A0A087YBL2_POEFO Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession A0A087YBL2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 350 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.6	Low	68.6	Low	177 Å²	177	155.8 Å²	155.8	87%	0.872	67%	0.669	S	S	*	*				0	126.2	0	-89.5	169.9	65.3	0	0	110.2	R6 I9	M1-R6 HydrophobicContact CE-CG 4.36Å; M1-I9 HydrophobicContact CE-CD1 3.69Å
2	S	66.9	Low	69	Low	75 Å²	75	147.9 Å²	147.9	52%	0.524	64%	0.644	S	S	.	*			trans	-63.3	145	177.6	163.1	0	0	0	0	111.7	R4 T5 R6	S2-R4 PolarHBondContact O-N 3.39Å; S2-R4 PolarHBondContact OG-N 3.43Å; S2-T5 PolarHBondContact N-OG1 3.43Å; S2-T5 PolarHBondContact O-N 3.34Å; S2-T5 PolarHBondContact O-OG1 3.16Å; S2-R6 PolarHBondContact O-N 3.04Å
3	R	66.1	Low	69.1	Low	223 Å²	223	145.2 Å²	145.2	84%	0.842	64%	0.64	S	S	*	*	H	α-helix	trans	-53.7	-26.3	175.8	-80.8	-178.9	168.9	-179.4	-2.5	112.7	R7	R3-R7 PolarHBondContact O-N 3.3Å
4	R	66.9	Low	69.2	Low	214 Å²	214	141.9 Å²	141.9	81%	0.808	63%	0.631	S	S	*	*	H	α-helix	trans	-70.6	-41.8	177.5	-128.5	177.2	-169.9	178.4	3.3	112.3	S2 R7 W8	S2-R4 PolarHBondContact O-N 3.39Å; S2-R4 PolarHBondContact OG-N 3.43Å; R4-R7 PolarHBondContact O-N 2.97Å; R4-W8 PolarHBondContact O-N 2.97Å
5	T	67.6	Low	68.8	Low	70 Å²	70	137.8 Å²	137.8	43%	0.429	63%	0.625	S	S	.	*	H	α-helix	trans	-68.8	-36	179	5.9	0	0	0	0	112	S2 W8 I9	S2-T5 PolarHBondContact N-OG1 3.43Å; S2-T5 PolarHBondContact O-N 3.34Å; S2-T5 PolarHBondContact O-OG1 3.16Å; T5-W8 PolarHBondContact O-N 3.17Å; T5-I9 WeakPolarHBondContact O-CG1 3.47Å; T5-I9 PolarHBondContact O-N 3.23Å
6	R	68.3	Low	68.2	Low	188 Å²	188	135.8 Å²	135.8	71%	0.709	62%	0.621	S	S	*	*	H	α-helix	trans	-64.5	-40.8	176	-128.3	177.9	-167.1	-178.2	3.1	112.7	M1 S2 L10	M1-R6 HydrophobicContact CE-CG 4.36Å; S2-R6 PolarHBondContact O-N 3.04Å; R6-L10 PolarHBondContact O-N 3.04Å; R6-L10 VanDerWaalsContact O-N 3.16Å
7	R	69.8	Low	67.5	Low	194 Å²	194	129.6 Å²	129.6	73%	0.732	60%	0.603	S	S	*	*	H	α-helix	trans	-68.2	-34.2	176.2	-76	-178.4	176.4	179.7	-0.6	112.6	R3 R4 R11	R3-R7 PolarHBondContact O-N 3.3Å; R4-R7 PolarHBondContact O-N 2.97Å; R7-R11 WeakPolarHBondContact O-CG 3.41Å; R7-R11 PolarHBondContact O-N 3.36Å; R7-R11 VanDerWaalsContact O-N 3.17Å
8	W	73.3	Confident	67	Low	189 Å²	189	127.8 Å²	127.8	72%	0.716	60%	0.598	S	S	*	*	H	α-helix	trans	-70.3	-45.4	178.8	-134.9	85.5	0	0	0	111.7	R4 T5 L10 R11 V12	R4-W8 PolarHBondContact O-N 2.97Å; T5-W8 PolarHBondContact O-N 3.17Å; W8-L10 VanDerWaalsContact C-N 3.32Å; W8-L10 PolarHBondContact O-N 2.93Å; W8-R11 PolarHBondContact O-N 3.11Å; W8-V12 HydrophobicContact CE3-CG2 3.64Å; W8-V12 HydrophobicContact CZ3-CG2 3.65Å; W8-V12 WeakPolarHBondContact O-CG2 3.37Å; W8-V12 PolarHBondContact O-N 3.43Å
9	I	73.6	Confident	66.4	Low	84 Å²	84	125.2 Å²	125.2	43%	0.431	59%	0.591	S	S	.	*	H	α-helix	trans	-60.8	-42.1	175.7	-66.6	164.9	0	0	0	111	M1 T5 R11 V12 L13	M1-I9 HydrophobicContact CE-CD1 3.69Å; T5-I9 WeakPolarHBondContact O-CG1 3.47Å; T5-I9 PolarHBondContact O-N 3.23Å; I9-R11 VanDerWaalsContact C-N 3.34Å; I9-R11 PolarHBondContact O-N 2.98Å; I9-V12 PolarHBondContact O-N 3.18Å; I9-L13 HydrophobicContact CG2-CD1 3.82Å; I9-L13 HydrophobicContact CG2-CG 4.41Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.49Å; I9-L13 PolarHBondContact O-N 3.33Å
10	L	73	Confident	65.7	Low	112 Å²	112	128.5 Å²	128.5	59%	0.586	60%	0.599	S	S	*	*	H	α-helix	trans	-62.9	-40.5	178.4	-143.7	94.8	0	0	0	112	R6 W8 L14	R6-L10 PolarHBondContact O-N 3.04Å; R6-L10 VanDerWaalsContact O-N 3.16Å; W8-L10 VanDerWaalsContact C-N 3.32Å; W8-L10 PolarHBondContact O-N 2.93Å; L10-L14 HydrophobicContact CD2-CD1 4.35Å; L10-L14 WeakPolarHBondContact O-CB 3.23Å; L10-L14 PolarHBondContact O-N 3.42Å
11	R	74	Confident	65.1	Low	188 Å²	188	129.4 Å²	129.4	71%	0.709	61%	0.607	S	S	*	*	H	α-helix	trans	-68.3	-39.4	177.7	-75.1	-177.6	178.8	-152.2	-0.7	112.3	R7 W8 I9 L14 C15	R7-R11 WeakPolarHBondContact O-CG 3.41Å; R7-R11 PolarHBondContact O-N 3.36Å; R7-R11 VanDerWaalsContact O-N 3.17Å; W8-R11 PolarHBondContact O-N 3.11Å; I9-R11 VanDerWaalsContact C-N 3.34Å; I9-R11 PolarHBondContact O-N 2.98Å; R11-L14 PolarHBondContact O-N 3.41Å; R11-C15 WeakPolarHBondContact O-CB 3.37Å; R11-C15 PolarHBondContact O-N 2.96Å; R11-C15 PolarHBondContact O-SG 3.34Å; R11-C15 VanDerWaalsContact O-SG 3.36Å
12	V	73.8	Confident	64.9	Low	61 Å²	61	129.9 Å²	129.9	37%	0.37	60%	0.604	S	S	.	*	H	α-helix	trans	-66	-42.6	176.3	172.3	0	0	0	0	111.1	W8 I9 C15 L16	W8-V12 HydrophobicContact CE3-CG2 3.64Å; W8-V12 HydrophobicContact CZ3-CG2 3.65Å; W8-V12 WeakPolarHBondContact O-CG2 3.37Å; W8-V12 PolarHBondContact O-N 3.43Å; I9-V12 PolarHBondContact O-N 3.18Å; V12-C15 PolarHBondContact O-N 2.99Å; V12-L16 HydrophobicContact CG1-CD1 3.86Å; V12-L16 WeakPolarHBondContact O-CB 3.47Å; V12-L16 WeakPolarHBondContact O-CG 3.39Å; V12-L16 PolarHBondContact O-N 3.34Å
13	L	70.5	Confident	64.2	Low	112 Å²	112	132.9 Å²	132.9	59%	0.586	61%	0.613	S	S	*	*	H	α-helix	trans	-65.7	-38.4	175.8	-72.3	169.5	0	0	0	112.4	I9 L16 G17	I9-L13 HydrophobicContact CG2-CD1 3.82Å; I9-L13 HydrophobicContact CG2-CG 4.41Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.49Å; I9-L13 PolarHBondContact O-N 3.33Å; L13-L16 PolarHBondContact O-N 2.89Å; L13-G17 PolarHBondContact O-N 3.48Å
14	L	70.1	Confident	63.4	Low	100 Å²	100	125.1 Å²	125.1	52%	0.524	60%	0.603	S	S	.	*	H	α-helix	trans	-65.1	-43.7	173.9	-108	131.4	0	0	0	112	L10 R11 G17 I18	L10-L14 HydrophobicContact CD2-CD1 4.35Å; L10-L14 WeakPolarHBondContact O-CB 3.23Å; L10-L14 PolarHBondContact O-N 3.42Å; R11-L14 PolarHBondContact O-N 3.41Å; L14-G17 PolarHBondContact O-N 2.91Å; L14-I18 HydrophobicContact CD2-CD1 4.31Å; L14-I18 WeakPolarHBondContact O-CD1 3.21Å; L14-I18 WeakPolarHBondContact O-CG1 3.42Å; L14-I18 PolarHBondContact O-N 3.07Å
15	C	63.6	Low	62.3	Low	80 Å²	80	117.9 Å²	117.9	54%	0.541	59%	0.594	S	S	.	*	H	α-helix	trans	-64.3	-42.2	175.9	-73.4	0	0	0	0	111.8	R11 V12 I18 V19	R11-C15 WeakPolarHBondContact O-CB 3.37Å; R11-C15 PolarHBondContact O-N 2.96Å; R11-C15 PolarHBondContact O-SG 3.34Å; R11-C15 VanDerWaalsContact O-SG 3.36Å; V12-C15 PolarHBondContact O-N 2.99Å; C15-I18 PolarHBondContact O-N 2.95Å; C15-V19 WeakPolarHBondContact O-CB 3.37Å; C15-V19 WeakPolarHBondContact O-CG2 3.41Å; C15-V19 PolarHBondContact O-N 3.46Å
16	L	59.3	Low	61.2	Low	105 Å²	105	123 Å²	123	55%	0.55	61%	0.611	S	S	.	*	H	α-helix	trans	-64.3	-39.3	175.4	-76.1	165	0	0	0	111.9	V12 L13 V19 Y20	V12-L16 HydrophobicContact CG1-CD1 3.86Å; V12-L16 WeakPolarHBondContact O-CB 3.47Å; V12-L16 WeakPolarHBondContact O-CG 3.39Å; V12-L16 PolarHBondContact O-N 3.34Å; L13-L16 PolarHBondContact O-N 2.89Å; L16-V19 PolarHBondContact O-N 3.27Å; L16-Y20 WeakPolarHBondContact O-CB 3.39Å; L16-Y20 PolarHBondContact O-N 3.44Å
17	G	55.9	Low	60.2	Low	32 Å²	32	117.2 Å²	117.2	33%	0.33	60%	0.599	S	S	.	*	H	α-helix	trans	-65.5	-40.4	175.3	0	0	0	0	0	113.6	L13 L14 Y20 L21	L13-G17 PolarHBondContact O-N 3.48Å; L14-G17 PolarHBondContact O-N 2.91Å; G17-Y20 PolarHBondContact O-N 3.38Å; G17-L21 WeakPolarHBondContact O-CD1 3.34Å; G17-L21 PolarHBondContact O-N 2.98Å
18	I	59.3	Low	59.4	Low	97 Å²	97	112.1 Å²	112.1	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-68.7	-38	176.9	-67	163.5	0	0	0	111.1	L14 C15 L21 K22	L14-I18 HydrophobicContact CD2-CD1 4.31Å; L14-I18 WeakPolarHBondContact O-CD1 3.21Å; L14-I18 WeakPolarHBondContact O-CG1 3.42Å; L14-I18 PolarHBondContact O-N 3.07Å; C15-I18 PolarHBondContact O-N 2.95Å; I18-L21 PolarHBondContact O-N 3.4Å; I18-K22 PolarHBondContact O-N 3.36Å; I18-K22 VanDerWaalsContact O-N 3.1Å
19	V	54.1	Low	58.5	Low	77 Å²	77	108.1 Å²	108.1	47%	0.467	59%	0.59	S	S	.	*	H	α-helix	trans	-67.2	-38.5	174.7	171.3	0	0	0	0	110.8	C15 L16 K22 I23	C15-V19 WeakPolarHBondContact O-CB 3.37Å; C15-V19 WeakPolarHBondContact O-CG2 3.41Å; C15-V19 PolarHBondContact O-N 3.46Å; L16-V19 PolarHBondContact O-N 3.27Å; V19-K22 PolarHBondContact O-N 2.99Å; V19-I23 HydrophobicContact CG1-CD1 3.45Å; V19-I23 VanDerWaalsContact CG1-CD1 3.45Å; V19-I23 HydrophobicContact CG1-CG1 4.35Å; V19-I23 WeakPolarHBondContact O-CB 3.42Å; V19-I23 VanDerWaalsContact O-CG1 3.26Å; V19-I23 WeakPolarHBondContact O-CG1 3.19Å; V19-I23 PolarHBondContact O-N 3.1Å
20	Y	53	Low	57.7	Low	192 Å²	192	108.3 Å²	108.3	75%	0.753	60%	0.595	S	S	*	*	H	α-helix	trans	-65.1	-39.9	174.9	-135.3	-94.2	0	0	0	112.5	L16 G17 K22 I23 G24	L16-Y20 WeakPolarHBondContact O-CB 3.39Å; L16-Y20 PolarHBondContact O-N 3.44Å; G17-Y20 PolarHBondContact O-N 3.38Å; Y20-K22 VanDerWaalsContact C-N 3.32Å; Y20-K22 PolarHBondContact O-N 3.06Å; Y20-I23 PolarHBondContact O-N 3.01Å; Y20-G24 PolarHBondContact O-N 3.45Å; Y20-G24 VanDerWaalsContact O-N 3.12Å
21	L	52.7	Low	57	Low	147 Å²	147	105.7 Å²	105.7	77%	0.77	59%	0.589	S	S	*	*	H	α-helix	trans	-64.9	-33.3	174.3	-105.2	107.8	0	0	0	113	G17 I18	G17-L21 WeakPolarHBondContact O-CD1 3.34Å; G17-L21 PolarHBondContact O-N 2.98Å; I18-L21 PolarHBondContact O-N 3.4Å
22	K	50.7	Low	56.4	Low	187 Å²	187	101.9 Å²	101.9	81%	0.813	58%	0.582	S	S	*	*	H	α-helix	trans	-81.4	-21.4	178.4	-84.3	-158.1	171.9	-170.6	0	114.6	I18 V19 Y20	I18-K22 PolarHBondContact O-N 3.36Å; I18-K22 VanDerWaalsContact O-N 3.1Å; V19-K22 PolarHBondContact O-N 2.99Å; Y20-K22 VanDerWaalsContact C-N 3.32Å; Y20-K22 PolarHBondContact O-N 3.06Å
23	I	53.3	Low	56.3	Low	138 Å²	138	100.4 Å²	100.4	71%	0.708	58%	0.579	S	S	*	*	H	α-helix	trans	-102.9	-21.4	-174.3	-62.5	175.4	0	0	0	112.6	V19 Y20	V19-I23 HydrophobicContact CG1-CD1 3.45Å; V19-I23 VanDerWaalsContact CG1-CD1 3.45Å; V19-I23 HydrophobicContact CG1-CG1 4.35Å; V19-I23 WeakPolarHBondContact O-CB 3.42Å; V19-I23 VanDerWaalsContact O-CG1 3.26Å; V19-I23 WeakPolarHBondContact O-CG1 3.19Å; V19-I23 PolarHBondContact O-N 3.1Å; Y20-I23 PolarHBondContact O-N 3.01Å
24	G	49	Very low	56.7	Low	61 Å²	61	95.5 Å²	95.5	63%	0.629	56%	0.555	S	S	*	*	H	α-helix	trans	-116.1	2.3	-174.3	0	0	0	0	0	117.4	Y20 F26	Y20-G24 PolarHBondContact O-N 3.45Å; Y20-G24 VanDerWaalsContact O-N 3.12Å; G24-F26 PolarHBondContact O-N 3.32Å
25	G	43.4	Very low	57	Low	61 Å²	61	92.3 Å²	92.3	63%	0.629	54%	0.541	S	S	*	.			trans	-89.9	78.1	-169.1	0	0	0	0	0	114.8	S27	G25-S27 PolarHBondContact O-N 3.04Å
26	F	45.3	Very low	57.9	Low	177 Å²	177	92.9 Å²	92.9	78%	0.776	54%	0.537	S	S	*	.			trans	-61.8	123.1	143.5	-83.6	-82.3	0	0	0	106.4	G24 S28	G24-F26 PolarHBondContact O-N 3.32Å; F26-S28 PolarHBondContact O-N 3.18Å; F26-S28 VanDerWaalsContact O-N 3.13Å
27	S	47.3	Very low	59.1	Low	67 Å²	67	92.7 Å²	92.7	47%	0.469	54%	0.536	S	S	.	.			trans	-52.8	124.2	178.6	179.5	0	0	0	0	109.2	G25 V29 V30 A31	G25-S27 PolarHBondContact O-N 3.04Å; S27-V29 PolarHBondContact O-N 3.2Å; S27-V30 WeakPolarHBondContact O-CB 3.44Å; S27-V30 PolarHBondContact O-N 2.98Å; S27-A31 PolarHBondContact O-N 3.13Å
28	S	52.5	Low	60.6	Low	87 Å²	87	91.1 Å²	91.1	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-54.4	-26.9	-178.8	37.2	0	0	0	0	112.5	F26 L32	F26-S28 PolarHBondContact O-N 3.18Å; F26-S28 VanDerWaalsContact O-N 3.13Å; S28-L32 WeakPolarHBondContact O-CB 3.48Å; S28-L32 WeakPolarHBondContact O-CD1 3.26Å; S28-L32 WeakPolarHBondContact O-CG 3.44Å; S28-L32 PolarHBondContact O-N 2.87Å
29	V	53.7	Low	62	Low	106 Å²	106	90.7 Å²	90.7	64%	0.642	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-40.4	174.1	-174.9	0	0	0	0	112.2	S27 G33	S27-V29 PolarHBondContact O-N 3.2Å; V29-G33 PolarHBondContact O-N 3.42Å
30	V	57.6	Low	63.5	Low	88 Å²	88	95 Å²	95	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-70.4	-39.3	177.1	-179.3	0	0	0	0	110.5	S27 G33 A34	S27-V30 WeakPolarHBondContact O-CB 3.44Å; S27-V30 PolarHBondContact O-N 2.98Å; V30-G33 PolarHBondContact O-N 2.93Å; V30-A34 PolarHBondContact O-N 3.12Å
31	A	58.7	Low	65.2	Low	56 Å²	56	87.3 Å²	87.3	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-40.6	175.5	0	0	0	0	0	112.5	S27 S35	S27-A31 PolarHBondContact O-N 3.13Å; A31-S35 WeakPolarHBondContact O-CB 3.44Å; A31-S35 PolarHBondContact O-N 3.31Å; A31-S35 VanDerWaalsContact O-N 3.1Å
32	L	59.7	Low	66.9	Low	109 Å²	109	84.1 Å²	84.1	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-62.4	-45.7	173.3	-80.2	158.5	0	0	0	111.2	S28 S35 I36	S28-L32 WeakPolarHBondContact O-CB 3.48Å; S28-L32 WeakPolarHBondContact O-CD1 3.26Å; S28-L32 WeakPolarHBondContact O-CG 3.44Å; S28-L32 PolarHBondContact O-N 2.87Å; L32-S35 PolarHBondContact O-N 2.86Å; L32-S35 PolarHBondContact O-OG 3.38Å; L32-I36 VanDerWaalsContact O-CG1 3.32Å; L32-I36 WeakPolarHBondContact O-CG1 3.41Å; L32-I36 PolarHBondContact O-N 3.45Å
33	G	72.6	Confident	68.6	Low	30 Å²	30	76.8 Å²	76.8	31%	0.309	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-46.7	177	0	0	0	0	0	113.8	V29 V30 S35 I36 I37	V29-G33 PolarHBondContact O-N 3.42Å; V30-G33 PolarHBondContact O-N 2.93Å; G33-S35 PolarHBondContact O-N 2.95Å; G33-I36 PolarHBondContact O-N 3.01Å; G33-I37 WeakPolarHBondContact O-CG1 3.13Å; G33-I37 PolarHBondContact O-N 3.11Å; G33-I37 VanDerWaalsContact O-N 3.13Å
34	A	78.4	Confident	70.5	Confident	8 Å²	8	70.6 Å²	70.6	7%	0.066	44%	0.437	C	S	.	.	H	α-helix	trans	-62	-42.5	178.1	0	0	0	0	0	112.3	V30 I36 I37 C38 P56	V30-A34 PolarHBondContact O-N 3.12Å; A34-I36 VanDerWaalsContact C-N 3.34Å; A34-I36 PolarHBondContact O-N 3.39Å; A34-I37 PolarHBondContact O-N 3.19Å; A34-C38 VanDerWaalsContact O-CB 3.32Å; A34-C38 WeakPolarHBondContact O-CB 3.44Å; A34-C38 PolarHBondContact O-N 3.06Å; A34-C38 PolarHBondContact O-SG 2.97Å; A34-P56 HydrophobicContact CB-CB 3.88Å; A34-P56 HydrophobicContact CB-CG 3.87Å
35	S	76.9	Confident	72.5	Confident	34 Å²	34	68.6 Å²	68.6	24%	0.238	42%	0.415	C	S	.	.	H	α-helix	trans	-61.2	-40.3	178.6	76.4	0	0	0	0	113	A31 L32 G33 N39	A31-S35 WeakPolarHBondContact O-CB 3.44Å; A31-S35 PolarHBondContact O-N 3.31Å; A31-S35 VanDerWaalsContact O-N 3.1Å; L32-S35 PolarHBondContact O-N 2.86Å; L32-S35 PolarHBondContact O-OG 3.38Å; G33-S35 PolarHBondContact O-N 2.95Å; S35-N39 VanDerWaalsContact O-CB 3.26Å; S35-N39 WeakPolarHBondContact O-CB 3.48Å; S35-N39 PolarHBondContact O-N 3.3Å; S35-N39 VanDerWaalsContact O-N 3.12Å; S35-N39 PolarHBondContact O-ND2 2.78Å; S35-N39 VanDerWaalsContact O-ND2 3.09Å
36	I	81.6	Confident	74.8	Confident	91 Å²	91	70.7 Å²	70.7	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-68.8	-45.5	179.4	-64.4	167.8	0	0	0	110.5	L32 G33 A34 N39 K40	L32-I36 VanDerWaalsContact O-CG1 3.32Å; L32-I36 WeakPolarHBondContact O-CG1 3.41Å; L32-I36 PolarHBondContact O-N 3.45Å; G33-I36 PolarHBondContact O-N 3.01Å; A34-I36 VanDerWaalsContact C-N 3.34Å; A34-I36 PolarHBondContact O-N 3.39Å; I36-N39 PolarHBondContact O-N 2.91Å; I36-K40 HydrophobicContact CG2-CD 4.39Å; I36-K40 WeakPolarHBondContact O-CG 3.32Å; I36-K40 PolarHBondContact O-N 2.81Å
37	I	85.1	Confident	77.1	Confident	101 Å²	101	69 Å²	69	52%	0.518	41%	0.405	S	S	.	.	H	α-helix	trans	-62.4	-54.4	179.7	-65.7	165.8	0	0	0	109.9	G33 A34 N39 K40 I41	G33-I37 WeakPolarHBondContact O-CG1 3.13Å; G33-I37 PolarHBondContact O-N 3.11Å; G33-I37 VanDerWaalsContact O-N 3.13Å; A34-I37 PolarHBondContact O-N 3.19Å; I37-N39 PolarHBondContact O-N 3.41Å; I37-K40 PolarHBondContact O-N 3.39Å; I37-I41 HydrophobicContact CG2-CD1 4.45Å; I37-I41 WeakPolarHBondContact O-CG1 3.36Å; I37-I41 PolarHBondContact O-N 3.1Å
38	C	88.6	Confident	79.4	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-27.1	-176.4	-66	0	0	0	0	113.4	A34 R49 C52 Q53	A34-C38 VanDerWaalsContact O-CB 3.32Å; A34-C38 WeakPolarHBondContact O-CB 3.44Å; A34-C38 PolarHBondContact O-N 3.06Å; A34-C38 PolarHBondContact O-SG 2.97Å; C38-R49 PolarHBondContact O-NH1 2.77Å; C38-C52 HydrophobicContact CB-CB 3.71Å; C38-C52 WeakPolarHBondContact CB-SG 3.34Å; C38-C52 WeakPolarHBondContact SG-CB 3.32Å; C38-C52 PolarHBondContact SG-O 3.25Å; C38-C52 CovalentContact SG-SG 2.03Å; C38-C52 PolarHBondContact SG-SG 3.36Å; C38-Q53 HydrophobicContact CB-CG 3.98Å
39	N	86.9	Confident	81.3	Confident	87 Å²	87	64.4 Å²	64.4	47%	0.465	36%	0.364	S	S	.	.	H	α-helix	trans	-76.6	-27.2	174.5	-76	-22.9	0	0	0	112.9	S35 I36 I37 R49	S35-N39 VanDerWaalsContact O-CB 3.26Å; S35-N39 WeakPolarHBondContact O-CB 3.48Å; S35-N39 PolarHBondContact O-N 3.3Å; S35-N39 VanDerWaalsContact O-N 3.12Å; S35-N39 PolarHBondContact O-ND2 2.78Å; S35-N39 VanDerWaalsContact O-ND2 3.09Å; I36-N39 PolarHBondContact O-N 2.91Å; I37-N39 PolarHBondContact O-N 3.41Å; N39-R49 PolarHBondContact O-NH1 3.23Å
40	K	86.9	Confident	83.2	Confident	167 Å²	167	64.6 Å²	64.6	73%	0.726	36%	0.361	S	S	*	.	H	α-helix	trans	-83.6	-17.1	177.8	-72.7	-177.3	177.5	-175.7	0	114.3	I36 I37 P42	I36-K40 HydrophobicContact CG2-CD 4.39Å; I36-K40 WeakPolarHBondContact O-CG 3.32Å; I36-K40 PolarHBondContact O-N 2.81Å; I37-K40 PolarHBondContact O-N 3.39Å; K40-P42 VanDerWaalsContact O-CD 3.27Å; K40-P42 WeakPolarHBondContact O-CD 3.32Å
41	I	88.1	Confident	84.9	Confident	32 Å²	32	61.8 Å²	61.8	16%	0.164	34%	0.342	C	S	.	.	S	Bend	trans	-67.1	119	179.1	-60.5	171.3	0	0	0	110	I37 L44 R49 I59 F93	I37-I41 HydrophobicContact CG2-CD1 4.45Å; I37-I41 WeakPolarHBondContact O-CG1 3.36Å; I37-I41 PolarHBondContact O-N 3.1Å; I41-L44 HydrophobicContact CB-CD1 3.75Å; I41-L44 HydrophobicContact CB-CG 4.09Å; I41-L44 HydrophobicContact CD1-CD1 4.06Å; I41-L44 HydrophobicContact CG1-CD1 4.47Å; I41-L44 HydrophobicContact CG2-CD1 3.87Å; I41-L44 HydrophobicContact CG2-CG 3.77Å; I41-R49 PolarHBondContact O-NH1 3.46Å; I41-R49 PolarHBondContact O-NH2 3.32Å; I41-I59 HydrophobicContact CD1-CG1 3.63Å; I41-I59 HydrophobicContact CD1-CG2 4.38Å; I41-F93 HydrophobicContact CG2-CD2 3.8Å; I41-F93 HydrophobicContact CG2-CE2 4.05Å
42	P	88.2	Confident	86.6	Confident	79 Å²	79	59.1 Å²	59.1	51%	0.513	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	138.7	-178.3	31.8	-35.5	0	0	0	111.3	K40 T91	K40-P42 VanDerWaalsContact O-CD 3.27Å; K40-P42 WeakPolarHBondContact O-CD 3.32Å; P42-T91 HydrophobicContact CB-CG2 3.67Å; P42-T91 HydrophobicContact CG-CG2 3.54Å; P42-T91 WeakPolarHBondContact O-CB 3.48Å; P42-T91 WeakPolarHBondContact O-CG2 3.47Å; P42-T91 PolarHBondContact O-OG1 3.13Å
43	G	87.9	Confident	88.1	Confident	33 Å²	33	57.4 Å²	57.4	34%	0.34	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-4.1	177.8	0	0	0	0	0	115.8	F93	G43-F93 CarbonylContact O-C 3.54Å; G43-F93 VanDerWaalsContact O-O 3.12Å
44	L	91.6	Very high	89	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.042	32%	0.32	C	S	.	.			trans	-71	128.8	170.7	-70.5	-176	0	0	0	111.6	I41 Q48 R49 C52 I59 F93 F166	I41-L44 HydrophobicContact CB-CD1 3.75Å; I41-L44 HydrophobicContact CB-CG 4.09Å; I41-L44 HydrophobicContact CD1-CD1 4.06Å; I41-L44 HydrophobicContact CG1-CD1 4.47Å; I41-L44 HydrophobicContact CG2-CD1 3.87Å; I41-L44 HydrophobicContact CG2-CG 3.77Å; L44-Q48 HydrophobicContact CB-CB 4.47Å; L44-Q48 HydrophobicContact CD2-CB 4.1Å; L44-R49 HydrophobicContact CB-CG 3.79Å; L44-R49 HydrophobicContact CD1-CG 4.34Å; L44-R49 PolarHBondContact O-NE 2.98Å; L44-C52 HydrophobicContact CD1-CB 4.36Å; L44-I59 HydrophobicContact CD1-CD1 4.3Å; L44-I59 HydrophobicContact CD2-CD1 4.38Å; L44-F93 HydrophobicContact CD2-CB 4Å; L44-F93 HydrophobicContact CD2-CD1 4.04Å; L44-F93 HydrophobicContact CD2-CD2 3.88Å; L44-F93 HydrophobicContact CD2-CE2 4.37Å; L44-F93 HydrophobicContact CD2-CG 3.69Å; L44-F93 HydrophobicContact CG-CD2 4.39Å; L44-F166 HydrophobicContact CD2-CE2 4.39Å; L44-F166 HydrophobicContact CD2-CZ 3.65Å
45	A	91.7	Very high	89.6	Confident	20 Å²	20	60.6 Å²	60.6	17%	0.165	32%	0.322	C	S	.	.			trans	-69.9	155.7	171	0	0	0	0	0	111.4	R47 Q48 R49 R170	A45-R47 VanDerWaalsContact C-N 3.31Å; A45-R47 PolarHBondContact O-N 3.38Å; A45-Q48 HydrophobicContact CB-CG 4.17Å; A45-Q48 WeakPolarHBondContact O-CA 3.45Å; A45-Q48 WeakPolarHBondContact O-CB 3.22Å; A45-Q48 PolarHBondContact O-N 3.23Å; A45-R49 PolarHBondContact O-N 3.46Å; A45-R170 HydrophobicContact CB-CB 4.34Å; A45-R170 HydrophobicContact CB-CG 4.23Å
46	P	92	Very high	90.2	Very high	105 Å²	105	61.2 Å²	61.2	68%	0.682	33%	0.325	S	S	*	.	H	α-helix	trans	-52.2	-43.3	-177.8	-29.5	35.9	0	0	0	114.4	Q48 R49 I50	P46-Q48 PolarHBondContact O-N 2.95Å; P46-R49 WeakPolarHBondContact O-CB 3.39Å; P46-R49 PolarHBondContact O-N 3.48Å; P46-I50 PolarHBondContact O-N 3.14Å
47	R	93.3	Very high	90.5	Very high	140 Å²	140	59.5 Å²	59.5	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-67.5	-33.5	176.7	-70.4	-175.5	175.6	176.3	-2.2	113.2	A45 R49 I50 I51 A169	A45-R47 VanDerWaalsContact C-N 3.31Å; A45-R47 PolarHBondContact O-N 3.38Å; R47-R49 VanDerWaalsContact C-N 3.32Å; R47-I50 PolarHBondContact O-N 2.02Å; R47-I51 WeakPolarHBondContact O-CG1 3.19Å; R47-I51 PolarHBondContact O-N 3.22Å; R47-A169 HydrophobicContact CB-CB 3.84Å
48	Q	94.6	Very high	90.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.5	-32.2	175.7	-64.5	179.1	-50.2	0	0	111.9	L44 A45 P46 I50 I51 C52 F166 A169	L44-Q48 HydrophobicContact CB-CB 4.47Å; L44-Q48 HydrophobicContact CD2-CB 4.1Å; A45-Q48 HydrophobicContact CB-CG 4.17Å; A45-Q48 WeakPolarHBondContact O-CA 3.45Å; A45-Q48 WeakPolarHBondContact O-CB 3.22Å; A45-Q48 PolarHBondContact O-N 3.23Å; P46-Q48 PolarHBondContact O-N 2.95Å; Q48-I50 VanDerWaalsContact C-N 3.34Å; Q48-I51 PolarHBondContact O-N 2.91Å; Q48-C52 WeakPolarHBondContact O-CB 3.45Å; Q48-C52 PolarHBondContact O-N 3.1Å; Q48-F166 HydrophobicContact CB-CD2 4.44Å; Q48-F166 HydrophobicContact CB-CE2 3.89Å; Q48-F166 HydrophobicContact CB-CZ 4.09Å; Q48-F166 HydrophobicContact CG-CE2 4.31Å; Q48-F166 HydrophobicContact CG-CZ 4.32Å; Q48-F166 WeakPolarHBondContact CG-O 3.4Å; Q48-F166 PolarHBondContact NE2-O 3.47Å; Q48-A169 HydrophobicContact CG-CB 3.86Å
49	R	94.1	Very high	91.1	Very high	58 Å²	58	55.3 Å²	55.3	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-39.9	174.7	-65.3	179.1	-173	-89.1	11.9	111.7	C38 N39 I41 L44 A45 P46 R47 I51 C52 Q53	C38-R49 PolarHBondContact O-NH1 2.77Å; N39-R49 PolarHBondContact O-NH1 3.23Å; I41-R49 PolarHBondContact O-NH1 3.46Å; I41-R49 PolarHBondContact O-NH2 3.32Å; L44-R49 HydrophobicContact CB-CG 3.79Å; L44-R49 HydrophobicContact CD1-CG 4.34Å; L44-R49 PolarHBondContact O-NE 2.98Å; A45-R49 PolarHBondContact O-N 3.46Å; P46-R49 WeakPolarHBondContact O-CB 3.39Å; P46-R49 PolarHBondContact O-N 3.48Å; R47-R49 VanDerWaalsContact C-N 3.32Å; R49-I51 VanDerWaalsContact C-N 3.34Å; R49-I51 PolarHBondContact O-N 3.48Å; R49-C52 WeakPolarHBondContact O-CB 2.98Å; R49-C52 PolarHBondContact O-N 2.86Å; R49-Q53 WeakPolarHBondContact O-CB 3.46Å; R49-Q53 VanDerWaalsContact O-CG 3.23Å; R49-Q53 WeakPolarHBondContact O-CG 3.31Å; R49-Q53 PolarHBondContact O-N 2.97Å
50	I	93.2	Very high	91.2	Very high	111 Å²	111	56.7 Å²	56.7	57%	0.569	30%	0.302	S	S	*	.	H	α-helix	trans	-61.6	-44.7	175.3	-61.9	170.1	0	0	0	110.2	P46 R47 Q48 Q53 S54	P46-I50 PolarHBondContact O-N 3.14Å; R47-I50 PolarHBondContact O-N 2.02Å; Q48-I50 VanDerWaalsContact C-N 3.34Å; I50-Q53 PolarHBondContact O-N 3.15Å; I50-S54 PolarHBondContact O-N 3.26Å; I50-S54 PolarHBondContact O-OG 3.41Å
51	I	93.4	Very high	91.7	Very high	28 Å²	28	49.4 Å²	49.4	14%	0.144	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-43.1	177.6	-61.5	158.8	0	0	0	110.8	R47 Q48 R49 Q53 S54 R55 F162 V165 F166 A169	R47-I51 WeakPolarHBondContact O-CG1 3.19Å; R47-I51 PolarHBondContact O-N 3.22Å; Q48-I51 PolarHBondContact O-N 2.91Å; R49-I51 VanDerWaalsContact C-N 3.34Å; R49-I51 PolarHBondContact O-N 3.48Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 3.44Å; I51-S54 WeakPolarHBondContact CA-OG 3.49Å; I51-S54 PolarHBondContact O-N 3.44Å; I51-S54 PolarHBondContact O-OG 3.48Å; I51-R55 PolarHBondContact O-N 2.96Å; I51-F162 HydrophobicContact CG2-CZ 4.35Å; I51-V165 HydrophobicContact CD1-CG1 3.69Å; I51-V165 WeakPolarHBondContact CD1-O 3.23Å; I51-V165 HydrophobicContact CG1-CG1 4.16Å; I51-F166 HydrophobicContact CB-CD2 4.21Å; I51-F166 HydrophobicContact CD1-CD2 4.48Å; I51-F166 HydrophobicContact CG2-CD2 3.9Å; I51-A169 HydrophobicContact CD1-CB 3.8Å
52	C	93.5	Very high	92	Very high	1 Å²	1	48 Å²	48	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-41.7	175.1	179.4	0	0	0	0	111.6	C38 L44 Q48 R49 S54 R55 P56 I59	C38-C52 HydrophobicContact CB-CB 3.71Å; C38-C52 WeakPolarHBondContact CB-SG 3.34Å; C38-C52 WeakPolarHBondContact SG-CB 3.32Å; C38-C52 PolarHBondContact SG-O 3.25Å; C38-C52 CovalentContact SG-SG 2.03Å; C38-C52 PolarHBondContact SG-SG 3.36Å; L44-C52 HydrophobicContact CD1-CB 4.36Å; Q48-C52 WeakPolarHBondContact O-CB 3.45Å; Q48-C52 PolarHBondContact O-N 3.1Å; R49-C52 WeakPolarHBondContact O-CB 2.98Å; R49-C52 PolarHBondContact O-N 2.86Å; C52-S54 VanDerWaalsContact C-N 3.33Å; C52-S54 PolarHBondContact O-N 3.04Å; C52-R55 CarbonylContact O-C 3.57Å; C52-R55 PolarHBondContact O-N 3.32Å; C52-P56 WeakPolarHBondContact O-CA 3.03Å; C52-P56 WeakPolarHBondContact O-CD 3.39Å; C52-I59 HydrophobicContact CB-CD1 4.19Å
53	Q	92.5	Very high	92.3	Very high	72 Å²	72	44.9 Å²	44.9	34%	0.336	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-36.8	177.5	-74.3	168.4	-7.9	0	0	112.3	C38 R49 I50 I51	C38-Q53 HydrophobicContact CB-CG 3.98Å; R49-Q53 WeakPolarHBondContact O-CB 3.46Å; R49-Q53 VanDerWaalsContact O-CG 3.23Å; R49-Q53 WeakPolarHBondContact O-CG 3.31Å; R49-Q53 PolarHBondContact O-N 2.97Å; I50-Q53 PolarHBondContact O-N 3.15Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 3.44Å
54	S	90.6	Very high	92.6	Very high	76 Å²	76	48.9 Å²	48.9	53%	0.531	26%	0.256	S	S	.	.	H	α-helix	trans	-73.7	-29.7	174.8	60.6	0	0	0	0	113.5	I50 I51 C52	I50-S54 PolarHBondContact O-N 3.26Å; I50-S54 PolarHBondContact O-OG 3.41Å; I51-S54 WeakPolarHBondContact CA-OG 3.49Å; I51-S54 PolarHBondContact O-N 3.44Å; I51-S54 PolarHBondContact O-OG 3.48Å; C52-S54 VanDerWaalsContact C-N 3.33Å; C52-S54 PolarHBondContact O-N 3.04Å
55	R	90	Very high	92.9	Very high	29 Å²	29	48.5 Å²	48.5	11%	0.109	25%	0.254	C	S	.	.			trans	-138.1	68	-173.7	-69	-59.8	-54.2	-80.3	-2.1	110.9	I51 C52 D57 A58 D130 Y158 F162	I51-R55 PolarHBondContact O-N 2.96Å; C52-R55 CarbonylContact O-C 3.57Å; C52-R55 PolarHBondContact O-N 3.32Å; R55-D57 VanDerWaalsContact C-N 3.28Å; R55-D57 VanDerWaalsContact C-OD1 3.26Å; R55-D57 WeakPolarHBondContact CA-OD1 3.39Å; R55-D57 IonicContact CZ-OD1 2.92Å; R55-D57 IonicContact CZ-OD2 3.88Å; R55-D57 IonicContact NE-OD1 2.81Å; R55-D57 PolarHBondContact NE-OD1 3.31Å; R55-D57 IonicContact NE-OD2 2.83Å; R55-D57 IonicContact NH2-OD1 3.42Å; R55-D57 IonicContact NH2-OD2 2.87Å; R55-D57 PolarHBondContact NH2-OD2 3.2Å; R55-D57 PolarHBondContact O-N 3.43Å; R55-A58 HydrophobicContact CB-CB 4.24Å; R55-A58 PolarHBondContact O-N 3.15Å; R55-D130 VanDerWaalsContact CD-OD2 3.25Å; R55-D130 WeakPolarHBondContact CD-OD2 3.42Å; R55-D130 IonicContact CZ-OD2 3.56Å; R55-D130 VanDerWaalsContact CZ-OD2 3.23Å; R55-D130 IonicContact NE-OD2 2.78Å; R55-D130 PolarHBondContact NE-OD2 2.95Å; R55-D130 VanDerWaalsContact NE-OD2 3.14Å; R55-D130 IonicContact NH1-OD2 2.94Å; R55-D130 PolarHBondContact NH1-OD2 2.92Å; R55-D130 IonicContact NH2-OD2 3.11Å; R55-Y158 PolarHBondContact NH1-OH 3.16Å; R55-F162 HydrophobicContact CB-CE2 4.38Å; R55-F162 HydrophobicContact CB-CZ 4.31Å; R55-F162 HydrophobicContact CG-CE2 4.39Å
