A0A087Y6Q6_POEFO Loading...

Serine/threonine-protein phosphatase 2A regulatory subunit B'' subunit gamma

AlphaFold DB , UniProt , Accession A0A087Y6Q6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 458 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	41	Very low	53.9	Low	255 Å²	255	143.6 Å²	143.6	100%	1.256	72%	0.723	S	S	*	*				0	87.9	0	-82.1	178.9	160.6	0	0	108.4
2	A	37.7	Very low	55.3	Low	101 Å²	101	138.2 Å²	138.2	84%	0.835	70%	0.702	S	S	*	*			trans	-113.6	122.8	164.5	0	0	0	0	0	105.3
3	K	39.6	Very low	55.9	Low	209 Å²	209	134.8 Å²	134.8	91%	0.909	69%	0.686	S	S	*	*			trans	-72.9	123.5	177.9	-75.6	175.7	171.9	179.5	0	107.7	E5	K3-E5 PolarHBondContact O-N 3.25Å
4	E	45.8	Very low	57	Low	183 Å²	183	135.4 Å²	135.4	86%	0.855	68%	0.682	S	S	*	*			trans	-64.1	118.9	164.2	-75.9	171.5	147.2	0	0	108.1	D6	E4-D6 PolarHBondContact O-N 2.85Å
5	E	51.1	Low	57.7	Low	183 Å²	183	138.1 Å²	138.1	86%	0.855	68%	0.681	S	S	*	*			trans	-78.8	103.9	166.9	-79	-175.9	158.6	0	0	107.9	K3 T7	K3-E5 PolarHBondContact O-N 3.25Å; E5-T7 PolarHBondContact O-N 3.27Å
6	D	49.1	Very low	58.1	Low	156 Å²	156	141.4 Å²	141.4	83%	0.834	68%	0.683	S	S	*	*			trans	-60.5	100.8	170.5	-85.9	-33.9	0	0	0	109.9	E4 H8	E4-D6 PolarHBondContact O-N 2.85Å; D6-H8 PolarHBondContact O-N 3.47Å
7	T	59.1	Low	58.4	Low	103 Å²	103	138.7 Å²	138.7	63%	0.632	67%	0.672	S	S	*	*			trans	-65.6	104.4	167.7	42.8	0	0	0	0	109.2	E5 W9	E5-T7 PolarHBondContact O-N 3.27Å; T7-W9 PolarHBondContact O-N 2.92Å
8	H	67.5	Low	58.5	Low	107 Å²	107	134.6 Å²	134.6	50%	0.495	66%	0.664	S	S	.	*			trans	-58.1	130.8	179.6	-167.9	-93.3	0	0	0	110.3	D6 S10 D11	D6-H8 PolarHBondContact O-N 3.47Å; H8-S10 WeakPolarHBondContact ND1-CB 3.25Å; H8-S10 PolarHBondContact ND1-OG 3.02Å; H8-S10 PolarHBondContact O-N 3.4Å; H8-D11 PolarHBondContact O-N 3.11Å
9	W	63.8	Low	58.3	Low	178 Å²	178	129.7 Å²	129.7	67%	0.674	65%	0.652	S	S	*	*	H	α-helix	trans	-51.3	-25.4	-174.1	62.1	-90	0	0	0	114	T7 D11 V12 L13	T7-W9 PolarHBondContact O-N 2.92Å; W9-D11 VanDerWaalsContact C-N 3.27Å; W9-D11 PolarHBondContact O-N 3.23Å; W9-V12 PolarHBondContact O-N 3Å; W9-L13 WeakPolarHBondContact O-CB 3.41Å; W9-L13 PolarHBondContact O-N 2.86Å
10	S	67	Low	58	Low	30 Å²	30	129.1 Å²	129.1	21%	0.21	65%	0.651	C	S	.	*	H	α-helix	trans	-62	-31.3	175	64.4	0	0	0	0	113.7	H8 K14	H8-S10 WeakPolarHBondContact ND1-CB 3.25Å; H8-S10 PolarHBondContact ND1-OG 3.02Å; H8-S10 PolarHBondContact O-N 3.4Å; S10-K14 WeakPolarHBondContact O-CB 3.11Å; S10-K14 VanDerWaalsContact O-CG 3.28Å; S10-K14 WeakPolarHBondContact O-CG 3.42Å; S10-K14 PolarHBondContact O-N 2.95Å
