31Å; M549-A552 PolarHBondContact O-N 2.96Å; M549-L553 HydrophobicContact CG-CD1 3.86Å; M549-L553 HydrophobicContact CG-CG 4.25Å; M549-L553 WeakPolarHBondContact O-CB 3.49Å; M549-L553 VanDerWaalsContact O-CG 3.29Å; M549-L553 WeakPolarHBondContact O-CG 3.47Å; M549-L553 PolarHBondContact O-N 3.46Å; M549-L553 HydrophobicContact SD-CD1 4.15Å; M549-L553 HydrophobicContact SD-CD2 4.37Å; M549-L553 HydrophobicContact SD-CG 3.96Å; M549-R568 HydrophobicContact CE-CB 4.48Å; M549-R568 HydrophobicContact SD-CB 4.21Å; M549-R570 HydrophobicContact CE-CB 3.67Å; M549-R570 HydrophobicContact CE-CG 4.2Å
550	D	92.7	Very high	91.7	Very high	95 Å²	95	58.7 Å²	58.7	51%	0.508	32%	0.32	S	S	.	.	H	α-helix	trans	-71.9	-32.5	-172.3	-58.5	-48.3	0	0	0	113	C548 Q554	C548-D550 VanDerWaalsContact C-N 3.31Å; C548-D550 PolarHBondContact O-N 3.43Å; D550-Q554 PolarHBondContact O-NE2 2.8Å
551	C	92.6	Very high	91.5	Very high	19 Å²	19	57.6 Å²	57.6	13%	0.128	32%	0.32	C	S	.	.	H	α-helix	trans	-72.5	-42.2	167.3	-70.8	0	0	0	0	111.5	L529 C548 M549 L553 Q554 L555	L529-C551 HydrophobicContact CB-CB 4.19Å; L529-C551 HydrophobicContact CD1-CB 4.32Å; C548-C551 PolarHBondContact O-N 3.48Å; C548-C551 VanDerWaalsContact SG-SG 3.66Å; M549-C551 PolarHBondContact O-N 3.31Å; C551-L553 VanDerWaalsContact C-N 3.26Å; C551-L553 PolarHBondContact O-N 3.15Å; C551-Q554 PolarHBondContact O-N 2.95Å; C551-Q554 VanDerWaalsContact O-N 3.17Å; C551-L555 WeakPolarHBondContact O-CG 3.5Å
552	A	91.7	Very high	91.5	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-33.7	179.5	0	0	0	0	0	113	T537 L539 L547 C548 M549 Q554 L555 R568	T537-A552 HydrophobicContact CG2-CB 3.61Å; L539-A552 HydrophobicContact CD2-CB 3.97Å; L547-A552 HydrophobicContact CB-CB 4.3Å; L547-A552 HydrophobicContact CD1-CB 4.31Å; C548-A552 WeakPolarHBondContact O-CB 3.36Å; C548-A552 PolarHBondContact O-N 2.8Å; M549-A552 PolarHBondContact O-N 2.96Å; A552-Q554 VanDerWaalsContact C-N 3.31Å; A552-Q554 PolarHBondContact O-N 2.89Å; A552-L555 PolarHBondContact O-N 2.89Å; A552-R568 HydrophobicContact CB-CG 4.35Å; A552-R568 VanDerWaalsContact O-CD 3.29Å; A552-R568 WeakPolarHBondContact O-CD 3.34Å; A552-R568 PolarHBondContact O-NE 2.84Å
553	L	92.8	Very high	91.5	Very high	106 Å²	106	67.5 Å²	67.5	56%	0.555	35%	0.345	S	S	*	.	H	α-helix	trans	-68	-24.9	177.8	-76.7	168	0	0	0	113.9	M549 C551 L555	M549-L553 HydrophobicContact CG-CD1 3.86Å; M549-L553 HydrophobicContact CG-CG 4.25Å; M549-L553 WeakPolarHBondContact O-CB 3.49Å; M549-L553 VanDerWaalsContact O-CG 3.29Å; M549-L553 WeakPolarHBondContact O-CG 3.47Å; M549-L553 PolarHBondContact O-N 3.46Å; M549-L553 HydrophobicContact SD-CD1 4.15Å; M549-L553 HydrophobicContact SD-CD2 4.37Å; M549-L553 HydrophobicContact SD-CG 3.96Å; C551-L553 VanDerWaalsContact C-N 3.26Å; C551-L553 PolarHBondContact O-N 3.15Å; L553-L555 VanDerWaalsContact C-N 3.3Å; L553-L555 PolarHBondContact O-N 3.47Å