56	P	89.8	Confident	93.1	Very high	47 Å²	47	47.7 Å²	47.7	31%	0.305	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-24.3	-176.8	29.1	-35.5	0	0	0	112.3	A34 C52 A58 I59	A34-P56 HydrophobicContact CB-CB 3.88Å; A34-P56 HydrophobicContact CB-CG 3.87Å; C52-P56 WeakPolarHBondContact O-CA 3.03Å; C52-P56 WeakPolarHBondContact O-CD 3.39Å; P56-A58 VanDerWaalsContact C-N 3.3Å; P56-A58 PolarHBondContact O-N 3.21Å; P56-I59 VanDerWaalsContact O-CG2 3.22Å; P56-I59 WeakPolarHBondContact O-CG2 3.04Å; P56-I59 PolarHBondContact O-N 2.01Å
57	D	88.5	Confident	93.2	Very high	55 Å²	55	45.8 Å²	45.8	29%	0.294	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-39.7	171.9	62	-40.1	0	0	0	111.9	R55 I59 L128	R55-D57 VanDerWaalsContact C-N 3.28Å; R55-D57 VanDerWaalsContact C-OD1 3.26Å; R55-D57 WeakPolarHBondContact CA-OD1 3.39Å; R55-D57 IonicContact CZ-OD1 2.92Å; R55-D57 IonicContact CZ-OD2 3.88Å; R55-D57 IonicContact NE-OD1 2.81Å; R55-D57 PolarHBondContact NE-OD1 3.31Å; R55-D57 IonicContact NE-OD2 2.83Å; R55-D57 IonicContact NH2-OD1 3.42Å; R55-D57 IonicContact NH2-OD2 2.87Å; R55-D57 PolarHBondContact NH2-OD2 3.2Å; R55-D57 PolarHBondContact O-N 3.43Å; D57-I59 PolarHBondContact O-N 3.14Å; D57-L128 HydrophobicContact CB-CD2 4.33Å
58	A	93.1	Very high	93.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-74.5	-23.8	-177	0	0	0	0	0	113.5	R55 P56 I60 V61 I62 I119 L128 F162	R55-A58 HydrophobicContact CB-CB 4.24Å; R55-A58 PolarHBondContact O-N 3.15Å; P56-A58 VanDerWaalsContact C-N 3.3Å; P56-A58 PolarHBondContact O-N 3.21Å; A58-I60 VanDerWaalsContact C-N 3.27Å; A58-I60 PolarHBondContact O-N 3.1Å; A58-V61 PolarHBondContact O-N 2.85Å; A58-V61 VanDerWaalsContact O-N 3.11Å; A58-I62 HydrophobicContact CB-CD1 4.3Å; A58-I62 WeakPolarHBondContact O-CG1 3.41Å; A58-I62 PolarHBondContact O-N 2.04Å; A58-I119 HydrophobicContact CB-CD1 4.27Å; A58-L128 HydrophobicContact CB-CD2 4.41Å; A58-F162 HydrophobicContact CB-CE1 4.27Å; A58-F162 HydrophobicContact CB-CE2 4.03Å; A58-F162 HydrophobicContact CB-CZ 3.57Å
59	I	92.3	Very high	93.5	Very high	13 Å²	13	42 Å²	42	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-33.1	-168.9	-162.5	59.2	0	0	0	113.7	I41 L44 C52 P56 D57 I62 G63 F93 F166	I41-I59 HydrophobicContact CD1-CG1 3.63Å; I41-I59 HydrophobicContact CD1-CG2 4.38Å; L44-I59 HydrophobicContact CD1-CD1 4.3Å; L44-I59 HydrophobicContact CD2-CD1 4.38Å; C52-I59 HydrophobicContact CB-CD1 4.19Å; P56-I59 VanDerWaalsContact O-CG2 3.22Å; P56-I59 WeakPolarHBondContact O-CG2 3.04Å; P56-I59 PolarHBondContact O-N 2.01Å; D57-I59 PolarHBondContact O-N 3.14Å; I59-I62 HydrophobicContact CD1-CD1 4.14Å; I59-G63 PolarHBondContact O-N 3Å; I59-F93 HydrophobicContact CD1-CE2 4.49Å; I59-F93 HydrophobicContact CD1-CZ 4.15Å; I59-F166 HydrophobicContact CD1-CE2 3.9Å; I59-F166 HydrophobicContact CD1-CZ 3.8Å
60	I	91.1	Very high	93.6	Very high	116 Å²	116	39.4 Å²	39.4	60%	0.595	21%	0.209	S	C	*	.	H	α-helix	trans	-66.5	-50.1	177.3	-60.5	175.6	0	0	0	109.2	A58 I62 G63 E64	A58-I60 VanDerWaalsContact C-N 3.27Å; A58-I60 PolarHBondContact O-N 3.1Å; I60-I62 VanDerWaalsContact C-N 3.31Å; I60-I62 PolarHBondContact O-N 3.09Å; I60-G63 WeakPolarHBondContact O-CA 3.43Å; I60-G63 PolarHBondContact O-N 3.01Å; I60-E64 WeakPolarHBondContact O-CG 3.37Å; I60-E64 PolarHBondContact O-N 3.36Å
61	V	96	Very high	93.7	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.085	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-38.9	178.1	-177.5	0	0	0	0	111.7	A58 G63 E64 G65 A118 I119 A122 L128	A58-V61 PolarHBondContact O-N 2.85Å; A58-V61 VanDerWaalsContact O-N 3.11Å; V61-G63 VanDerWaalsContact C-N 3.33Å; V61-G63 PolarHBondContact O-N 2.91Å; V61-E64 PolarHBondContact O-N 3.28Å; V61-G65 PolarHBondContact O-N 2.9Å; V61-A118 HydrophobicContact CG1-CB 3.96Å; V61-A118 WeakPolarHBondContact CG1-O 3.03Å; V61-I119 HydrophobicContact CB-CD1 4.06Å; V61-I119 HydrophobicContact CG1-CD1 3.78Å; V61-I119 HydrophobicContact CG1-CG1 4.32Å; V61-A122 HydrophobicContact CG1-CB 3.73Å; V61-A122 HydrophobicContact CG2-CB 3.98Å; V61-L128 HydrophobicContact CG2-CD2 4.13Å; V61-L128 HydrophobicContact CG2-CG 4.47Å
62	I	95.5	Very high	93.9	Very high	2 Å²	2	37 Å²	37	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-43.2	174.2	-60.7	165.1	0	0	0	110.3	A58 I59 I60 G65 A66 F93 V115 I119 F162 F166	A58-I62 HydrophobicContact CB-CD1 4.3Å; A58-I62 WeakPolarHBondContact O-CG1 3.41Å; A58-I62 PolarHBondContact O-N 2.04Å; I59-I62 HydrophobicContact CD1-CD1 4.14Å; I60-I62 VanDerWaalsContact C-N 3.31Å; I60-I62 PolarHBondContact O-N 3.09Å; I62-G65 PolarHBondContact O-N 3.35Å; I62-A66 WeakPolarHBondContact O-CB 3.45Å; I62-A66 PolarHBondContact O-N 3.23Å; I62-F93 HydrophobicContact CG2-CE1 3.71Å; I62-F93 HydrophobicContact CG2-CZ 4.21Å; I62-V115 HydrophobicContact CG1-CG1 4.4Å; I62-V115 HydrophobicContact CG2-CG1 3.97Å; I62-V115 HydrophobicContact CG2-CG2 4.19Å; I62-I119 HydrophobicContact CG1-CD1 4.02Å; I62-F162 HydrophobicContact CD1-CD1 4.42Å; I62-F162 HydrophobicContact CD1-CE1 3.45Å; I62-F162 VanDerWaalsContact CD1-CE1 3.45Å; I62-F162 HydrophobicContact CD1-CZ 4.07Å; I62-F162 HydrophobicContact CG1-CE1 3.95Å; I62-F166 HydrophobicContact CD1-CD1 4.21Å; I62-F166 HydrophobicContact CD1-CD2 3.74Å; I62-F166 HydrophobicContact CD1-CE1 4.33Å; I62-F166 HydrophobicContact CD1-CE2 3.83Å; I62-F166 HydrophobicContact CD1-CG 3.92Å; I62-F166 HydrophobicContact CD1-CZ 4.12Å; I62-F166 HydrophobicContact CG2-CD1 3.56Å; I62-F166 HydrophobicContact CG2-CE1 3.36Å; I62-F166 HydrophobicContact CG2-CG 4.31Å; I62-F166 HydrophobicContact CG2-CZ 3.92Å
63	G	93.8	Very high	94.1	Very high	14 Å²	14	37 Å²	37	14%	0.144	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-45.5	176.8	0	0	0	0	0	112.1	I59 I60 V61 A66 Q67	I59-G63 PolarHBondContact O-N 3Å; I60-G63 WeakPolarHBondContact O-CA 3.43Å; I60-G63 PolarHBondContact O-N 3.01Å; V61-G63 VanDerWaalsContact C-N 3.33Å; V61-G63 PolarHBondContact O-N 2.91Å; G63-A66 PolarHBondContact O-N 2.82Å; G63-Q67 WeakPolarHBondContact O-CB 3.04Å; G63-Q67 PolarHBondContact O-N 3.27Å
64	E	94.9	Very high	94.2	Very high	118 Å²	118	36.8 Å²	36.8	55%	0.551	20%	0.196	S	C	*	.	H	α-helix	trans	-60.8	-44.2	174.4	-69.4	175.6	174.2	0	0	111.9	I60 V61 Q67 M68	I60-E64 WeakPolarHBondContact O-CG 3.37Å; I60-E64 PolarHBondContact O-N 3.36Å; V61-E64 PolarHBondContact O-N 3.28Å; E64-Q67 PolarHBondContact O-N 3Å; E64-M68 WeakPolarHBondContact O-CB 3.08Å; E64-M68 PolarHBondContact O-N 2.03Å
65	G	97.3	Very high	94.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-39.3	176.4	0	0	0	0	0	113.3	V61 I62 M68 G69 G114 A118	V61-G65 PolarHBondContact O-N 2.9Å; I62-G65 PolarHBondContact O-N 3.35Å; G65-M68 WeakPolarHBondContact O-CB 3.2Å; G65-M68 PolarHBondContact O-N 3.09Å; G65-G69 PolarHBondContact O-N 3.49Å; G65-G114 WeakPolarHBondContact CA-O 3.37Å; G65-G114 CarbonylContact O-C 3.53Å; G65-G114 WeakPolarHBondContact O-CA 3.29Å; G65-A118 VanDerWaalsContact CA-CB 3.47Å
66	A	95.8	Very high	94.8	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.017	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-43.4	174.2	0	0	0	0	0	111.1	I62 G63 M68 G69 I70 V92 I111 V115	I62-A66 WeakPolarHBondContact O-CB 3.45Å; I62-A66 PolarHBondContact O-N 3.23Å; G63-A66 PolarHBondContact O-N 2.82Å; A66-M68 VanDerWaalsContact C-N 3.35Å; A66-G69 PolarHBondContact O-N 3.12Å; A66-I70 WeakPolarHBondContact O-CG1 3.27Å; A66-I70 PolarHBondContact O-N 3.26Å; A66-V92 HydrophobicContact CB-CB 4.08Å; A66-V92 HydrophobicContact CB-CG2 4.28Å; A66-I111 HydrophobicContact CB-CG2 4.36Å; A66-V115 HydrophobicContact CB-CG2 4.27Å
67	Q	94.9	Very high	95.1	Very high	65 Å²	65	34 Å²	34	30%	0.304	17%	0.171	S	C	.	.	H	α-helix	trans	-63.8	-40.3	175.9	-171.1	61.6	53	0	0	111.8	G63 E64 G69 I70 N71 V92	G63-Q67 WeakPolarHBondContact O-CB 3.04Å; G63-Q67 PolarHBondContact O-N 3.27Å; E64-Q67 PolarHBondContact O-N 3Å; Q67-G69 VanDerWaalsContact C-N 3.3Å; Q67-G69 PolarHBondContact O-N 3.21Å; Q67-I70 PolarHBondContact O-N 3.42Å; Q67-N71 PolarHBondContact NE2-OD1 2.88Å; Q67-N71 WeakPolarHBondContact O-CB 3.03Å; Q67-N71 PolarHBondContact O-N 2.74Å; Q67-N71 PolarHBondContact O-OD1 3.26Å; Q67-V92 HydrophobicContact CB-CG1 4.28Å
68	M	96.8	Very high	95.2	Very high	60 Å²	60	36.7 Å²	36.7	30%	0.296	18%	0.18	S	C	.	.	H	α-helix	trans	-57.3	-44.9	173.8	-172.5	-168.4	-61.1	0	0	110.9	E64 G65 A66 N71 E72 F221	E64-M68 WeakPolarHBondContact O-CB 3.08Å; E64-M68 PolarHBondContact O-N 2.03Å; G65-M68 WeakPolarHBondContact O-CB 3.2Å; G65-M68 PolarHBondContact O-N 3.09Å; A66-M68 VanDerWaalsContact C-N 3.35Å; M68-N71 PolarHBondContact O-N 3.21Å; M68-E72 WeakPolarHBondContact O-CB 3.02Å; M68-E72 PolarHBondContact O-N 2.9Å; M68-F221 HydrophobicContact CG-CD1 3.62Å; M68-F221 HydrophobicContact CG-CD2 4.45Å; M68-F221 HydrophobicContact CG-CE1 3.84Å; M68-F221 HydrophobicContact CG-CG 3.94Å; M68-F221 HydrophobicContact CG-CZ 4.38Å; M68-F221 HydrophobicContact SD-CB 3.95Å; M68-F221 HydrophobicContact SD-CD1 3.89Å; M68-F221 HydrophobicContact SD-CD2 3.67Å; M68-F221 HydrophobicContact SD-CE1 4.29Å; M68-F221 HydrophobicContact SD-CE2 4.15Å; M68-F221 HydrophobicContact SD-CG 3.54Å; M68-F221 VanDerWaalsContact SD-CG 3.54Å; M68-F221 HydrophobicContact SD-CZ 4.42Å
69	G	96.8	Very high	95	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-43.8	174.1	0	0	0	0	0	113.6	G65 A66 Q67 E72 C73	G65-G69 PolarHBondContact O-N 3.49Å; A66-G69 PolarHBondContact O-N 3.12Å; Q67-G69 VanDerWaalsContact C-N 3.3Å; Q67-G69 PolarHBondContact O-N 3.21Å; G69-E72 PolarHBondContact O-N 2.73Å; G69-C73 WeakPolarHBondContact O-CB 3.44Å; G69-C73 PolarHBondContact O-N 3.02Å
70	I	95.1	Very high	95	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-45.3	177.9	-67.6	166.1	0	0	0	111	A66 Q67 E72 C73 Q74 L87 V92 I111	A66-I70 WeakPolarHBondContact O-CG1 3.27Å; A66-I70 PolarHBondContact O-N 3.26Å; Q67-I70 PolarHBondContact O-N 3.42Å; I70-E72 VanDerWaalsContact C-N 3.31Å; I70-E72 PolarHBondContact O-N 3.32Å; I70-C73 WeakPolarHBondContact O-CB 3.26Å; I70-C73 PolarHBondContact O-N 2.03Å; I70-C73 VanDerWaalsContact O-N 3.16Å; I70-Q74 WeakPolarHBondContact O-CG 3.25Å; I70-Q74 PolarHBondContact O-N 3.05Å; I70-L87 HydrophobicContact CG1-CB 4.36Å; I70-L87 HydrophobicContact CG2-CB 4.26Å; I70-V92 HydrophobicContact CD1-CB 4.21Å; I70-V92 HydrophobicContact CD1-CG1 4.13Å; I70-I111 HydrophobicContact CG1-CD1 4.23Å; I70-I111 HydrophobicContact CG1-CG1 4.44Å
71	N	95.9	Very high	95	Very high	79 Å²	79	39.2 Å²	39.2	42%	0.422	19%	0.192	S	C	.	.	H	α-helix	trans	-60.8	-42.6	178.6	-70.4	-8.6	0	0	0	111.2	Q67 M68 Q74 F75	Q67-N71 PolarHBondContact NE2-OD1 2.88Å; Q67-N71 WeakPolarHBondContact O-CB 3.03Å; Q67-N71 PolarHBondContact O-N 2.74Å; Q67-N71 PolarHBondContact O-OD1 3.26Å; M68-N71 PolarHBondContact O-N 3.21Å; N71-Q74 PolarHBondContact O-N 3.46Å; N71-F75 WeakPolarHBondContact O-CB 3.48Å; N71-F75 PolarHBondContact O-N 3.32Å
72	E	98	Very high	94.9	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-68.4	-37.1	176.8	-171.4	54.4	-148.1	0	0	111.6	M68 G69 I70 F75 Q76 I110 F221 R222	M68-E72 WeakPolarHBondContact O-CB 3.02Å; M68-E72 PolarHBondContact O-N 2.9Å; G69-E72 PolarHBondContact O-N 2.73Å; I70-E72 VanDerWaalsContact C-N 3.31Å; I70-E72 PolarHBondContact O-N 3.32Å; E72-F75 WeakPolarHBondContact O-CB 3.42Å; E72-F75 PolarHBondContact O-N 3.17Å; E72-Q76 HydrophobicContact CG-CG 4.42Å; E72-Q76 VanDerWaalsContact O-CG 3.28Å; E72-Q76 WeakPolarHBondContact O-CG 3.23Å; E72-Q76 PolarHBondContact O-N 3.39Å; E72-Q76 PolarHBondContact OE1-NE2 3.36Å; E72-I110 HydrophobicContact CB-CD1 4.47Å; E72-I110 HydrophobicContact CB-CG1 4.28Å; E72-I110 HydrophobicContact CG-CD1 4.1Å; E72-I110 HydrophobicContact CG-CG1 4.37Å; E72-F221 HydrophobicContact CB-CD1 3.81Å; E72-F221 HydrophobicContact CB-CE1 3.56Å; E72-F221 HydrophobicContact CG-CD1 3.98Å; E72-F221 HydrophobicContact CG-CE1 3.96Å; E72-R222 VanDerWaalsContact OE1-CD 3.23Å; E72-R222 WeakPolarHBondContact OE1-CD 3.48Å; E72-R222 IonicContact OE1-NE 2.98Å; E72-R222 PolarHBondContact OE1-NE 2.91Å; E72-R222 VanDerWaalsContact OE1-NE 3.11Å; E72-R222 IonicContact OE2-CZ 2.79Å; E72-R222 IonicContact OE2-NE 3.27Å; E72-R222 PolarHBondContact OE2-NE 3.11Å; E72-R222 IonicContact OE2-NH2 3.96Å; E72-R222 PolarHBondContact OE2-NH2 2.86Å
73	C	96.7	Very high	94.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-47.6	172.3	-177.6	0	0	0	0	112.4	G69 I70 F75 Q76 F77 W82 C84 F106 I110	G69-C73 WeakPolarHBondContact O-CB 3.44Å; G69-C73 PolarHBondContact O-N 3.02Å; I70-C73 WeakPolarHBondContact O-CB 3.26Å; I70-C73 PolarHBondContact O-N 2.03Å; I70-C73 VanDerWaalsContact O-N 3.16Å; C73-F75 VanDerWaalsContact C-N 3.29Å; C73-F75 PolarHBondContact O-N 2.92Å; C73-Q76 PolarHBondContact O-N 3.19Å; C73-F77 WeakPolarHBondContact O-CB 3.06Å; C73-F77 WeakPolarHBondContact O-CD2 3.39Å; C73-F77 PolarHBondContact O-N 3.02Å; C73-W82 VanDerWaalsContact SG-CH2 3.51Å; C73-C84 HydrophobicContact CB-CB 3.96Å; C73-C84 WeakPolarHBondContact CB-SG 3.47Å; C73-C84 WeakPolarHBondContact SG-CB 3.36Å; C73-C84 CovalentContact SG-SG 2.04Å; C73-C84 PolarHBondContact SG-SG 3.32Å; C73-F106 HydrophobicContact CB-CE1 4.01Å; C73-I110 HydrophobicContact CB-CG2 4.22Å
74	Q	95.3	Very high	94.6	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	20%	0.196	S	C	.	.	H	α-helix	trans	-60.6	-40.4	174.9	-69.5	174	-5.2	0	0	111.4	I70 N71 F77 K78 C84	I70-Q74 WeakPolarHBondContact O-CG 3.25Å; I70-Q74 PolarHBondContact O-N 3.05Å; N71-Q74 PolarHBondContact O-N 3.46Å; Q74-F77 CarbonylContact O-C 3.54Å; Q74-F77 PolarHBondContact O-N 2.88Å; Q74-K78 WeakPolarHBondContact O-CA 3.47Å; Q74-K78 WeakPolarHBondContact O-CB 3.43Å; Q74-K78 PolarHBondContact O-N 3.04Å; Q74-C84 HydrophobicContact CG-CB 3.97Å
75	F	96.4	Very high	94	Very high	57 Å²	57	37.2 Å²	37.2	25%	0.25	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-48.1	175.7	178.2	-91.5	0	0	0	112.4	N71 E72 C73 F77 K78 R222 Y226	N71-F75 WeakPolarHBondContact O-CB 3.48Å; N71-F75 PolarHBondContact O-N 3.32Å; E72-F75 WeakPolarHBondContact O-CB 3.42Å; E72-F75 PolarHBondContact O-N 3.17Å; C73-F75 VanDerWaalsContact C-N 3.29Å; C73-F75 PolarHBondContact O-N 2.92Å; F75-F77 VanDerWaalsContact C-N 3.26Å; F75-F77 PolarHBondContact O-N 2.88Å; F75-K78 WeakPolarHBondContact O-CD 3.22Å; F75-K78 WeakPolarHBondContact O-CG 3.49Å; F75-R222 VanDerWaalsContact CD1-NE 3.32Å; F75-R222 VanDerWaalsContact CE1-CD 3.46Å; F75-R222 VanDerWaalsContact CE1-CZ 3.49Å; F75-Y226 HydrophobicContact CE1-CE1 4.02Å
76	Q	97.3	Very high	93	Very high	27 Å²	27	37.6 Å²	37.6	13%	0.126	19%	0.186	C	C	.	.	H	α-helix	trans	-68.7	-24.1	-178.3	-67.6	-62.7	-26.8	0	0	113	E72 C73 F106 Y226 K229	E72-Q76 HydrophobicContact CG-CG 4.42Å; E72-Q76 VanDerWaalsContact O-CG 3.28Å; E72-Q76 WeakPolarHBondContact O-CG 3.23Å; E72-Q76 PolarHBondContact O-N 3.39Å; E72-Q76 PolarHBondContact OE1-NE2 3.36Å; C73-Q76 PolarHBondContact O-N 3.19Å; Q76-F106 HydrophobicContact CB-CZ 4.16Å; Q76-F106 HydrophobicContact CG-CZ 4.09Å; Q76-Y226 VanDerWaalsContact NE2-CE1 3.35Å; Q76-K229 HydrophobicContact CB-CD 4.36Å
77	F	94.9	Very high	92.1	Very high	9 Å²	9	38 Å²	38	4%	0.039	19%	0.188	C	C	.	.	H	α-helix	trans	-114	6.3	-176.1	-73.4	-97.1	0	0	0	114.5	C73 Q74 F75 N79 G80 W82 N83 E103 F106 K229 Y232	C73-F77 WeakPolarHBondContact O-CB 3.06Å; C73-F77 WeakPolarHBondContact O-CD2 3.39Å; C73-F77 PolarHBondContact O-N 3.02Å; Q74-F77 CarbonylContact O-C 3.54Å; Q74-F77 PolarHBondContact O-N 2.88Å; F75-F77 VanDerWaalsContact C-N 3.26Å; F75-F77 PolarHBondContact O-N 2.88Å; F77-N79 PolarHBondContact O-N 3.49Å; F77-G80 PolarHBondContact O-N 3.2Å; F77-W82 HydrophobicContact CB-CE3 4.15Å; F77-W82 HydrophobicContact CB-CZ3 4.16Å; F77-W82 WeakPolarHBondContact CB-O 3.4Å; F77-W82 AromaticContact CD1-CE3 3.41Å; F77-W82 HydrophobicContact CD1-CE3 3.41Å; F77-W82 VanDerWaalsContact CD1-CE3 3.41Å; F77-W82 AromaticContact CD1-CZ3 3.58Å; F77-W82 HydrophobicContact CD1-CZ3 3.58Å; F77-W82 HydrophobicContact CD2-CE3 4.41Å; F77-W82 AromaticContact CD2-CZ3 3.77Å; F77-W82 HydrophobicContact CD2-CZ3 3.77Å; F77-W82 AromaticContact CE1-CE3 3.75Å; F77-W82 HydrophobicContact CE1-CE3 3.75Å; F77-W82 AromaticContact CE1-CZ3 3.73Å; F77-W82 HydrophobicContact CE1-CZ3 3.73Å; F77-W82 AromaticContact CE2-CZ3 3.96Å; F77-W82 HydrophobicContact CE2-CZ3 3.96Å; F77-W82 AromaticContact CG-CE3 3.76Å; F77-W82 HydrophobicContact CG-CE3 3.76Å; F77-W82 AromaticContact CG-CZ3 3.57Å; F77-W82 HydrophobicContact CG-CZ3 3.57Å; F77-W82 HydrophobicContact CZ-CE3 4.4Å; F77-W82 AromaticContact CZ-CZ3 3.91Å; F77-W82 HydrophobicContact CZ-CZ3 3.91Å; F77-N83 WeakPolarHBondContact O-CA 2.99Å; F77-E103 HydrophobicContact CE1-CG 4.43Å; F77-F106 HydrophobicContact CD2-CD1 4.38Å; F77-F106 HydrophobicContact CD2-CE1 4.25Å; F77-F106 HydrophobicContact CE2-CB 4.49Å; F77-F106 AromaticContact CE2-CD1 3.54Å; F77-F106 HydrophobicContact CE2-CD1 3.54Å; F77-F106 HydrophobicContact CE2-CD2 4.12Å; F77-F106 AromaticContact CE2-CE1 3.69Å; F77-F106 HydrophobicContact CE2-CE1 3.69Å; F77-F106 HydrophobicContact CE2-CE2 4.22Å; F77-F106 AromaticContact CE2-CG 3.78Å; F77-F106 HydrophobicContact CE2-CG 3.78Å; F77-F106 HydrophobicContact CE2-CZ 4.03Å; F77-F106 HydrophobicContact CZ-CB 4.42Å; F77-F106 HydrophobicContact CZ-CD1 4.27Å; F77-F106 HydrophobicContact CZ-CG 4.14Å; F77-K229 HydrophobicContact CE2-CD 4.07Å; F77-K229 HydrophobicContact CZ-CD 4.16Å; F77-Y232 HydrophobicContact CE1-CD1 4.43Å; F77-Y232 HydrophobicContact CE1-CD2 4.44Å; F77-Y232 AromaticContact CE1-CE1 3.92Å; F77-Y232 HydrophobicContact CE1-CE1 3.92Å; F77-Y232 AromaticContact CE1-CE2 3.88Å; F77-Y232 HydrophobicContact CE1-CE2 3.88Å; F77-Y232 AromaticContact CE1-CZ 3.61Å; F77-Y232 HydrophobicContact CZ-CD1 4.09Å; F77-Y232 AromaticContact CZ-CD2 3.84Å; F77-Y232 HydrophobicContact CZ-CD2 3.84Å; F77-Y232 HydrophobicContact CZ-CE1 4.02Å; F77-Y232 AromaticContact CZ-CE2 3.72Å; F77-Y232 HydrophobicContact CZ-CE2 3.72Å; F77-Y232 HydrophobicContact CZ-CG 4.01Å; F77-Y232 AromaticContact CZ-CZ 3.84Å
78	K	92.1	Very high	90.6	Very high	112 Å²	112	36.1 Å²	36.1	49%	0.487	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-33.1	-178	65.6	-172.3	179.2	-176	0	114.6	Q74 F75 R292	Q74-K78 WeakPolarHBondContact O-CA 3.47Å; Q74-K78 WeakPolarHBondContact O-CB 3.43Å; Q74-K78 PolarHBondContact O-N 3.04Å; F75-K78 WeakPolarHBondContact O-CD 3.22Å; F75-K78 WeakPolarHBondContact O-CG 3.49Å; K78-R292 PolarHBondContact O-NH2 3.39Å
79	N	89.1	Confident	89.1	Confident	84 Å²	84	39.3 Å²	39.3	45%	0.449	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.3	-176.6	-70.7	-14.9	0	0	0	113.9	F77	F77-N79 PolarHBondContact O-N 3.49Å
80	G	90.6	Very high	87.5	Confident	14 Å²	14	50.4 Å²	50.4	14%	0.144	24%	0.242	C	C	.	.	S	Bend	trans	-98.1	157.9	179.8	0	0	0	0	0	112.5	F77 W82 R292	F77-G80 PolarHBondContact O-N 3.2Å; G80-W82 CarbonylContact C-O 3.49Å; G80-W82 CarbonylContact O-C 3.49Å; G80-W82 PolarHBondContact O-N 3.38Å; G80-R292 PolarHBondContact O-NH1 2.64Å; G80-R292 PolarHBondContact O-NH2 2.85Å
81	R	92.7	Very high	86.8	Confident	84 Å²	84	51.6 Å²	51.6	32%	0.317	25%	0.25	S	C	.	.	S	Bend	trans	-57.5	-38.2	179.2	-65.1	179.4	-174.7	161.1	2.3	112.6	T289 R292 L307 M308	R81-T289 HydrophobicContact CB-CG2 3.96Å; R81-T289 HydrophobicContact CG-CG2 4.07Å; R81-R292 PolarHBondContact O-NH1 3.38Å; R81-L307 PolarHBondContact NE-O 3.28Å; R81-L307 PolarHBondContact NH2-O 2.89Å; R81-M308 HydrophobicContact CB-CE 3.92Å; R81-M308 HydrophobicContact CG-CE 3.43Å; R81-M308 VanDerWaalsContact CG-CE 3.43Å
82	W	92.8	Very high	86.1	Confident	20 Å²	20	49.6 Å²	49.6	8%	0.076	24%	0.24	C	C	.	.	S	Bend	trans	-93.2	120.4	162.2	-176.5	86	0	0	0	108.8	C73 F77 G80 C84 L97 E103 T107 Y277	C73-W82 VanDerWaalsContact SG-CH2 3.51Å; F77-W82 HydrophobicContact CB-CE3 4.15Å; F77-W82 HydrophobicContact CB-CZ3 4.16Å; F77-W82 WeakPolarHBondContact CB-O 3.4Å; F77-W82 AromaticContact CD1-CE3 3.41Å; F77-W82 HydrophobicContact CD1-CE3 3.41Å; F77-W82 VanDerWaalsContact CD1-CE3 3.41Å; F77-W82 AromaticContact CD1-CZ3 3.58Å; F77-W82 HydrophobicContact CD1-CZ3 3.58Å; F77-W82 HydrophobicContact CD2-CE3 4.41Å; F77-W82 AromaticContact CD2-CZ3 3.77Å; F77-W82 HydrophobicContact CD2-CZ3 3.77Å; F77-W82 AromaticContact CE1-CE3 3.75Å; F77-W82 HydrophobicContact CE1-CE3 3.75Å; F77-W82 AromaticContact CE1-CZ3 3.73Å; F77-W82 HydrophobicContact CE1-CZ3 3.73Å; F77-W82 AromaticContact CE2-CZ3 3.96Å; F77-W82 HydrophobicContact CE2-CZ3 3.96Å; F77-W82 AromaticContact CG-CE3 3.76Å; F77-W82 HydrophobicContact CG-CE3 3.76Å; F77-W82 AromaticContact CG-CZ3 3.57Å; F77-W82 HydrophobicContact CG-CZ3 3.57Å; F77-W82 HydrophobicContact CZ-CE3 4.4Å; F77-W82 AromaticContact CZ-CZ3 3.91Å; F77-W82 HydrophobicContact CZ-CZ3 3.91Å; G80-W82 CarbonylContact C-O 3.49Å; G80-W82 CarbonylContact O-C 3.49Å; G80-W82 PolarHBondContact O-N 3.38Å; W82-C84 HydrophobicContact CH2-CB 3.64Å; W82-C84 WeakPolarHBondContact CH2-SG 3.47Å; W82-C84 HydrophobicContact CZ2-CB 3.99Å; W82-C84 HydrophobicContact CZ3-CB 3.97Å; W82-L97 HydrophobicContact CZ2-CD1 3.92Å; W82-E103 HydrophobicContact CB-CG 4.38Å; W82-E103 HydrophobicContact CD2-CB 3.78Å; W82-E103 HydrophobicContact CD2-CG 3.66Å; W82-E103 HydrophobicContact CE3-CB 3.71Å; W82-E103 HydrophobicContact CE3-CG 3.5Å; W82-E103 HydrophobicContact CG-CB 4.48Å; W82-E103 HydrophobicContact CG-CG 4.06Å; W82-E103 HydrophobicContact CH2-CB 3.88Å; W82-E103 HydrophobicContact CZ2-CB 3.97Å; W82-E103 HydrophobicContact CZ3-CB 3.76Å; W82-E103 HydrophobicContact CZ3-CG 3.99Å; W82-T107 HydrophobicContact CH2-CG2 3.45Å; W82-T107 VanDerWaalsContact CH2-CG2 3.45Å; W82-T107 HydrophobicContact CZ2-CG2 3.88Å; W82-Y277 HydrophobicContact CB-CD1 3.95Å; W82-Y277 HydrophobicContact CB-CD2 3.75Å; W82-Y277 HydrophobicContact CB-CE1 4.01Å; W82-Y277 HydrophobicContact CB-CE2 3.81Å; W82-Y277 HydrophobicContact CB-CG 3.82Å; W82-Y277 AromaticContact CD1-CD1 3.89Å; W82-Y277 AromaticContact CD1-CE1 3.49Å; W82-Y277 VanDerWaalsContact CD1-CE1 3.49Å; W82-Y277 AromaticContact CD1-CZ 3.9Å; W82-Y277 HydrophobicContact CG-CD1 4.29Å; W82-Y277 AromaticContact CG-CE1 3.98Å; W82-Y277 HydrophobicContact CG-CE1 3.98Å; W82-Y277 HydrophobicContact CG-CE2 4.35Å
83	N	91.8	Very high	85.2	Confident	43 Å²	43	49.9 Å²	49.9	23%	0.23	24%	0.241	C	C	.	.			trans	-116.9	15.7	-174.7	70.2	-12.1	0	0	0	113.7	F77 S85	F77-N83 WeakPolarHBondContact O-CA 2.99Å; N83-S85 PolarHBondContact O-N 2.89Å; N83-S85 WeakPolarHBondContact OD1-CB 3.5Å; N83-S85 PolarHBondContact OD1-N 3.37Å; N83-S85 PolarHBondContact OD1-OG 3.02Å
84	C	91.3	Very high	83.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.007	26%	0.259	C	S	.	.	S	Bend	trans	63.2	7.2	179.6	-151	0	0	0	0	115.7	C73 Q74 W82 A86 L87	C73-C84 HydrophobicContact CB-CB 3.96Å; C73-C84 WeakPolarHBondContact CB-SG 3.47Å; C73-C84 WeakPolarHBondContact SG-CB 3.36Å; C73-C84 CovalentContact SG-SG 2.04Å; C73-C84 PolarHBondContact SG-SG 3.32Å; Q74-C84 HydrophobicContact CG-CB 3.97Å; W82-C84 HydrophobicContact CH2-CB 3.64Å; W82-C84 WeakPolarHBondContact CH2-SG 3.47Å; W82-C84 HydrophobicContact CZ2-CB 3.99Å; W82-C84 HydrophobicContact CZ3-CB 3.97Å; C84-A86 VanDerWaalsContact C-N 3.3Å; C84-A86 PolarHBondContact O-N 2.7Å; C84-L87 PolarHBondContact O-N 2.82Å; C84-L87 VanDerWaalsContact O-N 3.16Å; C84-L87 VanDerWaalsContact SG-CD1 3.56Å
85	S	83.1	Confident	82.6	Confident	42 Å²	42	52.7 Å²	52.7	29%	0.294	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-29	-177.2	55.7	0	0	0	0	114	N83 L87 L287	N83-S85 PolarHBondContact O-N 2.89Å; N83-S85 WeakPolarHBondContact OD1-CB 3.5Å; N83-S85 PolarHBondContact OD1-N 3.37Å; N83-S85 PolarHBondContact OD1-OG 3.02Å; S85-L87 PolarHBondContact O-N 3.4Å; S85-L287 WeakPolarHBondContact OG-CD1 3.49Å
86	A	76.9	Confident	81.6	Confident	8 Å²	8	53.9 Å²	53.9	7%	0.066	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.2	175.4	0	0	0	0	0	111.2	C84 K95 L287	C84-A86 VanDerWaalsContact C-N 3.3Å; C84-A86 PolarHBondContact O-N 2.7Å; A86-K95 WeakPolarHBondContact O-CD 3.39Å; A86-K95 WeakPolarHBondContact O-CE 3.39Å; A86-K95 PolarHBondContact O-NZ 3.47Å; A86-L287 HydrophobicContact CB-CD1 4.09Å; A86-L287 HydrophobicContact CB-CG 4.41Å
87	L	75.8	Confident	81	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.047	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	135.5	-178.3	-57.8	-175.3	0	0	0	111.3	I70 C84 S85 K95 L97 T107	I70-L87 HydrophobicContact CG1-CB 4.36Å; I70-L87 HydrophobicContact CG2-CB 4.26Å; C84-L87 PolarHBondContact O-N 2.82Å; C84-L87 VanDerWaalsContact O-N 3.16Å; C84-L87 VanDerWaalsContact SG-CD1 3.56Å; S85-L87 PolarHBondContact O-N 3.4Å; L87-K95 HydrophobicContact CD2-CB 4.37Å; L87-L97 HydrophobicContact CD2-CD2 4.38Å; L87-L97 HydrophobicContact CD2-CG 4.25Å; L87-T107 HydrophobicContact CD1-CG2 3.46Å; L87-T107 VanDerWaalsContact CD1-CG2 3.46Å
88	G	63	Low	80.6	Confident	26 Å²	26	60 Å²	60	27%	0.268	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-8.9	176.6	0	0	0	0	0	116	R90	G88-R90 PolarHBondContact O-N 2.79Å; G88-R90 VanDerWaalsContact O-N 3.12Å
89	E	65	Low	80.6	Confident	127 Å²	127	56 Å²	56	59%	0.593	28%	0.281	S	S	*	.	S	Bend	trans	-62.9	-21.2	-175.4	-157.6	178.5	-147.8	0	0	114.9	K95	E89-K95 IonicContact OE2-NZ 3.32Å; E89-K95 PolarHBondContact OE2-NZ 3.18Å
90	R	65	Low	80.8	Confident	233 Å²	233	52 Å²	52	88%	0.879	26%	0.26	S	S	*	.	S	Bend	trans	-123.6	-47.5	174.7	-66.8	-173.5	177.6	-171.9	-1.9	112	G88	G88-R90 PolarHBondContact O-N 2.79Å; G88-R90 VanDerWaalsContact O-N 3.12Å
91	T	78.6	Confident	81.1	Confident	29 Å²	29	51.5 Å²	51.5	18%	0.178	25%	0.254	C	S	.	.			trans	-153.6	147.8	178.1	96.1	0	0	0	0	109.8	P42 F93 G94	P42-T91 HydrophobicContact CB-CG2 3.67Å; P42-T91 HydrophobicContact CG-CG2 3.54Å; P42-T91 WeakPolarHBondContact O-CB 3.48Å; P42-T91 WeakPolarHBondContact O-CG2 3.47Å; P42-T91 PolarHBondContact O-OG1 3.13Å; T91-F93 PolarHBondContact O-N 3.35Å; T91-F93 PolarHBondContact OG1-N 3.47Å; T91-G94 WeakPolarHBondContact OG1-CA 3.27Å; T91-G94 PolarHBondContact OG1-N 2.78Å