11	D	71.5	Confident	57.6	Low	75 Å²	75	132.2 Å²	132.2	40%	0.401	66%	0.66	S	S	.	*	H	α-helix	trans	-83	-30.6	-176.9	-67.2	-19.6	0	0	0	111.7	H8 W9 R15	H8-D11 PolarHBondContact O-N 3.11Å; W9-D11 VanDerWaalsContact C-N 3.27Å; W9-D11 PolarHBondContact O-N 3.23Å; D11-R15 WeakPolarHBondContact O-CB 3.34Å; D11-R15 PolarHBondContact O-N 3.43Å
12	V	70.2	Confident	58.2	Low	78 Å²	78	129.3 Å²	129.3	47%	0.473	64%	0.64	S	S	.	*	H	α-helix	trans	-66.5	-42.6	167.7	-179.9	0	0	0	0	110.1	W9 R15 R16	W9-V12 PolarHBondContact O-N 3Å; V12-R15 PolarHBondContact O-N 3.45Å; V12-R16 WeakPolarHBondContact O-CB 3.29Å; V12-R16 PolarHBondContact O-N 3.15Å
13	L	63.5	Low	59	Low	94 Å²	94	131.4 Å²	131.4	49%	0.492	63%	0.633	S	S	.	*	H	α-helix	trans	-66.9	-41.3	178	-150.1	93.8	0	0	0	112.1	W9 R16 L17	W9-L13 WeakPolarHBondContact O-CB 3.41Å; W9-L13 PolarHBondContact O-N 2.86Å; L13-R16 PolarHBondContact O-N 2.97Å; L13-L17 HydrophobicContact CD2-CD1 4.03Å; L13-L17 HydrophobicContact CG-CD1 4.28Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.17Å; L13-L17 PolarHBondContact O-N 3.29Å
14	K	71.1	Confident	59.7	Low	143 Å²	143	126.9 Å²	126.9	62%	0.622	62%	0.619	S	S	*	*	H	α-helix	trans	-63.1	-39.5	173.9	-79.4	173.8	-176.7	172.2	0	112.1	S10 A18	S10-K14 WeakPolarHBondContact O-CB 3.11Å; S10-K14 VanDerWaalsContact O-CG 3.28Å; S10-K14 WeakPolarHBondContact O-CG 3.42Å; S10-K14 PolarHBondContact O-N 2.95Å; K14-A18 VanDerWaalsContact O-CB 3.23Å; K14-A18 WeakPolarHBondContact O-CB 3.42Å; K14-A18 PolarHBondContact O-N 2.89Å
15	R	68.2	Low	60	Low	177 Å²	177	124 Å²	124	67%	0.668	62%	0.618	S	S	*	*	H	α-helix	trans	-63.7	-41.6	173.8	-114.6	176.6	-87	164.4	-7.5	112	D11 V12 A18 G19	D11-R15 WeakPolarHBondContact O-CB 3.34Å; D11-R15 PolarHBondContact O-N 3.43Å; V12-R15 PolarHBondContact O-N 3.45Å; R15-A18 PolarHBondContact O-N 3.32Å; R15-G19 PolarHBondContact O-N 3Å; R15-G19 VanDerWaalsContact O-N 3.09Å
16	R	63.6	Low	60.3	Low	190 Å²	190	121 Å²	121	72%	0.717	60%	0.599	S	S	*	*	H	α-helix	trans	-70	-40.4	179.1	-152	176.5	-171	177.5	2	112.4	V12 L13 G19 L20	V12-R16 WeakPolarHBondContact O-CB 3.29Å; V12-R16 PolarHBondContact O-N 3.15Å; L13-R16 PolarHBondContact O-N 2.97Å; R16-G19 PolarHBondContact O-N 3.4Å; R16-L20 WeakPolarHBondContact O-CG 3.14Å; R16-L20 PolarHBondContact O-N 3.48Å