554	Q	93.2	Very high	91.6	Very high	162 Å²	162	73 Å²	73	76%	0.757	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-1.4	-179.5	-66.5	173.6	56.6	0	0	113.7	D550 C551 A552	D550-Q554 PolarHBondContact O-NE2 2.8Å; C551-Q554 PolarHBondContact O-N 2.95Å; C551-Q554 VanDerWaalsContact O-N 3.17Å; A552-Q554 VanDerWaalsContact C-N 3.31Å; A552-Q554 PolarHBondContact O-N 2.89Å
555	L	90.3	Very high	91.7	Very high	39 Å²	39	70.5 Å²	70.5	20%	0.204	35%	0.352	C	S	.	.			trans	-115.3	129.6	-171	-59.9	165.8	0	0	0	111.6	L529 L547 C551 A552 L553 P559 I565 R568	L529-L555 HydrophobicContact CD1-CD1 3.65Å; L529-L555 HydrophobicContact CD1-CD2 4.17Å; L529-L555 HydrophobicContact CD1-CG 4.35Å; L547-L555 HydrophobicContact CD1-CD1 3.58Å; C551-L555 WeakPolarHBondContact O-CG 3.5Å; A552-L555 PolarHBondContact O-N 2.89Å; L553-L555 VanDerWaalsContact C-N 3.3Å; L553-L555 PolarHBondContact O-N 3.47Å; L555-P559 HydrophobicContact CD1-CG 4.35Å; L555-I565 HydrophobicContact CB-CD1 3.74Å; L555-I565 WeakPolarHBondContact O-CD1 3.29Å; L555-R568 PolarHBondContact O-NH2 3.18Å
556	E	93.2	Very high	91.7	Very high	167 Å²	167	73.8 Å²	73.8	78%	0.78	37%	0.37	S	S	*	.	S	Bend	trans	-86.9	-25.8	169.8	-62.1	-174.1	157.8	0	0	112.4	I565	E556-I565 PolarHBondContact O-N 3.47Å
557	T	93.3	Very high	91.9	Very high	74 Å²	74	72.9 Å²	72.9	45%	0.454	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-126.7	147.4	177.4	62.6	0	0	0	0	111.6	K563 I565	T557-K563 CarbonylContact C-O 3.57Å; T557-K563 WeakPolarHBondContact CA-O 3.29Å; T557-I565 WeakPolarHBondContact O-CD1 3.39Å
558	C	90.2	Very high	92.1	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.382	C	S	.	.			trans	-68.4	120.9	178.3	173.5	0	0	0	0	109.9	L539 C542 L560 C561 R562 K563 I565	L539-C558 HydrophobicContact CD1-CB 3.82Å; C542-C558 VanDerWaalsContact SG-SG 3.6Å; C558-L560 VanDerWaalsContact C-N 3.25Å; C558-L560 PolarHBondContact O-N 2.84Å; C558-C561 PolarHBondContact O-N 2.85Å; C558-R562 WeakPolarHBondContact O-CA 3.39Å; C558-R562 PolarHBondContact O-N 2.9Å; C558-K563 WeakPolarHBondContact CB-O 3.4Å; C558-K563 PolarHBondContact N-O 3.17Å; C558-I565 HydrophobicContact CB-CG1 4.28Å
559	P	87.5	Confident	92.1	Very high	58 Å²	58	79.8 Å²	79.8	38%	0.377	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-35	-175.3	22.6	-32.4	0	0	0	112.2	L547 L555 C561	L547-P559 HydrophobicContact CD1-CG 4.44Å; L555-P559 HydrophobicContact CD1-CG 4.35Å; P559-C561 PolarHBondContact O-N 3.45Å
560	L	86.6	Confident	92	Very high	90 Å²	90	84.8 Å²	84.8	47%	0.471	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.8	-175.1	-61.1	163.1	0	0	0	114.1	H544 D546 C558	H544-L560 HydrophobicContact CB-CD1 3.76Å; D546-L560 HydrophobicContact CB-CD1 4.08Å; D546-L560 VanDerWaalsContact OD2-CD1 3.23Å; D546-L560 WeakPolarHBondContact OD2-CD1 3.31Å; C558-L560 VanDerWaalsContact C-N 3.25Å; C558-L560 PolarHBondContact O-N 2.84Å