92	V	82.1	Confident	81.3	Confident	37 Å²	37	49.9 Å²	49.9	22%	0.224	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-19.2	173.8	-60.7	0	0	0	0	112.6	A66 Q67 I70	A66-V92 HydrophobicContact CB-CB 4.08Å; A66-V92 HydrophobicContact CB-CG2 4.28Å; Q67-V92 HydrophobicContact CB-CG1 4.28Å; I70-V92 HydrophobicContact CD1-CB 4.21Å; I70-V92 HydrophobicContact CD1-CG1 4.13Å
93	F	79.8	Confident	81.4	Confident	15 Å²	15	49.3 Å²	49.3	7%	0.066	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-16.6	-175.1	-61	-58.5	0	0	0	114.3	I41 G43 L44 I59 I62 T91 F166 R170	I41-F93 HydrophobicContact CG2-CD2 3.8Å; I41-F93 HydrophobicContact CG2-CE2 4.05Å; G43-F93 CarbonylContact O-C 3.54Å; G43-F93 VanDerWaalsContact O-O 3.12Å; L44-F93 HydrophobicContact CD2-CB 4Å; L44-F93 HydrophobicContact CD2-CD1 4.04Å; L44-F93 HydrophobicContact CD2-CD2 3.88Å; L44-F93 HydrophobicContact CD2-CE2 4.37Å; L44-F93 HydrophobicContact CD2-CG 3.69Å; L44-F93 HydrophobicContact CG-CD2 4.39Å; I59-F93 HydrophobicContact CD1-CE2 4.49Å; I59-F93 HydrophobicContact CD1-CZ 4.15Å; I62-F93 HydrophobicContact CG2-CE1 3.71Å; I62-F93 HydrophobicContact CG2-CZ 4.21Å; T91-F93 PolarHBondContact O-N 3.35Å; T91-F93 PolarHBondContact OG1-N 3.47Å; F93-F166 HydrophobicContact CD1-CE1 4.13Å; F93-F166 HydrophobicContact CD1-CZ 4.37Å; F93-F166 AromaticContact CE1-CE1 3.93Å; F93-F166 HydrophobicContact CE1-CE1 3.93Å; F93-F166 HydrophobicContact CE1-CZ 4.13Å; F93-R170 PolarHBondContact O-NH1 3.19Å; F93-R170 PolarHBondContact O-NH2 3.49Å
94	G	64.9	Low	81.6	Confident	37 Å²	37	47.3 Å²	47.3	38%	0.381	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-19.4	-160.3	0	0	0	0	0	117.6	T91 E96	T91-G94 WeakPolarHBondContact OG1-CA 3.27Å; T91-G94 PolarHBondContact OG1-N 2.78Å; G94-E96 PolarHBondContact O-N 2.95Å
95	K	70.9	Confident	82	Confident	92 Å²	92	47.2 Å²	47.2	40%	0.4	24%	0.237	S	C	.	.			trans	-94.4	103.9	-171.9	-150.9	176.9	-173.6	167.4	0	111.3	A86 L87 E89	A86-K95 WeakPolarHBondContact O-CD 3.39Å; A86-K95 WeakPolarHBondContact O-CE 3.39Å; A86-K95 PolarHBondContact O-NZ 3.47Å; L87-K95 HydrophobicContact CD2-CB 4.37Å; E89-K95 IonicContact OE2-NZ 3.32Å; E89-K95 PolarHBondContact OE2-NZ 3.18Å
96	E	76.3	Confident	82.7	Confident	83 Å²	83	45.2 Å²	45.2	39%	0.388	22%	0.223	S	C	.	.			trans	-89.6	135.3	168.6	171.2	165.4	-156	0	0	110.1	G94 K98 Y108 R177 N181	G94-E96 PolarHBondContact O-N 2.95Å; E96-K98 PolarHBondContact O-N 2.03Å; E96-Y108 VanDerWaalsContact CG-OH 3.25Å; E96-Y108 WeakPolarHBondContact CG-OH 3.48Å; E96-Y108 PolarHBondContact OE1-OH 2.9Å; E96-R177 IonicContact OE1-CZ 3.59Å; E96-R177 IonicContact OE1-NE 2.69Å; E96-R177 PolarHBondContact OE1-NE 2.95Å; E96-R177 IonicContact OE1-NH2 2.7Å; E96-R177 PolarHBondContact OE1-NH2 2.9Å; E96-N181 PolarHBondContact OE1-ND2 2Å
97	L	85.3	Confident	83.6	Confident	20 Å²	20	45.2 Å²	45.2	11%	0.105	22%	0.221	C	C	.	.			trans	-68	124.6	168	-71.7	170.2	0	0	0	109.5	W82 L87 V99 A104 T107 R177	W82-L97 HydrophobicContact CZ2-CD1 3.92Å; L87-L97 HydrophobicContact CD2-CD2 4.38Å; L87-L97 HydrophobicContact CD2-CG 4.25Å; L97-V99 VanDerWaalsContact C-N 3.29Å; L97-V99 PolarHBondContact O-N 3.47Å; L97-A104 HydrophobicContact CB-CB 4.15Å; L97-A104 HydrophobicContact CD1-CB 3.99Å; L97-T107 HydrophobicContact CD1-CG2 3.99Å; L97-R177 PolarHBondContact O-NH2 2.85Å
98	K	84.9	Confident	84.6	Confident	145 Å²	145	46 Å²	46	63%	0.63	22%	0.224	S	C	*	.	S	Bend	trans	-64.5	-33.1	-174.1	-67.6	174.2	176.5	179.2	0	113.4	E96 P282 V283	E96-K98 PolarHBondContact O-N 2.03Å; K98-P282 PolarHBondContact NZ-O 3.12Å; K98-V283 WeakPolarHBondContact CD-O 3.26Å
99	V	91.8	Very high	86.3	Confident	27 Å²	27	44.7 Å²	44.7	16%	0.164	21%	0.211	C	C	.	.	S	Bend	trans	-91.7	140.5	-174.3	-174.3	0	0	0	0	111.7	L97 S101 A104 R177 D272 T284	L97-V99 VanDerWaalsContact C-N 3.29Å; L97-V99 PolarHBondContact O-N 3.47Å; V99-S101 PolarHBondContact O-N 3.38Å; V99-A104 WeakPolarHBondContact O-CB 3.49Å; V99-R177 VanDerWaalsContact C-NH1 3.31Å; V99-R177 PolarHBondContact O-NH1 3.22Å; V99-D272 HydrophobicContact CG1-CB 3.74Å; V99-T284 HydrophobicContact CG2-CG2 4.13Å
100	G	95	Very high	87.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.01	18%	0.183	C	C	.	.			trans	-62.9	33.4	169.6	0	0	0	0	0	117.1	Y270 I271 D272	G100-Y270 WeakPolarHBondContact O-CB 3.25Å; G100-I271 PolarHBondContact O-N 3.46Å; G100-D272 VanDerWaalsContact CA-OD2 3.27Å; G100-D272 WeakPolarHBondContact CA-OD2 3.32Å; G100-D272 PolarHBondContact N-OD2 3.41Å; G100-D272 PolarHBondContact O-N 3.33Å
101	S	96.4	Very high	89.4	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.014	15%	0.149	C	C	.	.			trans	-84.9	172.9	-166.3	76.4	0	0	0	0	114.7	V99 E103 A104 A105 D272	V99-S101 PolarHBondContact O-N 3.38Å; S101-E103 WeakPolarHBondContact CB-OE2 3.06Å; S101-E103 PolarHBondContact O-N 3.39Å; S101-E103 PolarHBondContact OG-N 3.17Å; S101-E103 PolarHBondContact OG-OE2 3.4Å; S101-A104 WeakPolarHBondContact O-CB 3.02Å; S101-A104 PolarHBondContact O-N 3.18Å; S101-A104 PolarHBondContact OG-N 3.4Å; S101-A105 PolarHBondContact O-N 3.31Å; S101-D272 WeakPolarHBondContact CA-O 3.1Å
102	K	96.8	Very high	90.4	Very high	50 Å²	50	27.8 Å²	27.8	22%	0.217	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-36.5	173.1	-69.1	-172.3	172.3	-168	0	112	A104 A105 F106 Y232 A235 Y270	K102-A104 VanDerWaalsContact C-N 3.34Å; K102-A105 WeakPolarHBondContact O-CB 3.04Å; K102-A105 PolarHBondContact O-N 3.5Å; K102-F106 PolarHBondContact O-N 3.02Å; K102-F106 VanDerWaalsContact O-N 3.1Å; K102-Y232 HydrophobicContact CB-CD2 3.97Å; K102-Y232 HydrophobicContact CB-CE2 3.49Å; K102-Y232 VanDerWaalsContact CB-CE2 3.49Å; K102-Y232 WeakPolarHBondContact O-CD2 3.27Å; K102-A235 HydrophobicContact CD-CB 4.23Å; K102-A235 HydrophobicContact CG-CB 4.12Å; K102-Y270 HydrophobicContact CD-CD1 4.36Å; K102-Y270 HydrophobicContact CD-CE1 4.15Å; K102-Y270 HydrophobicContact CG-CD1 3.53Å; K102-Y270 HydrophobicContact CG-CD2 4.23Å; K102-Y270 HydrophobicContact CG-CE1 3.77Å; K102-Y270 HydrophobicContact CG-CE2 4.42Å; K102-Y270 HydrophobicContact CG-CG 3.76Å
103	E	95.8	Very high	91.1	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-66.3	-40.8	178.5	-58.4	76.9	-161.3	0	0	110.2	F77 W82 S101 A105 F106 T107 Y232 S274 Y277	F77-E103 HydrophobicContact CE1-CG 4.43Å; W82-E103 HydrophobicContact CB-CG 4.38Å; W82-E103 HydrophobicContact CD2-CB 3.78Å; W82-E103 HydrophobicContact CD2-CG 3.66Å; W82-E103 HydrophobicContact CE3-CB 3.71Å; W82-E103 HydrophobicContact CE3-CG 3.5Å; W82-E103 HydrophobicContact CG-CB 4.48Å; W82-E103 HydrophobicContact CG-CG 4.06Å; W82-E103 HydrophobicContact CH2-CB 3.88Å; W82-E103 HydrophobicContact CZ2-CB 3.97Å; W82-E103 HydrophobicContact CZ3-CB 3.76Å; W82-E103 HydrophobicContact CZ3-CG 3.99Å; S101-E103 WeakPolarHBondContact CB-OE2 3.06Å; S101-E103 PolarHBondContact O-N 3.39Å; S101-E103 PolarHBondContact OG-N 3.17Å; S101-E103 PolarHBondContact OG-OE2 3.4Å; E103-A105 VanDerWaalsContact C-N 3.35Å; E103-A105 PolarHBondContact O-N 3.29Å; E103-F106 PolarHBondContact O-N 2.75Å; E103-T107 WeakPolarHBondContact O-CG2 3.49Å; E103-T107 PolarHBondContact O-N 3.29Å; E103-T107 PolarHBondContact O-OG1 3.48Å; E103-Y232 HydrophobicContact CG-CE2 4.17Å; E103-Y232 PolarHBondContact OE1-OH 2.86Å; E103-Y232 VanDerWaalsContact OE1-OH 3.08Å; E103-S274 VanDerWaalsContact CD-OG 3.29Å; E103-S274 WeakPolarHBondContact OE1-CB 3.1Å; E103-S274 PolarHBondContact OE1-OG 2.8Å; E103-S274 PolarHBondContact OE2-OG 3.35Å; E103-Y277 HydrophobicContact CG-CE2 4.28Å; E103-Y277 PolarHBondContact OE2-OH 2.77Å
104	A	95.8	Very high	92	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.2	-47.4	171.4	0	0	0	0	0	111.5	L97 V99 S101 K102 F106 T107 Y108 M180	L97-A104 HydrophobicContact CB-CB 4.15Å; L97-A104 HydrophobicContact CD1-CB 3.99Å; V99-A104 WeakPolarHBondContact O-CB 3.49Å; S101-A104 WeakPolarHBondContact O-CB 3.02Å; S101-A104 PolarHBondContact O-N 3.18Å; S101-A104 PolarHBondContact OG-N 3.4Å; K102-A104 VanDerWaalsContact C-N 3.34Å; A104-F106 VanDerWaalsContact C-N 3.33Å; A104-F106 PolarHBondContact O-N 3.37Å; A104-T107 WeakPolarHBondContact CA-OG1 3.46Å; A104-T107 PolarHBondContact O-N 3.31Å; A104-T107 VanDerWaalsContact O-N 3.1Å; A104-T107 PolarHBondContact O-OG1 3.17Å; A104-Y108 VanDerWaalsContact O-CD2 3.25Å; A104-Y108 WeakPolarHBondContact O-CD2 3.41Å; A104-Y108 PolarHBondContact O-N 2.87Å; A104-M180 HydrophobicContact CB-CE 4.31Å
105	A	97.8	Very high	93.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-54.4	-47.1	178.3	0	0	0	0	0	113	S101 K102 E103 A109 N184 L268 V269	S101-A105 PolarHBondContact O-N 3.31Å; K102-A105 WeakPolarHBondContact O-CB 3.04Å; K102-A105 PolarHBondContact O-N 3.5Å; E103-A105 VanDerWaalsContact C-N 3.35Å; E103-A105 PolarHBondContact O-N 3.29Å; A105-A109 PolarHBondContact O-N 3.2Å; A105-N184 VanDerWaalsContact CA-ND2 3.34Å; A105-N184 WeakPolarHBondContact CA-ND2 2.99Å; A105-N184 VanDerWaalsContact CB-ND2 3.3Å; A105-N184 WeakPolarHBondContact CB-ND2 3.39Å; A105-L268 HydrophobicContact CB-CB 4.27Å; A105-V269 VanDerWaalsContact CB-O 3.25Å; A105-V269 WeakPolarHBondContact CB-O 3.43Å
106	F	98	Very high	94.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.3	-43.9	176.3	-180	-84.2	0	0	0	112.2	C73 Q76 F77 K102 E103 A104 Y108 A109 I110 L228 K229 Y232 L268	C73-F106 HydrophobicContact CB-CE1 4.01Å; Q76-F106 HydrophobicContact CB-CZ 4.16Å; Q76-F106 HydrophobicContact CG-CZ 4.09Å; F77-F106 HydrophobicContact CD2-CD1 4.38Å; F77-F106 HydrophobicContact CD2-CE1 4.25Å; F77-F106 HydrophobicContact CE2-CB 4.49Å; F77-F106 AromaticContact CE2-CD1 3.54Å; F77-F106 HydrophobicContact CE2-CD1 3.54Å; F77-F106 HydrophobicContact CE2-CD2 4.12Å; F77-F106 AromaticContact CE2-CE1 3.69Å; F77-F106 HydrophobicContact CE2-CE1 3.69Å; F77-F106 HydrophobicContact CE2-CE2 4.22Å; F77-F106 AromaticContact CE2-CG 3.78Å; F77-F106 HydrophobicContact CE2-CG 3.78Å; F77-F106 HydrophobicContact CE2-CZ 4.03Å; F77-F106 HydrophobicContact CZ-CB 4.42Å; F77-F106 HydrophobicContact CZ-CD1 4.27Å; F77-F106 HydrophobicContact CZ-CG 4.14Å; K102-F106 PolarHBondContact O-N 3.02Å; K102-F106 VanDerWaalsContact O-N 3.1Å; E103-F106 PolarHBondContact O-N 2.75Å; A104-F106 VanDerWaalsContact C-N 3.33Å; A104-F106 PolarHBondContact O-N 3.37Å; F106-Y108 PolarHBondContact O-N 3.5Å; F106-A109 PolarHBondContact O-N 3.34Å; F106-I110 HydrophobicContact CD1-CB 4.49Å; F106-I110 HydrophobicContact CD1-CG2 4.09Å; F106-I110 HydrophobicContact CE1-CB 4.01Å; F106-I110 HydrophobicContact CE1-CG1 4.39Å; F106-I110 HydrophobicContact CE1-CG2 3.8Å; F106-I110 HydrophobicContact CZ-CB 4.33Å; F106-I110 HydrophobicContact CZ-CG1 4.47Å; F106-I110 WeakPolarHBondContact O-CG2 3.42Å; F106-I110 PolarHBondContact O-N 2.81Å; F106-L228 HydrophobicContact CD2-CB 4.02Å; F106-L228 HydrophobicContact CE2-CB 3.56Å; F106-L228 HydrophobicContact CZ-CB 4.36Å; F106-K229 HydrophobicContact CE2-CB 4.21Å; F106-Y232 HydrophobicContact CB-CD2 3.94Å; F106-L268 HydrophobicContact CB-CD1 4.45Å
107	T	96.5	Very high	96	Very high	7 Å²	7	16.4 Å²	16.4	4%	0.043	8%	0.077	C	C	.	.	H	α-helix	trans	-63.3	-43	-176.8	58.2	0	0	0	0	112.9	W82 L87 L97 E103 A104 I110 I111	W82-T107 HydrophobicContact CH2-CG2 3.45Å; W82-T107 VanDerWaalsContact CH2-CG2 3.45Å; W82-T107 HydrophobicContact CZ2-CG2 3.88Å; L87-T107 HydrophobicContact CD1-CG2 3.46Å; L87-T107 VanDerWaalsContact CD1-CG2 3.46Å; L97-T107 HydrophobicContact CD1-CG2 3.99Å; E103-T107 WeakPolarHBondContact O-CG2 3.49Å; E103-T107 PolarHBondContact O-N 3.29Å; E103-T107 PolarHBondContact O-OG1 3.48Å; A104-T107 WeakPolarHBondContact CA-OG1 3.46Å; A104-T107 PolarHBondContact O-N 3.31Å; A104-T107 VanDerWaalsContact O-N 3.1Å; A104-T107 PolarHBondContact O-OG1 3.17Å; T107-I110 WeakPolarHBondContact O-CG2 3.48Å; T107-I111 WeakPolarHBondContact O-CB 3.48Å; T107-I111 WeakPolarHBondContact O-CD1 3.27Å; T107-I111 VanDerWaalsContact O-CG1 3.23Å; T107-I111 WeakPolarHBondContact O-CG1 3.34Å; T107-I111 PolarHBondContact O-N 3.32Å
108	Y	97.2	Very high	96.6	Very high	25 Å²	25	15.8 Å²	15.8	10%	0.098	8%	0.075	C	C	.	.	H	α-helix	trans	-61.5	-45.4	175.7	-84.1	-72.3	0	0	0	111.3	E96 A104 F106 A112 N181 N185	E96-Y108 VanDerWaalsContact CG-OH 3.25Å; E96-Y108 WeakPolarHBondContact CG-OH 3.48Å; E96-Y108 PolarHBondContact OE1-OH 2.9Å; A104-Y108 VanDerWaalsContact O-CD2 3.25Å; A104-Y108 WeakPolarHBondContact O-CD2 3.41Å; A104-Y108 PolarHBondContact O-N 2.87Å; F106-Y108 PolarHBondContact O-N 3.5Å; Y108-A112 VanDerWaalsContact O-CB 3.28Å; Y108-A112 WeakPolarHBondContact O-CB 3.43Å; Y108-A112 PolarHBondContact O-N 2.86Å; Y108-N181 HydrophobicContact CD1-CB 4.12Å; Y108-N181 HydrophobicContact CD2-CB 4.45Å; Y108-N181 HydrophobicContact CE1-CB 3.99Å; Y108-N181 HydrophobicContact CE2-CB 4.36Å; Y108-N181 WeakPolarHBondContact CE2-OD1 3.32Å; Y108-N181 HydrophobicContact CG-CB 4.36Å; Y108-N181 VanDerWaalsContact CZ-ND2 3.3Å; Y108-N181 PolarHBondContact OH-ND2 3.48Å; Y108-N181 VanDerWaalsContact OH-ND2 3.13Å; Y108-N185 WeakPolarHBondContact CB-OD1 3.4Å; Y108-N185 VanDerWaalsContact CD1-OD1 3.3Å; Y108-N185 WeakPolarHBondContact CD1-OD1 3.42Å; Y108-N185 PolarHBondContact O-OD1 2.92Å
109	A	98.4	Very high	97.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-63.5	-49.8	178.9	0	0	0	0	0	112.9	A105 F106 I111 A112 A113 N184 G188 L228 L268	A105-A109 PolarHBondContact O-N 3.2Å; F106-A109 PolarHBondContact O-N 3.34Å; A109-I111 PolarHBondContact O-N 2.9Å; A109-A112 PolarHBondContact O-N 3.06Å; A109-A113 VanDerWaalsContact O-CB 3.32Å; A109-A113 WeakPolarHBondContact O-CB 3.44Å; A109-A113 PolarHBondContact O-N 3.43Å; A109-N184 VanDerWaalsContact CA-O 3.24Å; A109-N184 WeakPolarHBondContact CA-O 3.45Å; A109-N184 VanDerWaalsContact CB-O 3.24Å; A109-N184 WeakPolarHBondContact CB-O 3.41Å; A109-G188 WeakPolarHBondContact O-CA 3.33Å; A109-L228 HydrophobicContact CB-CD1 4.49Å; A109-L228 HydrophobicContact CB-CD2 3.71Å; A109-L268 HydrophobicContact CB-CD2 3.57Å
110	I	98.3	Very high	97.5	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-69.1	-34.1	-176.9	-164.9	67	0	0	0	112.2	E72 C73 F106 T107 G114 F221 L228	E72-I110 HydrophobicContact CB-CD1 4.47Å; E72-I110 HydrophobicContact CB-CG1 4.28Å; E72-I110 HydrophobicContact CG-CD1 4.1Å; E72-I110 HydrophobicContact CG-CG1 4.37Å; C73-I110 HydrophobicContact CB-CG2 4.22Å; F106-I110 HydrophobicContact CD1-CB 4.49Å; F106-I110 HydrophobicContact CD1-CG2 4.09Å; F106-I110 HydrophobicContact CE1-CB 4.01Å; F106-I110 HydrophobicContact CE1-CG1 4.39Å; F106-I110 HydrophobicContact CE1-CG2 3.8Å; F106-I110 HydrophobicContact CZ-CB 4.33Å; F106-I110 HydrophobicContact CZ-CG1 4.47Å; F106-I110 WeakPolarHBondContact O-CG2 3.42Å; F106-I110 PolarHBondContact O-N 2.81Å; T107-I110 WeakPolarHBondContact O-CG2 3.48Å; I110-G114 PolarHBondContact O-N 3.33Å; I110-F221 HydrophobicContact CD1-CE1 3.82Å; I110-F221 HydrophobicContact CD1-CZ 3.67Å; I110-F221 HydrophobicContact CG1-CE1 4.06Å; I110-F221 HydrophobicContact CG1-CZ 3.98Å; I110-L228 HydrophobicContact CB-CD1 4.11Å; I110-L228 HydrophobicContact CD1-CD1 3.51Å; I110-L228 HydrophobicContact CG1-CD1 4.41Å
111	I	97.3	Very high	97.7	Very high	34 Å²	34	8.6 Å²	8.6	17%	0.174	5%	0.045	C	C	.	.	H	α-helix	trans	-71.3	-44.2	176.6	-69	168.8	0	0	0	110.7	A66 I70 T107 A109 A113 G114 V115 I167	A66-I111 HydrophobicContact CB-CG2 4.36Å; I70-I111 HydrophobicContact CG1-CD1 4.23Å; I70-I111 HydrophobicContact CG1-CG1 4.44Å; T107-I111 WeakPolarHBondContact O-CB 3.48Å; T107-I111 WeakPolarHBondContact O-CD1 3.27Å; T107-I111 VanDerWaalsContact O-CG1 3.23Å; T107-I111 WeakPolarHBondContact O-CG1 3.34Å; T107-I111 PolarHBondContact O-N 3.32Å; A109-I111 PolarHBondContact O-N 2.9Å; I111-A113 VanDerWaalsContact C-N 3.3Å; I111-A113 PolarHBondContact O-N 2.81Å; I111-G114 PolarHBondContact O-N 3.35Å; I111-V115 WeakPolarHBondContact O-CG2 3.29Å; I111-V115 PolarHBondContact O-N 3.49Å; I111-I167 HydrophobicContact CG2-CD1 4.37Å
112	A	98.3	Very high	97.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62	-39.9	176.2	0	0	0	0	0	111.9	Y108 A109 A116 S163 I167 N185 R189	Y108-A112 VanDerWaalsContact O-CB 3.28Å; Y108-A112 WeakPolarHBondContact O-CB 3.43Å; Y108-A112 PolarHBondContact O-N 2.86Å; A109-A112 PolarHBondContact O-N 3.06Å; A112-A116 WeakPolarHBondContact O-CB 3.47Å; A112-A116 PolarHBondContact O-N 2.86Å; A112-A116 VanDerWaalsContact O-N 3.13Å; A112-S163 PolarHBondContact O-OG 3.31Å; A112-I167 HydrophobicContact CB-CG2 4.36Å; A112-N185 HydrophobicContact CB-CB 3.88Å; A112-N185 WeakPolarHBondContact CB-O 3.49Å; A112-R189 HydrophobicContact CB-CG 4.45Å
113	A	98.6	Very high	97.7	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.008	4%	0.037	C	C	.	.	H	α-helix	trans	-65.4	-42.5	172.6	0	0	0	0	0	111.9	A109 I111 A116 H117 F221	A109-A113 VanDerWaalsContact O-CB 3.32Å; A109-A113 WeakPolarHBondContact O-CB 3.44Å; A109-A113 PolarHBondContact O-N 3.43Å; I111-A113 VanDerWaalsContact C-N 3.3Å; I111-A113 PolarHBondContact O-N 2.81Å; A113-A116 PolarHBondContact O-N 3.47Å; A113-H117 VanDerWaalsContact O-CB 3.23Å; A113-H117 WeakPolarHBondContact O-CB 3.41Å; A113-H117 PolarHBondContact O-N 2.91Å; A113-F221 HydrophobicContact CB-CE2 4.48Å
114	G	98.4	Very high	97.7	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.1	-43.9	178.2	0	0	0	0	0	113.1	G65 I110 I111 H117 A118 F221	G65-G114 WeakPolarHBondContact CA-O 3.37Å; G65-G114 CarbonylContact O-C 3.53Å; G65-G114 WeakPolarHBondContact O-CA 3.29Å; I110-G114 PolarHBondContact O-N 3.33Å; I111-G114 PolarHBondContact O-N 3.35Å; G114-H117 PolarHBondContact O-N 3.13Å; G114-A118 WeakPolarHBondContact O-CB 3.32Å; G114-A118 PolarHBondContact O-N 3.33Å; G114-F221 VanDerWaalsContact CA-CE2 3.43Å
115	V	98.3	Very high	97.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65.8	-43.7	175.6	174.3	0	0	0	0	111.5	I62 A66 I111 H117 I119 I167	I62-V115 HydrophobicContact CG1-CG1 4.4Å; I62-V115 HydrophobicContact CG2-CG1 3.97Å; I62-V115 HydrophobicContact CG2-CG2 4.19Å; A66-V115 HydrophobicContact CB-CG2 4.27Å; I111-V115 WeakPolarHBondContact O-CG2 3.29Å; I111-V115 PolarHBondContact O-N 3.49Å; V115-H117 VanDerWaalsContact C-N 3.34Å; V115-H117 PolarHBondContact O-N 3.47Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.23Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.43Å; V115-I119 PolarHBondContact O-N 3.27Å; V115-I167 HydrophobicContact CB-CD1 4.24Å; V115-I167 HydrophobicContact CB-CG1 4.25Å; V115-I167 HydrophobicContact CG1-CD1 4.39Å; V115-I167 HydrophobicContact CG1-CG1 4.29Å; V115-I167 HydrophobicContact CG2-CD1 3.65Å; V115-I167 HydrophobicContact CG2-CG1 4.2Å
116	A	98.6	Very high	97.4	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-42.6	176.7	0	0	0	0	0	111.8	A112 A113 T120 L160 L192	A112-A116 WeakPolarHBondContact O-CB 3.47Å; A112-A116 PolarHBondContact O-N 2.86Å; A112-A116 VanDerWaalsContact O-N 3.13Å; A113-A116 PolarHBondContact O-N 3.47Å; A116-T120 WeakPolarHBondContact O-CB 3.33Å; A116-T120 PolarHBondContact O-N 3.41Å; A116-T120 PolarHBondContact O-OG1 2.93Å; A116-L160 HydrophobicContact CB-CD2 4.04Å; A116-L192 HydrophobicContact CB-CD2 3.55Å
117	H	98.6	Very high	97.3	Very high	23 Å²	23	22.2 Å²	22.2	11%	0.106	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-50.6	178.1	-174.3	-72.8	0	0	0	111.5	A113 G114 V115 I119 T120 A121 L192 L218 P219 F221	A113-H117 VanDerWaalsContact O-CB 3.23Å; A113-H117 WeakPolarHBondContact O-CB 3.41Å; A113-H117 PolarHBondContact O-N 2.91Å; G114-H117 PolarHBondContact O-N 3.13Å; V115-H117 VanDerWaalsContact C-N 3.34Å; V115-H117 PolarHBondContact O-N 3.47Å; H117-I119 PolarHBondContact O-N 2.93Å; H117-T120 PolarHBondContact O-N 3.42Å; H117-A121 WeakPolarHBondContact O-CB 3.47Å; H117-A121 PolarHBondContact O-N 2.93Å; H117-L192 HydrophobicContact CB-CD1 4.33Å; H117-L192 HydrophobicContact CB-CD2 4.12Å; H117-L218 WeakPolarHBondContact O-CD1 3.39Å; H117-P219 PolarHBondContact NE2-O 3.2Å; H117-F221 HydrophobicContact CB-CD2 4.18Å; H117-F221 HydrophobicContact CB-CE2 4.26Å; H117-F221 AromaticContact CD2-CD2 3.94Å; H117-F221 AromaticContact CG-CD2 3.96Å
118	A	98.3	Very high	97.1	Very high	8 Å²	8	22.2 Å²	22.2	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-63	-43.4	-179.9	0	0	0	0	0	112.7	V61 G65 G114 A121 A122	V61-A118 HydrophobicContact CG1-CB 3.96Å; V61-A118 WeakPolarHBondContact CG1-O 3.03Å; G65-A118 VanDerWaalsContact CA-CB 3.47Å; G114-A118 WeakPolarHBondContact O-CB 3.32Å; G114-A118 PolarHBondContact O-N 3.33Å; A118-A121 PolarHBondContact O-N 3.42Å; A118-A122 WeakPolarHBondContact O-CB 3.34Å; A118-A122 PolarHBondContact O-N 3.49Å
119	I	98.1	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-48.2	177	-67.8	-70.8	0	0	0	110.8	A58 V61 I62 V115 H117 A121 A122 C123 L128 Y158 F162	A58-I119 HydrophobicContact CB-CD1 4.27Å; V61-I119 HydrophobicContact CB-CD1 4.06Å; V61-I119 HydrophobicContact CG1-CD1 3.78Å; V61-I119 HydrophobicContact CG1-CG1 4.32Å; I62-I119 HydrophobicContact CG1-CD1 4.02Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.23Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.43Å; V115-I119 PolarHBondContact O-N 3.27Å; H117-I119 PolarHBondContact O-N 2.93Å; I119-A121 VanDerWaalsContact C-N 3.3Å; I119-A121 PolarHBondContact O-N 2.83Å; I119-A122 PolarHBondContact O-N 3.09Å; I119-C123 PolarHBondContact O-N 2.87Å; I119-C123 PolarHBondContact O-SG 2.98Å; I119-L128 HydrophobicContact CD1-CD1 4.07Å; I119-L128 HydrophobicContact CG2-CD1 4.38Å; I119-Y158 HydrophobicContact CG2-CD1 3.85Å; I119-Y158 HydrophobicContact CG2-CE1 3.88Å; I119-F162 HydrophobicContact CD1-CD1 4.25Å; I119-F162 HydrophobicContact CD1-CE1 4.46Å; I119-F162 HydrophobicContact CG1-CD1 4.23Å; I119-F162 HydrophobicContact CG1-CG 4.49Å; I119-F162 HydrophobicContact CG2-CB 4.11Å; I119-F162 HydrophobicContact CG2-CG 4.33Å
120	T	98.1	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-39.7	177.4	-69.3	0	0	0	0	111.6	A116 H117 C123 T124 A154 D155 I156 G159 L218	A116-T120 WeakPolarHBondContact O-CB 3.33Å; A116-T120 PolarHBondContact O-N 3.41Å; A116-T120 PolarHBondContact O-OG1 2.93Å; H117-T120 PolarHBondContact O-N 3.42Å; T120-C123 PolarHBondContact O-N 3.35Å; T120-T124 WeakPolarHBondContact O-CB 3.22Å; T120-T124 PolarHBondContact O-N 2.83Å; T120-T124 PolarHBondContact O-OG1 2.84Å; T120-A154 HydrophobicContact CG2-CB 3.76Å; T120-D155 WeakPolarHBondContact CG2-O 3.37Å; T120-D155 PolarHBondContact OG1-O 3.19Å; T120-I156 HydrophobicContact CG2-CD1 4.44Å; T120-G159 WeakPolarHBondContact OG1-CA 3.4Å; T120-L218 HydrophobicContact CG2-CD1 3.91Å; T120-L218 HydrophobicContact CG2-CD2 3.85Å; T120-L218 HydrophobicContact CG2-CG 3.98Å
121	A	97.5	Very high	96	Very high	21 Å²	21	30.8 Å²	30.8	17%	0.174	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-47.3	176.4	0	0	0	0	0	111.5	H117 A118 I119 C123 T124 Q125 L218	H117-A121 WeakPolarHBondContact O-CB 3.47Å; H117-A121 PolarHBondContact O-N 2.93Å; A118-A121 PolarHBondContact O-N 3.42Å; I119-A121 VanDerWaalsContact C-N 3.3Å; I119-A121 PolarHBondContact O-N 2.83Å; A121-C123 VanDerWaalsContact C-N 3.35Å; A121-C123 PolarHBondContact O-N 3.24Å; A121-T124 WeakPolarHBondContact O-CB 3.46Å; A121-T124 PolarHBondContact O-N 3.34Å; A121-T124 VanDerWaalsContact O-N 3.15Å; A121-Q125 VanDerWaalsContact O-CG 3.31Å; A121-Q125 WeakPolarHBondContact O-CG 3.42Å; A121-Q125 PolarHBondContact O-N 3.17Å; A121-L218 HydrophobicContact CB-CD1 3.72Å
122	A	97.4	Very high	95.8	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-39.8	179.1	0	0	0	0	0	112.4	V61 A118 I119 T124 Q125 G126 N127 L128	V61-A122 HydrophobicContact CG1-CB 3.73Å; V61-A122 HydrophobicContact CG2-CB 3.98Å; A118-A122 WeakPolarHBondContact O-CB 3.34Å; A118-A122 PolarHBondContact O-N 3.49Å; I119-A122 PolarHBondContact O-N 3.09Å; A122-T124 VanDerWaalsContact C-N 3.35Å; A122-Q125 PolarHBondContact O-N 3.18Å; A122-G126 PolarHBondContact O-N 2.76Å; A122-G126 VanDerWaalsContact O-N 3.1Å; A122-N127 HydrophobicContact CB-CB 4.22Å; A122-N127 PolarHBondContact O-N 2.94Å; A122-L128 HydrophobicContact CB-CD1 3.79Å; A122-L128 HydrophobicContact CB-CG 3.93Å
123	C	96.6	Very high	95.6	Very high	3 Å²	3	33 Å²	33	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-41.8	173	-66.5	0	0	0	0	112.4	I119 T120 A121 Q125 G126 C131 Y158	I119-C123 PolarHBondContact O-N 2.87Å; I119-C123 PolarHBondContact O-SG 2.98Å; T120-C123 PolarHBondContact O-N 3.35Å; A121-C123 VanDerWaalsContact C-N 3.35Å; A121-C123 PolarHBondContact O-N 3.24Å; C123-Q125 VanDerWaalsContact C-N 3.28Å; C123-Q125 PolarHBondContact O-N 2.82Å; C123-G126 PolarHBondContact O-N 3.28Å; C123-C131 WeakPolarHBondContact CA-SG 3.31Å; C123-C131 HydrophobicContact CB-CB 3.72Å; C123-C131 WeakPolarHBondContact CB-SG 3.39Å; C123-C131 WeakPolarHBondContact SG-CB 3.36Å; C123-C131 CovalentContact SG-SG 2.02Å; C123-C131 PolarHBondContact SG-SG 2.93Å; C123-Y158 VanDerWaalsContact SG-CD1 3.54Å
124	T	95.1	Very high	95.3	Very high	39 Å²	39	33.2 Å²	33.2	24%	0.239	21%	0.207	C	C	.	.	H	α-helix	trans	-68	-30.7	179.4	-51.4	0	0	0	0	111.5	T120 A121 A122 C152 A154	T120-T124 WeakPolarHBondContact O-CB 3.22Å; T120-T124 PolarHBondContact O-N 2.83Å; T120-T124 PolarHBondContact O-OG1 2.84Å; A121-T124 WeakPolarHBondContact O-CB 3.46Å; A121-T124 PolarHBondContact O-N 3.34Å; A121-T124 VanDerWaalsContact O-N 3.15Å; A122-T124 VanDerWaalsContact C-N 3.35Å; T124-C152 HydrophobicContact CG2-CB 4.19Å; T124-C152 WeakPolarHBondContact CG2-SG 3.11Å; T124-C152 PolarHBondContact O-SG 3.2Å; T124-A154 HydrophobicContact CG2-CB 4.37Å; T124-A154 WeakPolarHBondContact OG1-CA 3.43Å; T124-A154 WeakPolarHBondContact OG1-CB 3.23Å
125	Q	94.9	Very high	94.8	Very high	132 Å²	132	40.4 Å²	40.4	62%	0.617	24%	0.239	S	C	*	.	H	α-helix	trans	-83.8	-11.5	177.3	-68.7	168.8	10	0	0	113.5	A121 A122 C123 N127	A121-Q125 VanDerWaalsContact O-CG 3.31Å; A121-Q125 WeakPolarHBondContact O-CG 3.42Å; A121-Q125 PolarHBondContact O-N 3.17Å; A122-Q125 PolarHBondContact O-N 3.18Å; C123-Q125 VanDerWaalsContact C-N 3.28Å; C123-Q125 PolarHBondContact O-N 2.82Å; Q125-N127 PolarHBondContact OE1-ND2 3.45Å
126	G	93.8	Very high	94.1	Very high	58 Å²	58	47.1 Å²	47.1	60%	0.598	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	18.9	-174.9	0	0	0	0	0	114.2	A122 C123 L128	A122-G126 PolarHBondContact O-N 2.76Å; A122-G126 VanDerWaalsContact O-N 3.1Å; C123-G126 PolarHBondContact O-N 3.28Å; G126-L128 VanDerWaalsContact C-N 3.3Å