17	L	63.3	Low	60.9	Low	96 Å²	96	118.9 Å²	118.9	50%	0.503	59%	0.588	S	S	.	*	H	α-helix	trans	-69.6	-31	174.4	-76.8	164.7	0	0	0	112.8	L13 L20 K21	L13-L17 HydrophobicContact CD2-CD1 4.03Å; L13-L17 HydrophobicContact CG-CD1 4.28Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.17Å; L13-L17 PolarHBondContact O-N 3.29Å; L17-L20 HydrophobicContact CD2-CD1 4.46Å; L17-K21 PolarHBondContact O-N 3.22Å
18	A	59.4	Low	60.9	Low	64 Å²	64	120.9 Å²	120.9	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-70.4	-32.5	172.5	0	0	0	0	0	112.5	K14 R15	K14-A18 VanDerWaalsContact O-CB 3.23Å; K14-A18 WeakPolarHBondContact O-CB 3.42Å; K14-A18 PolarHBondContact O-N 2.89Å; R15-A18 PolarHBondContact O-N 3.32Å
19	G	55.1	Low	60.4	Low	42 Å²	42	122.9 Å²	122.9	43%	0.433	60%	0.599	S	S	.	*	H	α-helix	trans	-69.8	-43	170.8	0	0	0	0	0	113	R15 R16 K21 K22	R15-G19 PolarHBondContact O-N 3Å; R15-G19 VanDerWaalsContact O-N 3.09Å; R16-G19 PolarHBondContact O-N 3.4Å; G19-K21 VanDerWaalsContact C-N 3.29Å; G19-K21 PolarHBondContact O-N 2.85Å; G19-K22 PolarHBondContact O-N 3.31Å
20	L	52.1	Low	60.5	Low	118 Å²	118	119.3 Å²	119.3	62%	0.618	59%	0.59	S	S	*	*	H	α-helix	trans	-64.4	-28	177.7	-78.8	159.9	0	0	0	113.7	R16 L17 K22	R16-L20 WeakPolarHBondContact O-CG 3.14Å; R16-L20 PolarHBondContact O-N 3.48Å; L17-L20 HydrophobicContact CD2-CD1 4.46Å; L20-K22 PolarHBondContact O-N 3.27Å
21	K	49.8	Very low	60.5	Low	195 Å²	195	121.5 Å²	121.5	85%	0.848	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-6.1	174.2	-81.6	-173.6	175.2	-175.4	0	114.1	L17 G19	L17-K21 PolarHBondContact O-N 3.22Å; G19-K21 VanDerWaalsContact C-N 3.29Å; G19-K21 PolarHBondContact O-N 2.85Å
22	K	53.1	Low	60.3	Low	193 Å²	193	124 Å²	124	84%	0.839	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-0.8	-177.2	-124.9	-179.1	-178.8	-175.3	0	114.4	G19 L20	G19-K22 PolarHBondContact O-N 3.31Å; L20-K22 PolarHBondContact O-N 3.27Å
23	E	54.6	Low	60.4	Low	145 Å²	145	122.9 Å²	122.9	68%	0.678	60%	0.602	S	S	*	*	S	Bend	trans	-132.3	84	175.4	-76.2	-176.2	153.3	0	0	109.5
24	D	55.3	Low	61	Low	115 Å²	115	122.5 Å²	122.5	62%	0.615	60%	0.598	S	S	*	*				-176	81.2	125.2	-130.6	-9.9	0	0	0	110.4	K31	D24-K31 WeakPolarHBondContact OD1-CE 3.11Å; D24-K31 IonicContact OD1-NZ 2.74Å; D24-K31 PolarHBondContact OD1-NZ 3.33Å; D24-K31 IonicContact OD2-NZ 2.77Å; D24-K31 PolarHBondContact OD2-NZ 3.43Å
25	S	51.5	Low	61.1	Low	121 Å²	121	122 Å²	122	85%	0.846	60%	0.598	S	S	*	*			trans	-125.8	32.8	167.4	72	0	0	0	0	110.5