561	C	91	Very high	91.7	Very high	44 Å²	44	84.2 Å²	84.2	30%	0.297	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	9	-176.2	80.1	0	0	0	0	115.4	C542 H544 C558 P559 K563	C542-C561 WeakPolarHBondContact CB-SG 3.47Å; H544-C561 VanDerWaalsContact CE1-SG 3.59Å; C558-C561 PolarHBondContact O-N 2.85Å; P559-C561 PolarHBondContact O-N 3.45Å; C561-K563 PolarHBondContact O-N 2.71Å
562	R	90.9	Very high	90.7	Very high	207 Å²	207	90.2 Å²	90.2	78%	0.781	44%	0.44	S	S	*	.			trans	53.8	20.1	175.6	-51.6	-175.6	-174.3	-167.4	1	115.9	C558	C558-R562 WeakPolarHBondContact O-CA 3.39Å; C558-R562 PolarHBondContact O-N 2.9Å
563	K	92.2	Very high	89.1	Confident	121 Å²	121	94.7 Å²	94.7	53%	0.526	47%	0.472	S	S	.	.			trans	-84.4	141.1	173.3	-68.3	-178.5	-179.2	176.2	0	110.3	C542 T557 C558 C561	C542-K563 HydrophobicContact CB-CB 4.39Å; C542-K563 HydrophobicContact CB-CD 4.13Å; T557-K563 CarbonylContact C-O 3.57Å; T557-K563 WeakPolarHBondContact CA-O 3.29Å; C558-K563 WeakPolarHBondContact CB-O 3.4Å; C558-K563 PolarHBondContact N-O 3.17Å; C561-K563 PolarHBondContact O-N 2.71Å
564	E	94.6	Very high	86.8	Confident	143 Å²	143	97.6 Å²	97.6	67%	0.668	48%	0.482	S	S	*	.	B	Isolated β-bridge	trans	-53.8	138.4	172.9	-168.4	-178.3	171.4	0	0	112.3	P541 V566	P541-E564 WeakPolarHBondContact CD-O 3.49Å; E564-V566 PolarHBondContact O-N 2.86Å
565	I	94.9	Very high	84.3	Confident	10 Å²	10	98.1 Å²	98.1	5%	0.051	49%	0.488	C	S	.	.			trans	-95.6	93.5	-178.3	-59.3	166.2	0	0	0	109.6	L539 L555 E556 T557 C558 R568	L539-I565 HydrophobicContact CD1-CD1 3.85Å; L539-I565 HydrophobicContact CD1-CG1 4.15Å; L539-I565 HydrophobicContact CD2-CD1 4Å; L539-I565 HydrophobicContact CD2-CG1 4.35Å; L539-I565 HydrophobicContact CD2-CG2 3.92Å; L539-I565 HydrophobicContact CG-CD1 4.49Å; L555-I565 HydrophobicContact CB-CD1 3.74Å; L555-I565 WeakPolarHBondContact O-CD1 3.29Å; E556-I565 PolarHBondContact O-N 3.47Å; T557-I565 WeakPolarHBondContact O-CD1 3.39Å; C558-I565 HydrophobicContact CB-CG1 4.28Å; I565-R568 HydrophobicContact CG2-CG 3.68Å; I565-R568 VanDerWaalsContact CG2-CZ 3.48Å
566	V	93.8	Very high	81.5	Confident	108 Å²	108	104.8 Å²	104.8	66%	0.655	54%	0.538	S	S	*	.	S	Bend	trans	-71.4	-35.5	178.4	179.8	0	0	0	0	111.7	K540 E564	K540-V566 PolarHBondContact O-N 3.42Å; E564-V566 PolarHBondContact O-N 2.86Å
567	S	92.9	Very high	80.9	Confident	49 Å²	49	101.7 Å²	101.7	34%	0.343	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	161.4	170.9	69.3	0	0	0	0	113.3	K540	K540-S567 WeakPolarHBondContact CB-OG 3.4Å; K540-S567 PolarHBondContact N-O 3.41Å; K540-S567 PolarHBondContact O-N 3.32Å
568	R	94.4	Very high	80.3	Confident	73 Å²	73	103.2 Å²	103.2	28%	0.275	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.5	-176.9	-62	157.1	-166.9	74.6	3.8	107.1	T537 L539 M549 A552 L555 I565	T537-R568 HydrophobicContact CG2-CB 3.93Å; L539-R568 HydrophobicContact CD2-CG 4.02Å; M549-R568 HydrophobicContact CE-CB 4.48Å; M549-R568 HydrophobicContact SD-CB 4.21Å; A552-R568 HydrophobicContact CB-CG 4.35Å; A552-R568 VanDerWaalsContact O-CD 3.29Å; A552-R568 WeakPolarHBondContact O-CD 3.34Å; A552-R568 PolarHBondContact O-NE 2.84Å; L555-R568 PolarHBondContact O-NH2 3.18Å; I565-R568 HydrophobicContact CG2-CG 3.68Å; I565-R568 VanDerWaalsContact CG2-CZ 3.48Å