127	N	94.3	Very high	93.2	Very high	110 Å²	110	49.7 Å²	49.7	59%	0.588	28%	0.281	S	S	*	.			trans	-81.2	-8.5	179.7	-70.1	-9	0	0	0	113.4	A122 Q125	A122-N127 HydrophobicContact CB-CB 4.22Å; A122-N127 PolarHBondContact O-N 2.94Å; Q125-N127 PolarHBondContact OE1-ND2 3.45Å
128	L	93.7	Very high	92.1	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.042	30%	0.3	C	S	.	.	S	Bend	trans	-123.3	136.3	178.1	-69.2	175.2	0	0	0	109.4	D57 A58 V61 I119 A122 G126 C131	D57-L128 HydrophobicContact CB-CD2 4.33Å; A58-L128 HydrophobicContact CB-CD2 4.41Å; V61-L128 HydrophobicContact CG2-CD2 4.13Å; V61-L128 HydrophobicContact CG2-CG 4.47Å; I119-L128 HydrophobicContact CD1-CD1 4.07Å; I119-L128 HydrophobicContact CG2-CD1 4.38Å; A122-L128 HydrophobicContact CB-CD1 3.79Å; A122-L128 HydrophobicContact CB-CG 3.93Å; G126-L128 VanDerWaalsContact C-N 3.3Å; L128-C131 VanDerWaalsContact CB-SG 3.51Å
129	S	87.4	Confident	90.5	Very high	98 Å²	98	56.5 Å²	56.5	69%	0.685	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-33.9	-173.5	54.8	0	0	0	0	113.9	C131	S129-C131 VanDerWaalsContact C-N 3.31Å; S129-C131 PolarHBondContact O-N 3.42Å
130	D	88.7	Confident	89.2	Confident	87 Å²	87	63.2 Å²	63.2	47%	0.465	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	19.2	-168.2	-61	4.9	0	0	0	112.9	R55 Y158	R55-D130 VanDerWaalsContact CD-OD2 3.25Å; R55-D130 WeakPolarHBondContact CD-OD2 3.42Å; R55-D130 IonicContact CZ-OD2 3.56Å; R55-D130 VanDerWaalsContact CZ-OD2 3.23Å; R55-D130 IonicContact NE-OD2 2.78Å; R55-D130 PolarHBondContact NE-OD2 2.95Å; R55-D130 VanDerWaalsContact NE-OD2 3.14Å; R55-D130 IonicContact NH1-OD2 2.94Å; R55-D130 PolarHBondContact NH1-OD2 2.92Å; R55-D130 IonicContact NH2-OD2 3.11Å; D130-Y158 WeakPolarHBondContact O-CE2 3.42Å; D130-Y158 PolarHBondContact O-OH 3.42Å
131	C	93.8	Very high	87.7	Confident	20 Å²	20	69.5 Å²	69.5	14%	0.135	38%	0.384	C	S	.	.			trans	-148.9	164.1	174.9	54.1	0	0	0	0	111.2	C123 L128 S129 Y158	C123-C131 WeakPolarHBondContact CA-SG 3.31Å; C123-C131 HydrophobicContact CB-CB 3.72Å; C123-C131 WeakPolarHBondContact CB-SG 3.39Å; C123-C131 WeakPolarHBondContact SG-CB 3.36Å; C123-C131 CovalentContact SG-SG 2.02Å; C123-C131 PolarHBondContact SG-SG 2.93Å; L128-C131 VanDerWaalsContact CB-SG 3.51Å; S129-C131 VanDerWaalsContact C-N 3.31Å; S129-C131 PolarHBondContact O-N 3.42Å; C131-Y158 HydrophobicContact CB-CD1 3.84Å; C131-Y158 HydrophobicContact CB-CD2 4.07Å; C131-Y158 HydrophobicContact CB-CE1 3.6Å; C131-Y158 HydrophobicContact CB-CE2 3.81Å; C131-Y158 HydrophobicContact CB-CG 4.06Å
132	S	93.8	Very high	86.2	Confident	50 Å²	50	69.4 Å²	69.4	35%	0.35	38%	0.382	S	S	.	.			trans	-146.1	-179.1	-179.9	67.6	0	0	0	0	110.5	K135	S132-K135 WeakPolarHBondContact OG-CE 3.46Å
133	C	93.3	Very high	84.5	Confident	29 Å²	29	77.8 Å²	77.8	20%	0.196	42%	0.418	C	S	.	.	S	Bend	trans	-54	157	164.7	-42	0	0	0	0	111.7	K135 C152 S153	C133-K135 PolarHBondContact O-N 3.19Å; C133-K135 VanDerWaalsContact O-N 3.15Å; C133-C152 HydrophobicContact CB-CB 4.01Å; C133-C152 WeakPolarHBondContact CB-SG 3.48Å; C133-C152 WeakPolarHBondContact SG-CB 3.2Å; C133-C152 CovalentContact SG-SG 2.01Å; C133-C152 PolarHBondContact SG-SG 3.24Å; C133-S153 CarbonylContact C-O 3.42Å; C133-S153 WeakPolarHBondContact CA-O 3.46Å
134	D	92.1	Very high	83.1	Confident	6 Å²	6	85.2 Å²	85.2	3%	0.032	46%	0.457	C	S	.	.			trans	-63.2	109.1	173.6	-172.9	-2.7	0	0	0	110.4	E136 K137 S153 D155 R157	D134-E136 VanDerWaalsContact C-N 3.3Å; D134-E136 PolarHBondContact O-N 3.12Å; D134-E136 PolarHBondContact OD1-N 2.89Å; D134-K137 PolarHBondContact O-N 2.66Å; D134-K137 WeakPolarHBondContact OD2-CD 3.48Å; D134-K137 WeakPolarHBondContact OD2-CE 3.22Å; D134-K137 IonicContact OD2-NZ 2.97Å; D134-K137 PolarHBondContact OD2-NZ 3.48Å; D134-S153 WeakPolarHBondContact CB-O 3.32Å; D134-S153 PolarHBondContact N-O 2.95Å; D134-D155 HydrophobicContact CB-CB 4.15Å; D134-R157 IonicContact OD1-NH2 3.51Å
135	K	87.6	Confident	81.9	Confident	152 Å²	152	89 Å²	89	66%	0.661	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-74.3	-21.5	-176.1	-62.7	-178	-177.2	177.5	0	112.8	S132 C133 K137	S132-K135 WeakPolarHBondContact OG-CE 3.46Å; C133-K135 PolarHBondContact O-N 3.19Å; C133-K135 VanDerWaalsContact O-N 3.15Å; K135-K137 PolarHBondContact O-N 2.93Å
136	E	84.9	Confident	81	Confident	141 Å²	141	84.4 Å²	84.4	66%	0.659	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-71	-20.3	179.2	-65.5	173.4	-158.7	0	0	111.7	D134 R157	D134-E136 VanDerWaalsContact C-N 3.3Å; D134-E136 PolarHBondContact O-N 3.12Å; D134-E136 PolarHBondContact OD1-N 2.89Å; E136-R157 VanDerWaalsContact CD-NH2 3.25Å; E136-R157 IonicContact OE1-CZ 3.62Å; E136-R157 VanDerWaalsContact OE1-CZ 3.26Å; E136-R157 IonicContact OE1-NH1 2.98Å; E136-R157 PolarHBondContact OE1-NH1 3.4Å; E136-R157 IonicContact OE1-NH2 3.74Å; E136-R157 PolarHBondContact OE1-NH2 2.93Å; E136-R157 IonicContact OE2-NH1 3.62Å; E136-R157 IonicContact OE2-NH2 2.86Å
137	K	79.8	Confident	80.3	Confident	54 Å²	54	82.4 Å²	82.4	24%	0.235	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-111.3	47.9	-177.1	-64.4	176.8	-171.3	135.6	0	112.1	D134 K135 W149 T216	D134-K137 PolarHBondContact O-N 2.66Å; D134-K137 WeakPolarHBondContact OD2-CD 3.48Å; D134-K137 WeakPolarHBondContact OD2-CE 3.22Å; D134-K137 IonicContact OD2-NZ 2.97Å; D134-K137 PolarHBondContact OD2-NZ 3.48Å; K135-K137 PolarHBondContact O-N 2.93Å; K137-W149 HydrophobicContact CB-CD2 3.91Å; K137-W149 HydrophobicContact CB-CE3 3.81Å; K137-W149 HydrophobicContact CB-CG 4.43Å; K137-W149 HydrophobicContact CB-CZ3 4.16Å; K137-W149 HydrophobicContact CD-CE3 4.29Å; K137-W149 HydrophobicContact CD-CH2 3.68Å; K137-W149 HydrophobicContact CD-CZ2 4.1Å; K137-W149 HydrophobicContact CD-CZ3 3.79Å; K137-W149 HydrophobicContact CG-CD2 4.31Å; K137-W149 HydrophobicContact CG-CE3 4.31Å; K137-W149 HydrophobicContact CG-CH2 4.16Å; K137-W149 HydrophobicContact CG-CZ2 4.13Å; K137-W149 HydrophobicContact CG-CZ3 4.26Å; K137-T216 HydrophobicContact CD-CG2 3.91Å; K137-T216 PolarHBondContact NZ-OG1 2.92Å
138	Q	73.9	Confident	79.9	Confident	105 Å²	105	81.6 Å²	81.6	49%	0.491	43%	0.426	S	S	.	.	S	Bend	trans	-122	126.5	177.4	-66.7	-176.2	-9.6	0	0	110.7	F140	Q138-F140 VanDerWaalsContact C-N 3.29Å; Q138-F140 PolarHBondContact O-N 3.27Å; Q138-F140 VanDerWaalsContact O-N 3.14Å
139	G	64.8	Low	79.5	Confident	68 Å²	68	83.7 Å²	83.7	70%	0.701	43%	0.433	S	S	*	.	S	Bend	trans	78.4	-8.7	163.9	0	0	0	0	0	117.5	W149	G139-W149 PolarHBondContact N-O 2.95Å
140	F	71.3	Confident	79.4	Confident	142 Å²	142	79.8 Å²	79.8	62%	0.623	41%	0.408	S	S	*	.			trans	-77.8	126.3	179.8	-168.4	-93.3	0	0	0	112	Q138 W149	Q138-F140 VanDerWaalsContact C-N 3.29Å; Q138-F140 PolarHBondContact O-N 3.27Å; Q138-F140 VanDerWaalsContact O-N 3.14Å; F140-W149 PolarHBondContact O-N 3.35Å
141	Y	66.3	Low	79.3	Confident	132 Å²	132	78.4 Å²	78.4	52%	0.518	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.9	174.4	-174.4	-87.7	0	0	0	109.5	K143 K148	Y141-K143 HydrophobicContact CD1-CG 3.94Å; Y141-K143 HydrophobicContact CE1-CG 3.93Å; Y141-K143 PolarHBondContact O-N 3.41Å; Y141-K148 HydrophobicContact CD2-CB 3.86Å
142	S	67	Low	79.3	Confident	18 Å²	18	79.1 Å²	79.1	13%	0.126	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	107	173	-178.4	0	0	0	0	109.2	D144 Q145 G146 W147	S142-D144 PolarHBondContact O-N 3.47Å; S142-Q145 PolarHBondContact O-N 3.42Å; S142-Q145 PolarHBondContact OG-N 3.46Å; S142-G146 PolarHBondContact O-N 2.83Å; S142-W147 PolarHBondContact N-O 3.19Å; S142-W147 VanDerWaalsContact N-O 3.12Å
143	K	61.2	Low	79.3	Confident	182 Å²	182	76.8 Å²	76.8	79%	0.791	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.7	175.4	-80.1	-173.1	176.7	-178.2	0	112	Y141	Y141-K143 HydrophobicContact CD1-CG 3.94Å; Y141-K143 HydrophobicContact CE1-CG 3.93Å; Y141-K143 PolarHBondContact O-N 3.41Å
144	D	66.6	Low	79.4	Confident	158 Å²	158	75.5 Å²	75.5	85%	0.845	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-27.7	-175.4	-45.8	-42.9	0	0	0	112.9	S142	S142-D144 PolarHBondContact O-N 3.47Å
145	Q	70.1	Confident	79.6	Confident	120 Å²	120	76.6 Å²	76.6	56%	0.561	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-7.7	-177	-57.4	-170.1	7.2	0	0	114.1	S142 W147	S142-Q145 PolarHBondContact O-N 3.42Å; S142-Q145 PolarHBondContact OG-N 3.46Å; Q145-W147 VanDerWaalsContact C-N 3.3Å; Q145-W147 VanDerWaalsContact CB-NE1 3.32Å; Q145-W147 PolarHBondContact O-N 3Å; Q145-W147 VanDerWaalsContact OE1-CE2 3.28Å; Q145-W147 VanDerWaalsContact OE1-CZ2 3.24Å
146	G	76	Confident	80	Confident	35 Å²	35	70.1 Å²	70.1	36%	0.361	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	24.8	176.5	0	0	0	0	0	114.4	S142	S142-G146 PolarHBondContact O-N 2.83Å
147	W	80.6	Confident	80.6	Confident	16 Å²	16	69.4 Å²	69.4	6%	0.061	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.5	176	64.8	-93.6	0	0	0	112.3	S142 Q145 W149 L198 K212 C214	S142-W147 PolarHBondContact N-O 3.19Å; S142-W147 VanDerWaalsContact N-O 3.12Å; Q145-W147 VanDerWaalsContact C-N 3.3Å; Q145-W147 VanDerWaalsContact CB-NE1 3.32Å; Q145-W147 PolarHBondContact O-N 3Å; Q145-W147 VanDerWaalsContact OE1-CE2 3.28Å; Q145-W147 VanDerWaalsContact OE1-CZ2 3.24Å; W147-W149 AromaticContact CH2-CD2 3.8Å; W147-W149 HydrophobicContact CH2-CD2 3.8Å; W147-W149 AromaticContact CH2-CE2 3.5Å; W147-W149 VanDerWaalsContact CH2-CE2 3.5Å; W147-W149 HydrophobicContact CH2-CE3 4.03Å; W147-W149 HydrophobicContact CH2-CG 4.46Å; W147-W149 AromaticContact CH2-CH2 3.77Å; W147-W149 HydrophobicContact CH2-CH2 3.77Å; W147-W149 AromaticContact CH2-CZ2 3.53Å; W147-W149 HydrophobicContact CH2-CZ2 3.53Å; W147-W149 AromaticContact CH2-CZ3 4Å; W147-W149 HydrophobicContact CH2-CZ3 4Å; W147-W149 AromaticContact CH2-NE1 3.96Å; W147-W149 AromaticContact CZ3-CD2 3.57Å; W147-W149 HydrophobicContact CZ3-CD2 3.57Å; W147-W149 AromaticContact CZ3-CE2 3.77Å; W147-W149 AromaticContact CZ3-CE3 3.79Å; W147-W149 HydrophobicContact CZ3-CE3 3.79Å; W147-W149 AromaticContact CZ3-CG 3.93Å; W147-W149 HydrophobicContact CZ3-CG 3.93Å; W147-W149 HydrophobicContact CZ3-CH2 4.37Å; W147-W149 HydrophobicContact CZ3-CZ2 4.21Å; W147-W149 HydrophobicContact CZ3-CZ3 4.17Å; W147-L198 HydrophobicContact CH2-CD1 3.92Å; W147-L198 HydrophobicContact CH2-CD2 4.05Å; W147-L198 HydrophobicContact CZ2-CD1 4.36Å; W147-L198 HydrophobicContact CZ2-CD2 3.63Å; W147-L198 HydrophobicContact CZ3-CD1 4.44Å; W147-K212 HydrophobicContact CB-CD 4.19Å; W147-K212 HydrophobicContact CB-CG 3.46Å; W147-K212 VanDerWaalsContact CB-CG 3.46Å; W147-K212 WeakPolarHBondContact CB-O 3.18Å; W147-K212 HydrophobicContact CG-CG 4.44Å; W147-C214 HydrophobicContact CD2-CB 4.05Å; W147-C214 HydrophobicContact CE3-CB 3.46Å; W147-C214 VanDerWaalsContact CE3-CB 3.46Å; W147-C214 HydrophobicContact CH2-CB 4.21Å; W147-C214 HydrophobicContact CZ3-CB 3.57Å
148	K	84.8	Confident	81.4	Confident	92 Å²	92	69.4 Å²	69.4	40%	0.4	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144.7	-179.4	66.9	-178.1	-179.6	179.3	0	112.7	Y141 K212 T213 C214	Y141-K148 HydrophobicContact CD2-CB 3.86Å; K148-K212 PolarHBondContact N-O 2.63Å; K148-T213 WeakPolarHBondContact CE-OG1 3.38Å; K148-T213 HydrophobicContact CG-CG2 4.39Å; K148-T213 WeakPolarHBondContact O-CA 3.43Å; K148-C214 PolarHBondContact O-N 3.3Å
149	W	86.3	Confident	82.5	Confident	53 Å²	53	64.4 Å²	64.4	20%	0.201	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	133.6	167.4	-72.2	106.1	0	0	0	110.4	K137 G139 F140 W147 L198 T216	K137-W149 HydrophobicContact CB-CD2 3.91Å; K137-W149 HydrophobicContact CB-CE3 3.81Å; K137-W149 HydrophobicContact CB-CG 4.43Å; K137-W149 HydrophobicContact CB-CZ3 4.16Å; K137-W149 HydrophobicContact CD-CE3 4.29Å; K137-W149 HydrophobicContact CD-CH2 3.68Å; K137-W149 HydrophobicContact CD-CZ2 4.1Å; K137-W149 HydrophobicContact CD-CZ3 3.79Å; K137-W149 HydrophobicContact CG-CD2 4.31Å; K137-W149 HydrophobicContact CG-CE3 4.31Å; K137-W149 HydrophobicContact CG-CH2 4.16Å; K137-W149 HydrophobicContact CG-CZ2 4.13Å; K137-W149 HydrophobicContact CG-CZ3 4.26Å; G139-W149 PolarHBondContact N-O 2.95Å; F140-W149 PolarHBondContact O-N 3.35Å; W147-W149 AromaticContact CH2-CD2 3.8Å; W147-W149 HydrophobicContact CH2-CD2 3.8Å; W147-W149 AromaticContact CH2-CE2 3.5Å; W147-W149 VanDerWaalsContact CH2-CE2 3.5Å; W147-W149 HydrophobicContact CH2-CE3 4.03Å; W147-W149 HydrophobicContact CH2-CG 4.46Å; W147-W149 AromaticContact CH2-CH2 3.77Å; W147-W149 HydrophobicContact CH2-CH2 3.77Å; W147-W149 AromaticContact CH2-CZ2 3.53Å; W147-W149 HydrophobicContact CH2-CZ2 3.53Å; W147-W149 AromaticContact CH2-CZ3 4Å; W147-W149 HydrophobicContact CH2-CZ3 4Å; W147-W149 AromaticContact CH2-NE1 3.96Å; W147-W149 AromaticContact CZ3-CD2 3.57Å; W147-W149 HydrophobicContact CZ3-CD2 3.57Å; W147-W149 AromaticContact CZ3-CE2 3.77Å; W147-W149 AromaticContact CZ3-CE3 3.79Å; W147-W149 HydrophobicContact CZ3-CE3 3.79Å; W147-W149 AromaticContact CZ3-CG 3.93Å; W147-W149 HydrophobicContact CZ3-CG 3.93Å; W147-W149 HydrophobicContact CZ3-CH2 4.37Å; W147-W149 HydrophobicContact CZ3-CZ2 4.21Å; W147-W149 HydrophobicContact CZ3-CZ3 4.17Å; W149-L198 HydrophobicContact CH2-CD1 3.71Å; W149-L198 HydrophobicContact CZ3-CD1 3.61Å; W149-T216 HydrophobicContact CH2-CG2 3.8Å; W149-T216 HydrophobicContact CZ3-CG2 3.86Å
150	G	85.2	Confident	84.1	Confident	16 Å²	16	62.1 Å²	62.1	17%	0.165	31%	0.311	C	S	.	.			trans	-169.8	177.5	172.4	0	0	0	0	0	111.5	C214 W215	G150-C214 PolarHBondContact N-O 2.98Å; G150-C214 VanDerWaalsContact N-O 3.1Å; G150-W215 WeakPolarHBondContact O-CB 3.33Å
151	G	86.8	Confident	85.4	Confident	58 Å²	58	57 Å²	57	60%	0.598	30%	0.299	S	S	*	.	S	Bend	trans	73.3	-159.4	-169.2	0	0	0	0	0	112.3
152	C	92.1	Very high	86.9	Confident	35 Å²	35	51.9 Å²	51.9	24%	0.236	28%	0.279	C	S	.	.			trans	-107.6	96.6	180	-177.7	0	0	0	0	109.7	T124 C133	T124-C152 HydrophobicContact CG2-CB 4.19Å; T124-C152 WeakPolarHBondContact CG2-SG 3.11Å; T124-C152 PolarHBondContact O-SG 3.2Å; C133-C152 HydrophobicContact CB-CB 4.01Å; C133-C152 WeakPolarHBondContact CB-SG 3.48Å; C133-C152 WeakPolarHBondContact SG-CB 3.2Å; C133-C152 CovalentContact SG-SG 2.01Å; C133-C152 PolarHBondContact SG-SG 3.24Å
153	S	94.8	Very high	88.4	Confident	1 Å²	1	51 Å²	51	1%	0.007	27%	0.273	C	S	.	.			trans	-68.3	130	171.4	-74	0	0	0	0	109.9	C133 D134 D155 W215 T216	C133-S153 CarbonylContact C-O 3.42Å; C133-S153 WeakPolarHBondContact CA-O 3.46Å; D134-S153 WeakPolarHBondContact CB-O 3.32Å; D134-S153 PolarHBondContact N-O 2.95Å; S153-D155 PolarHBondContact O-N 3.46Å; S153-W215 WeakPolarHBondContact OG-CA 3.46Å; S153-T216 WeakPolarHBondContact CA-O 3.37Å; S153-T216 WeakPolarHBondContact CB-OG1 3.33Å; S153-T216 PolarHBondContact OG-N 3.13Å
154	A	95.8	Very high	90.1	Very high	2 Å²	2	47.5 Å²	47.5	2%	0.017	26%	0.258	C	S	.	.			trans	-67	122.8	178.4	0	0	0	0	0	111.7	T120 T124 I156 M196 T216	T120-A154 HydrophobicContact CG2-CB 3.76Å; T124-A154 HydrophobicContact CG2-CB 4.37Å; T124-A154 WeakPolarHBondContact OG1-CA 3.43Å; T124-A154 WeakPolarHBondContact OG1-CB 3.23Å; A154-I156 PolarHBondContact O-N 3.43Å; A154-M196 HydrophobicContact CB-CE 3.91Å; A154-T216 WeakPolarHBondContact CB-O 3.38Å; A154-T216 PolarHBondContact N-O 3.01Å
155	D	96.1	Very high	91.5	Very high	29 Å²	29	44.3 Å²	44.3	16%	0.155	24%	0.244	C	C	.	.			trans	-82.2	92.6	173.9	-175	6.3	0	0	0	110.6	T120 D134 S153 R157 Y158	T120-D155 WeakPolarHBondContact CG2-O 3.37Å; T120-D155 PolarHBondContact OG1-O 3.19Å; D134-D155 HydrophobicContact CB-CB 4.15Å; S153-D155 PolarHBondContact O-N 3.46Å; D155-R157 VanDerWaalsContact C-N 3.32Å; D155-R157 WeakPolarHBondContact OD1-CB 3.47Å; D155-R157 PolarHBondContact OD1-N 2.93Å; D155-R157 VanDerWaalsContact OD1-N 3.09Å; D155-R157 IonicContact OD1-NE 3.77Å; D155-Y158 PolarHBondContact OD1-N 3.47Å
156	I	96.7	Very high	92.8	Very high	16 Å²	16	38.6 Å²	38.6	8%	0.082	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-31.1	179.5	-170.2	54.8	0	0	0	112.2	T120 A154 Y158 G159 L160 L192 M196 L218	T120-I156 HydrophobicContact CG2-CD1 4.44Å; A154-I156 PolarHBondContact O-N 3.43Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 2.77Å; I156-G159 PolarHBondContact O-N 2.93Å; I156-L160 HydrophobicContact CD1-CD2 4.19Å; I156-L160 HydrophobicContact CD1-CG 4.04Å; I156-L160 HydrophobicContact CG1-CD1 3.84Å; I156-L160 HydrophobicContact CG1-CD2 4.36Å; I156-L160 HydrophobicContact CG1-CG 3.88Å; I156-L160 VanDerWaalsContact O-CG 3.22Å; I156-L160 WeakPolarHBondContact O-CG 3.32Å; I156-L160 PolarHBondContact O-N 3.03Å; I156-L192 HydrophobicContact CD1-CD2 3.63Å; I156-L192 HydrophobicContact CD1-CG 3.77Å; I156-M196 HydrophobicContact CB-CE 3.98Å; I156-M196 HydrophobicContact CB-CG 4.29Å; I156-M196 HydrophobicContact CB-SD 3.96Å; I156-M196 HydrophobicContact CD1-SD 4.06Å; I156-M196 HydrophobicContact CG1-CG 4.23Å; I156-M196 HydrophobicContact CG1-SD 3.92Å; I156-M196 HydrophobicContact CG2-CE 4.49Å; I156-M196 HydrophobicContact CG2-CG 4.32Å; I156-L218 HydrophobicContact CD1-CD2 4.03Å
157	R	97	Very high	93.7	Very high	125 Å²	125	37.4 Å²	37.4	47%	0.472	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-41.2	-176.5	-65.6	177.3	-65.8	174.1	-6.4	111	D134 E136 D155 G161	D134-R157 IonicContact OD1-NH2 3.51Å; E136-R157 VanDerWaalsContact CD-NH2 3.25Å; E136-R157 IonicContact OE1-CZ 3.62Å; E136-R157 VanDerWaalsContact OE1-CZ 3.26Å; E136-R157 IonicContact OE1-NH1 2.98Å; E136-R157 PolarHBondContact OE1-NH1 3.4Å; E136-R157 IonicContact OE1-NH2 3.74Å; E136-R157 PolarHBondContact OE1-NH2 2.93Å; E136-R157 IonicContact OE2-NH1 3.62Å; E136-R157 IonicContact OE2-NH2 2.86Å; D155-R157 VanDerWaalsContact C-N 3.32Å; D155-R157 WeakPolarHBondContact OD1-CB 3.47Å; D155-R157 PolarHBondContact OD1-N 2.93Å; D155-R157 VanDerWaalsContact OD1-N 3.09Å; D155-R157 IonicContact OD1-NE 3.77Å; R157-G161 PolarHBondContact O-N 3.5Å
158	Y	96.3	Very high	94.5	Very high	55 Å²	55	37.9 Å²	37.9	22%	0.216	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-50.7	175.4	-172.8	-88.7	0	0	0	111.9	R55 I119 C123 D130 C131 D155 I156 L160 G161 F162	R55-Y158 PolarHBondContact NH1-OH 3.16Å; I119-Y158 HydrophobicContact CG2-CD1 3.85Å; I119-Y158 HydrophobicContact CG2-CE1 3.88Å; C123-Y158 VanDerWaalsContact SG-CD1 3.54Å; D130-Y158 WeakPolarHBondContact O-CE2 3.42Å; D130-Y158 PolarHBondContact O-OH 3.42Å; C131-Y158 HydrophobicContact CB-CD1 3.84Å; C131-Y158 HydrophobicContact CB-CD2 4.07Å; C131-Y158 HydrophobicContact CB-CE1 3.6Å; C131-Y158 HydrophobicContact CB-CE2 3.81Å; C131-Y158 HydrophobicContact CB-CG 4.06Å; D155-Y158 PolarHBondContact OD1-N 3.47Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 2.77Å; Y158-L160 PolarHBondContact O-N 2.84Å; Y158-G161 PolarHBondContact O-N 2.89Å; Y158-F162 HydrophobicContact CE1-CD2 4.27Å; Y158-F162 WeakPolarHBondContact O-CB 3.47Å; Y158-F162 PolarHBondContact O-N 3.42Å
159	G	97.4	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-40.2	-179.4	0	0	0	0	0	113.4	T120 I156 F162 S163	T120-G159 WeakPolarHBondContact OG1-CA 3.4Å; I156-G159 PolarHBondContact O-N 2.93Å; G159-F162 PolarHBondContact O-N 3.23Å; G159-S163 VanDerWaalsContact O-CB 3.29Å; G159-S163 WeakPolarHBondContact O-CB 3.47Å; G159-S163 PolarHBondContact O-N 3.48Å
160	L	98.4	Very high	95.3	Very high	20 Å²	20	34.5 Å²	34.5	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-44.8	174.1	-62.6	173.3	0	0	0	111.4	A116 I156 Y158 S163 K164 R189 L192 E193	A116-L160 HydrophobicContact CB-CD2 4.04Å; I156-L160 HydrophobicContact CD1-CD2 4.19Å; I156-L160 HydrophobicContact CD1-CG 4.04Å; I156-L160 HydrophobicContact CG1-CD1 3.84Å; I156-L160 HydrophobicContact CG1-CD2 4.36Å; I156-L160 HydrophobicContact CG1-CG 3.88Å; I156-L160 VanDerWaalsContact O-CG 3.22Å; I156-L160 WeakPolarHBondContact O-CG 3.32Å; I156-L160 PolarHBondContact O-N 3.03Å; Y158-L160 PolarHBondContact O-N 2.84Å; L160-S163 PolarHBondContact O-N 3.04Å; L160-K164 VanDerWaalsContact O-CB 3.32Å; L160-K164 WeakPolarHBondContact O-CB 3.32Å; L160-K164 PolarHBondContact O-N 3.47Å; L160-R189 HydrophobicContact CD2-CB 3.69Å; L160-R189 HydrophobicContact CD2-CG 4Å; L160-R189 VanDerWaalsContact CD2-O 3.24Å; L160-R189 WeakPolarHBondContact CD2-O 3.33Å; L160-L192 HydrophobicContact CD2-CD2 4.24Å; L160-E193 HydrophobicContact CD1-CB 3.87Å; L160-E193 HydrophobicContact CD1-CG 3.92Å
161	G	97.9	Very high	95.6	Very high	35 Å²	35	34.8 Å²	34.8	36%	0.361	19%	0.19	S	C	.	.	H	α-helix	trans	-61.4	-45.9	177.2	0	0	0	0	0	112.2	R157 Y158 K164 V165	R157-G161 PolarHBondContact O-N 3.5Å; Y158-G161 PolarHBondContact O-N 2.89Å; G161-K164 WeakPolarHBondContact O-CB 3.24Å; G161-K164 PolarHBondContact O-N 2.97Å; G161-V165 WeakPolarHBondContact O-CG2 3.36Å; G161-V165 PolarHBondContact O-N 3.37Å
162	F	97.3	Very high	95.8	Very high	24 Å²	24	35.8 Å²	35.8	11%	0.105	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-48.6	178.2	-160.6	-69	0	0	0	111.5	I51 R55 A58 I62 I119 Y158 G159 K164 V165 F166	I51-F162 HydrophobicContact CG2-CZ 4.35Å; R55-F162 HydrophobicContact CB-CE2 4.38Å; R55-F162 HydrophobicContact CB-CZ 4.31Å; R55-F162 HydrophobicContact CG-CE2 4.39Å; A58-F162 HydrophobicContact CB-CE1 4.27Å; A58-F162 HydrophobicContact CB-CE2 4.03Å; A58-F162 HydrophobicContact CB-CZ 3.57Å; I62-F162 HydrophobicContact CD1-CD1 4.42Å; I62-F162 HydrophobicContact CD1-CE1 3.45Å; I62-F162 VanDerWaalsContact CD1-CE1 3.45Å; I62-F162 HydrophobicContact CD1-CZ 4.07Å; I62-F162 HydrophobicContact CG1-CE1 3.95Å; I119-F162 HydrophobicContact CD1-CD1 4.25Å; I119-F162 HydrophobicContact CD1-CE1 4.46Å; I119-F162 HydrophobicContact CG1-CD1 4.23Å; I119-F162 HydrophobicContact CG1-CG 4.49Å; I119-F162 HydrophobicContact CG2-CB 4.11Å; I119-F162 HydrophobicContact CG2-CG 4.33Å; Y158-F162 HydrophobicContact CE1-CD2 4.27Å; Y158-F162 WeakPolarHBondContact O-CB 3.47Å; Y158-F162 PolarHBondContact O-N 3.42Å; G159-F162 PolarHBondContact O-N 3.23Å; F162-K164 VanDerWaalsContact C-N 3.27Å; F162-K164 PolarHBondContact O-N 2.81Å; F162-V165 PolarHBondContact O-N 2.73Å; F162-F166 HydrophobicContact CD1-CB 4.29Å; F162-F166 HydrophobicContact CE1-CB 4.09Å; F162-F166 PolarHBondContact O-N 3.11Å
163	S	98.1	Very high	95.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-42.9	176.1	172.8	0	0	0	0	111.3	A112 G159 L160 F166 I167	A112-S163 PolarHBondContact O-OG 3.31Å; G159-S163 VanDerWaalsContact O-CB 3.29Å; G159-S163 WeakPolarHBondContact O-CB 3.47Å; G159-S163 PolarHBondContact O-N 3.48Å; L160-S163 PolarHBondContact O-N 3.04Å; S163-F166 PolarHBondContact O-N 3.18Å; S163-I167 WeakPolarHBondContact O-CB 3.35Å; S163-I167 WeakPolarHBondContact O-CG1 3.29Å; S163-I167 PolarHBondContact O-N 3.17Å
164	K	98.1	Very high	95.2	Very high	108 Å²	108	47.9 Å²	47.9	47%	0.47	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-52.2	175	-171.8	174.6	-175.6	165.6	0	112.2	L160 G161 F162 F166 D168	L160-K164 VanDerWaalsContact O-CB 3.32Å; L160-K164 WeakPolarHBondContact O-CB 3.32Å; L160-K164 PolarHBondContact O-N 3.47Å; G161-K164 WeakPolarHBondContact O-CB 3.24Å; G161-K164 PolarHBondContact O-N 2.97Å; F162-K164 VanDerWaalsContact C-N 3.27Å; F162-K164 PolarHBondContact O-N 2.81Å; K164-F166 VanDerWaalsContact C-N 3.34Å; K164-F166 PolarHBondContact O-N 3.48Å; K164-D168 WeakPolarHBondContact CG-OD2 3.4Å; K164-D168 WeakPolarHBondContact O-CB 3.46Å; K164-D168 VanDerWaalsContact O-CG 3.3Å; K164-D168 PolarHBondContact O-N 3.25Å
165	V	96.6	Very high	95	Very high	90 Å²	90	50.7 Å²	50.7	55%	0.545	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-43.2	-179.5	171.2	0	0	0	0	111.5	I51 G161 F162 A169	I51-V165 HydrophobicContact CD1-CG1 3.69Å; I51-V165 WeakPolarHBondContact CD1-O 3.23Å; I51-V165 HydrophobicContact CG1-CG1 4.16Å; G161-V165 WeakPolarHBondContact O-CG2 3.36Å; G161-V165 PolarHBondContact O-N 3.37Å; F162-V165 PolarHBondContact O-N 2.73Å; V165-A169 VanDerWaalsContact O-CB 3.22Å; V165-A169 WeakPolarHBondContact O-CB 3.32Å; V165-A169 PolarHBondContact O-N 3.4Å
166	F	96.4	Very high	94.9	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.25	C	S	.	.	H	α-helix	trans	-82.7	-46.5	-174.3	-174	-89.1	0	0	0	114.5	L44 Q48 I51 I59 I62 F93 F162 S163 K164	L44-F166 HydrophobicContact CD2-CE2 4.39Å; L44-F166 HydrophobicContact CD2-CZ 3.65Å; Q48-F166 HydrophobicContact CB-CD2 4.44Å; Q48-F166 HydrophobicContact CB-CE2 3.89Å; Q48-F166 HydrophobicContact CB-CZ 4.09Å; Q48-F166 HydrophobicContact CG-CE2 4.31Å; Q48-F166 HydrophobicContact CG-CZ 4.32Å; Q48-F166 WeakPolarHBondContact CG-O 3.4Å; Q48-F166 PolarHBondContact NE2-O 3.47Å; I51-F166 HydrophobicContact CB-CD2 4.21Å; I51-F166 HydrophobicContact CD1-CD2 4.48Å; I51-F166 HydrophobicContact CG2-CD2 3.9Å; I59-F166 HydrophobicContact CD1-CE2 3.9Å; I59-F166 HydrophobicContact CD1-CZ 3.8Å; I62-F166 HydrophobicContact CD1-CD1 4.21Å; I62-F166 HydrophobicContact CD1-CD2 3.74Å; I62-F166 HydrophobicContact CD1-CE1 4.33Å; I62-F166 HydrophobicContact CD1-CE2 3.83Å; I62-F166 HydrophobicContact CD1-CG 3.92Å; I62-F166 HydrophobicContact CD1-CZ 4.12Å; I62-F166 HydrophobicContact CG2-CD1 3.56Å; I62-F166 HydrophobicContact CG2-CE1 3.36Å; I62-F166 HydrophobicContact CG2-CG 4.31Å; I62-F166 HydrophobicContact CG2-CZ 3.92Å; F93-F166 HydrophobicContact CD1-CE1 4.13Å; F93-F166 HydrophobicContact CD1-CZ 4.37Å; F93-F166 AromaticContact CE1-CE1 3.93Å; F93-F166 HydrophobicContact CE1-CE1 3.93Å; F93-F166 HydrophobicContact CE1-CZ 4.13Å; F162-F166 HydrophobicContact CD1-CB 4.29Å; F162-F166 HydrophobicContact CE1-CB 4.09Å; F162-F166 PolarHBondContact O-N 3.11Å; S163-F166 PolarHBondContact O-N 3.18Å; K164-F166 VanDerWaalsContact C-N 3.34Å; K164-F166 PolarHBondContact O-N 3.48Å
167	I	96.1	Very high	94.8	Very high	9 Å²	9	50.8 Å²	50.8	5%	0.046	25%	0.251	C	S	.	.	H	α-helix	trans	-72.6	-41.8	-176.1	-60.1	-65.3	0	0	0	110.3	I111 A112 V115 S163 A169	I111-I167 HydrophobicContact CG2-CD1 4.37Å; A112-I167 HydrophobicContact CB-CG2 4.36Å; V115-I167 HydrophobicContact CB-CD1 4.24Å; V115-I167 HydrophobicContact CB-CG1 4.25Å; V115-I167 HydrophobicContact CG1-CD1 4.39Å; V115-I167 HydrophobicContact CG1-CG1 4.29Å; V115-I167 HydrophobicContact CG2-CD1 3.65Å; V115-I167 HydrophobicContact CG2-CG1 4.2Å; S163-I167 WeakPolarHBondContact O-CB 3.35Å; S163-I167 WeakPolarHBondContact O-CG1 3.29Å; S163-I167 PolarHBondContact O-N 3.17Å; I167-A169 VanDerWaalsContact C-N 3.27Å; I167-A169 PolarHBondContact O-N 3.13Å