26	R	58.3	Low	61.2	Low	122 Å²	122	117.5 Å²	117.5	46%	0.46	59%	0.59	S	S	.	*			trans	-107.5	132.1	178.3	-61.7	-173.4	-153.1	171.3	10.1	108.9	E30 E34	R26-E30 VanDerWaalsContact CA-OE2 3.29Å; R26-E30 WeakPolarHBondContact CA-OE2 3.3Å; R26-E30 HydrophobicContact CB-CB 4.5Å; R26-E30 WeakPolarHBondContact CB-OE2 3.43Å; R26-E34 IonicContact NH1-OE1 3.6Å; R26-E34 PolarHBondContact NH1-OE1 2.66Å; R26-E34 IonicContact NH1-OE2 3.16Å
27	N	61.1	Low	61.7	Low	110 Å²	110	115.2 Å²	115.2	59%	0.588	59%	0.588	S	S	*	*			trans	-64.3	149.9	-176.7	-124.2	3.5	0	0	0	109.8	E29 E30 K31	N27-E29 PolarHBondContact O-N 2.86Å; N27-E29 VanDerWaalsContact O-N 3.08Å; N27-E30 HydrophobicContact CB-CG 4.31Å; N27-E30 PolarHBondContact N-OE2 2.91Å; N27-E30 VanDerWaalsContact N-OE2 3.12Å; N27-E30 WeakPolarHBondContact O-CB 3.38Å; N27-E30 PolarHBondContact O-N 2.92Å; N27-K31 PolarHBondContact O-N 3.33Å
28	E	58.4	Low	62.5	Low	146 Å²	146	114.8 Å²	114.8	68%	0.682	59%	0.585	S	S	*	*	H	α-helix	trans	-55.6	-29.2	176.3	-81.7	-156.5	167.7	0	0	112.8	K31 K32	E28-K31 PolarHBondContact O-N 3.48Å; E28-K32 WeakPolarHBondContact O-CG 3.45Å; E28-K32 PolarHBondContact O-N 3.45Å
29	E	58.8	Low	63.3	Low	148 Å²	148	118.4 Å²	118.4	69%	0.692	59%	0.589	S	S	*	*	H	α-helix	trans	-66.2	-36.7	174.4	-71.2	180	154.3	0	0	113	N27 K32 A33	N27-E29 PolarHBondContact O-N 2.86Å; N27-E29 VanDerWaalsContact O-N 3.08Å; E29-K32 PolarHBondContact O-N 2.54Å; E29-A33 WeakPolarHBondContact O-CB 3.31Å; E29-A33 PolarHBondContact O-N 3.39Å
30	E	64.2	Low	64	Low	103 Å²	103	120 Å²	120	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-70.7	-37.3	177.4	-67.2	177.2	151.2	0	0	110.9	R26 N27 A33 E34	R26-E30 VanDerWaalsContact CA-OE2 3.29Å; R26-E30 WeakPolarHBondContact CA-OE2 3.3Å; R26-E30 HydrophobicContact CB-CB 4.5Å; R26-E30 WeakPolarHBondContact CB-OE2 3.43Å; N27-E30 HydrophobicContact CB-CG 4.31Å; N27-E30 PolarHBondContact N-OE2 2.91Å; N27-E30 VanDerWaalsContact N-OE2 3.12Å; N27-E30 WeakPolarHBondContact O-CB 3.38Å; N27-E30 PolarHBondContact O-N 2.92Å; E30-A33 PolarHBondContact O-N 3.49Å; E30-E34 PolarHBondContact O-N 2.65Å
31	K	68.5	Low	65.2	Low	76 Å²	76	119.9 Å²	119.9	33%	0.33	59%	0.585	S	S	.	*	H	α-helix	trans	-65.1	-43.7	174.1	-66.4	-176.1	-179.3	-179.9	0	111.5	D24 N27 E28 A33 E34 E35	D24-K31 WeakPolarHBondContact OD1-CE 3.11Å; D24-K31 IonicContact OD1-NZ 2.74Å; D24-K31 PolarHBondContact OD1-NZ 3.33Å; D24-K31 IonicContact OD2-NZ 2.77Å; D24-K31 PolarHBondContact OD2-NZ 3.43Å; N27-K31 PolarHBondContact O-N 3.33Å; E28-K31 PolarHBondContact O-N 3.48Å; K31-A33 VanDerWaalsContact C-N 3.33Å; K31-A33 PolarHBondContact O-N 2.8Å; K31-E34 PolarHBondContact O-N 3.34Å; K31-E35 WeakPolarHBondContact O-CB 3.44Å; K31-E35 WeakPolarHBondContact O-CG 3.16Å; K31-E35 PolarHBondContact O-N 2.96Å