569	I	93.2	Very high	79.7	Confident	79 Å²	79	108.9 Å²	108.9	41%	0.405	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.4	113.7	-172.6	-56.1	179.3	0	0	0	108.9	T537 Q538 K540 Q571	T537-I569 WeakPolarHBondContact CA-O 3.45Å; Q538-I569 PolarHBondContact N-O 2.7Å; Q538-I569 PolarHBondContact O-N 3.01Å; K540-I569 HydrophobicContact CD-CD1 4.48Å; K540-I569 HydrophobicContact CG-CD1 3.86Å; K540-I569 HydrophobicContact CG-CG1 4.44Å; I569-Q571 PolarHBondContact O-N 2.85Å
570	R	91	Very high	79.3	Confident	136 Å²	136	111.9 Å²	111.9	51%	0.513	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.5	117.1	175.6	-150	173.7	-171.7	158.6	10.1	109.8	D536 M549 I572	D536-R570 CarbonylContact O-C 3.46Å; D536-R570 WeakPolarHBondContact O-CA 3.43Å; D536-R570 IonicContact OD1-NE 3.52Å; D536-R570 IonicContact OD2-CZ 2.74Å; D536-R570 IonicContact OD2-NE 3.56Å; D536-R570 PolarHBondContact OD2-NE 2.69Å; D536-R570 IonicContact OD2-NH2 3.5Å; D536-R570 PolarHBondContact OD2-NH2 3.26Å; M549-R570 HydrophobicContact CE-CB 3.67Å; M549-R570 HydrophobicContact CE-CG 4.2Å; R570-I572 PolarHBondContact O-N 2.88Å
571	Q	85.4	Confident	78.8	Confident	84 Å²	84	113.3 Å²	113.3	39%	0.393	58%	0.576	S	S	.	*			trans	-84.6	97.9	175.3	-65.4	-169.9	-41.1	0	0	108.8	D536 Q538 I569 S573	D536-Q571 PolarHBondContact O-N 2.71Å; Q538-Q571 HydrophobicContact CB-CG 4.02Å; I569-Q571 PolarHBondContact O-N 2.85Å; Q571-S573 PolarHBondContact O-N 2.85Å
572	I	71.3	Confident	78	Confident	145 Å²	145	117.9 Å²	117.9	74%	0.744	60%	0.595	S	S	*	*			trans	-72	98.3	174.4	-57.3	174.3	0	0	0	108.1	R570 H574	R570-I572 PolarHBondContact O-N 2.88Å; I572-H574 PolarHBondContact O-N 2.99Å
573	S	57.7	Low	77.1	Confident	94 Å²	94	111.5 Å²	111.5	66%	0.657	58%	0.582	S	S	*	*			trans	-69	111.6	171	48.7	0	0	0	0	109.8	Q571 I575	Q571-S573 PolarHBondContact O-N 2.85Å; S573-I575 PolarHBondContact O-N 3.06Å
574	H	44.6	Very low	75.9	Confident	166 Å²	166	110.8 Å²	110.8	77%	0.769	59%	0.586	S	S	*	*			trans	-66	105.7	166	-89.5	-87.5	0	0	0	109	I572 S576	I572-H574 PolarHBondContact O-N 2.99Å; H574-S576 PolarHBondContact O-N 3.25Å; H574-S576 PolarHBondContact O-OG 3.38Å
575	I	41.3	Very low	74.3	Confident	174 Å²	174	108.1 Å²	108.1	89%	0.892	58%	0.579	S	S	*	*			trans	-54.5	122.2	169.6	-56.4	174.5	0	0	0	107.8	S573	S573-I575 PolarHBondContact O-N 3.06Å
576	S	31.4	Very low	72.5	Confident	179 Å²	179	117 Å²	117	100%	1.252	63%	0.627	S	S	*	*			trans	-136.5	0	-176.2	-54.1	0	0	0	0	109.1	H574	H574-S576 PolarHBondContact O-N 3.25Å; H574-S576 PolarHBondContact O-OG 3.38Å

Retrieved 576 of 576 residues in 99.4 ms (Link to these results)

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