168	D	96.1	Very high	94.7	Very high	26 Å²	26	45.5 Å²	45.5	14%	0.139	23%	0.233	C	C	.	.	H	α-helix	trans	-76.9	-14.7	-178.3	-56	-3.2	0	0	0	111.9	K164 R170 E171 L182 N185 R189	K164-D168 WeakPolarHBondContact CG-OD2 3.4Å; K164-D168 WeakPolarHBondContact O-CB 3.46Å; K164-D168 VanDerWaalsContact O-CG 3.3Å; K164-D168 PolarHBondContact O-N 3.25Å; D168-R170 PolarHBondContact O-N 3.12Å; D168-R170 VanDerWaalsContact O-N 3.08Å; D168-E171 WeakPolarHBondContact O-CB 3.39Å; D168-E171 PolarHBondContact O-N 2.78Å; D168-L182 HydrophobicContact CB-CD2 3.49Å; D168-L182 VanDerWaalsContact CB-CD2 3.49Å; D168-N185 PolarHBondContact OD1-ND2 3.26Å; D168-R189 IonicContact OD1-CZ 3.39Å; D168-R189 IonicContact OD1-NH1 3Å; D168-R189 PolarHBondContact OD1-NH1 2.94Å; D168-R189 IonicContact OD1-NH2 2.88Å; D168-R189 PolarHBondContact OD1-NH2 2.84Å; D168-R189 IonicContact OD2-CZ 3.02Å; D168-R189 IonicContact OD2-NH1 2.94Å; D168-R189 IonicContact OD2-NH2 3.45Å; D168-R189 PolarHBondContact OD2-NH2 3.27Å
169	A	95.2	Very high	94.7	Very high	11 Å²	11	45 Å²	45	9%	0.091	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21	177.5	0	0	0	0	0	114.3	R47 Q48 I51 V165 I167	R47-A169 HydrophobicContact CB-CB 3.84Å; Q48-A169 HydrophobicContact CG-CB 3.86Å; I51-A169 HydrophobicContact CD1-CB 3.8Å; V165-A169 VanDerWaalsContact O-CB 3.22Å; V165-A169 WeakPolarHBondContact O-CB 3.32Å; V165-A169 PolarHBondContact O-N 3.4Å; I167-A169 VanDerWaalsContact C-N 3.27Å; I167-A169 PolarHBondContact O-N 3.13Å
170	R	92.3	Very high	94.7	Very high	64 Å²	64	45 Å²	45	24%	0.242	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-27.2	174.1	-170.7	-164.4	-44.9	-126	-7.4	112.7	A45 F93 D168 V172	A45-R170 HydrophobicContact CB-CB 4.34Å; A45-R170 HydrophobicContact CB-CG 4.23Å; F93-R170 PolarHBondContact O-NH1 3.19Å; F93-R170 PolarHBondContact O-NH2 3.49Å; D168-R170 PolarHBondContact O-N 3.12Å; D168-R170 VanDerWaalsContact O-N 3.08Å; R170-V172 VanDerWaalsContact C-N 3.28Å; R170-V172 PolarHBondContact O-N 2.79Å
171	E	93	Very high	94.6	Very high	21 Å²	21	44.1 Å²	44.1	10%	0.098	23%	0.229	C	C	.	.			trans	-82.9	66.7	-171.7	-62.9	-55.6	149.7	0	0	111.8	D168 T178 N181 L182	D168-E171 WeakPolarHBondContact O-CB 3.39Å; D168-E171 PolarHBondContact O-N 2.78Å; E171-T178 HydrophobicContact CB-CG2 3.76Å; E171-T178 WeakPolarHBondContact OE2-CA 3.41Å; E171-T178 WeakPolarHBondContact OE2-CB 3.47Å; E171-T178 PolarHBondContact OE2-OG1 2.88Å; E171-N181 VanDerWaalsContact CD-ND2 3.3Å; E171-N181 HydrophobicContact CG-CB 4.18Å; E171-N181 WeakPolarHBondContact OE1-CB 3.36Å; E171-N181 PolarHBondContact OE1-ND2 2.97Å; E171-N181 PolarHBondContact OE2-ND2 2.92Å; E171-L182 HydrophobicContact CB-CD1 4.45Å; E171-L182 HydrophobicContact CB-CD2 3.8Å; E171-L182 HydrophobicContact CB-CG 4.01Å; E171-L182 HydrophobicContact CG-CD2 3.97Å; E171-L182 HydrophobicContact CG-CG 4.18Å
172	V	89.5	Confident	94.6	Very high	80 Å²	80	45.1 Å²	45.1	49%	0.485	23%	0.225	S	C	.	.			trans	-86.2	-31.5	-173.4	-176.4	0	0	0	0	112.7	R170	R170-V172 VanDerWaalsContact C-N 3.28Å; R170-V172 PolarHBondContact O-N 2.79Å
173	K	89	Confident	94.6	Very high	158 Å²	158	46 Å²	46	69%	0.687	23%	0.23	S	C	*	.	S	Bend	trans	-77.4	141	-172.7	-66.5	-177.6	-179.1	177.7	0	110.9	N175 T178	K173-N175 PolarHBondContact O-N 3.43Å; K173-N175 VanDerWaalsContact O-N 3.16Å; K173-T178 WeakPolarHBondContact O-CB 3.18Å; K173-T178 WeakPolarHBondContact O-CG2 2.89Å; K173-T178 PolarHBondContact O-OG1 2.92Å
174	Q	86.6	Confident	94.7	Very high	131 Å²	131	46 Å²	46	61%	0.612	23%	0.23	S	C	*	.			trans	-89.4	71.4	174.5	-68.2	-173.9	-9.5	0	0	111.1	R248	Q174-R248 VanDerWaalsContact OE1-CD 3.24Å
175	N	92	Very high	94.7	Very high	61 Å²	61	40.9 Å²	40.9	33%	0.326	21%	0.208	S	C	.	.	S	Bend	trans	-127.6	171	177.3	68.1	9.7	0	0	0	112	K173 R177 T178 L179	K173-N175 PolarHBondContact O-N 3.43Å; K173-N175 VanDerWaalsContact O-N 3.16Å; N175-R177 PolarHBondContact O-N 3.38Å; N175-R177 PolarHBondContact OD1-N 2.98Å; N175-T178 PolarHBondContact O-N 3.49Å; N175-T178 VanDerWaalsContact OD1-CB 3.3Å; N175-T178 WeakPolarHBondContact OD1-CB 3.21Å; N175-T178 PolarHBondContact OD1-N 3.48Å; N175-T178 PolarHBondContact OD1-OG1 3.35Å; N175-L179 PolarHBondContact O-N 3.08Å
176	A	94	Very high	94.8	Very high	20 Å²	20	39.3 Å²	39.3	17%	0.165	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-34.4	-179	0	0	0	0	0	112.3	L179 M180 P240 I271	A176-L179 PolarHBondContact O-N 2.6Å; A176-M180 PolarHBondContact O-N 3.03Å; A176-P240 HydrophobicContact CB-CB 3.74Å; A176-P240 HydrophobicContact CB-CG 3.75Å; A176-I271 HydrophobicContact CB-CD1 4.39Å
177	R	94.4	Very high	94.9	Very high	28 Å²	28	39.2 Å²	39.2	11%	0.106	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-47.8	177	175.5	57.7	178.1	-161	-3.6	112	E96 L97 V99 N175 L179 M180 N181 I271	E96-R177 IonicContact OE1-CZ 3.59Å; E96-R177 IonicContact OE1-NE 2.69Å; E96-R177 PolarHBondContact OE1-NE 2.95Å; E96-R177 IonicContact OE1-NH2 2.7Å; E96-R177 PolarHBondContact OE1-NH2 2.9Å; L97-R177 PolarHBondContact O-NH2 2.85Å; V99-R177 VanDerWaalsContact C-NH1 3.31Å; V99-R177 PolarHBondContact O-NH1 3.22Å; N175-R177 PolarHBondContact O-N 3.38Å; N175-R177 PolarHBondContact OD1-N 2.98Å; R177-L179 VanDerWaalsContact C-N 3.34Å; R177-L179 PolarHBondContact O-N 2.71Å; R177-M180 WeakPolarHBondContact O-CA 3.3Å; R177-M180 VanDerWaalsContact O-CB 3.3Å; R177-M180 WeakPolarHBondContact O-CB 3.2Å; R177-M180 PolarHBondContact O-N 3.16Å; R177-M180 VanDerWaalsContact O-N 3.08Å; R177-N181 WeakPolarHBondContact CD-OD1 3.47Å; R177-N181 PolarHBondContact NE-OD1 3.4Å; R177-N181 VanDerWaalsContact NE-OD1 3.07Å; R177-N181 VanDerWaalsContact O-CG 3.28Å; R177-N181 PolarHBondContact O-N 2.04Å; R177-N181 PolarHBondContact O-OD1 3.07Å; R177-I271 HydrophobicContact CB-CD1 4.28Å
178	T	94.8	Very high	95	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.08	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-39.9	176.9	-76	0	0	0	0	111.8	E171 K173 N175 M180 N181 L182	E171-T178 HydrophobicContact CB-CG2 3.76Å; E171-T178 WeakPolarHBondContact OE2-CA 3.41Å; E171-T178 WeakPolarHBondContact OE2-CB 3.47Å; E171-T178 PolarHBondContact OE2-OG1 2.88Å; K173-T178 WeakPolarHBondContact O-CB 3.18Å; K173-T178 WeakPolarHBondContact O-CG2 2.89Å; K173-T178 PolarHBondContact O-OG1 2.92Å; N175-T178 PolarHBondContact O-N 3.49Å; N175-T178 VanDerWaalsContact OD1-CB 3.3Å; N175-T178 WeakPolarHBondContact OD1-CB 3.21Å; N175-T178 PolarHBondContact OD1-N 3.48Å; N175-T178 PolarHBondContact OD1-OG1 3.35Å; T178-M180 VanDerWaalsContact C-N 3.26Å; T178-M180 PolarHBondContact O-N 3Å; T178-N181 PolarHBondContact O-N 3.05Å; T178-L182 HydrophobicContact CG2-CD1 3.79Å; T178-L182 HydrophobicContact CG2-CG 4.26Å; T178-L182 WeakPolarHBondContact O-CB 3.49Å; T178-L182 VanDerWaalsContact O-CG 3.24Å; T178-L182 WeakPolarHBondContact O-CG 3.02Å; T178-L182 PolarHBondContact O-N 3.17Å
179	L	95.9	Very high	95.1	Very high	46 Å²	46	37.8 Å²	37.8	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-38.1	173.1	-65.9	175.8	0	0	0	112.1	N175 A176 R177 H183 P249 L252	N175-L179 PolarHBondContact O-N 3.08Å; A176-L179 PolarHBondContact O-N 2.6Å; R177-L179 VanDerWaalsContact C-N 3.34Å; R177-L179 PolarHBondContact O-N 2.71Å; L179-H183 WeakPolarHBondContact O-CB 3.46Å; L179-H183 PolarHBondContact O-N 3.2Å; L179-H183 VanDerWaalsContact O-N 3.09Å; L179-P249 HydrophobicContact CD1-CB 3.87Å; L179-P249 HydrophobicContact CD1-CG 4.28Å; L179-L252 HydrophobicContact CB-CD1 3.86Å; L179-L252 HydrophobicContact CB-CD2 4.21Å; L179-L252 HydrophobicContact CB-CG 3.87Å; L179-L252 HydrophobicContact CD1-CD2 4.39Å; L179-L252 HydrophobicContact CD1-CG 4.39Å
180	M	97.4	Very high	95.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.5	-47.3	177.5	-170.2	-154.7	78.4	0	0	110.9	A104 A176 R177 T178 H183 N184 L252 V269 I271	A104-M180 HydrophobicContact CB-CE 4.31Å; A176-M180 PolarHBondContact O-N 3.03Å; R177-M180 WeakPolarHBondContact O-CA 3.3Å; R177-M180 VanDerWaalsContact O-CB 3.3Å; R177-M180 WeakPolarHBondContact O-CB 3.2Å; R177-M180 PolarHBondContact O-N 3.16Å; R177-M180 VanDerWaalsContact O-N 3.08Å; T178-M180 VanDerWaalsContact C-N 3.26Å; T178-M180 PolarHBondContact O-N 3Å; M180-H183 PolarHBondContact O-N 3.13Å; M180-N184 WeakPolarHBondContact O-CB 3.36Å; M180-N184 PolarHBondContact O-N 3Å; M180-N184 PolarHBondContact O-ND2 3.04Å; M180-L252 HydrophobicContact CB-CD1 4.19Å; M180-V269 HydrophobicContact CG-CG2 3.98Å; M180-V269 WeakPolarHBondContact CG-O 3.28Å; M180-I271 HydrophobicContact CB-CG2 4.34Å; M180-I271 HydrophobicContact CG-CG2 4.34Å; M180-I271 HydrophobicContact SD-CD1 4.45Å; M180-I271 HydrophobicContact SD-CG1 3.91Å; M180-I271 HydrophobicContact SD-CG2 4.34Å
181	N	96.9	Very high	95.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-50.2	178.8	-65.9	-3.1	0	0	0	110.9	E96 Y108 E171 R177 T178 H183 N184 N185	E96-N181 PolarHBondContact OE1-ND2 2Å; Y108-N181 HydrophobicContact CD1-CB 4.12Å; Y108-N181 HydrophobicContact CD2-CB 4.45Å; Y108-N181 HydrophobicContact CE1-CB 3.99Å; Y108-N181 HydrophobicContact CE2-CB 4.36Å; Y108-N181 WeakPolarHBondContact CE2-OD1 3.32Å; Y108-N181 HydrophobicContact CG-CB 4.36Å; Y108-N181 VanDerWaalsContact CZ-ND2 3.3Å; Y108-N181 PolarHBondContact OH-ND2 3.48Å; Y108-N181 VanDerWaalsContact OH-ND2 3.13Å; E171-N181 VanDerWaalsContact CD-ND2 3.3Å; E171-N181 HydrophobicContact CG-CB 4.18Å; E171-N181 WeakPolarHBondContact OE1-CB 3.36Å; E171-N181 PolarHBondContact OE1-ND2 2.97Å; E171-N181 PolarHBondContact OE2-ND2 2.92Å; R177-N181 WeakPolarHBondContact CD-OD1 3.47Å; R177-N181 PolarHBondContact NE-OD1 3.4Å; R177-N181 VanDerWaalsContact NE-OD1 3.07Å; R177-N181 VanDerWaalsContact O-CG 3.28Å; R177-N181 PolarHBondContact O-N 2.04Å; R177-N181 PolarHBondContact O-OD1 3.07Å; T178-N181 PolarHBondContact O-N 3.05Å; N181-H183 VanDerWaalsContact C-N 3.35Å; N181-H183 PolarHBondContact O-N 3.48Å; N181-N184 PolarHBondContact O-N 3.26Å; N181-N185 WeakPolarHBondContact O-CB 3.48Å; N181-N185 PolarHBondContact O-N 3.28Å; N181-N185 PolarHBondContact O-ND2 3.08Å; N181-N185 PolarHBondContact O-OD1 3.26Å
182	L	97.2	Very high	95.8	Very high	56 Å²	56	35.5 Å²	35.5	29%	0.293	18%	0.176	S	C	.	.	H	α-helix	trans	-59.5	-42.7	178.2	-70.7	172.9	0	0	0	112.5	D168 E171 T178 E186	D168-L182 HydrophobicContact CB-CD2 3.49Å; D168-L182 VanDerWaalsContact CB-CD2 3.49Å; E171-L182 HydrophobicContact CB-CD1 4.45Å; E171-L182 HydrophobicContact CB-CD2 3.8Å; E171-L182 HydrophobicContact CB-CG 4.01Å; E171-L182 HydrophobicContact CG-CD2 3.97Å; E171-L182 HydrophobicContact CG-CG 4.18Å; T178-L182 HydrophobicContact CG2-CD1 3.79Å; T178-L182 HydrophobicContact CG2-CG 4.26Å; T178-L182 WeakPolarHBondContact O-CB 3.49Å; T178-L182 VanDerWaalsContact O-CG 3.24Å; T178-L182 WeakPolarHBondContact O-CG 3.02Å; T178-L182 PolarHBondContact O-N 3.17Å; L182-E186 WeakPolarHBondContact O-CB 3.48Å; L182-E186 PolarHBondContact O-N 3.36Å; L182-E186 VanDerWaalsContact O-N 3.13Å
183	H	98.1	Very high	96.2	Very high	44 Å²	44	36 Å²	36	20%	0.204	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-49	176.1	-179.8	97.7	0	0	0	111.2	L179 M180 N181 E186 V187 L264 D267 V269	L179-H183 WeakPolarHBondContact O-CB 3.46Å; L179-H183 PolarHBondContact O-N 3.2Å; L179-H183 VanDerWaalsContact O-N 3.09Å; M180-H183 PolarHBondContact O-N 3.13Å; N181-H183 VanDerWaalsContact C-N 3.35Å; N181-H183 PolarHBondContact O-N 3.48Å; H183-E186 WeakPolarHBondContact O-CB 3.36Å; H183-E186 PolarHBondContact O-N 3.42Å; H183-V187 WeakPolarHBondContact O-CG2 3.01Å; H183-V187 PolarHBondContact O-N 3.11Å; H183-L264 PolarHBondContact CE1-O 3.16Å; H183-L264 PolarHBondContact NE2-O 2.88Å; H183-D267 PolarHBondContact CD2-O 3.37Å; H183-D267 PolarHBondContact NE2-O 2.84Å; H183-V269 HydrophobicContact CB-CG2 4.12Å; H183-V269 VanDerWaalsContact CD2-CG2 3.45Å; H183-V269 WeakPolarHBondContact CD2-CG2 3.43Å
184	N	98.6	Very high	96.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-35.9	-177.7	-69.1	-40.1	0	0	0	112.7	A105 A109 M180 N181 E186 V187 G188 L268 V269	A105-N184 VanDerWaalsContact CA-ND2 3.34Å; A105-N184 WeakPolarHBondContact CA-ND2 2.99Å; A105-N184 VanDerWaalsContact CB-ND2 3.3Å; A105-N184 WeakPolarHBondContact CB-ND2 3.39Å; A109-N184 VanDerWaalsContact CA-O 3.24Å; A109-N184 WeakPolarHBondContact CA-O 3.45Å; A109-N184 VanDerWaalsContact CB-O 3.24Å; A109-N184 WeakPolarHBondContact CB-O 3.41Å; M180-N184 WeakPolarHBondContact O-CB 3.36Å; M180-N184 PolarHBondContact O-N 3Å; M180-N184 PolarHBondContact O-ND2 3.04Å; N181-N184 PolarHBondContact O-N 3.26Å; N184-E186 VanDerWaalsContact C-N 3.26Å; N184-E186 PolarHBondContact O-N 2.94Å; N184-V187 PolarHBondContact O-N 3.16Å; N184-G188 PolarHBondContact O-N 3.38Å; N184-G188 VanDerWaalsContact O-N 3.07Å; N184-L268 HydrophobicContact CB-CD2 4.3Å; N184-L268 WeakPolarHBondContact OD1-CA 3.33Å; N184-V269 PolarHBondContact ND2-O 2.67Å; N184-V269 PolarHBondContact OD1-N 3.3Å
185	N	98.4	Very high	97.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.4	-44.7	170.5	-70	-14.3	0	0	0	110.9	Y108 A112 D168 N181 G188 R189	Y108-N185 WeakPolarHBondContact CB-OD1 3.4Å; Y108-N185 VanDerWaalsContact CD1-OD1 3.3Å; Y108-N185 WeakPolarHBondContact CD1-OD1 3.42Å; Y108-N185 PolarHBondContact O-OD1 2.92Å; A112-N185 HydrophobicContact CB-CB 3.88Å; A112-N185 WeakPolarHBondContact CB-O 3.49Å; D168-N185 PolarHBondContact OD1-ND2 3.26Å; N181-N185 WeakPolarHBondContact O-CB 3.48Å; N181-N185 PolarHBondContact O-N 3.28Å; N181-N185 PolarHBondContact O-ND2 3.08Å; N181-N185 PolarHBondContact O-OD1 3.26Å; N185-G188 PolarHBondContact O-N 3.41Å; N185-R189 PolarHBondContact O-N 2.91Å; N185-R189 VanDerWaalsContact O-N 3.11Å
186	E	98.5	Very high	97.3	Very high	56 Å²	56	30.7 Å²	30.7	26%	0.262	15%	0.149	S	C	.	.	H	α-helix	trans	-67.3	-39.3	178.8	-171.1	62.9	-169.8	0	0	112.7	L182 H183 N184 G188 R189 K190	L182-E186 WeakPolarHBondContact O-CB 3.48Å; L182-E186 PolarHBondContact O-N 3.36Å; L182-E186 VanDerWaalsContact O-N 3.13Å; H183-E186 WeakPolarHBondContact O-CB 3.36Å; H183-E186 PolarHBondContact O-N 3.42Å; N184-E186 VanDerWaalsContact C-N 3.26Å; N184-E186 PolarHBondContact O-N 2.94Å; E186-G188 VanDerWaalsContact C-N 3.31Å; E186-G188 PolarHBondContact O-N 3Å; E186-R189 PolarHBondContact O-N 2.87Å; E186-R189 IonicContact OE2-CZ 3.14Å; E186-R189 IonicContact OE2-NE 3.26Å; E186-R189 PolarHBondContact OE2-NE 3.4Å; E186-R189 IonicContact OE2-NH2 3.73Å; E186-R189 PolarHBondContact OE2-NH2 3.36Å; E186-K190 HydrophobicContact CG-CD 4.25Å; E186-K190 HydrophobicContact CG-CG 4.47Å; E186-K190 WeakPolarHBondContact O-CB 3.4Å; E186-K190 WeakPolarHBondContact O-CG 3.28Å; E186-K190 PolarHBondContact O-N 2.89Å; E186-K190 WeakPolarHBondContact OE1-CE 3.45Å
187	V	98.6	Very high	97.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-45.6	173.9	170.4	0	0	0	0	110.6	H183 N184 K190 I191 D265 D267 L268	H183-V187 WeakPolarHBondContact O-CG2 3.01Å; H183-V187 PolarHBondContact O-N 3.11Å; N184-V187 PolarHBondContact O-N 3.16Å; V187-K190 PolarHBondContact O-N 3.37Å; V187-I191 HydrophobicContact CG1-CD1 3.71Å; V187-I191 WeakPolarHBondContact O-CB 3.46Å; V187-I191 WeakPolarHBondContact O-CG1 3.43Å; V187-I191 PolarHBondContact O-N 2.86Å; V187-D265 WeakPolarHBondContact CG2-O 3.3Å; V187-D267 WeakPolarHBondContact CG2-O 3.45Å; V187-L268 HydrophobicContact CB-CD2 4.09Å; V187-L268 HydrophobicContact CG1-CD2 3.64Å; V187-L268 HydrophobicContact CG1-CG 4.2Å
188	G	98.5	Very high	97.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-47.8	176.2	0	0	0	0	0	112.9	A109 N184 N185 E186 I191 L192	A109-G188 WeakPolarHBondContact O-CA 3.33Å; N184-G188 PolarHBondContact O-N 3.38Å; N184-G188 VanDerWaalsContact O-N 3.07Å; N185-G188 PolarHBondContact O-N 3.41Å; E186-G188 VanDerWaalsContact C-N 3.31Å; E186-G188 PolarHBondContact O-N 3Å; G188-I191 PolarHBondContact O-N 3.31Å; G188-L192 PolarHBondContact O-N 2.82Å; G188-L192 VanDerWaalsContact O-N 3.08Å
189	R	98.7	Very high	97.1	Very high	4 Å²	4	41 Å²	41	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-45.6	176	-77.9	-172.3	-64.4	-107.5	7.2	112.4	A112 L160 D168 N185 E186 L192 E193	A112-R189 HydrophobicContact CB-CG 4.45Å; L160-R189 HydrophobicContact CD2-CB 3.69Å; L160-R189 HydrophobicContact CD2-CG 4Å; L160-R189 VanDerWaalsContact CD2-O 3.24Å; L160-R189 WeakPolarHBondContact CD2-O 3.33Å; D168-R189 IonicContact OD1-CZ 3.39Å; D168-R189 IonicContact OD1-NH1 3Å; D168-R189 PolarHBondContact OD1-NH1 2.94Å; D168-R189 IonicContact OD1-NH2 2.88Å; D168-R189 PolarHBondContact OD1-NH2 2.84Å; D168-R189 IonicContact OD2-CZ 3.02Å; D168-R189 IonicContact OD2-NH1 2.94Å; D168-R189 IonicContact OD2-NH2 3.45Å; D168-R189 PolarHBondContact OD2-NH2 3.27Å; N185-R189 PolarHBondContact O-N 2.91Å; N185-R189 VanDerWaalsContact O-N 3.11Å; E186-R189 PolarHBondContact O-N 2.87Å; E186-R189 IonicContact OE2-CZ 3.14Å; E186-R189 IonicContact OE2-NE 3.26Å; E186-R189 PolarHBondContact OE2-NE 3.4Å; E186-R189 IonicContact OE2-NH2 3.73Å; E186-R189 PolarHBondContact OE2-NH2 3.36Å; R189-L192 WeakPolarHBondContact O-CB 3.34Å; R189-L192 PolarHBondContact O-N 2.97Å; R189-E193 PolarHBondContact O-N 2.86Å
190	K	98.3	Very high	96.9	Very high	42 Å²	42	41.5 Å²	41.5	18%	0.183	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-38	178	-76.4	-179	172.9	-175.1	0	113.4	E186 V187 L192 E193 K194 D265	E186-K190 HydrophobicContact CG-CD 4.25Å; E186-K190 HydrophobicContact CG-CG 4.47Å; E186-K190 WeakPolarHBondContact O-CB 3.4Å; E186-K190 WeakPolarHBondContact O-CG 3.28Å; E186-K190 PolarHBondContact O-N 2.89Å; E186-K190 WeakPolarHBondContact OE1-CE 3.45Å; V187-K190 PolarHBondContact O-N 3.37Å; K190-L192 VanDerWaalsContact C-N 3.32Å; K190-E193 PolarHBondContact O-N 3.31Å; K190-K194 WeakPolarHBondContact O-CB 3.38Å; K190-K194 WeakPolarHBondContact O-CG 3.37Å; K190-K194 PolarHBondContact O-N 3.34Å; K190-D265 HydrophobicContact CD-CB 4.43Å; K190-D265 IonicContact NZ-OD2 3.89Å; K190-D265 PolarHBondContact NZ-OD2 3.5Å
191	I	97.9	Very high	96.6	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.036	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-40.4	176.5	-73.6	166.5	0	0	0	110.1	V187 G188 N195 L224 I227 L228 K231	V187-I191 HydrophobicContact CG1-CD1 3.71Å; V187-I191 WeakPolarHBondContact O-CB 3.46Å; V187-I191 WeakPolarHBondContact O-CG1 3.43Å; V187-I191 PolarHBondContact O-N 2.86Å; G188-I191 PolarHBondContact O-N 3.31Å; I191-N195 WeakPolarHBondContact O-CB 3.22Å; I191-N195 PolarHBondContact O-N 2.92Å; I191-N195 PolarHBondContact O-ND2 2.88Å; I191-L224 HydrophobicContact CG2-CD2 3.97Å; I191-I227 HydrophobicContact CD1-CG2 4.47Å; I191-I227 HydrophobicContact CG2-CB 4.33Å; I191-I227 HydrophobicContact CG2-CG2 3.77Å; I191-L228 HydrophobicContact CD1-CD2 3.41Å; I191-L228 VanDerWaalsContact CD1-CD2 3.41Å; I191-L228 HydrophobicContact CD1-CG 4.04Å; I191-L228 HydrophobicContact CG2-CG 4.49Å; I191-K231 HydrophobicContact CD1-CG 4.13Å
192	L	98.3	Very high	96.4	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-50	172.5	173.9	64.7	0	0	0	111.6	A116 H117 I156 L160 G188 R189 K190 K194 N195 M196 L218 P219 L224	A116-L192 HydrophobicContact CB-CD2 3.55Å; H117-L192 HydrophobicContact CB-CD1 4.33Å; H117-L192 HydrophobicContact CB-CD2 4.12Å; I156-L192 HydrophobicContact CD1-CD2 3.63Å; I156-L192 HydrophobicContact CD1-CG 3.77Å; L160-L192 HydrophobicContact CD2-CD2 4.24Å; G188-L192 PolarHBondContact O-N 2.82Å; G188-L192 VanDerWaalsContact O-N 3.08Å; R189-L192 WeakPolarHBondContact O-CB 3.34Å; R189-L192 PolarHBondContact O-N 2.97Å; K190-L192 VanDerWaalsContact C-N 3.32Å; L192-K194 PolarHBondContact O-N 3.48Å; L192-N195 PolarHBondContact O-N 3.44Å; L192-M196 PolarHBondContact O-N 3.27Å; L192-L218 HydrophobicContact CD1-CD2 3.93Å; L192-P219 HydrophobicContact CD1-CG 4Å; L192-L224 HydrophobicContact CB-CD1 4.4Å; L192-L224 HydrophobicContact CD1-CD1 3.56Å
193	E	97.8	Very high	95.9	Very high	91 Å²	91	51.3 Å²	51.3	43%	0.425	24%	0.244	S	C	.	.	H	α-helix	trans	-56	-47.1	179.9	-170.3	178.5	-150.3	0	0	112.6	L160 R189 K190 N195 M196	L160-E193 HydrophobicContact CD1-CB 3.87Å; L160-E193 HydrophobicContact CD1-CG 3.92Å; R189-E193 PolarHBondContact O-N 2.86Å; K190-E193 PolarHBondContact O-N 3.31Å; E193-N195 PolarHBondContact O-N 3.43Å; E193-M196 WeakPolarHBondContact O-CG 3.49Å; E193-M196 PolarHBondContact O-N 2.77Å
194	K	97.3	Very high	95.4	Very high	135 Å²	135	49.8 Å²	49.8	59%	0.587	24%	0.24	S	C	*	.	H	α-helix	trans	-69.8	-15.6	-178	-72.3	-179.5	178.4	-175.9	0	114.1	K190 L192	K190-K194 WeakPolarHBondContact O-CB 3.38Å; K190-K194 WeakPolarHBondContact O-CG 3.37Å; K190-K194 PolarHBondContact O-N 3.34Å; L192-K194 PolarHBondContact O-N 3.48Å
195	N	97.4	Very high	95.1	Very high	57 Å²	57	55.8 Å²	55.8	31%	0.305	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	15.9	-176.4	-72.7	-81.4	0	0	0	113.1	I191 L192 E193 P219 L224 I227	I191-N195 WeakPolarHBondContact O-CB 3.22Å; I191-N195 PolarHBondContact O-N 2.92Å; I191-N195 PolarHBondContact O-ND2 2.88Å; L192-N195 PolarHBondContact O-N 3.44Å; E193-N195 PolarHBondContact O-N 3.43Å; N195-P219 HydrophobicContact CB-CB 4.4Å; N195-P219 HydrophobicContact CB-CG 4.15Å; N195-P219 WeakPolarHBondContact O-CB 3.46Å; N195-P219 WeakPolarHBondContact O-CG 3.38Å; N195-L224 HydrophobicContact CB-CD2 4.01Å; N195-I227 WeakPolarHBondContact OD1-CD1 3.34Å
196	M	96.4	Very high	94.6	Very high	45 Å²	45	62 Å²	62	22%	0.222	32%	0.32	C	S	.	.			trans	-57.5	142.2	167.5	-67.2	-65	-69.6	0	0	110.4	A154 I156 L192 E193 T217 L218	A154-M196 HydrophobicContact CB-CE 3.91Å; I156-M196 HydrophobicContact CB-CE 3.98Å; I156-M196 HydrophobicContact CB-CG 4.29Å; I156-M196 HydrophobicContact CB-SD 3.96Å; I156-M196 HydrophobicContact CD1-SD 4.06Å; I156-M196 HydrophobicContact CG1-CG 4.23Å; I156-M196 HydrophobicContact CG1-SD 3.92Å; I156-M196 HydrophobicContact CG2-CE 4.49Å; I156-M196 HydrophobicContact CG2-CG 4.32Å; L192-M196 PolarHBondContact O-N 3.27Å; E193-M196 WeakPolarHBondContact O-CG 3.49Å; E193-M196 PolarHBondContact O-N 2.77Å; M196-T217 WeakPolarHBondContact CE-O 3.34Å; M196-L218 HydrophobicContact CE-CD2 4.38Å; M196-L218 HydrophobicContact SD-CD2 3.77Å; M196-L218 HydrophobicContact SD-CG 4.44Å
197	R	94.9	Very high	94	Very high	103 Å²	103	62 Å²	62	39%	0.389	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.8	-175.1	-67	-176.9	167.8	178.2	-7.4	111.3	T216 T217 E223	R197-T216 CarbonylContact O-C 3.48Å; R197-T216 VanDerWaalsContact O-CA 3.27Å; R197-T216 WeakPolarHBondContact O-CA 3.24Å; R197-T217 HydrophobicContact CB-CG2 3.85Å; R197-T217 PolarHBondContact N-O 3.25Å; R197-T217 PolarHBondContact O-N 2.87Å; R197-E223 VanDerWaalsContact CZ-CD 3.47Å; R197-E223 IonicContact CZ-OE1 2.88Å; R197-E223 VanDerWaalsContact CZ-OE1 3.27Å; R197-E223 IonicContact CZ-OE2 3.72Å; R197-E223 IonicContact NE-OE2 3Å; R197-E223 IonicContact NH1-OE1 3.23Å; R197-E223 PolarHBondContact NH1-OE1 2.98Å; R197-E223 IonicContact NH1-OE2 3.63Å; R197-E223 PolarHBondContact NH1-OE2 2.71Å; R197-E223 IonicContact NH2-OE1 3.57Å; R197-E223 PolarHBondContact NH2-OE1 2.97Å; R197-E223 IonicContact NH2-OE2 3.48Å; R197-E223 PolarHBondContact NH2-OE2 3.4Å
198	L	91.7	Very high	93.5	Very high	81 Å²	81	64.1 Å²	64.1	42%	0.424	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.1	165.8	-173.5	71.8	0	0	0	108	W147 W149 C214 T216	W147-L198 HydrophobicContact CH2-CD1 3.92Å; W147-L198 HydrophobicContact CH2-CD2 4.05Å; W147-L198 HydrophobicContact CZ2-CD1 4.36Å; W147-L198 HydrophobicContact CZ2-CD2 3.63Å; W147-L198 HydrophobicContact CZ3-CD1 4.44Å; W149-L198 HydrophobicContact CH2-CD1 3.71Å; W149-L198 HydrophobicContact CZ3-CD1 3.61Å; L198-C214 HydrophobicContact CD1-CB 3.74Å; L198-C214 HydrophobicContact CD2-CB 4.37Å; L198-C214 HydrophobicContact CG-CB 3.99Å; L198-T216 HydrophobicContact CD1-CG2 4.42Å
199	E	92.7	Very high	93.1	Very high	93 Å²	93	67.9 Å²	67.9	44%	0.435	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	143.4	171.6	-79.3	-175.5	-178.7	0	0	109.8	C214 W215 T217	E199-C214 CarbonylContact O-C 3.56Å; E199-C214 WeakPolarHBondContact O-CA 3.45Å; E199-C214 VanDerWaalsContact O-CB 3.25Å; E199-C214 WeakPolarHBondContact O-CB 3.38Å; E199-W215 PolarHBondContact N-O 3.27Å; E199-W215 PolarHBondContact O-N 3.02Å; E199-T217 HydrophobicContact CB-CG2 4.22Å; E199-T217 VanDerWaalsContact CD-CG2 3.44Å; E199-T217 HydrophobicContact CG-CG2 3.59Å
200	C	91.5	Very high	92.5	Very high	57 Å²	57	73 Å²	73	39%	0.385	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142	-177.1	-60	0	0	0	0	110.8	K212 T213 C214	C200-K212 HydrophobicContact CB-CD 4.25Å; C200-T213 CarbonylContact C-O 3.54Å; C200-T213 VanDerWaalsContact CA-O 3.29Å; C200-T213 WeakPolarHBondContact CA-O 3.46Å; C200-C214 HydrophobicContact CB-CB 3.99Å; C200-C214 WeakPolarHBondContact CB-SG 3.46Å; C200-C214 WeakPolarHBondContact SG-CB 3.25Å; C200-C214 CovalentContact SG-SG 2.03Å; C200-C214 PolarHBondContact SG-SG 3.07Å
201	K	91.5	Very high	92	Very high	120 Å²	120	74.5 Å²	74.5	52%	0.522	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.9	168.7	-176.9	172.8	-179.4	177.5	0	110.5	H203 K212 T213 W215	K201-H203 PolarHBondContact O-CD2 2.93Å; K201-H203 VanDerWaalsContact O-CD2 3.3Å; K201-K212 CarbonylContact O-C 3.57Å; K201-K212 WeakPolarHBondContact O-CA 3.03Å; K201-K212 WeakPolarHBondContact O-CB 3.25Å; K201-T213 PolarHBondContact N-O 3.21Å; K201-T213 PolarHBondContact O-N 3.04Å; K201-W215 HydrophobicContact CB-CH2 3.64Å; K201-W215 HydrophobicContact CB-CZ3 3.96Å
202	C	91.3	Very high	91.6	Very high	38 Å²	38	77.2 Å²	77.2	26%	0.257	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.8	178	-61.2	0	0	0	0	110.6	C209	C202-C209 HydrophobicContact CB-CB 3.86Å; C202-C209 WeakPolarHBondContact CB-SG 3.46Å; C202-C209 VanDerWaalsContact SG-CA 3.55Å; C202-C209 WeakPolarHBondContact SG-CB 3.38Å; C202-C209 CovalentContact SG-SG 2.03Å; C202-C209 PolarHBondContact SG-SG 3.19Å
203	H	88.4	Confident	91.1	Very high	104 Å²	104	78 Å²	78	48%	0.481	44%	0.437	S	S	.	.			trans	-131	13.9	-174.8	-60.8	-79.2	0	0	0	112.8	K201 T211	K201-H203 PolarHBondContact O-CD2 2.93Å; K201-H203 VanDerWaalsContact O-CD2 3.3Å; H203-T211 PolarHBondContact N-O 2.78Å
204	G	87.1	Confident	90.9	Very high	12 Å²	12	73.7 Å²	73.7	12%	0.124	42%	0.417	C	S	.	.	S	Bend	trans	-72.5	166.6	177.2	0	0	0	0	0	112.8	S206 G207 S208	G204-S206 PolarHBondContact O-N 2.87Å; G204-G207 PolarHBondContact O-N 3.02Å; G204-S208 VanDerWaalsContact C-OG 3.26Å; G204-S208 WeakPolarHBondContact CA-O 3.47Å; G204-S208 WeakPolarHBondContact CA-OG 3.47Å; G204-S208 PolarHBondContact N-O 3.43Å; G204-S208 PolarHBondContact O-N 3.29Å