32	K	67.4	Low	66.3	Low	127 Å²	127	117.4 Å²	117.4	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-63.4	-38.6	173.8	-76.3	179.5	-177.6	172	0	111.8	E28 E29 E35 T36	E28-K32 WeakPolarHBondContact O-CG 3.45Å; E28-K32 PolarHBondContact O-N 3.45Å; E29-K32 PolarHBondContact O-N 2.54Å; K32-E35 PolarHBondContact O-N 2.79Å; K32-T36 WeakPolarHBondContact O-CB 3.24Å; K32-T36 PolarHBondContact O-N 2.94Å; K32-T36 PolarHBondContact O-OG1 3.14Å
33	A	71.2	Confident	67.1	Low	55 Å²	55	113.4 Å²	113.4	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-64.7	-45.5	176.2	0	0	0	0	0	111.8	E29 E30 K31 T36 E37	E29-A33 WeakPolarHBondContact O-CB 3.31Å; E29-A33 PolarHBondContact O-N 3.39Å; E30-A33 PolarHBondContact O-N 3.49Å; K31-A33 VanDerWaalsContact C-N 3.33Å; K31-A33 PolarHBondContact O-N 2.8Å; A33-T36 PolarHBondContact O-N 3.18Å; A33-E37 PolarHBondContact O-N 3.45Å
34	E	75.6	Confident	67.4	Low	87 Å²	87	109 Å²	109	41%	0.407	54%	0.538	S	S	.	.	H	α-helix	trans	-61.9	-42.8	174.3	-83.8	-178.6	164.4	0	0	111.8	R26 E30 K31 T36 E37 L38	R26-E34 IonicContact NH1-OE1 3.6Å; R26-E34 PolarHBondContact NH1-OE1 2.66Å; R26-E34 IonicContact NH1-OE2 3.16Å; E30-E34 PolarHBondContact O-N 2.65Å; K31-E34 PolarHBondContact O-N 3.34Å; E34-T36 VanDerWaalsContact C-N 3.3Å; E34-T36 PolarHBondContact O-N 2.84Å; E34-E37 PolarHBondContact O-N 3.28Å; E34-L38 WeakPolarHBondContact O-CB 3.28Å; E34-L38 WeakPolarHBondContact O-CD1 3.5Å; E34-L38 WeakPolarHBondContact O-CG 3.37Å; E34-L38 PolarHBondContact O-N 3.1Å
35	E	73.2	Confident	68	Low	132 Å²	132	108.6 Å²	108.6	62%	0.617	53%	0.532	S	S	*	.	H	α-helix	trans	-61.3	-39.8	174	-78.8	-178.6	171.6	0	0	111.8	K31 K32 F39	K31-E35 WeakPolarHBondContact O-CB 3.44Å; K31-E35 WeakPolarHBondContact O-CG 3.16Å; K31-E35 PolarHBondContact O-N 2.96Å; K32-E35 PolarHBondContact O-N 2.79Å; E35-F39 WeakPolarHBondContact O-CB 3.22Å; E35-F39 PolarHBondContact O-N 3.26Å
36	T	70.9	Confident	68.7	Low	82 Å²	82	112 Å²	112	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-69	-38.3	177.6	-47.9	0	0	0	0	111.1	K32 A33 E34 T40	K32-T36 WeakPolarHBondContact O-CB 3.24Å; K32-T36 PolarHBondContact O-N 2.94Å; K32-T36 PolarHBondContact O-OG1 3.14Å; A33-T36 PolarHBondContact O-N 3.18Å; E34-T36 VanDerWaalsContact C-N 3.3Å; E34-T36 PolarHBondContact O-N 2.84Å; T36-T40 VanDerWaalsContact O-CB 3.3Å; T36-T40 WeakPolarHBondContact O-CB 3.48Å; T36-T40 PolarHBondContact O-N 3.24Å; T36-T40 PolarHBondContact O-OG1 3.41Å