205	V	92.1	Very high	90.7	Very high	126 Å²	126	70.3 Å²	70.3	76%	0.764	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-52.2	134	178.3	-176.7	0	0	0	0	109.7	G207 S208	V205-G207 PolarHBondContact O-N 2.94Å; V205-S208 PolarHBondContact N-OG 3.23Å; V205-S208 WeakPolarHBondContact O-CB 3.3Å; V205-S208 PolarHBondContact O-N 2.85Å; V205-S208 VanDerWaalsContact O-N 3.11Å; V205-S208 PolarHBondContact O-OG 2.8Å
206	S	88.3	Confident	90.5	Very high	131 Å²	131	68.3 Å²	68.3	92%	0.916	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	55.5	28.1	-176.7	-54.5	0	0	0	0	115.1	G204	G204-S206 PolarHBondContact O-N 2.87Å
207	G	85.1	Confident	90.5	Very high	57 Å²	57	67.8 Å²	67.8	59%	0.588	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	82.3	11.1	-179.8	0	0	0	0	0	114.5	G204 V205	G204-G207 PolarHBondContact O-N 3.02Å; V205-G207 PolarHBondContact O-N 2.94Å
208	S	88.9	Confident	90.6	Very high	43 Å²	43	63.8 Å²	63.8	30%	0.301	38%	0.376	S	S	.	.			trans	-63.7	153.7	175.4	59	0	0	0	0	112.6	G204 V205	G204-S208 VanDerWaalsContact C-OG 3.26Å; G204-S208 WeakPolarHBondContact CA-O 3.47Å; G204-S208 WeakPolarHBondContact CA-OG 3.47Å; G204-S208 PolarHBondContact N-O 3.43Å; G204-S208 PolarHBondContact O-N 3.29Å; V205-S208 PolarHBondContact N-OG 3.23Å; V205-S208 WeakPolarHBondContact O-CB 3.3Å; V205-S208 PolarHBondContact O-N 2.85Å; V205-S208 VanDerWaalsContact O-N 3.11Å; V205-S208 PolarHBondContact O-OG 2.8Å
209	C	89.3	Confident	90.9	Very high	80 Å²	80	60.2 Å²	60.2	54%	0.541	36%	0.357	S	S	.	.	S	Bend	trans	-95.6	20.7	-179	-68.6	0	0	0	0	114.1	C202 T211	C202-C209 HydrophobicContact CB-CB 3.86Å; C202-C209 WeakPolarHBondContact CB-SG 3.46Å; C202-C209 VanDerWaalsContact SG-CA 3.55Å; C202-C209 WeakPolarHBondContact SG-CB 3.38Å; C202-C209 CovalentContact SG-SG 2.03Å; C202-C209 PolarHBondContact SG-SG 3.19Å; C209-T211 PolarHBondContact O-N 2.87Å
210	T	86.5	Confident	91.2	Very high	111 Å²	111	62.8 Å²	62.8	68%	0.681	37%	0.367	S	S	*	.	S	Bend	trans	-61.3	-33.1	177.5	52.2	0	0	0	0	112.3
211	T	86.9	Confident	91.5	Very high	73 Å²	73	61 Å²	61	45%	0.448	35%	0.353	S	S	.	.	S	Bend	trans	-122.7	125.3	165.5	-61	0	0	0	0	108.6	H203 C209	H203-T211 PolarHBondContact N-O 2.78Å; C209-T211 PolarHBondContact O-N 2.87Å
212	K	89.5	Confident	91.8	Very high	65 Å²	65	60 Å²	60	28%	0.283	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.5	174.4	69.6	-172.9	179.8	-177.5	0	111.5	W147 K148 C200 K201	W147-K212 HydrophobicContact CB-CD 4.19Å; W147-K212 HydrophobicContact CB-CG 3.46Å; W147-K212 VanDerWaalsContact CB-CG 3.46Å; W147-K212 WeakPolarHBondContact CB-O 3.18Å; W147-K212 HydrophobicContact CG-CG 4.44Å; K148-K212 PolarHBondContact N-O 2.63Å; C200-K212 HydrophobicContact CB-CD 4.25Å; K201-K212 CarbonylContact O-C 3.57Å; K201-K212 WeakPolarHBondContact O-CA 3.03Å; K201-K212 WeakPolarHBondContact O-CB 3.25Å
213	T	89.5	Confident	92.1	Very high	17 Å²	17	60.9 Å²	60.9	10%	0.104	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132	176.5	-53.8	0	0	0	0	107.8	K148 C200 K201	K148-T213 WeakPolarHBondContact CE-OG1 3.38Å; K148-T213 HydrophobicContact CG-CG2 4.39Å; K148-T213 WeakPolarHBondContact O-CA 3.43Å; C200-T213 CarbonylContact C-O 3.54Å; C200-T213 VanDerWaalsContact CA-O 3.29Å; C200-T213 WeakPolarHBondContact CA-O 3.46Å; K201-T213 PolarHBondContact N-O 3.21Å; K201-T213 PolarHBondContact O-N 3.04Å
214	C	91.9	Very high	92.6	Very high	0 Å²	0	56 Å²	56	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.9	-179.3	-45.4	0	0	0	0	112.6	W147 K148 G150 L198 E199 C200	W147-C214 HydrophobicContact CD2-CB 4.05Å; W147-C214 HydrophobicContact CE3-CB 3.46Å; W147-C214 VanDerWaalsContact CE3-CB 3.46Å; W147-C214 HydrophobicContact CH2-CB 4.21Å; W147-C214 HydrophobicContact CZ3-CB 3.57Å; K148-C214 PolarHBondContact O-N 3.3Å; G150-C214 PolarHBondContact N-O 2.98Å; G150-C214 VanDerWaalsContact N-O 3.1Å; L198-C214 HydrophobicContact CD1-CB 3.74Å; L198-C214 HydrophobicContact CD2-CB 4.37Å; L198-C214 HydrophobicContact CG-CB 3.99Å; E199-C214 CarbonylContact O-C 3.56Å; E199-C214 WeakPolarHBondContact O-CA 3.45Å; E199-C214 VanDerWaalsContact O-CB 3.25Å; E199-C214 WeakPolarHBondContact O-CB 3.38Å; C200-C214 HydrophobicContact CB-CB 3.99Å; C200-C214 WeakPolarHBondContact CB-SG 3.46Å; C200-C214 WeakPolarHBondContact SG-CB 3.25Å; C200-C214 CovalentContact SG-SG 2.03Å; C200-C214 PolarHBondContact SG-SG 3.07Å
215	W	93.4	Very high	93.1	Very high	64 Å²	64	55.4 Å²	55.4	24%	0.242	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	154.9	175.3	50.4	94.4	0	0	0	110.3	G150 S153 E199 K201	G150-W215 WeakPolarHBondContact O-CB 3.33Å; S153-W215 WeakPolarHBondContact OG-CA 3.46Å; E199-W215 PolarHBondContact N-O 3.27Å; E199-W215 PolarHBondContact O-N 3.02Å; K201-W215 HydrophobicContact CB-CH2 3.64Å; K201-W215 HydrophobicContact CB-CZ3 3.96Å
216	T	94.7	Very high	93.4	Very high	15 Å²	15	55 Å²	55	9%	0.092	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133	171	55.1	0	0	0	0	110.7	K137 W149 S153 A154 R197 L198	K137-T216 HydrophobicContact CD-CG2 3.91Å; K137-T216 PolarHBondContact NZ-OG1 2.92Å; W149-T216 HydrophobicContact CH2-CG2 3.8Å; W149-T216 HydrophobicContact CZ3-CG2 3.86Å; S153-T216 WeakPolarHBondContact CA-O 3.37Å; S153-T216 WeakPolarHBondContact CB-OG1 3.33Å; S153-T216 PolarHBondContact OG-N 3.13Å; A154-T216 WeakPolarHBondContact CB-O 3.38Å; A154-T216 PolarHBondContact N-O 3.01Å; R197-T216 CarbonylContact O-C 3.48Å; R197-T216 VanDerWaalsContact O-CA 3.27Å; R197-T216 WeakPolarHBondContact O-CA 3.24Å; L198-T216 HydrophobicContact CD1-CG2 4.42Å
217	T	95.9	Very high	93.9	Very high	33 Å²	33	51 Å²	51	20%	0.202	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	162.4	178.6	-168.5	0	0	0	0	111.2	M196 R197 E199	M196-T217 WeakPolarHBondContact CE-O 3.34Å; R197-T217 HydrophobicContact CB-CG2 3.85Å; R197-T217 PolarHBondContact N-O 3.25Å; R197-T217 PolarHBondContact O-N 2.87Å; E199-T217 HydrophobicContact CB-CG2 4.22Å; E199-T217 VanDerWaalsContact CD-CG2 3.44Å; E199-T217 HydrophobicContact CG-CG2 3.59Å
218	L	97.3	Very high	94.5	Very high	20 Å²	20	48.3 Å²	48.3	11%	0.105	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-72.4	146.4	173.1	-70.9	161.9	0	0	0	110.8	H117 T120 A121 I156 L192 M196	H117-L218 WeakPolarHBondContact O-CD1 3.39Å; T120-L218 HydrophobicContact CG2-CD1 3.91Å; T120-L218 HydrophobicContact CG2-CD2 3.85Å; T120-L218 HydrophobicContact CG2-CG 3.98Å; A121-L218 HydrophobicContact CB-CD1 3.72Å; I156-L218 HydrophobicContact CD1-CD2 4.03Å; L192-L218 HydrophobicContact CD1-CD2 3.93Å; M196-L218 HydrophobicContact CE-CD2 4.38Å; M196-L218 HydrophobicContact SD-CD2 3.77Å; M196-L218 HydrophobicContact SD-CG 4.44Å
219	P	97.5	Very high	95	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.032	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-67.3	165.1	171.6	28.2	-33.3	0	0	0	111.6	H117 L192 N195 F221 L224	H117-P219 PolarHBondContact NE2-O 3.2Å; L192-P219 HydrophobicContact CD1-CG 4Å; N195-P219 HydrophobicContact CB-CB 4.4Å; N195-P219 HydrophobicContact CB-CG 4.15Å; N195-P219 WeakPolarHBondContact O-CB 3.46Å; N195-P219 WeakPolarHBondContact O-CG 3.38Å; P219-F221 PolarHBondContact O-N 3.39Å; P219-L224 HydrophobicContact CG-CD1 3.98Å; P219-L224 HydrophobicContact CG-CD2 3.88Å; P219-L224 HydrophobicContact CG-CG 3.97Å
220	K	97.6	Very high	95.4	Very high	147 Å²	147	50.8 Å²	50.8	64%	0.639	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-67.2	128.9	169.6	-64.8	178.7	179.2	175.1	0	108.1	R222 E223	K220-R222 PolarHBondContact O-N 2.8Å; K220-R222 VanDerWaalsContact O-N 3.12Å; K220-E223 HydrophobicContact CB-CG 4.12Å; K220-E223 PolarHBondContact N-OE2 3.41Å; K220-E223 WeakPolarHBondContact O-CB 3.43Å; K220-E223 PolarHBondContact O-N 3.2Å
221	F	98.2	Very high	95.9	Very high	21 Å²	21	48.1 Å²	48.1	9%	0.092	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-31.5	-174.1	-162.4	-104.7	0	0	0	113.5	M68 E72 I110 A113 G114 H117 P219 E223 L224 G225	M68-F221 HydrophobicContact CG-CD1 3.62Å; M68-F221 HydrophobicContact CG-CD2 4.45Å; M68-F221 HydrophobicContact CG-CE1 3.84Å; M68-F221 HydrophobicContact CG-CG 3.94Å; M68-F221 HydrophobicContact CG-CZ 4.38Å; M68-F221 HydrophobicContact SD-CB 3.95Å; M68-F221 HydrophobicContact SD-CD1 3.89Å; M68-F221 HydrophobicContact SD-CD2 3.67Å; M68-F221 HydrophobicContact SD-CE1 4.29Å; M68-F221 HydrophobicContact SD-CE2 4.15Å; M68-F221 HydrophobicContact SD-CG 3.54Å; M68-F221 VanDerWaalsContact SD-CG 3.54Å; M68-F221 HydrophobicContact SD-CZ 4.42Å; E72-F221 HydrophobicContact CB-CD1 3.81Å; E72-F221 HydrophobicContact CB-CE1 3.56Å; E72-F221 HydrophobicContact CG-CD1 3.98Å; E72-F221 HydrophobicContact CG-CE1 3.96Å; I110-F221 HydrophobicContact CD1-CE1 3.82Å; I110-F221 HydrophobicContact CD1-CZ 3.67Å; I110-F221 HydrophobicContact CG1-CE1 4.06Å; I110-F221 HydrophobicContact CG1-CZ 3.98Å; A113-F221 HydrophobicContact CB-CE2 4.48Å; G114-F221 VanDerWaalsContact CA-CE2 3.43Å; H117-F221 HydrophobicContact CB-CD2 4.18Å; H117-F221 HydrophobicContact CB-CE2 4.26Å; H117-F221 AromaticContact CD2-CD2 3.94Å; H117-F221 AromaticContact CG-CD2 3.96Å; P219-F221 PolarHBondContact O-N 3.39Å; F221-E223 VanDerWaalsContact C-N 3.27Å; F221-E223 PolarHBondContact O-N 3.34Å; F221-L224 HydrophobicContact CD2-CD1 3.85Å; F221-L224 HydrophobicContact CE2-CD1 4.13Å; F221-L224 WeakPolarHBondContact O-CB 3.34Å; F221-L224 PolarHBondContact O-N 2.87Å; F221-G225 PolarHBondContact O-N 3.36Å
222	R	98.3	Very high	96.5	Very high	99 Å²	99	46.5 Å²	46.5	37%	0.374	21%	0.206	S	C	.	.	H	α-helix	trans	-56.4	-37.9	172.8	178.5	55.8	54.1	71.6	3.5	113.4	E72 F75 K220 G225 Y226	E72-R222 VanDerWaalsContact OE1-CD 3.23Å; E72-R222 WeakPolarHBondContact OE1-CD 3.48Å; E72-R222 IonicContact OE1-NE 2.98Å; E72-R222 PolarHBondContact OE1-NE 2.91Å; E72-R222 VanDerWaalsContact OE1-NE 3.11Å; E72-R222 IonicContact OE2-CZ 2.79Å; E72-R222 IonicContact OE2-NE 3.27Å; E72-R222 PolarHBondContact OE2-NE 3.11Å; E72-R222 IonicContact OE2-NH2 3.96Å; E72-R222 PolarHBondContact OE2-NH2 2.86Å; F75-R222 VanDerWaalsContact CD1-NE 3.32Å; F75-R222 VanDerWaalsContact CE1-CD 3.46Å; F75-R222 VanDerWaalsContact CE1-CZ 3.49Å; K220-R222 PolarHBondContact O-N 2.8Å; K220-R222 VanDerWaalsContact O-N 3.12Å; R222-G225 PolarHBondContact O-N 3.46Å; R222-Y226 HydrophobicContact CG-CD2 4.2Å; R222-Y226 HydrophobicContact CG-CE2 3.55Å; R222-Y226 VanDerWaalsContact O-CD2 3.29Å; R222-Y226 WeakPolarHBondContact O-CD2 3.4Å; R222-Y226 PolarHBondContact O-N 3.48Å; R222-Y226 VanDerWaalsContact O-N 3.13Å
223	E	98.1	Very high	96.8	Very high	55 Å²	55	46.2 Å²	46.2	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-68.7	-39.3	179.7	-62.8	164.7	156.2	0	0	110.7	R197 K220 F221 G225 Y226 I227	R197-E223 VanDerWaalsContact CZ-CD 3.47Å; R197-E223 IonicContact CZ-OE1 2.88Å; R197-E223 VanDerWaalsContact CZ-OE1 3.27Å; R197-E223 IonicContact CZ-OE2 3.72Å; R197-E223 IonicContact NE-OE2 3Å; R197-E223 IonicContact NH1-OE1 3.23Å; R197-E223 PolarHBondContact NH1-OE1 2.98Å; R197-E223 IonicContact NH1-OE2 3.63Å; R197-E223 PolarHBondContact NH1-OE2 2.71Å; R197-E223 IonicContact NH2-OE1 3.57Å; R197-E223 PolarHBondContact NH2-OE1 2.97Å; R197-E223 IonicContact NH2-OE2 3.48Å; R197-E223 PolarHBondContact NH2-OE2 3.4Å; K220-E223 HydrophobicContact CB-CG 4.12Å; K220-E223 PolarHBondContact N-OE2 3.41Å; K220-E223 WeakPolarHBondContact O-CB 3.43Å; K220-E223 PolarHBondContact O-N 3.2Å; F221-E223 VanDerWaalsContact C-N 3.27Å; F221-E223 PolarHBondContact O-N 3.34Å; E223-G225 VanDerWaalsContact C-N 3.29Å; E223-G225 PolarHBondContact O-N 3.07Å; E223-Y226 PolarHBondContact O-N 3.32Å; E223-I227 WeakPolarHBondContact O-CG1 3.5Å; E223-I227 PolarHBondContact O-N 3.39Å
224	L	98.1	Very high	97.1	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-40.5	171.9	-61.2	174.1	0	0	0	111.4	I191 L192 N195 P219 F221 Y226 I227 L228	I191-L224 HydrophobicContact CG2-CD2 3.97Å; L192-L224 HydrophobicContact CB-CD1 4.4Å; L192-L224 HydrophobicContact CD1-CD1 3.56Å; N195-L224 HydrophobicContact CB-CD2 4.01Å; P219-L224 HydrophobicContact CG-CD1 3.98Å; P219-L224 HydrophobicContact CG-CD2 3.88Å; P219-L224 HydrophobicContact CG-CG 3.97Å; F221-L224 HydrophobicContact CD2-CD1 3.85Å; F221-L224 HydrophobicContact CE2-CD1 4.13Å; F221-L224 WeakPolarHBondContact O-CB 3.34Å; F221-L224 PolarHBondContact O-N 2.87Å; L224-Y226 VanDerWaalsContact C-N 3.32Å; L224-Y226 PolarHBondContact O-N 3.1Å; L224-I227 PolarHBondContact O-N 3.02Å; L224-L228 WeakPolarHBondContact O-CB 3.42Å; L224-L228 PolarHBondContact O-N 3.34Å
225	G	98.3	Very high	97.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.2	-45.7	174	0	0	0	0	0	112.4	F221 R222 E223 K229	F221-G225 PolarHBondContact O-N 3.36Å; R222-G225 PolarHBondContact O-N 3.46Å; E223-G225 VanDerWaalsContact C-N 3.29Å; E223-G225 PolarHBondContact O-N 3.07Å; G225-K229 WeakPolarHBondContact O-CB 3.24Å; G225-K229 PolarHBondContact O-N 3.26Å
226	Y	98.6	Very high	97.6	Very high	119 Å²	119	50.5 Å²	50.5	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-66.3	-44.3	176.7	-65.5	-48.7	0	0	0	113	F75 Q76 R222 E223 L224 L228 K229 E230	F75-Y226 HydrophobicContact CE1-CE1 4.02Å; Q76-Y226 VanDerWaalsContact NE2-CE1 3.35Å; R222-Y226 HydrophobicContact CG-CD2 4.2Å; R222-Y226 HydrophobicContact CG-CE2 3.55Å; R222-Y226 VanDerWaalsContact O-CD2 3.29Å; R222-Y226 WeakPolarHBondContact O-CD2 3.4Å; R222-Y226 PolarHBondContact O-N 3.48Å; R222-Y226 VanDerWaalsContact O-N 3.13Å; E223-Y226 PolarHBondContact O-N 3.32Å; L224-Y226 VanDerWaalsContact C-N 3.32Å; L224-Y226 PolarHBondContact O-N 3.1Å; Y226-L228 PolarHBondContact O-N 3.28Å; Y226-K229 WeakPolarHBondContact O-CB 3.48Å; Y226-K229 PolarHBondContact O-N 2.98Å; Y226-K229 VanDerWaalsContact O-N 3.11Å; Y226-E230 PolarHBondContact O-N 2.86Å
227	I	98.4	Very high	97.7	Very high	46 Å²	46	51.5 Å²	51.5	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-47.1	177.8	-65.1	165.6	0	0	0	110.4	I191 N195 E223 L224 K229 E230 K231	I191-I227 HydrophobicContact CD1-CG2 4.47Å; I191-I227 HydrophobicContact CG2-CB 4.33Å; I191-I227 HydrophobicContact CG2-CG2 3.77Å; N195-I227 WeakPolarHBondContact OD1-CD1 3.34Å; E223-I227 WeakPolarHBondContact O-CG1 3.5Å; E223-I227 PolarHBondContact O-N 3.39Å; L224-I227 PolarHBondContact O-N 3.02Å; I227-K229 PolarHBondContact O-N 2.92Å; I227-E230 WeakPolarHBondContact O-CB 3.24Å; I227-E230 PolarHBondContact O-N 3.23Å; I227-K231 WeakPolarHBondContact O-CG 3.17Å; I227-K231 PolarHBondContact O-N 2.76Å
228	L	98.5	Very high	97.7	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-31.5	176.3	-79.2	166.6	0	0	0	111.9	F106 A109 I110 I191 L224 Y226 K231 Y232 L268	F106-L228 HydrophobicContact CD2-CB 4.02Å; F106-L228 HydrophobicContact CE2-CB 3.56Å; F106-L228 HydrophobicContact CZ-CB 4.36Å; A109-L228 HydrophobicContact CB-CD1 4.49Å; A109-L228 HydrophobicContact CB-CD2 3.71Å; I110-L228 HydrophobicContact CB-CD1 4.11Å; I110-L228 HydrophobicContact CD1-CD1 3.51Å; I110-L228 HydrophobicContact CG1-CD1 4.41Å; I191-L228 HydrophobicContact CD1-CD2 3.41Å; I191-L228 VanDerWaalsContact CD1-CD2 3.41Å; I191-L228 HydrophobicContact CD1-CG 4.04Å; I191-L228 HydrophobicContact CG2-CG 4.49Å; L224-L228 WeakPolarHBondContact O-CB 3.42Å; L224-L228 PolarHBondContact O-N 3.34Å; Y226-L228 PolarHBondContact O-N 3.28Å; L228-K231 PolarHBondContact O-N 3.41Å; L228-Y232 WeakPolarHBondContact O-CB 3.31Å; L228-Y232 PolarHBondContact O-N 3.07Å; L228-L268 HydrophobicContact CD2-CD1 4.47Å; L228-L268 HydrophobicContact CD2-CD2 4.45Å
229	K	97.9	Very high	97.6	Very high	56 Å²	56	52 Å²	52	24%	0.243	24%	0.243	C	C	.	.	H	α-helix	trans	-70.1	-36.7	178.5	-176.1	58.1	174.1	168.7	0	111.4	Q76 F77 F106 G225 Y226 I227 Y232 A233	Q76-K229 HydrophobicContact CB-CD 4.36Å; F77-K229 HydrophobicContact CE2-CD 4.07Å; F77-K229 HydrophobicContact CZ-CD 4.16Å; F106-K229 HydrophobicContact CE2-CB 4.21Å; G225-K229 WeakPolarHBondContact O-CB 3.24Å; G225-K229 PolarHBondContact O-N 3.26Å; Y226-K229 WeakPolarHBondContact O-CB 3.48Å; Y226-K229 PolarHBondContact O-N 2.98Å; Y226-K229 VanDerWaalsContact O-N 3.11Å; I227-K229 PolarHBondContact O-N 2.92Å; K229-Y232 HydrophobicContact CD-CD1 4.07Å; K229-Y232 WeakPolarHBondContact O-CB 3.14Å; K229-Y232 PolarHBondContact O-N 3.38Å; K229-A233 PolarHBondContact O-N 3.19Å
230	E	97.9	Very high	97.5	Very high	119 Å²	119	53.8 Å²	53.8	56%	0.556	26%	0.255	S	S	*	.	H	α-helix	trans	-64.3	-44.8	170.7	-166.8	-151.2	148.5	0	0	111.3	Y226 I227 Y232 A233 H234	Y226-E230 PolarHBondContact O-N 2.86Å; I227-E230 WeakPolarHBondContact O-CB 3.24Å; I227-E230 PolarHBondContact O-N 3.23Å; E230-Y232 VanDerWaalsContact C-N 3.26Å; E230-Y232 PolarHBondContact O-N 2.04Å; E230-A233 WeakPolarHBondContact O-CB 3.29Å; E230-A233 PolarHBondContact O-N 2.76Å; E230-H234 PolarHBondContact O-N 2.65Å; E230-H234 PolarHBondContact O-ND1 3.1Å
231	K	98	Very high	97.1	Very high	55 Å²	55	47.8 Å²	47.8	24%	0.239	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-35.1	173.8	-67.1	-63.4	-172.5	179.3	0	112.5	I191 I227 L228 H234 A235 T266 L268	I191-K231 HydrophobicContact CD1-CG 4.13Å; I227-K231 WeakPolarHBondContact O-CG 3.17Å; I227-K231 PolarHBondContact O-N 2.76Å; L228-K231 PolarHBondContact O-N 3.41Å; K231-H234 CarbonylContact O-C 3.59Å; K231-H234 PolarHBondContact O-N 3.31Å; K231-A235 PolarHBondContact O-N 2.69Å; K231-T266 WeakPolarHBondContact CD-O 3.07Å; K231-T266 WeakPolarHBondContact CE-O 3.03Å; K231-L268 HydrophobicContact CB-CD1 3.99Å; K231-L268 HydrophobicContact CB-CG 4.08Å
232	Y	97.9	Very high	96.6	Very high	40 Å²	40	53.4 Å²	53.4	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-40.8	175.5	161.2	-86.7	0	0	0	112	F77 K102 E103 F106 L228 K229 E230 H234 A235	F77-Y232 HydrophobicContact CE1-CD1 4.43Å; F77-Y232 HydrophobicContact CE1-CD2 4.44Å; F77-Y232 AromaticContact CE1-CE1 3.92Å; F77-Y232 HydrophobicContact CE1-CE1 3.92Å; F77-Y232 AromaticContact CE1-CE2 3.88Å; F77-Y232 HydrophobicContact CE1-CE2 3.88Å; F77-Y232 AromaticContact CE1-CZ 3.61Å; F77-Y232 HydrophobicContact CZ-CD1 4.09Å; F77-Y232 AromaticContact CZ-CD2 3.84Å; F77-Y232 HydrophobicContact CZ-CD2 3.84Å; F77-Y232 HydrophobicContact CZ-CE1 4.02Å; F77-Y232 AromaticContact CZ-CE2 3.72Å; F77-Y232 HydrophobicContact CZ-CE2 3.72Å; F77-Y232 HydrophobicContact CZ-CG 4.01Å; F77-Y232 AromaticContact CZ-CZ 3.84Å; K102-Y232 HydrophobicContact CB-CD2 3.97Å; K102-Y232 HydrophobicContact CB-CE2 3.49Å; K102-Y232 VanDerWaalsContact CB-CE2 3.49Å; K102-Y232 WeakPolarHBondContact O-CD2 3.27Å; E103-Y232 HydrophobicContact CG-CE2 4.17Å; E103-Y232 PolarHBondContact OE1-OH 2.86Å; E103-Y232 VanDerWaalsContact OE1-OH 3.08Å; F106-Y232 HydrophobicContact CB-CD2 3.94Å; L228-Y232 WeakPolarHBondContact O-CB 3.31Å; L228-Y232 PolarHBondContact O-N 3.07Å; K229-Y232 HydrophobicContact CD-CD1 4.07Å; K229-Y232 WeakPolarHBondContact O-CB 3.14Å; K229-Y232 PolarHBondContact O-N 3.38Å; E230-Y232 VanDerWaalsContact C-N 3.26Å; E230-Y232 PolarHBondContact O-N 2.04Å; Y232-H234 PolarHBondContact O-N 3.15Å; Y232-A235 WeakPolarHBondContact O-CB 3.06Å; Y232-A235 PolarHBondContact O-N 3.02Å
233	A	96.8	Very high	95.7	Very high	58 Å²	58	50.7 Å²	50.7	48%	0.479	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-39.9	177.5	0	0	0	0	0	111.1	K229 E230	K229-A233 PolarHBondContact O-N 3.19Å; E230-A233 WeakPolarHBondContact O-CB 3.29Å; E230-A233 PolarHBondContact O-N 2.76Å
234	H	96.6	Very high	94.5	Very high	135 Å²	135	54.1 Å²	54.1	63%	0.625	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	16.5	-178.9	-54.8	100.2	0	0	0	114.3	E230 K231 Y232	E230-H234 PolarHBondContact O-N 2.65Å; E230-H234 PolarHBondContact O-ND1 3.1Å; K231-H234 CarbonylContact O-C 3.59Å; K231-H234 PolarHBondContact O-N 3.31Å; Y232-H234 PolarHBondContact O-N 3.15Å
235	A	97.7	Very high	93.5	Very high	9 Å²	9	65.6 Å²	65.6	7%	0.074	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-58	142.4	-177.6	0	0	0	0	0	111.8	K102 K231 Y232 L268 Y270	K102-A235 HydrophobicContact CD-CB 4.23Å; K102-A235 HydrophobicContact CG-CB 4.12Å; K231-A235 PolarHBondContact O-N 2.69Å; Y232-A235 WeakPolarHBondContact O-CB 3.06Å; Y232-A235 PolarHBondContact O-N 3.02Å; A235-L268 CarbonylContact C-O 3.55Å; A235-L268 VanDerWaalsContact CA-O 3.3Å; A235-L268 WeakPolarHBondContact CA-O 3.39Å; A235-L268 HydrophobicContact CB-CB 4.04Å; A235-Y270 HydrophobicContact CB-CD1 4.11Å; A235-Y270 HydrophobicContact CB-CE1 4.48Å; A235-Y270 WeakPolarHBondContact O-CE1 3.49Å
236	V	97.1	Very high	92.4	Very high	27 Å²	27	70.8 Å²	70.8	16%	0.164	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.7	-169.2	-178	0	0	0	0	110.9	V238 I254 D267 L268 V269 Y270	V236-V238 HydrophobicContact CG1-CG1 4.15Å; V236-V238 PolarHBondContact O-N 2.95Å; V236-I254 HydrophobicContact CG1-CB 4.32Å; V236-I254 HydrophobicContact CG1-CD1 4.27Å; V236-I254 HydrophobicContact CG1-CG1 3.87Å; V236-I254 HydrophobicContact CG1-CG2 3.82Å; V236-D267 HydrophobicContact CG2-CB 4.09Å; V236-L268 PolarHBondContact N-O 3.25Å; V236-V269 WeakPolarHBondContact O-CA 3.42Å; V236-Y270 VanDerWaalsContact C-CE1 3.43Å; V236-Y270 VanDerWaalsContact O-CD1 3.27Å; V236-Y270 WeakPolarHBondContact O-CD1 3.48Å; V236-Y270 PolarHBondContact O-N 3Å
237	H	97.3	Very high	91.4	Very high	37 Å²	37	73.4 Å²	73.4	17%	0.171	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.1	172.9	-159.3	172.1	0	0	0	109	K255 Y270 I271	H237-K255 HydrophobicContact CB-CB 4.32Å; H237-K255 WeakPolarHBondContact O-CB 3.41Å; H237-K255 PolarHBondContact O-N 3.17Å; H237-Y270 HydrophobicContact CB-CE1 3.87Å; H237-Y270 HydrophobicContact CB-CE2 3.9Å; H237-Y270 VanDerWaalsContact CB-CZ 3.49Å; H237-Y270 WeakPolarHBondContact CB-OH 3.49Å; H237-Y270 AromaticContact CD2-CD2 3.91Å; H237-Y270 AromaticContact CD2-CE2 3.67Å; H237-Y270 PolarHBondContact CD2-O 2.84Å; H237-Y270 AromaticContact CG-CE2 3.58Å; H237-Y270 AromaticContact CG-CZ 3.72Å; H237-Y270 VanDerWaalsContact N-CE1 3.29Å; H237-Y270 AromaticContact ND1-CE2 3.94Å; H237-I271 PolarHBondContact NE2-O 3.42Å
238	V	96.8	Very high	90.7	Very high	1 Å²	1	77.9 Å²	77.9	1%	0.006	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	159.6	-179.3	-60.4	0	0	0	0	111.9	V236 L252 K253 P263 V269 Y270 I271	V236-V238 HydrophobicContact CG1-CG1 4.15Å; V236-V238 PolarHBondContact O-N 2.95Å; V238-L252 HydrophobicContact CB-CB 4.17Å; V238-L252 HydrophobicContact CG2-CB 4.07Å; V238-L252 HydrophobicContact CG2-CD1 3.95Å; V238-L252 HydrophobicContact CG2-CD2 4.29Å; V238-L252 HydrophobicContact CG2-CG 4.32Å; V238-K253 CarbonylContact C-O 3.6Å; V238-K253 WeakPolarHBondContact CA-O 3.28Å; V238-K253 WeakPolarHBondContact CB-O 3.24Å; V238-P263 HydrophobicContact CG1-CB 4.36Å; V238-P263 HydrophobicContact CG1-CG 4.24Å; V238-V269 HydrophobicContact CG1-CB 3.92Å; V238-V269 HydrophobicContact CG1-CG1 3.88Å; V238-V269 HydrophobicContact CG2-CB 3.84Å; V238-V269 HydrophobicContact CG2-CG2 4.21Å; V238-Y270 WeakPolarHBondContact CG2-O 3.45Å; V238-Y270 PolarHBondContact N-O 3.47Å; V238-I271 HydrophobicContact CG2-CG2 3.89Å
239	E	95	Very high	90.1	Very high	61 Å²	61	79.1 Å²	79.1	29%	0.285	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	148.6	174.1	66	-176.8	178.7	0	0	111.1	K253 K255	E239-K253 HydrophobicContact CG-CG 3.89Å; E239-K253 PolarHBondContact N-O 2.85Å; E239-K253 PolarHBondContact O-N 2.91Å; E239-K253 WeakPolarHBondContact OE1-CE 3.49Å; E239-K253 IonicContact OE1-NZ 2.68Å; E239-K253 PolarHBondContact OE1-NZ 2.04Å; E239-K255 HydrophobicContact CB-CB 4.5Å; E239-K255 HydrophobicContact CB-CG 4.46Å; E239-K255 HydrophobicContact CG-CB 4.41Å; E239-K255 HydrophobicContact CG-CG 4.42Å
240	P	93.6	Very high	89.6	Confident	44 Å²	44	84.2 Å²	84.2	29%	0.286	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	133.6	-179.6	29.3	-34.6	0	0	0	111.8	A176 P249 L252	A176-P240 HydrophobicContact CB-CB 3.74Å; A176-P240 HydrophobicContact CB-CG 3.75Å; P240-P249 HydrophobicContact CB-CB 3.72Å; P240-L252 HydrophobicContact CB-CD2 4.31Å
241	V	90.4	Very high	89.4	Confident	20 Å²	20	80.3 Å²	80.3	12%	0.121	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.9	165.5	-176.3	0	0	0	0	108.9	P249 K250 F251 K253 Y260	V241-P249 WeakPolarHBondContact O-CA 3.24Å; V241-K250 PolarHBondContact O-N 3.35Å; V241-F251 HydrophobicContact CB-CD1 4.38Å; V241-F251 HydrophobicContact CB-CE1 4.01Å; V241-F251 HydrophobicContact CB-CE2 4.19Å; V241-F251 HydrophobicContact CB-CZ 3.92Å; V241-F251 HydrophobicContact CG1-CE1 4.08Å; V241-F251 HydrophobicContact CG1-CZ 4.08Å; V241-F251 HydrophobicContact CG2-CD2 4.28Å; V241-F251 HydrophobicContact CG2-CE1 4.4Å; V241-F251 HydrophobicContact CG2-CE2 3.72Å; V241-F251 HydrophobicContact CG2-CZ 3.81Å; V241-F251 PolarHBondContact N-O 3.03Å; V241-K253 HydrophobicContact CG2-CB 3.93Å; V241-K253 HydrophobicContact CG2-CD 3.57Å; V241-K253 HydrophobicContact CG2-CG 3.62Å; V241-Y260 HydrophobicContact CG1-CE2 3.92Å; V241-Y260 WeakPolarHBondContact CG1-OH 3.01Å; V241-Y260 HydrophobicContact CG2-CE2 3.92Å
242	K	87	Confident	89.2	Confident	140 Å²	140	78.3 Å²	78.3	61%	0.609	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	137.4	-179.4	-63.6	179	-177.4	175.6	0	110.6
243	A	79.9	Confident	89	Confident	41 Å²	41	78 Å²	78	34%	0.339	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-70.5	137.2	171.1	0	0	0	0	0	110.5	R245 K247 R248	A243-R245 VanDerWaalsContact C-N 3.31Å; A243-R245 PolarHBondContact O-N 2.91Å; A243-K247 PolarHBondContact O-N 3.34Å; A243-K247 VanDerWaalsContact O-N 3.11Å; A243-R248 PolarHBondContact N-O 3.11Å
244	S	73.8	Confident	89	Confident	128 Å²	128	76.5 Å²	76.5	90%	0.895	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-40.4	-175.8	-172.7	0	0	0	0	113.2
245	R	75.6	Confident	88.8	Confident	241 Å²	241	75.2 Å²	75.2	91%	0.909	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-36.9	-175.3	-73.5	-175.2	176.9	169.8	-1	115.4	A243	A243-R245 VanDerWaalsContact C-N 3.31Å; A243-R245 PolarHBondContact O-N 2.91Å
246	N	76.6	Confident	88.4	Confident	110 Å²	110	81 Å²	81	59%	0.588	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-0.9	-167.8	-67.3	5.9	0	0	0	114.1	R248	N246-R248 HydrophobicContact CB-CG 4.22Å; N246-R248 WeakPolarHBondContact O-CG 3.35Å; N246-R248 PolarHBondContact O-N 3.17Å
247	K	76.4	Confident	87.8	Confident	174 Å²	174	84.9 Å²	84.9	76%	0.757	41%	0.411	S	S	*	.			trans	52	5.3	-171.6	-65.7	-176.3	179.6	177.4	0	115.3	A243	A243-K247 PolarHBondContact O-N 3.34Å; A243-K247 VanDerWaalsContact O-N 3.11Å
248	R	83	Confident	86.9	Confident	140 Å²	140	94.9 Å²	94.9	53%	0.528	45%	0.449	S	S	.	.			trans	-75.6	138.6	177.8	-64.3	-168.9	-173.1	175.7	3.1	110.2	Q174 A243 N246 K250	Q174-R248 VanDerWaalsContact OE1-CD 3.24Å; A243-R248 PolarHBondContact N-O 3.11Å; N246-R248 HydrophobicContact CB-CG 4.22Å; N246-R248 WeakPolarHBondContact O-CG 3.35Å; N246-R248 PolarHBondContact O-N 3.17Å; R248-K250 PolarHBondContact O-N 3.34Å
249	P	86.7	Confident	86.3	Confident	26 Å²	26	96.6 Å²	96.6	17%	0.169	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.4	176.8	30.4	-33	0	0	0	109.7	L179 P240 V241	L179-P249 HydrophobicContact CD1-CB 3.87Å; L179-P249 HydrophobicContact CD1-CG 4.28Å; P240-P249 HydrophobicContact CB-CB 3.72Å; V241-P249 WeakPolarHBondContact O-CA 3.24Å
250	K	88.6	Confident	86	Confident	162 Å²	162	100.8 Å²	100.8	70%	0.704	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	-40	-179.5	-171.9	179.2	179.8	179.1	0	111.9	V241 R248	V241-K250 PolarHBondContact O-N 3.35Å; R248-K250 PolarHBondContact O-N 3.34Å
251	F	91.7	Very high	86	Confident	37 Å²	37	106.5 Å²	106.5	16%	0.162	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	172.6	178.1	65.6	-85.9	0	0	0	110.5	V241 K253 Y260 K262	V241-F251 HydrophobicContact CB-CD1 4.38Å; V241-F251 HydrophobicContact CB-CE1 4.01Å; V241-F251 HydrophobicContact CB-CE2 4.19Å; V241-F251 HydrophobicContact CB-CZ 3.92Å; V241-F251 HydrophobicContact CG1-CE1 4.08Å; V241-F251 HydrophobicContact CG1-CZ 4.08Å; V241-F251 HydrophobicContact CG2-CD2 4.28Å; V241-F251 HydrophobicContact CG2-CE1 4.4Å; V241-F251 HydrophobicContact CG2-CE2 3.72Å; V241-F251 HydrophobicContact CG2-CZ 3.81Å; V241-F251 PolarHBondContact N-O 3.03Å; F251-K253 HydrophobicContact CE2-CB 4.43Å; F251-Y260 HydrophobicContact CE1-CE1 4.47Å; F251-Y260 HydrophobicContact CE2-CE1 4.2Å; F251-Y260 HydrophobicContact CZ-CD1 4.39Å; F251-Y260 AromaticContact CZ-CE1 3.49Å; F251-Y260 HydrophobicContact CZ-CE1 3.49Å; F251-Y260 VanDerWaalsContact CZ-CE1 3.49Å; F251-Y260 HydrophobicContact CZ-CE2 4.22Å; F251-Y260 AromaticContact CZ-CZ 3.41Å; F251-Y260 VanDerWaalsContact CZ-CZ 3.41Å; F251-Y260 VanDerWaalsContact CZ-OH 3.27Å; F251-Y260 WeakPolarHBondContact CZ-OH 3.5Å; F251-K262 HydrophobicContact CD2-CD 4.32Å; F251-K262 HydrophobicContact CD2-CG 4.11Å; F251-K262 HydrophobicContact CE2-CG 4.19Å
252	L	94.4	Very high	86.2	Confident	13 Å²	13	111.5 Å²	111.5	7%	0.068	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.2	178.8	-60.5	172.9	0	0	0	110.6	L179 M180 V238 P240 P263 V269 I271	L179-L252 HydrophobicContact CB-CD1 3.86Å; L179-L252 HydrophobicContact CB-CD2 4.21Å; L179-L252 HydrophobicContact CB-CG 3.87Å; L179-L252 HydrophobicContact CD1-CD2 4.39Å; L179-L252 HydrophobicContact CD1-CG 4.39Å; M180-L252 HydrophobicContact CB-CD1 4.19Å; V238-L252 HydrophobicContact CB-CB 4.17Å; V238-L252 HydrophobicContact CG2-CB 4.07Å; V238-L252 HydrophobicContact CG2-CD1 3.95Å; V238-L252 HydrophobicContact CG2-CD2 4.29Å; V238-L252 HydrophobicContact CG2-CG 4.32Å; P240-L252 HydrophobicContact CB-CD2 4.31Å; L252-P263 WeakPolarHBondContact O-CD 3.43Å; L252-V269 HydrophobicContact CD1-CG2 4.28Å; L252-I271 HydrophobicContact CD2-CG2 4.44Å
253	K	94.9	Very high	86.6	Confident	35 Å²	35	105.7 Å²	105.7	15%	0.152	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	155.8	170.6	70.2	174.1	177.9	113.2	0	110.5	V238 E239 V241 F251 K255 Y260	V238-K253 CarbonylContact C-O 3.6Å; V238-K253 WeakPolarHBondContact CA-O 3.28Å; V238-K253 WeakPolarHBondContact CB-O 3.24Å; E239-K253 HydrophobicContact CG-CG 3.89Å; E239-K253 PolarHBondContact N-O 2.85Å; E239-K253 PolarHBondContact O-N 2.91Å; E239-K253 WeakPolarHBondContact OE1-CE 3.49Å; E239-K253 IonicContact OE1-NZ 2.68Å; E239-K253 PolarHBondContact OE1-NZ 2.04Å; V241-K253 HydrophobicContact CG2-CB 3.93Å; V241-K253 HydrophobicContact CG2-CD 3.57Å; V241-K253 HydrophobicContact CG2-CG 3.62Å; F251-K253 HydrophobicContact CE2-CB 4.43Å; K253-K255 PolarHBondContact O-N 2.85Å; K253-Y260 HydrophobicContact CD-CD2 3.83Å; K253-Y260 HydrophobicContact CD-CE2 4.3Å
254	I	95.5	Very high	87.3	Confident	26 Å²	26	107.9 Å²	107.9	13%	0.133	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.7	174	-57.7	178.5	0	0	0	108.9	V236 K256 R261 P263	V236-I254 HydrophobicContact CG1-CB 4.32Å; V236-I254 HydrophobicContact CG1-CD1 4.27Å; V236-I254 HydrophobicContact CG1-CG1 3.87Å; V236-I254 HydrophobicContact CG1-CG2 3.82Å; I254-K256 VanDerWaalsContact C-N 3.26Å; I254-K256 HydrophobicContact CG2-CD 4.13Å; I254-K256 HydrophobicContact CG2-CG 4Å; I254-K256 PolarHBondContact O-N 2.61Å; I254-R261 HydrophobicContact CD1-CB 4.36Å; I254-R261 HydrophobicContact CD1-CG 4.23Å; I254-R261 WeakPolarHBondContact CG1-O 3.36Å; I254-R261 PolarHBondContact N-O 3.29Å; I254-P263 HydrophobicContact CG1-CB 4.48Å
255	K	92.6	Very high	88.2	Confident	108 Å²	108	105.5 Å²	105.5	47%	0.47	47%	0.47	S	S	.	.	S	Bend	trans	-76.1	77.3	179.9	-168.6	176.4	-173.1	174.9	0	110.1	H237 E239 K253	H237-K255 HydrophobicContact CB-CB 4.32Å; H237-K255 WeakPolarHBondContact O-CB 3.41Å; H237-K255 PolarHBondContact O-N 3.17Å; E239-K255 HydrophobicContact CB-CB 4.5Å; E239-K255 HydrophobicContact CB-CG 4.46Å; E239-K255 HydrophobicContact CG-CB 4.41Å; E239-K255 HydrophobicContact CG-CG 4.42Å; K253-K255 PolarHBondContact O-N 2.85Å
256	K	89.9	Confident	89.1	Confident	131 Å²	131	95 Å²	95	57%	0.57	43%	0.433	S	S	*	.			trans	-133	140.8	173.9	-76.8	-177	179.2	-172	0	110.3	I254 Y258 S259	I254-K256 VanDerWaalsContact C-N 3.26Å; I254-K256 HydrophobicContact CG2-CD 4.13Å; I254-K256 HydrophobicContact CG2-CG 4Å; I254-K256 PolarHBondContact O-N 2.61Å; K256-Y258 PolarHBondContact O-N 2.83Å; K256-S259 PolarHBondContact O-N 3.46Å
257	P	83.4	Confident	90.1	Very high	108 Å²	108	91.3 Å²	91.3	70%	0.701	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	139	172.9	-22.7	33	0	0	0	110.7	S259	P257-S259 PolarHBondContact O-N 2.98Å
258	Y	79.6	Confident	91.1	Very high	247 Å²	247	83 Å²	83	97%	0.969	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	15.9	174.7	-46.6	-75	0	0	0	116	K256	K256-Y258 PolarHBondContact O-N 2.83Å
259	S	83.4	Confident	91.9	Very high	37 Å²	37	76.4 Å²	76.4	26%	0.259	35%	0.352	S	S	.	.			trans	-114.1	131.5	176.1	-167	0	0	0	0	111.6	K256 P257 R261	K256-S259 PolarHBondContact O-N 3.46Å; P257-S259 PolarHBondContact O-N 2.98Å; S259-R261 PolarHBondContact OG-N 2.88Å
260	Y	88.1	Confident	92.4	Very high	149 Å²	149	76.7 Å²	76.7	58%	0.584	35%	0.35	S	S	*	.			trans	-111	25.4	173.4	-156.3	-105.7	0	0	0	111.8	V241 F251 K253	V241-Y260 HydrophobicContact CG1-CE2 3.92Å; V241-Y260 WeakPolarHBondContact CG1-OH 3.01Å; V241-Y260 HydrophobicContact CG2-CE2 3.92Å; F251-Y260 HydrophobicContact CE1-CE1 4.47Å; F251-Y260 HydrophobicContact CE2-CE1 4.2Å; F251-Y260 HydrophobicContact CZ-CD1 4.39Å; F251-Y260 AromaticContact CZ-CE1 3.49Å; F251-Y260 HydrophobicContact CZ-CE1 3.49Å; F251-Y260 VanDerWaalsContact CZ-CE1 3.49Å; F251-Y260 HydrophobicContact CZ-CE2 4.22Å; F251-Y260 AromaticContact CZ-CZ 3.41Å; F251-Y260 VanDerWaalsContact CZ-CZ 3.41Å; F251-Y260 VanDerWaalsContact CZ-OH 3.27Å; F251-Y260 WeakPolarHBondContact CZ-OH 3.5Å; K253-Y260 HydrophobicContact CD-CD2 3.83Å; K253-Y260 HydrophobicContact CD-CE2 4.3Å
261	R	94.1	Very high	92.8	Very high	163 Å²	163	70.2 Å²	70.2	62%	0.615	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-75.3	134.1	-177.9	-169.3	174.9	176.7	175.7	0.1	110.6	I254 S259	I254-R261 HydrophobicContact CD1-CB 4.36Å; I254-R261 HydrophobicContact CD1-CG 4.23Å; I254-R261 WeakPolarHBondContact CG1-O 3.36Å; I254-R261 PolarHBondContact N-O 3.29Å; S259-R261 PolarHBondContact OG-N 2.88Å
262	K	94.1	Very high	93	Very high	126 Å²	126	72 Å²	72	55%	0.548	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-77.9	147.2	169.9	-68.5	-176.7	-178.5	177.4	0	110.3	F251	F251-K262 HydrophobicContact CD2-CD 4.32Å; F251-K262 HydrophobicContact CD2-CG 4.11Å; F251-K262 HydrophobicContact CE2-CG 4.19Å
263	P	95.1	Very high	93.1	Very high	17 Å²	17	79.4 Å²	79.4	11%	0.11	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-61	156.7	170.9	29.3	-36.1	0	0	0	110.5	V238 L252 I254 V269	V238-P263 HydrophobicContact CG1-CB 4.36Å; V238-P263 HydrophobicContact CG1-CG 4.24Å; L252-P263 WeakPolarHBondContact O-CD 3.43Å; I254-P263 HydrophobicContact CG1-CB 4.48Å; P263-V269 HydrophobicContact CB-CG1 3.59Å; P263-V269 HydrophobicContact CG-CG1 3.79Å
264	L	95.1	Very high	93.1	Very high	88 Å²	88	80 Å²	80	46%	0.461	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-67.1	154.4	171.1	-57.9	170.7	0	0	0	109.5	H183 T266 D267	H183-L264 PolarHBondContact CE1-O 3.16Å; H183-L264 PolarHBondContact NE2-O 2.88Å; L264-T266 PolarHBondContact O-N 3.14Å; L264-D267 HydrophobicContact CB-CB 4.33Å; L264-D267 VanDerWaalsContact CB-OD2 3.25Å; L264-D267 WeakPolarHBondContact CB-OD2 3.28Å; L264-D267 WeakPolarHBondContact CG-OD2 3.48Å; L264-D267 PolarHBondContact N-OD2 3.14Å; L264-D267 PolarHBondContact O-N 3.22Å; L264-D267 VanDerWaalsContact O-N 3.17Å
265	D	93.8	Very high	93	Very high	77 Å²	77	80 Å²	80	41%	0.412	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-3.5	179.1	71.6	-22.6	0	0	0	114	V187 K190	V187-D265 WeakPolarHBondContact CG2-O 3.3Å; K190-D265 HydrophobicContact CD-CB 4.43Å; K190-D265 IonicContact NZ-OD2 3.89Å; K190-D265 PolarHBondContact NZ-OD2 3.5Å
266	T	94.4	Very high	93	Very high	22 Å²	22	79.9 Å²	79.9	14%	0.135	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	0.6	173.9	54.3	0	0	0	0	113	K231 L264	K231-T266 WeakPolarHBondContact CD-O 3.07Å; K231-T266 WeakPolarHBondContact CE-O 3.03Å; L264-T266 PolarHBondContact O-N 3.14Å
267	D	96.9	Very high	93.1	Very high	32 Å²	32	74.8 Å²	74.8	17%	0.171	36%	0.358	C	S	.	.	S	Bend	trans	-88.9	132.2	176.6	-68.2	-20.7	0	0	0	109.8	H183 V187 V236 L264	H183-D267 PolarHBondContact CD2-O 3.37Å; H183-D267 PolarHBondContact NE2-O 2.84Å; V187-D267 WeakPolarHBondContact CG2-O 3.45Å; V236-D267 HydrophobicContact CG2-CB 4.09Å; L264-D267 HydrophobicContact CB-CB 4.33Å; L264-D267 VanDerWaalsContact CB-OD2 3.25Å; L264-D267 WeakPolarHBondContact CB-OD2 3.28Å; L264-D267 WeakPolarHBondContact CG-OD2 3.48Å; L264-D267 PolarHBondContact N-OD2 3.14Å; L264-D267 PolarHBondContact O-N 3.22Å; L264-D267 VanDerWaalsContact O-N 3.17Å
268	L	98.6	Very high	93.6	Very high	0 Å²	0	70 Å²	70	0%	0	33%	0.327	C	S	.	.			trans	-70.7	139.5	166.5	-68.5	177.9	0	0	0	109.5	A105 F106 A109 N184 V187 L228 K231 A235 V236	A105-L268 HydrophobicContact CB-CB 4.27Å; F106-L268 HydrophobicContact CB-CD1 4.45Å; A109-L268 HydrophobicContact CB-CD2 3.57Å; N184-L268 HydrophobicContact CB-CD2 4.3Å; N184-L268 WeakPolarHBondContact OD1-CA 3.33Å; V187-L268 HydrophobicContact CB-CD2 4.09Å; V187-L268 HydrophobicContact CG1-CD2 3.64Å; V187-L268 HydrophobicContact CG1-CG 4.2Å; L228-L268 HydrophobicContact CD2-CD1 4.47Å; L228-L268 HydrophobicContact CD2-CD2 4.45Å; K231-L268 HydrophobicContact CB-CD1 3.99Å; K231-L268 HydrophobicContact CB-CG 4.08Å; A235-L268 CarbonylContact C-O 3.55Å; A235-L268 VanDerWaalsContact CA-O 3.3Å; A235-L268 WeakPolarHBondContact CA-O 3.39Å; A235-L268 HydrophobicContact CB-CB 4.04Å; V236-L268 PolarHBondContact N-O 3.25Å
269	V	98.3	Very high	94.3	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.8	-176	-57.2	0	0	0	0	111.6	A105 M180 H183 N184 V236 V238 L252 P263	A105-V269 VanDerWaalsContact CB-O 3.25Å; A105-V269 WeakPolarHBondContact CB-O 3.43Å; M180-V269 HydrophobicContact CG-CG2 3.98Å; M180-V269 WeakPolarHBondContact CG-O 3.28Å; H183-V269 HydrophobicContact CB-CG2 4.12Å; H183-V269 VanDerWaalsContact CD2-CG2 3.45Å; H183-V269 WeakPolarHBondContact CD2-CG2 3.43Å; N184-V269 PolarHBondContact ND2-O 2.67Å; N184-V269 PolarHBondContact OD1-N 3.3Å; V236-V269 WeakPolarHBondContact O-CA 3.42Å; V238-V269 HydrophobicContact CG1-CB 3.92Å; V238-V269 HydrophobicContact CG1-CG1 3.88Å; V238-V269 HydrophobicContact CG2-CB 3.84Å; V238-V269 HydrophobicContact CG2-CG2 4.21Å; L252-V269 HydrophobicContact CD1-CG2 4.28Å; P263-V269 HydrophobicContact CB-CG1 3.59Å; P263-V269 HydrophobicContact CG-CG1 3.79Å
270	Y	98.1	Very high	94.6	Very high	32 Å²	32	64.8 Å²	64.8	13%	0.125	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.9	177.7	72.6	-84.1	0	0	0	110.5	G100 K102 A235 V236 H237 V238 D272	G100-Y270 WeakPolarHBondContact O-CB 3.25Å; K102-Y270 HydrophobicContact CD-CD1 4.36Å; K102-Y270 HydrophobicContact CD-CE1 4.15Å; K102-Y270 HydrophobicContact CG-CD1 3.53Å; K102-Y270 HydrophobicContact CG-CD2 4.23Å; K102-Y270 HydrophobicContact CG-CE1 3.77Å; K102-Y270 HydrophobicContact CG-CE2 4.42Å; K102-Y270 HydrophobicContact CG-CG 3.76Å; A235-Y270 HydrophobicContact CB-CD1 4.11Å; A235-Y270 HydrophobicContact CB-CE1 4.48Å; A235-Y270 WeakPolarHBondContact O-CE1 3.49Å; V236-Y270 VanDerWaalsContact C-CE1 3.43Å; V236-Y270 VanDerWaalsContact O-CD1 3.27Å; V236-Y270 WeakPolarHBondContact O-CD1 3.48Å; V236-Y270 PolarHBondContact O-N 3Å; H237-Y270 HydrophobicContact CB-CE1 3.87Å; H237-Y270 HydrophobicContact CB-CE2 3.9Å; H237-Y270 VanDerWaalsContact CB-CZ 3.49Å; H237-Y270 WeakPolarHBondContact CB-OH 3.49Å; H237-Y270 AromaticContact CD2-CD2 3.91Å; H237-Y270 AromaticContact CD2-CE2 3.67Å; H237-Y270 PolarHBondContact CD2-O 2.84Å; H237-Y270 AromaticContact CG-CE2 3.58Å; H237-Y270 AromaticContact CG-CZ 3.72Å; H237-Y270 VanDerWaalsContact N-CE1 3.29Å; H237-Y270 AromaticContact ND1-CE2 3.94Å; V238-Y270 WeakPolarHBondContact CG2-O 3.45Å; V238-Y270 PolarHBondContact N-O 3.47Å; Y270-D272 WeakPolarHBondContact CD2-O 3.3Å
271	I	97	Very high	94.7	Very high	27 Å²	27	60.1 Å²	60.1	14%	0.138	31%	0.305	C	S	.	.	S	Bend	trans	-108.5	-27.9	-177.3	59.1	177.5	0	0	0	112.6	G100 A176 R177 M180 H237 V238 L252	G100-I271 PolarHBondContact O-N 3.46Å; A176-I271 HydrophobicContact CB-CD1 4.39Å; R177-I271 HydrophobicContact CB-CD1 4.28Å; M180-I271 HydrophobicContact CB-CG2 4.34Å; M180-I271 HydrophobicContact CG-CG2 4.34Å; M180-I271 HydrophobicContact SD-CD1 4.45Å; M180-I271 HydrophobicContact SD-CG1 3.91Å; M180-I271 HydrophobicContact SD-CG2 4.34Å; H237-I271 PolarHBondContact NE2-O 3.42Å; V238-I271 HydrophobicContact CG2-CG2 3.89Å; L252-I271 HydrophobicContact CD2-CG2 4.44Å
272	D	96	Very high	94.4	Very high	75 Å²	75	57.4 Å²	57.4	40%	0.401	31%	0.308	S	S	.	.	S	Bend	trans	-119.8	143.2	-176.9	-59	-46.3	0	0	0	110.7	V99 G100 S101 Y270	V99-D272 HydrophobicContact CG1-CB 3.74Å; G100-D272 VanDerWaalsContact CA-OD2 3.27Å; G100-D272 WeakPolarHBondContact CA-OD2 3.32Å; G100-D272 PolarHBondContact N-OD2 3.41Å; G100-D272 PolarHBondContact O-N 3.33Å; S101-D272 WeakPolarHBondContact CA-O 3.1Å; Y270-D272 WeakPolarHBondContact CD2-O 3.3Å
273	K	95.6	Very high	94	Very high	167 Å²	167	56.7 Å²	56.7	73%	0.726	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-63.1	144.1	173.9	-68.3	-175.6	178.8	-178.2	0	109.8
274	S	95	Very high	93.5	Very high	47 Å²	47	57.3 Å²	57.3	33%	0.329	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-58.3	133.6	174.7	-59	0	0	0	0	110.3	E103	E103-S274 VanDerWaalsContact CD-OG 3.29Å; E103-S274 WeakPolarHBondContact OE1-CB 3.1Å; E103-S274 PolarHBondContact OE1-OG 2.8Å; E103-S274 PolarHBondContact OE2-OG 3.35Å
275	P	93.4	Very high	92.9	Very high	28 Å²	28	54.5 Å²	54.5	18%	0.182	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-69.1	172.1	176.9	31.5	-36.9	0	0	0	111.3	Y277 T284	P275-Y277 WeakPolarHBondContact CD-OH 3.29Å; P275-Y277 HydrophobicContact CG-CD1 4.32Å; P275-Y277 HydrophobicContact CG-CE1 3.66Å; P275-Y277 HydrophobicContact CG-CE2 4.43Å; P275-Y277 WeakPolarHBondContact O-CD2 3.11Å; P275-Y277 PolarHBondContact O-N 3.23Å; P275-T284 HydrophobicContact CB-CG2 3.62Å; P275-T284 HydrophobicContact CG-CG2 4.17Å
276	N	92.3	Very high	92.6	Very high	105 Å²	105	51.2 Å²	51.2	56%	0.561	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-76.1	118.3	169.8	-172.3	-2.3	0	0	0	110	C278	N276-C278 VanDerWaalsContact OD1-CB 3.28Å; N276-C278 WeakPolarHBondContact OD1-CB 3.09Å; N276-C278 PolarHBondContact OD1-N 3.27Å; N276-C278 PolarHBondContact OD1-SG 3.32Å
277	Y	93.6	Very high	92.3	Very high	24 Å²	24	54.7 Å²	54.7	9%	0.094	31%	0.31	C	S	.	.			trans	-90.9	5.8	-179.6	-63	-66.4	0	0	0	114.4	W82 E103 P275 S286 G288	W82-Y277 HydrophobicContact CB-CD1 3.95Å; W82-Y277 HydrophobicContact CB-CD2 3.75Å; W82-Y277 HydrophobicContact CB-CE1 4.01Å; W82-Y277 HydrophobicContact CB-CE2 3.81Å; W82-Y277 HydrophobicContact CB-CG 3.82Å; W82-Y277 AromaticContact CD1-CD1 3.89Å; W82-Y277 AromaticContact CD1-CE1 3.49Å; W82-Y277 VanDerWaalsContact CD1-CE1 3.49Å; W82-Y277 AromaticContact CD1-CZ 3.9Å; W82-Y277 HydrophobicContact CG-CD1 4.29Å; W82-Y277 AromaticContact CG-CE1 3.98Å; W82-Y277 HydrophobicContact CG-CE1 3.98Å; W82-Y277 HydrophobicContact CG-CE2 4.35Å; E103-Y277 HydrophobicContact CG-CE2 4.28Å; E103-Y277 PolarHBondContact OE2-OH 2.77Å; P275-Y277 WeakPolarHBondContact CD-OH 3.29Å; P275-Y277 HydrophobicContact CG-CD1 4.32Å; P275-Y277 HydrophobicContact CG-CE1 3.66Å; P275-Y277 HydrophobicContact CG-CE2 4.43Å; P275-Y277 WeakPolarHBondContact O-CD2 3.11Å; P275-Y277 PolarHBondContact O-N 3.23Å; Y277-S286 WeakPolarHBondContact CA-OG 3.3Å; Y277-G288 WeakPolarHBondContact O-CA 3.33Å
278	C	93.6	Very high	92.1	Very high	8 Å²	8	53.8 Å²	53.8	5%	0.054	31%	0.308	C	S	.	.	S	Bend	trans	-68.5	-43.3	-178.2	-69	0	0	0	0	113.2	N276 G288 T289 C310 R312	N276-C278 VanDerWaalsContact OD1-CB 3.28Å; N276-C278 WeakPolarHBondContact OD1-CB 3.09Å; N276-C278 PolarHBondContact OD1-N 3.27Å; N276-C278 PolarHBondContact OD1-SG 3.32Å; C278-G288 WeakPolarHBondContact O-CA 3.5Å; C278-T289 PolarHBondContact O-N 2.7Å; C278-T289 PolarHBondContact O-OG1 3.47Å; C278-C310 HydrophobicContact CB-CB 3.63Å; C278-C310 WeakPolarHBondContact CB-SG 3.31Å; C278-C310 WeakPolarHBondContact SG-CB 3.43Å; C278-C310 CovalentContact SG-SG 2.02Å; C278-C310 PolarHBondContact SG-SG 3.22Å; C278-R312 PolarHBondContact O-NH1 3.34Å
279	E	93.2	Very high	91.9	Very high	104 Å²	104	53.8 Å²	53.8	49%	0.486	31%	0.308	S	S	.	.	S	Bend	trans	-106	154.5	-178.3	-60.5	-53.1	140.2	0	0	110.7	D281 S286 G288 R312	E279-D281 PolarHBondContact O-N 2.82Å; E279-S286 WeakPolarHBondContact O-CB 3.37Å; E279-S286 PolarHBondContact O-OG 2.93Å; E279-G288 VanDerWaalsContact C-CA 3.43Å; E279-R312 IonicContact OE1-CZ 3.62Å; E279-R312 IonicContact OE1-NE 2.76Å; E279-R312 IonicContact OE1-NH1 3.79Å; E279-R312 PolarHBondContact OE1-NH1 3.38Å
280	A	91.3	Very high	91.7	Very high	70 Å²	70	60.6 Å²	60.6	58%	0.579	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.2	172.7	0	0	0	0	0	109.3	S286	A280-S286 WeakPolarHBondContact CA-O 3.33Å
281	D	89.9	Confident	91.4	Very high	50 Å²	50	61.6 Å²	61.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	107.4	178.3	172.5	18.1	0	0	0	110.1	E279 V283 T284 G285 S286	E279-D281 PolarHBondContact O-N 2.82Å; D281-V283 PolarHBondContact O-N 3.05Å; D281-V283 VanDerWaalsContact OD1-CB 3.29Å; D281-V283 WeakPolarHBondContact OD1-CB 3.4Å; D281-V283 PolarHBondContact OD1-N 3.09Å; D281-T284 WeakPolarHBondContact CB-OG1 3.45Å; D281-T284 VanDerWaalsContact CG-OG1 3.28Å; D281-T284 PolarHBondContact O-N 3.38Å; D281-T284 PolarHBondContact O-OG1 3.05Å; D281-T284 VanDerWaalsContact OD2-CB 3.31Å; D281-T284 WeakPolarHBondContact OD2-CB 3.43Å; D281-T284 WeakPolarHBondContact OD2-CG2 3.27Å; D281-T284 PolarHBondContact OD2-N 3.18Å; D281-T284 PolarHBondContact OD2-OG1 3.44Å; D281-G285 CarbonylContact O-C 3.57Å; D281-G285 WeakPolarHBondContact O-CA 3.42Å; D281-G285 PolarHBondContact O-N 2.89Å; D281-S286 PolarHBondContact N-O 2.86Å; D281-S286 PolarHBondContact O-N 3.08Å
282	P	86.4	Confident	91.2	Very high	107 Å²	107	62 Å²	62	70%	0.695	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.8	177.5	-22.7	33.7	0	0	0	114.3	K98	K98-P282 PolarHBondContact NZ-O 3.12Å
283	V	86.8	Confident	91	Very high	111 Å²	111	63 Å²	63	67%	0.673	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-49.6	-178.2	-178.1	0	0	0	0	110.1	K98 D281	K98-V283 WeakPolarHBondContact CD-O 3.26Å; D281-V283 PolarHBondContact O-N 3.05Å; D281-V283 VanDerWaalsContact OD1-CB 3.29Å; D281-V283 WeakPolarHBondContact OD1-CB 3.4Å; D281-V283 PolarHBondContact OD1-N 3.09Å
284	T	84.3	Confident	90.8	Very high	29 Å²	29	55.5 Å²	55.5	18%	0.178	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-20.8	175.3	56.9	0	0	0	0	112.9	V99 P275 D281	V99-T284 HydrophobicContact CG2-CG2 4.13Å; P275-T284 HydrophobicContact CB-CG2 3.62Å; P275-T284 HydrophobicContact CG-CG2 4.17Å; D281-T284 WeakPolarHBondContact CB-OG1 3.45Å; D281-T284 VanDerWaalsContact CG-OG1 3.28Å; D281-T284 PolarHBondContact O-N 3.38Å; D281-T284 PolarHBondContact O-OG1 3.05Å; D281-T284 VanDerWaalsContact OD2-CB 3.31Å; D281-T284 WeakPolarHBondContact OD2-CB 3.43Å; D281-T284 WeakPolarHBondContact OD2-CG2 3.27Å; D281-T284 PolarHBondContact OD2-N 3.18Å; D281-T284 PolarHBondContact OD2-OG1 3.44Å
285	G	82.6	Confident	90.7	Very high	30 Å²	30	56.1 Å²	56.1	31%	0.309	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	19.3	-174.1	0	0	0	0	0	113.3	D281	D281-G285 CarbonylContact O-C 3.57Å; D281-G285 WeakPolarHBondContact O-CA 3.42Å; D281-G285 PolarHBondContact O-N 2.89Å
286	S	87.5	Confident	90.4	Very high	7 Å²	7	59.5 Å²	59.5	5%	0.049	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.8	172.4	179.7	0	0	0	0	110.2	Y277 E279 A280 D281 G288	Y277-S286 WeakPolarHBondContact CA-OG 3.3Å; E279-S286 WeakPolarHBondContact O-CB 3.37Å; E279-S286 PolarHBondContact O-OG 2.93Å; A280-S286 WeakPolarHBondContact CA-O 3.33Å; D281-S286 PolarHBondContact N-O 2.86Å; D281-S286 PolarHBondContact O-N 3.08Å; S286-G288 PolarHBondContact OG-N 3.05Å
287	L	88.8	Confident	90.1	Very high	95 Å²	95	60.4 Å²	60.4	50%	0.497	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-10.5	172.7	-63	177.2	0	0	0	112.7	S85 A86	S85-L287 WeakPolarHBondContact OG-CD1 3.49Å; A86-L287 HydrophobicContact CB-CD1 4.09Å; A86-L287 HydrophobicContact CB-CG 4.41Å
288	G	92.1	Very high	89.6	Confident	13 Å²	13	63 Å²	63	13%	0.134	37%	0.372	C	S	.	.			trans	77.3	178.1	-171.5	0	0	0	0	0	113.7	Y277 C278 E279 S286	Y277-G288 WeakPolarHBondContact O-CA 3.33Å; C278-G288 WeakPolarHBondContact O-CA 3.5Å; E279-G288 VanDerWaalsContact C-CA 3.43Å; S286-G288 PolarHBondContact OG-N 3.05Å
289	T	94.1	Very high	88.5	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	40%	0.397	C	S	.	.	S	Bend	trans	-111.1	3	179.6	60.9	0	0	0	0	114.3	R81 C278 G291 R292 M308 R312 C349	R81-T289 HydrophobicContact CB-CG2 3.96Å; R81-T289 HydrophobicContact CG-CG2 4.07Å; C278-T289 PolarHBondContact O-N 2.7Å; C278-T289 PolarHBondContact O-OG1 3.47Å; T289-G291 PolarHBondContact O-N 3.4Å; T289-R292 VanDerWaalsContact O-CB 3.24Å; T289-R292 WeakPolarHBondContact O-CB 3.12Å; T289-R292 WeakPolarHBondContact O-CG 3.45Å; T289-R292 PolarHBondContact O-N 2.88Å; T289-R292 VanDerWaalsContact O-N 3.15Å; T289-M308 WeakPolarHBondContact CB-O 3.3Å; T289-M308 HydrophobicContact CG2-CE 4.15Å; T289-M308 WeakPolarHBondContact CG2-O 3.36Å; T289-M308 PolarHBondContact OG1-O 3.2Å; T289-R312 PolarHBondContact OG1-NH2 3.35Å; T289-C349 VanDerWaalsContact O-CB 3.24Å; T289-C349 WeakPolarHBondContact O-CB 3.27Å
290	Q	93.8	Very high	87.6	Confident	144 Å²	144	72.6 Å²	72.6	67%	0.673	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	136.7	176.9	-177.1	166.2	35.6	0	0	111.2	R292 K350	Q290-R292 PolarHBondContact O-N 3.35Å; Q290-K350 WeakPolarHBondContact CG-OXT 3.47Å; Q290-K350 PolarHBondContact NE2-OXT 3.02Å
291	G	92	Very high	87.3	Confident	52 Å²	52	73.3 Å²	73.3	54%	0.536	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	0	-178.3	0	0	0	0	0	115.1	T289 C349	T289-G291 PolarHBondContact O-N 3.4Å; G291-C349 PolarHBondContact N-O 2.68Å
292	R	92.4	Very high	86.9	Confident	35 Å²	35	75.7 Å²	75.7	13%	0.132	42%	0.421	C	S	.	.			trans	-76.3	140.7	179.3	-69.1	-165.4	61.3	-176.7	-8	112.4	K78 G80 R81 T289 Q290 M308 T348 C349	K78-R292 PolarHBondContact O-NH2 3.39Å; G80-R292 PolarHBondContact O-NH1 2.64Å; G80-R292 PolarHBondContact O-NH2 2.85Å; R81-R292 PolarHBondContact O-NH1 3.38Å; T289-R292 VanDerWaalsContact O-CB 3.24Å; T289-R292 WeakPolarHBondContact O-CB 3.12Å; T289-R292 WeakPolarHBondContact O-CG 3.45Å; T289-R292 PolarHBondContact O-N 2.88Å; T289-R292 VanDerWaalsContact O-N 3.15Å; Q290-R292 PolarHBondContact O-N 3.35Å; R292-M308 HydrophobicContact CB-CG 4.49Å; R292-T348 CarbonylContact O-C 3.4Å; R292-T348 VanDerWaalsContact O-CA 3.29Å; R292-T348 WeakPolarHBondContact O-CA 3.39Å; R292-C349 PolarHBondContact O-N 2.86Å
293	V	92.3	Very high	86.9	Confident	97 Å²	97	71.2 Å²	71.2	59%	0.588	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	135.2	173.1	-178.1	0	0	0	0	110.2	V346 Y347 T348	V293-V346 HydrophobicContact CG1-CG1 4.07Å; V293-V346 HydrophobicContact CG2-CG1 4.13Å; V293-Y347 CarbonylContact C-O 3.55Å; V293-Y347 VanDerWaalsContact CA-O 3.3Å; V293-Y347 WeakPolarHBondContact CA-O 3.25Å; V293-T348 HydrophobicContact CG2-CG2 4.34Å
294	C	92.4	Very high	87.2	Confident	9 Å²	9	66 Å²	66	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.4	176.1	67.9	0	0	0	0	111.3	C305 M308 C309 Y347	C294-C305 VanDerWaalsContact C-SG 3.5Å; C294-C305 HydrophobicContact CB-CB 3.83Å; C294-C305 WeakPolarHBondContact CB-SG 3.16Å; C294-C305 WeakPolarHBondContact SG-CA 3.37Å; C294-C305 WeakPolarHBondContact SG-CB 3.3Å; C294-C305 CovalentContact SG-SG 2.04Å; C294-C305 PolarHBondContact SG-SG 3.18Å; C294-M308 HydrophobicContact CB-CB 3.97Å; C294-M308 HydrophobicContact CB-CG 4.05Å; C294-C309 VanDerWaalsContact SG-SG 3.69Å; C294-Y347 PolarHBondContact N-O 2.85Å
295	N	91.1	Very high	87.5	Confident	60 Å²	60	64.7 Å²	64.7	32%	0.321	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-105.4	116.5	178.6	-168.4	-11.2	0	0	0	110.8	T297 M298 S303 G304 C305	N295-T297 PolarHBondContact OD1-N 3.47Å; N295-T297 VanDerWaalsContact OD1-N 3.14Å; N295-T297 PolarHBondContact OD1-OG1 3.27Å; N295-M298 HydrophobicContact CB-CG 4.49Å; N295-S303 PolarHBondContact N-O 3.04Å; N295-G304 VanDerWaalsContact O-CA 3.3Å; N295-G304 WeakPolarHBondContact O-CA 3.4Å; N295-C305 VanDerWaalsContact C-SG 3.58Å; N295-C305 PolarHBondContact O-N 2.91Å