37	E	75	Confident	68.7	Low	143 Å²	143	112.7 Å²	112.7	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-66	-46.7	173.9	-95.5	-171.2	154.4	0	0	111.8	A33 E34 T40 K41	A33-E37 PolarHBondContact O-N 3.45Å; E34-E37 PolarHBondContact O-N 3.28Å; E37-T40 PolarHBondContact O-N 3.46Å; E37-K41 WeakPolarHBondContact O-CB 3.41Å; E37-K41 PolarHBondContact O-N 2.98Å
38	L	78.6	Confident	68.1	Low	86 Å²	86	111 Å²	111	45%	0.45	53%	0.525	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.8	-81.3	158.4	0	0	0	110.8	E34 K41 Y42	E34-L38 WeakPolarHBondContact O-CB 3.28Å; E34-L38 WeakPolarHBondContact O-CD1 3.5Å; E34-L38 WeakPolarHBondContact O-CG 3.37Å; E34-L38 PolarHBondContact O-N 3.1Å; L38-K41 PolarHBondContact O-N 3.4Å; L38-Y42 HydrophobicContact CB-CE2 4.45Å; L38-Y42 HydrophobicContact CD2-CE2 3.82Å; L38-Y42 WeakPolarHBondContact O-CD2 3.46Å; L38-Y42 PolarHBondContact O-N 3.32Å
39	F	75.9	Confident	67.7	Low	140 Å²	140	106.9 Å²	106.9	61%	0.614	52%	0.521	S	S	*	.	H	α-helix	trans	-58.8	-47.7	173.7	178.2	-95.1	0	0	0	111.2	E35 K41 Y42 Y43	E35-F39 WeakPolarHBondContact O-CB 3.22Å; E35-F39 PolarHBondContact O-N 3.26Å; F39-K41 VanDerWaalsContact C-N 3.31Å; F39-K41 PolarHBondContact O-N 2.95Å; F39-Y42 PolarHBondContact O-N 3.46Å; F39-Y43 HydrophobicContact CZ-CD2 4.43Å; F39-Y43 WeakPolarHBondContact O-CB 3.26Å; F39-Y43 PolarHBondContact O-N 3.07Å
40	T	70.4	Confident	67.3	Low	77 Å²	77	104.3 Å²	104.3	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-62.3	-39.9	178.9	-57.4	0	0	0	0	111.4	T36 E37 S44	T36-T40 VanDerWaalsContact O-CB 3.3Å; T36-T40 WeakPolarHBondContact O-CB 3.48Å; T36-T40 PolarHBondContact O-N 3.24Å; T36-T40 PolarHBondContact O-OG1 3.41Å; E37-T40 PolarHBondContact O-N 3.46Å; T40-S44 VanDerWaalsContact O-CB 3.24Å; T40-S44 WeakPolarHBondContact O-CB 3.48Å; T40-S44 PolarHBondContact O-N 2.9Å; T40-S44 PolarHBondContact O-OG 2.87Å
41	K	76.9	Confident	66.8	Low	114 Å²	114	105.6 Å²	105.6	50%	0.496	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-52.5	176.8	-174.7	-177.8	175.8	-174.5	0	111.7	E37 L38 F39 Y43 S44 E45	E37-K41 WeakPolarHBondContact O-CB 3.41Å; E37-K41 PolarHBondContact O-N 2.98Å; L38-K41 PolarHBondContact O-N 3.4Å; F39-K41 VanDerWaalsContact C-N 3.31Å; F39-K41 PolarHBondContact O-N 2.95Å; K41-Y43 VanDerWaalsContact C-N 3.34Å; K41-Y43 PolarHBondContact O-N 2.97Å; K41-S44 WeakPolarHBondContact CA-OG 3.26Å; K41-S44 PolarHBondContact O-N 3.31Å; K41-S44 PolarHBondContact O-OG 2.98Å; K41-E45 WeakPolarHBondContact CE-OE1 3.25Å; K41-E45 WeakPolarHBondContact O-CB 3.39Å; K41-E45 WeakPolarHBondContact O-CG 3.41Å; K41-E45 PolarHBondContact O-N 3.08Å