296	K	88.3	Confident	87.9	Confident	99 Å²	99	67.1 Å²	67.1	43%	0.43	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.5	-179.9	-179.2	179.7	176.4	-173.8	0	113.2	M298 Y314 Y347	K296-M298 VanDerWaalsContact C-N 3.31Å; K296-M298 PolarHBondContact O-N 3.13Å; K296-Y314 HydrophobicContact CD-CE2 4.31Å; K296-Y314 WeakPolarHBondContact CD-OH 3.45Å; K296-Y314 WeakPolarHBondContact CE-OH 3.45Å; K296-Y347 HydrophobicContact CB-CD2 3.69Å; K296-Y347 HydrophobicContact CB-CE1 4.45Å; K296-Y347 HydrophobicContact CB-CE2 3.5Å; K296-Y347 VanDerWaalsContact CB-CE2 3.5Å; K296-Y347 HydrophobicContact CB-CG 4.23Å; K296-Y347 HydrophobicContact CD-CE1 3.86Å; K296-Y347 HydrophobicContact CD-CE2 4.12Å; K296-Y347 HydrophobicContact CG-CE2 4.46Å
297	T	85.9	Confident	88	Confident	125 Å²	125	69.9 Å²	69.9	77%	0.767	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-16.4	-175.1	52.3	0	0	0	0	113.5	N295	N295-T297 PolarHBondContact OD1-N 3.47Å; N295-T297 VanDerWaalsContact OD1-N 3.14Å; N295-T297 PolarHBondContact OD1-OG1 3.27Å
298	M	83	Confident	88.2	Confident	78 Å²	78	65.5 Å²	65.5	38%	0.384	35%	0.349	S	S	.	.			trans	-106.8	60.3	-175.1	-58.7	-173.7	81.6	0	0	112.7	N295 K296 Q300 H301 G304	N295-M298 HydrophobicContact CB-CG 4.49Å; K296-M298 VanDerWaalsContact C-N 3.31Å; K296-M298 PolarHBondContact O-N 3.13Å; M298-Q300 VanDerWaalsContact C-N 3.31Å; M298-Q300 PolarHBondContact O-N 2.99Å; M298-Q300 VanDerWaalsContact O-N 3.16Å; M298-H301 HydrophobicContact CB-CB 3.8Å; M298-H301 HydrophobicContact CE-CB 3.87Å; M298-H301 PolarHBondContact O-N 2.93Å; M298-G304 WeakPolarHBondContact O-CA 3.13Å
299	M	70	Confident	88.3	Confident	118 Å²	118	64.9 Å²	64.9	58%	0.581	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-40	-170	-60.8	-172.8	76.2	0	0	114.7	D306	M299-D306 WeakPolarHBondContact CE-OD2 3.32Å
300	Q	75.4	Confident	88.3	Confident	195 Å²	195	66.8 Å²	66.8	91%	0.911	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.6	-177.6	-64.1	-179.8	-4.8	0	0	114.3	M298	M298-Q300 VanDerWaalsContact C-N 3.31Å; M298-Q300 PolarHBondContact O-N 2.99Å; M298-Q300 VanDerWaalsContact O-N 3.16Å
301	H	83.6	Confident	88.1	Confident	85 Å²	85	63.3 Å²	63.3	39%	0.394	36%	0.359	S	S	.	.	S	Bend	trans	-92.2	155.9	-179.6	-166.8	-106.5	0	0	0	111.1	M298 S303 G304 L307	M298-H301 HydrophobicContact CB-CB 3.8Å; M298-H301 HydrophobicContact CE-CB 3.87Å; M298-H301 PolarHBondContact O-N 2.93Å; H301-S303 PolarHBondContact ND1-N 2.89Å; H301-S303 PolarHBondContact ND1-OG 3.08Å; H301-S303 PolarHBondContact O-N 2.78Å; H301-S303 VanDerWaalsContact O-N 3.12Å; H301-G304 WeakPolarHBondContact O-CA 3.36Å; H301-G304 PolarHBondContact O-N 2.85Å; H301-L307 WeakPolarHBondContact O-CD1 3.4Å
302	I	83.1	Confident	88.2	Confident	101 Å²	101	64.2 Å²	64.2	52%	0.518	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-30	-177.4	-57.1	171.8	0	0	0	112.2	G304	I302-G304 VanDerWaalsContact C-N 3.31Å
303	S	86.3	Confident	88.2	Confident	13 Å²	13	63.9 Å²	63.9	9%	0.091	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5	174	60.8	0	0	0	0	114.3	N295 H301	N295-S303 PolarHBondContact N-O 3.04Å; H301-S303 PolarHBondContact ND1-N 2.89Å; H301-S303 PolarHBondContact ND1-OG 3.08Å; H301-S303 PolarHBondContact O-N 2.78Å; H301-S303 VanDerWaalsContact O-N 3.12Å
304	G	91.9	Very high	88.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-62.4	144.1	177.1	0	0	0	0	0	111.4	N295 M298 H301 I302 D306 L307 M308	N295-G304 VanDerWaalsContact O-CA 3.3Å; N295-G304 WeakPolarHBondContact O-CA 3.4Å; M298-G304 WeakPolarHBondContact O-CA 3.13Å; H301-G304 WeakPolarHBondContact O-CA 3.36Å; H301-G304 PolarHBondContact O-N 2.85Å; I302-G304 VanDerWaalsContact C-N 3.31Å; G304-D306 VanDerWaalsContact C-N 3.27Å; G304-D306 PolarHBondContact O-N 3.17Å; G304-L307 PolarHBondContact O-N 2.8Å; G304-M308 WeakPolarHBondContact O-CB 3.36Å; G304-M308 PolarHBondContact O-N 3.49Å
305	C	91.7	Very high	88.3	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.02	35%	0.353	C	S	.	.	H	α-helix	trans	-59.6	-35.5	-179.3	-67	0	0	0	0	113.5	C294 N295 L307 C309 Y314	C294-C305 VanDerWaalsContact C-SG 3.5Å; C294-C305 HydrophobicContact CB-CB 3.83Å; C294-C305 WeakPolarHBondContact CB-SG 3.16Å; C294-C305 WeakPolarHBondContact SG-CA 3.37Å; C294-C305 WeakPolarHBondContact SG-CB 3.3Å; C294-C305 CovalentContact SG-SG 2.04Å; C294-C305 PolarHBondContact SG-SG 3.18Å; N295-C305 VanDerWaalsContact C-SG 3.58Å; N295-C305 PolarHBondContact O-N 2.91Å; C305-L307 PolarHBondContact O-N 3.32Å; C305-C309 WeakPolarHBondContact O-CB 3.2Å; C305-C309 PolarHBondContact O-N 3.29Å; C305-C309 PolarHBondContact O-SG 2.79Å; C305-Y314 HydrophobicContact CB-CD1 3.38Å; C305-Y314 HydrophobicContact CB-CE1 3.62Å; C305-Y314 HydrophobicContact CB-CG 4.04Å
306	D	89.2	Confident	88.5	Confident	80 Å²	80	65.9 Å²	65.9	43%	0.428	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-45.3	178.6	-61	-19.4	0	0	0	111.8	M299 G304 C310 G311	M299-D306 WeakPolarHBondContact CE-OD2 3.32Å; G304-D306 VanDerWaalsContact C-N 3.27Å; G304-D306 PolarHBondContact O-N 3.17Å; D306-C310 PolarHBondContact O-N 3.17Å; D306-G311 PolarHBondContact O-N 3.32Å
307	L	90.4	Very high	88.6	Confident	66 Å²	66	64.4 Å²	64.4	35%	0.346	35%	0.353	S	S	.	.	H	α-helix	trans	-79	-39.6	179.5	-71.2	178	0	0	0	112.6	R81 H301 G304 C305	R81-L307 PolarHBondContact NE-O 3.28Å; R81-L307 PolarHBondContact NH2-O 2.89Å; H301-L307 WeakPolarHBondContact O-CD1 3.4Å; G304-L307 PolarHBondContact O-N 2.8Å; C305-L307 PolarHBondContact O-N 3.32Å
308	M	92.8	Very high	88.9	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-69.2	-41.1	-178.9	-175.8	88.7	-61	0	0	111.8	R81 T289 R292 C294 G304 C310	R81-M308 HydrophobicContact CB-CE 3.92Å; R81-M308 HydrophobicContact CG-CE 3.43Å; R81-M308 VanDerWaalsContact CG-CE 3.43Å; T289-M308 WeakPolarHBondContact CB-O 3.3Å; T289-M308 HydrophobicContact CG2-CE 4.15Å; T289-M308 WeakPolarHBondContact CG2-O 3.36Å; T289-M308 PolarHBondContact OG1-O 3.2Å; R292-M308 HydrophobicContact CB-CG 4.49Å; C294-M308 HydrophobicContact CB-CB 3.97Å; C294-M308 HydrophobicContact CB-CG 4.05Å; G304-M308 WeakPolarHBondContact O-CB 3.36Å; G304-M308 PolarHBondContact O-N 3.49Å; M308-C310 VanDerWaalsContact C-N 3.35Å
309	C	94.2	Very high	89.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2.3	-176.6	-47	0	0	0	0	113.2	C294 C305 G311 R312 G313 C349	C294-C309 VanDerWaalsContact SG-SG 3.69Å; C305-C309 WeakPolarHBondContact O-CB 3.2Å; C305-C309 PolarHBondContact O-N 3.29Å; C305-C309 PolarHBondContact O-SG 2.79Å; C309-G311 PolarHBondContact O-N 3.47Å; C309-G311 VanDerWaalsContact O-N 3.13Å; C309-R312 WeakPolarHBondContact O-CB 3.25Å; C309-R312 WeakPolarHBondContact O-CG 3.47Å; C309-R312 PolarHBondContact O-N 3.27Å; C309-G313 WeakPolarHBondContact CB-O 3.37Å; C309-C349 WeakPolarHBondContact CA-SG 3.45Å; C309-C349 HydrophobicContact CB-CB 3.57Å; C309-C349 WeakPolarHBondContact CB-SG 3.03Å; C309-C349 PolarHBondContact N-SG 3.48Å; C309-C349 VanDerWaalsContact N-SG 3.41Å; C309-C349 WeakPolarHBondContact SG-CA 3.42Å; C309-C349 WeakPolarHBondContact SG-CB 3.39Å; C309-C349 CovalentContact SG-SG 2.04Å; C309-C349 PolarHBondContact SG-SG 3.48Å
310	C	93.5	Very high	90.1	Very high	40 Å²	40	65.6 Å²	65.6	27%	0.27	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	35.9	172.5	-52.8	0	0	0	0	113.8	C278 D306 M308 R312	C278-C310 HydrophobicContact CB-CB 3.63Å; C278-C310 WeakPolarHBondContact CB-SG 3.31Å; C278-C310 WeakPolarHBondContact SG-CB 3.43Å; C278-C310 CovalentContact SG-SG 2.02Å; C278-C310 PolarHBondContact SG-SG 3.22Å; D306-C310 PolarHBondContact O-N 3.17Å; M308-C310 VanDerWaalsContact C-N 3.35Å; C310-R312 VanDerWaalsContact C-N 3.32Å; C310-R312 PolarHBondContact O-N 2.98Å
311	G	90.7	Very high	90.8	Very high	72 Å²	72	64 Å²	64	74%	0.742	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-1.9	-179.1	0	0	0	0	0	116	D306 C309 G313	D306-G311 PolarHBondContact O-N 3.32Å; C309-G311 PolarHBondContact O-N 3.47Å; C309-G311 VanDerWaalsContact O-N 3.13Å; G311-G313 PolarHBondContact O-N 2.78Å
312	R	93.3	Very high	91.3	Very high	70 Å²	70	64.1 Å²	64.1	26%	0.264	34%	0.343	S	S	.	.	S	Bend	trans	-72	-11	177	-58.8	-168.4	-56.9	-90.3	-8.1	113.9	C278 E279 T289 C309 C310 K350	C278-R312 PolarHBondContact O-NH1 3.34Å; E279-R312 IonicContact OE1-CZ 3.62Å; E279-R312 IonicContact OE1-NE 2.76Å; E279-R312 IonicContact OE1-NH1 3.79Å; E279-R312 PolarHBondContact OE1-NH1 3.38Å; T289-R312 PolarHBondContact OG1-NH2 3.35Å; C309-R312 WeakPolarHBondContact O-CB 3.25Å; C309-R312 WeakPolarHBondContact O-CG 3.47Å; C309-R312 PolarHBondContact O-N 3.27Å; C310-R312 VanDerWaalsContact C-N 3.32Å; C310-R312 PolarHBondContact O-N 2.98Å; R312-K350 HydrophobicContact CB-CB 4.5Å; R312-K350 PolarHBondContact NE-O 2.68Å; R312-K350 PolarHBondContact NH2-O 2.96Å
313	G	92.2	Very high	91.9	Very high	28 Å²	28	64.1 Å²	64.1	29%	0.289	34%	0.336	S	S	.	.			trans	79.2	-174.3	-170.9	0	0	0	0	0	112.9	C309 G311 K350	C309-G313 WeakPolarHBondContact CB-O 3.37Å; G311-G313 PolarHBondContact O-N 2.78Å; G313-K350 PolarHBondContact O-N 3.41Å
314	Y	94.4	Very high	92.3	Very high	67 Å²	67	68.8 Å²	68.8	26%	0.263	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.1	-175.5	52.2	-88.5	0	0	0	111.4	K296 C305 Y347 T348	K296-Y314 HydrophobicContact CD-CE2 4.31Å; K296-Y314 WeakPolarHBondContact CD-OH 3.45Å; K296-Y314 WeakPolarHBondContact CE-OH 3.45Å; C305-Y314 HydrophobicContact CB-CD1 3.38Å; C305-Y314 HydrophobicContact CB-CE1 3.62Å; C305-Y314 HydrophobicContact CB-CG 4.04Å; Y314-Y347 AromaticContact CD2-CD1 3.64Å; Y314-Y347 HydrophobicContact CD2-CD1 3.64Å; Y314-Y347 HydrophobicContact CD2-CG 4.06Å; Y314-Y347 AromaticContact CE2-CD1 3.59Å; Y314-Y347 HydrophobicContact CE2-CD1 3.59Å; Y314-Y347 HydrophobicContact CE2-CE1 4.17Å; Y314-Y347 HydrophobicContact CE2-CG 4.19Å; Y314-T348 CarbonylContact C-O 3.49Å; Y314-T348 WeakPolarHBondContact CA-O 3.18Å; Y314-T348 VanDerWaalsContact CB-O 3.27Å; Y314-T348 WeakPolarHBondContact CB-O 3.47Å
315	N	94.4	Very high	92.5	Very high	70 Å²	70	69.4 Å²	69.4	37%	0.374	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	146.8	169.4	-63.6	-37.2	0	0	0	109.5	Y347 T348 K350	N315-Y347 CarbonylContact O-C 3.38Å; N315-Y347 VanDerWaalsContact O-CA 3.28Å; N315-Y347 WeakPolarHBondContact O-CA 3.08Å; N315-T348 PolarHBondContact N-O 2.88Å; N315-T348 PolarHBondContact O-N 3.12Å; N315-K350 WeakPolarHBondContact OD1-CE 3.39Å
316	T	93.7	Very high	92.6	Very high	72 Å²	72	74.8 Å²	74.8	44%	0.442	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.4	176	-55.8	0	0	0	0	109	E345 Y347	T316-E345 HydrophobicContact CG2-CB 4.3Å; T316-Y347 HydrophobicContact CG2-CD1 3.98Å; T316-Y347 HydrophobicContact CG2-CE1 3.62Å; T316-Y347 WeakPolarHBondContact OG1-CD1 3.45Å; T316-Y347 WeakPolarHBondContact OG1-CE1 3.48Å
317	H	91.3	Very high	92.9	Very high	68 Å²	68	74.1 Å²	74.1	32%	0.315	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.2	174.9	-59.2	-81.9	0	0	0	109.7	Y319 E345 V346 T348	H317-Y319 HydrophobicContact CB-CD2 4.03Å; H317-Y319 HydrophobicContact CB-CE2 3.26Å; H317-E345 CarbonylContact O-C 3.12Å; H317-E345 WeakPolarHBondContact O-CA 3.28Å; H317-V346 PolarHBondContact N-O 3.05Å; H317-V346 PolarHBondContact O-N 3.16Å; H317-T348 PolarHBondContact CD2-OG1 2.93Å; H317-T348 PolarHBondContact NE2-OG1 3.04Å; H317-T348 VanDerWaalsContact NE2-OG1 3.16Å
318	Q	90.9	Very high	93.1	Very high	140 Å²	140	78.3 Å²	78.3	65%	0.654	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.1	175.7	-67.2	-172	-15.7	0	0	109.9	E345	Q318-E345 HydrophobicContact CG-CG 4.26Å; Q318-E345 PolarHBondContact NE2-OE1 3.42Å
319	Y	88.6	Confident	93.2	Very high	132 Å²	132	84.8 Å²	84.8	52%	0.518	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.1	177.6	-63.5	-80.1	0	0	0	110.4	H317 T344 V346	H317-Y319 HydrophobicContact CB-CD2 4.03Å; H317-Y319 HydrophobicContact CB-CE2 3.26Å; Y319-T344 PolarHBondContact N-O 2.98Å; Y319-T344 PolarHBondContact O-N 3.44Å; Y319-T344 PolarHBondContact O-OG1 2.88Å; Y319-V346 HydrophobicContact CD2-CB 4.24Å; Y319-V346 HydrophobicContact CD2-CG2 3.98Å; Y319-V346 HydrophobicContact CE2-CB 4.3Å; Y319-V346 HydrophobicContact CE2-CG2 4.45Å
320	S	90.9	Very high	93	Very high	74 Å²	74	87.8 Å²	87.8	52%	0.517	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	108.6	167.7	-170.6	0	0	0	0	108.9	E342	S320-E342 CarbonylContact C-O 3.59Å; S320-E342 WeakPolarHBondContact CA-O 2.98Å
321	R	90.7	Very high	92.4	Very high	161 Å²	161	97.3 Å²	97.3	61%	0.608	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	121	173.5	-173.4	-178.1	-176.7	-170	0.2	108.1	W323 S341 E342 T344	R321-W323 HydrophobicContact CB-CZ3 4.48Å; R321-W323 HydrophobicContact CG-CE3 4.16Å; R321-W323 HydrophobicContact CG-CZ3 4.5Å; R321-W323 VanDerWaalsContact O-CZ3 3.31Å; R321-W323 WeakPolarHBondContact O-CZ3 3.5Å; R321-S341 CarbonylContact O-C 3.58Å; R321-S341 VanDerWaalsContact O-CA 3.26Å; R321-S341 WeakPolarHBondContact O-CA 3.27Å; R321-E342 PolarHBondContact N-O 3.01Å; R321-E342 PolarHBondContact O-N 3.11Å; R321-T344 HydrophobicContact CB-CG2 4.18Å
322	V	93.7	Very high	91.8	Very high	88 Å²	88	97.6 Å²	97.6	53%	0.533	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.8	177.3	-176.3	0	0	0	0	109.1	T339 C340	V322-T339 HydrophobicContact CG1-CG2 3.3Å; V322-C340 VanDerWaalsContact CA-O 3.32Å; V322-C340 WeakPolarHBondContact CA-O 2.98Å; V322-C340 WeakPolarHBondContact CG1-O 3.49Å
323	W	94.6	Very high	91.5	Very high	100 Å²	100	99.7 Å²	99.7	38%	0.379	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	161.5	175.7	71.7	100.3	0	0	0	111.8	R321 C340 E342	R321-W323 HydrophobicContact CB-CZ3 4.48Å; R321-W323 HydrophobicContact CG-CE3 4.16Å; R321-W323 HydrophobicContact CG-CZ3 4.5Å; R321-W323 VanDerWaalsContact O-CZ3 3.31Å; R321-W323 WeakPolarHBondContact O-CZ3 3.5Å; W323-C340 HydrophobicContact CD2-CB 4.39Å; W323-C340 HydrophobicContact CZ2-CB 4.19Å; W323-C340 PolarHBondContact N-O 3.25Å; W323-C340 PolarHBondContact O-N 2.95Å; W323-E342 HydrophobicContact CH2-CB 3.53Å; W323-E342 HydrophobicContact CZ3-CB 3.53Å
324	Q	95.6	Very high	91.4	Very high	111 Å²	111	104.6 Å²	104.6	52%	0.519	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.9	173.7	-64.6	-59.1	-36.6	0	0	109.7	C337 N338 T339	Q324-C337 HydrophobicContact CB-CB 3.86Å; Q324-C337 HydrophobicContact CG-CB 4.37Å; Q324-N338 WeakPolarHBondContact CA-O 3.2Å; Q324-N338 PolarHBondContact OE1-O 2.82Å; Q324-T339 PolarHBondContact NE2-OG1 2.02Å
325	C	95.3	Very high	91.4	Very high	13 Å²	13	105.5 Å²	105.5	9%	0.088	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	167.9	-176.1	65.6	0	0	0	0	110.5	C327 N338 C340	C325-C327 PolarHBondContact O-N 2.9Å; C325-C327 VanDerWaalsContact O-N 3.09Å; C325-N338 PolarHBondContact N-O 3.4Å; C325-N338 PolarHBondContact O-N 3.44Å; C325-N338 PolarHBondContact SG-O 3.28Å; C325-N338 VanDerWaalsContact SG-O 3.36Å; C325-C340 HydrophobicContact CB-CB 3.61Å; C325-C340 WeakPolarHBondContact CB-SG 3.37Å; C325-C340 WeakPolarHBondContact SG-CB 3.46Å; C325-C340 PolarHBondContact SG-N 2.78Å; C325-C340 CovalentContact SG-SG 2Å; C325-C340 PolarHBondContact SG-SG 2.8Å
326	N	94.9	Very high	91.4	Very high	116 Å²	116	108.7 Å²	108.7	62%	0.62	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.3	38.2	174.6	-60.2	-38.5	0	0	0	113.1	K328	N326-K328 PolarHBondContact O-N 3.08Å
327	C	95.2	Very high	91.6	Very high	66 Å²	66	107.1 Å²	107.1	45%	0.446	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.6	-177.7	-64.8	0	0	0	0	111.1	C325 V335 K336 C337	C325-C327 PolarHBondContact O-N 2.9Å; C325-C327 VanDerWaalsContact O-N 3.09Å; C327-V335 HydrophobicContact CB-CG1 3.76Å; C327-K336 WeakPolarHBondContact CA-O 3.45Å; C327-C337 HydrophobicContact CB-CB 4.12Å; C327-C337 WeakPolarHBondContact CB-SG 3.14Å; C327-C337 WeakPolarHBondContact SG-CB 3.2Å; C327-C337 CovalentContact SG-SG 2.04Å; C327-C337 PolarHBondContact SG-SG 3.45Å
328	K	93.7	Very high	91.9	Very high	154 Å²	154	108.2 Å²	108.2	67%	0.67	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	128.8	175	-65.6	-175	-179.9	-177	0	109.6	N326 K336	N326-K328 PolarHBondContact O-N 3.08Å; K328-K336 PolarHBondContact N-O 3.05Å; K328-K336 PolarHBondContact O-N 3.33Å
329	F	94.4	Very high	92.1	Very high	138 Å²	138	106.2 Å²	106.2	61%	0.605	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	124	170.4	-178.3	-100.5	0	0	0	108.9	V335	F329-V335 HydrophobicContact CD2-CG2 4.06Å
330	L	90.1	Very high	92.5	Very high	63 Å²	63	101.7 Å²	101.7	33%	0.33	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.4	175.3	-72	153.9	0	0	0	107.8	C332 C333 Y334 K336	L330-C332 PolarHBondContact O-N 2.89Å; L330-C333 PolarHBondContact O-N 2.95Å; L330-C333 VanDerWaalsContact O-N 3.11Å; L330-Y334 HydrophobicContact CB-CD2 4.36Å; L330-Y334 HydrophobicContact CB-CE2 4.02Å; L330-Y334 HydrophobicContact CD1-CD2 3.91Å; L330-Y334 HydrophobicContact CD1-CE2 3.26Å; L330-Y334 HydrophobicContact CG-CE2 4.25Å; L330-Y334 PolarHBondContact N-O 2.89Å; L330-K336 HydrophobicContact CD1-CB 3.68Å; L330-K336 HydrophobicContact CD1-CD 4.28Å
331	W	81.6	Confident	92.6	Very high	240 Å²	240	102.1 Å²	102.1	91%	0.909	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	104.2	-179.1	-162.2	86.2	0	0	0	108.8
332	C	78.2	Confident	92.8	Very high	78 Å²	78	99.7 Å²	99.7	53%	0.527	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	137	15.3	-162.4	60.8	0	0	0	0	112	L330 Y334	L330-C332 PolarHBondContact O-N 2.89Å; C332-Y334 HydrophobicContact CB-CE1 4.47Å; C332-Y334 WeakPolarHBondContact SG-CE1 3.43Å
333	C	87	Confident	92.7	Very high	115 Å²	115	106 Å²	106	78%	0.777	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	22.2	157.9	-53.7	0	0	0	0	117.2	L330	L330-C333 PolarHBondContact O-N 2.95Å; L330-C333 VanDerWaalsContact O-N 3.11Å
334	Y	90.6	Very high	92.5	Very high	130 Å²	130	103 Å²	103	51%	0.51	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	149.6	170.1	61.7	-87.5	0	0	0	112.4	L330 C332	L330-Y334 HydrophobicContact CB-CD2 4.36Å; L330-Y334 HydrophobicContact CB-CE2 4.02Å; L330-Y334 HydrophobicContact CD1-CD2 3.91Å; L330-Y334 HydrophobicContact CD1-CE2 3.26Å; L330-Y334 HydrophobicContact CG-CE2 4.25Å; L330-Y334 PolarHBondContact N-O 2.89Å; C332-Y334 HydrophobicContact CB-CE1 4.47Å; C332-Y334 WeakPolarHBondContact SG-CE1 3.43Å
335	V	94.5	Very high	92.3	Very high	87 Å²	87	102.1 Å²	102.1	53%	0.527	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.8	176.7	-179.2	0	0	0	0	107.7	C327 F329	C327-V335 HydrophobicContact CB-CG1 3.76Å; F329-V335 HydrophobicContact CD2-CG2 4.06Å
336	K	94.8	Very high	92.1	Very high	137 Å²	137	103.6 Å²	103.6	60%	0.596	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.5	172.5	-172.3	174.1	-178.3	176.4	0	108.8	C327 K328 L330	C327-K336 WeakPolarHBondContact CA-O 3.45Å; K328-K336 PolarHBondContact N-O 3.05Å; K328-K336 PolarHBondContact O-N 3.33Å; L330-K336 HydrophobicContact CD1-CB 3.68Å; L330-K336 HydrophobicContact CD1-CD 4.28Å
337	C	96.9	Very high	92	Very high	38 Å²	38	99.7 Å²	99.7	26%	0.257	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	154.2	177.5	-58.1	0	0	0	0	110.5	Q324 C327	Q324-C337 HydrophobicContact CB-CB 3.86Å; Q324-C337 HydrophobicContact CG-CB 4.37Å; C327-C337 HydrophobicContact CB-CB 4.12Å; C327-C337 WeakPolarHBondContact CB-SG 3.14Å; C327-C337 WeakPolarHBondContact SG-CB 3.2Å; C327-C337 CovalentContact SG-SG 2.04Å; C327-C337 PolarHBondContact SG-SG 3.45Å
338	N	96.9	Very high	92	Very high	92 Å²	92	97.5 Å²	97.5	49%	0.492	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	154.1	166.5	-66.6	-8	0	0	0	109.2	Q324 C325	Q324-N338 WeakPolarHBondContact CA-O 3.2Å; Q324-N338 PolarHBondContact OE1-O 2.82Å; C325-N338 PolarHBondContact N-O 3.4Å; C325-N338 PolarHBondContact O-N 3.44Å; C325-N338 PolarHBondContact SG-O 3.28Å; C325-N338 VanDerWaalsContact SG-O 3.36Å
339	T	96	Very high	92	Very high	98 Å²	98	90.3 Å²	90.3	60%	0.601	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	112.2	170.5	-59.1	0	0	0	0	108.5	V322 Q324	V322-T339 HydrophobicContact CG1-CG2 3.3Å; Q324-T339 PolarHBondContact NE2-OG1 2.02Å
340	C	96	Very high	92	Very high	37 Å²	37	89.1 Å²	89.1	25%	0.25	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	153.2	173.1	-76.6	0	0	0	0	110.5	V322 W323 C325	V322-C340 VanDerWaalsContact CA-O 3.32Å; V322-C340 WeakPolarHBondContact CA-O 2.98Å; V322-C340 WeakPolarHBondContact CG1-O 3.49Å; W323-C340 HydrophobicContact CD2-CB 4.39Å; W323-C340 HydrophobicContact CZ2-CB 4.19Å; W323-C340 PolarHBondContact N-O 3.25Å; W323-C340 PolarHBondContact O-N 2.95Å; C325-C340 HydrophobicContact CB-CB 3.61Å; C325-C340 WeakPolarHBondContact CB-SG 3.37Å; C325-C340 WeakPolarHBondContact SG-CB 3.46Å; C325-C340 PolarHBondContact SG-N 2.78Å; C325-C340 CovalentContact SG-SG 2Å; C325-C340 PolarHBondContact SG-SG 2.8Å
341	S	93.8	Very high	92.1	Very high	83 Å²	83	90.5 Å²	90.5	58%	0.58	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.4	173.3	64	0	0	0	0	111.3	R321	R321-S341 CarbonylContact O-C 3.58Å; R321-S341 VanDerWaalsContact O-CA 3.26Å; R321-S341 WeakPolarHBondContact O-CA 3.27Å
342	E	94.2	Very high	92.7	Very high	109 Å²	109	82.6 Å²	82.6	51%	0.509	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.2	173.7	-179.7	178.4	-144.2	0	0	109.8	S320 R321 W323 T344	S320-E342 CarbonylContact C-O 3.59Å; S320-E342 WeakPolarHBondContact CA-O 2.98Å; R321-E342 PolarHBondContact N-O 3.01Å; R321-E342 PolarHBondContact O-N 3.11Å; W323-E342 HydrophobicContact CH2-CB 3.53Å; W323-E342 HydrophobicContact CZ3-CB 3.53Å; E342-T344 HydrophobicContact CG-CG2 4.24Å; E342-T344 PolarHBondContact O-N 3.28Å
343	R	92.1	Very high	93.5	Very high	220 Å²	220	82.8 Å²	82.8	83%	0.83	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	115.9	171.7	-70.3	-175.4	177.4	177.2	-0.6	108.5
344	T	90.4	Very high	93.8	Very high	38 Å²	38	80.9 Å²	80.9	23%	0.233	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.4	179.7	55.3	0	0	0	0	110.7	Y319 R321 E342	Y319-T344 PolarHBondContact N-O 2.98Å; Y319-T344 PolarHBondContact O-N 3.44Å; Y319-T344 PolarHBondContact O-OG1 2.88Å; R321-T344 HydrophobicContact CB-CG2 4.18Å; E342-T344 HydrophobicContact CG-CG2 4.24Å; E342-T344 PolarHBondContact O-N 3.28Å
345	E	91	Very high	94	Very high	92 Å²	92	77.9 Å²	77.9	43%	0.43	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	134	173.5	-52.7	-162	143.8	0	0	110.5	T316 H317 Q318 Y347	T316-E345 HydrophobicContact CG2-CB 4.3Å; H317-E345 CarbonylContact O-C 3.12Å; H317-E345 WeakPolarHBondContact O-CA 3.28Å; Q318-E345 HydrophobicContact CG-CG 4.26Å; Q318-E345 PolarHBondContact NE2-OE1 3.42Å; E345-Y347 HydrophobicContact CB-CE1 4.34Å; E345-Y347 HydrophobicContact CB-CE2 4.36Å; E345-Y347 PolarHBondContact OE2-OH 3.4Å
346	V	92	Very high	94	Very high	44 Å²	44	77.3 Å²	77.3	27%	0.267	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.7	173.5	-179.9	0	0	0	0	108.3	V293 H317 Y319 T348	V293-V346 HydrophobicContact CG1-CG1 4.07Å; V293-V346 HydrophobicContact CG2-CG1 4.13Å; H317-V346 PolarHBondContact N-O 3.05Å; H317-V346 PolarHBondContact O-N 3.16Å; Y319-V346 HydrophobicContact CD2-CB 4.24Å; Y319-V346 HydrophobicContact CD2-CG2 3.98Å; Y319-V346 HydrophobicContact CE2-CB 4.3Å; Y319-V346 HydrophobicContact CE2-CG2 4.45Å; V346-T348 HydrophobicContact CG1-CG2 4.41Å
347	Y	93.8	Very high	94	Very high	34 Å²	34	73 Å²	73	13%	0.133	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.8	179.5	-50.5	-76.2	0	0	0	110.1	V293 C294 K296 Y314 N315 T316 E345	V293-Y347 CarbonylContact C-O 3.55Å; V293-Y347 VanDerWaalsContact CA-O 3.3Å; V293-Y347 WeakPolarHBondContact CA-O 3.25Å; C294-Y347 PolarHBondContact N-O 2.85Å; K296-Y347 HydrophobicContact CB-CD2 3.69Å; K296-Y347 HydrophobicContact CB-CE1 4.45Å; K296-Y347 HydrophobicContact CB-CE2 3.5Å; K296-Y347 VanDerWaalsContact CB-CE2 3.5Å; K296-Y347 HydrophobicContact CB-CG 4.23Å; K296-Y347 HydrophobicContact CD-CE1 3.86Å; K296-Y347 HydrophobicContact CD-CE2 4.12Å; K296-Y347 HydrophobicContact CG-CE2 4.46Å; Y314-Y347 AromaticContact CD2-CD1 3.64Å; Y314-Y347 HydrophobicContact CD2-CD1 3.64Å; Y314-Y347 HydrophobicContact CD2-CG 4.06Å; Y314-Y347 AromaticContact CE2-CD1 3.59Å; Y314-Y347 HydrophobicContact CE2-CD1 3.59Å; Y314-Y347 HydrophobicContact CE2-CE1 4.17Å; Y314-Y347 HydrophobicContact CE2-CG 4.19Å; N315-Y347 CarbonylContact O-C 3.38Å; N315-Y347 VanDerWaalsContact O-CA 3.28Å; N315-Y347 WeakPolarHBondContact O-CA 3.08Å; T316-Y347 HydrophobicContact CG2-CD1 3.98Å; T316-Y347 HydrophobicContact CG2-CE1 3.62Å; T316-Y347 WeakPolarHBondContact OG1-CD1 3.45Å; T316-Y347 WeakPolarHBondContact OG1-CE1 3.48Å; E345-Y347 HydrophobicContact CB-CE1 4.34Å; E345-Y347 HydrophobicContact CB-CE2 4.36Å; E345-Y347 PolarHBondContact OE2-OH 3.4Å
348	T	94.3	Very high	93.7	Very high	21 Å²	21	75.7 Å²	75.7	13%	0.129	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.2	-179.5	53.7	0	0	0	0	111	R292 V293 Y314 N315 H317 V346	R292-T348 CarbonylContact O-C 3.4Å; R292-T348 VanDerWaalsContact O-CA 3.29Å; R292-T348 WeakPolarHBondContact O-CA 3.39Å; V293-T348 HydrophobicContact CG2-CG2 4.34Å; Y314-T348 CarbonylContact C-O 3.49Å; Y314-T348 WeakPolarHBondContact CA-O 3.18Å; Y314-T348 VanDerWaalsContact CB-O 3.27Å; Y314-T348 WeakPolarHBondContact CB-O 3.47Å; N315-T348 PolarHBondContact N-O 2.88Å; N315-T348 PolarHBondContact O-N 3.12Å; H317-T348 PolarHBondContact CD2-OG1 2.93Å; H317-T348 PolarHBondContact NE2-OG1 3.04Å; H317-T348 VanDerWaalsContact NE2-OG1 3.16Å; V346-T348 HydrophobicContact CG1-CG2 4.41Å
349	C	94.4	Very high	93.5	Very high	2 Å²	2	74.3 Å²	74.3	1%	0.014	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	139.1	-179.9	-63.1	0	0	0	0	112.2	T289 G291 R292 C309	T289-C349 VanDerWaalsContact O-CB 3.24Å; T289-C349 WeakPolarHBondContact O-CB 3.27Å; G291-C349 PolarHBondContact N-O 2.68Å; R292-C349 PolarHBondContact O-N 2.86Å; C309-C349 WeakPolarHBondContact CA-SG 3.45Å; C309-C349 HydrophobicContact CB-CB 3.57Å; C309-C349 WeakPolarHBondContact CB-SG 3.03Å; C309-C349 PolarHBondContact N-SG 3.48Å; C309-C349 VanDerWaalsContact N-SG 3.41Å; C309-C349 WeakPolarHBondContact SG-CA 3.42Å; C309-C349 WeakPolarHBondContact SG-CB 3.39Å; C309-C349 CovalentContact SG-SG 2.04Å; C309-C349 PolarHBondContact SG-SG 3.48Å
350	K	93.8	Very high	93.2	Very high	114 Å²	114	72.2 Å²	72.2	50%	0.496	35%	0.352	S	S	.	.			trans	-68	0	174.4	-68.6	-176.3	-179	-178.9	0	112.7	Q290 R312 G313 N315	Q290-K350 WeakPolarHBondContact CG-OXT 3.47Å; Q290-K350 PolarHBondContact NE2-OXT 3.02Å; R312-K350 HydrophobicContact CB-CB 4.5Å; R312-K350 PolarHBondContact NE-O 2.68Å; R312-K350 PolarHBondContact NH2-O 2.96Å; G313-K350 PolarHBondContact O-N 3.41Å; N315-K350 WeakPolarHBondContact OD1-CE 3.39Å

Retrieved 350 of 350 residues in 137.3 ms (Link to these results)

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