42	Y	73.9	Confident	66.2	Low	143 Å²	143	107.9 Å²	107.9	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-67.2	-35.9	179	-71.5	-59.7	0	0	0	112.4	L38 F39 W46	L38-Y42 HydrophobicContact CB-CE2 4.45Å; L38-Y42 HydrophobicContact CD2-CE2 3.82Å; L38-Y42 WeakPolarHBondContact O-CD2 3.46Å; L38-Y42 PolarHBondContact O-N 3.32Å; F39-Y42 PolarHBondContact O-N 3.46Å; Y42-W46 VanDerWaalsContact O-CB 3.24Å; Y42-W46 WeakPolarHBondContact O-CB 3.3Å; Y42-W46 PolarHBondContact O-N 3.15Å
43	Y	68.4	Low	65.9	Low	110 Å²	110	106.3 Å²	106.3	43%	0.431	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-43.5	174.5	-178.3	-97.4	0	0	0	111.6	F39 K41 W46 R47	F39-Y43 HydrophobicContact CZ-CD2 4.43Å; F39-Y43 WeakPolarHBondContact O-CB 3.26Å; F39-Y43 PolarHBondContact O-N 3.07Å; K41-Y43 VanDerWaalsContact C-N 3.34Å; K41-Y43 PolarHBondContact O-N 2.97Å; Y43-W46 HydrophobicContact CD2-CE3 4.37Å; Y43-W46 HydrophobicContact CE2-CE3 4.33Å; Y43-W46 HydrophobicContact CE2-CZ3 4.27Å; Y43-W46 PolarHBondContact O-N 3.15Å; Y43-R47 HydrophobicContact CE1-CG 4.15Å; Y43-R47 WeakPolarHBondContact O-CB 3.48Å; Y43-R47 PolarHBondContact O-N 3.48Å
44	S	62.4	Low	65.8	Low	53 Å²	53	110.4 Å²	110.4	37%	0.371	55%	0.55	S	S	.	.	H	α-helix	trans	-68.9	-39	176.7	52.4	0	0	0	0	112.5	T40 K41 R47 C48	T40-S44 VanDerWaalsContact O-CB 3.24Å; T40-S44 WeakPolarHBondContact O-CB 3.48Å; T40-S44 PolarHBondContact O-N 2.9Å; T40-S44 PolarHBondContact O-OG 2.87Å; K41-S44 WeakPolarHBondContact CA-OG 3.26Å; K41-S44 PolarHBondContact O-N 3.31Å; K41-S44 PolarHBondContact O-OG 2.98Å; S44-R47 PolarHBondContact O-N 3.33Å; S44-C48 VanDerWaalsContact O-CB 3.26Å; S44-C48 WeakPolarHBondContact O-CB 3.43Å; S44-C48 PolarHBondContact O-N 3.1Å; S44-C48 PolarHBondContact O-SG 3.09Å; S44-C48 VanDerWaalsContact O-SG 3.41Å
45	E	67.6	Low	65.5	Low	105 Å²	105	108.8 Å²	108.8	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-62.3	-42.4	171.8	-74.8	174.3	-175.5	0	0	111.8	K41 C48 G49	K41-E45 WeakPolarHBondContact CE-OE1 3.25Å; K41-E45 WeakPolarHBondContact O-CB 3.39Å; K41-E45 WeakPolarHBondContact O-CG 3.41Å; K41-E45 PolarHBondContact O-N 3.08Å; E45-C48 PolarHBondContact O-N 3.25Å; E45-G49 PolarHBondContact O-N 3.11Å
46	W	66.2	Low	65.2	Low	192 Å²	192	108 Å²	108	73%	0.727	54%	0.54	S	S	*	.	H	α-helix	trans	-65.4	-40.8	174.7	-177.7	72.2	0	0	0	112.6	Y42 Y43 G49	Y42-W46 VanDerWaalsContact O-CB 3.24Å; Y42-W46 WeakPolarHBondContact O-CB 3.3Å; Y42-W46 PolarHBondContact O-N 3.15Å; Y43-W46 HydrophobicContact CD2-CE3 4.37Å; Y43-W46 HydrophobicContact CE2-CE3 4.33Å; Y43-W46 HydrophobicContact CE2-CZ3 4.27Å; Y43-W46 PolarHBondContact O-N 3.15Å; W46-G49 PolarHBondContact O-N 3.17Å
47	R	57.7	Low	65.4	Low	137 Å²	137	111.9 Å²	111.9	52%	0.517	55%	0.55	S	S	.	*	H	α-helix	trans	-64.6	-42.7	174	-112.2	-96.4	-160.7	158.9	4.6	112.5	Y43 S44 G49 V50 E51	Y43-R47 HydrophobicContact CE1-CG 4.15Å; Y43-R47 WeakPolarHBondContact O-CB 3.48Å; Y43-R47 PolarHBondContact O-N 3.48Å; S44-R47 PolarHBondContact O-N 3.33Å; R47-G49 PolarHBondContact O-N 3.49Å; R47-V50 PolarHBondContact O-N 2.99Å; R47-V50 VanDerWaalsContact O-N 3.13Å; R47-E51 IonicContact NH1-OE1 3.66Å
48	C	48.4	Very low	65.5	Low	75 Å²	75	111 Å²	111	51%	0.507	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-21	-179.5	-85.8	0	0	0	0	113.1	S44 E45 V50 E51	S44-C48 VanDerWaalsContact O-CB 3.26Å; S44-C48 WeakPolarHBondContact O-CB 3.43Å; S44-C48 PolarHBondContact O-N 3.1Å; S44-C48 PolarHBondContact O-SG 3.09Å; S44-C48 VanDerWaalsContact O-SG 3.41Å; E45-C48 PolarHBondContact O-N 3.25Å; C48-V50 PolarHBondContact O-N 3.44Å; C48-V50 VanDerWaalsContact O-N 3.11Å; C48-E51 PolarHBondContact O-N 3.31Å
49	G	50.2	Low	65.5	Low	59 Å²	59	111.7 Å²	111.7	61%	0.608	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-17	171.3	0	0	0	0	0	114.2	E45 W46 R47	E45-G49 PolarHBondContact O-N 3.11Å; W46-G49 PolarHBondContact O-N 3.17Å; R47-G49 PolarHBondContact O-N 3.49Å
50	V	51.1	Low	65.5	Low	95 Å²	95	109.8 Å²	109.8	58%	0.576	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-10	-178.5	-168.8	0	0	0	0	112.6	R47 C48	R47-V50 PolarHBondContact O-N 2.99Å; R47-V50 VanDerWaalsContact O-N 3.13Å; C48-V50 PolarHBondContact O-N 3.44Å; C48-V50 VanDerWaalsContact O-N 3.11Å
51	E	53.6	Low	65.5	Low	129 Å²	129	111.3 Å²	111.3	60%	0.603	56%	0.557	S	S	*	*			trans	-106.6	48.4	-174.1	-68.1	-175.5	179.8	0	0	112.9	R47 C48	R47-E51 IonicContact NH1-OE1 3.66Å; C48-E51 PolarHBondContact O-N 3.31Å
52	T	55.5	Low	65.4	Low	124 Å²	124	114.4 Å²	114.4	76%	0.761	57%	0.57	S	S	*	*			trans	-104.5	4.3	-180	45.6	0	0	0	0	114.9
53	D	61.2	Low	65.5	Low	95 Å²	95	114.9 Å²	114.9	51%	0.508	57%	0.572	S	S	.	*			trans	-92.6	112	-179.4	-135.8	-41.6	0	0	0	110.6	S55 Y56	D53-S55 VanDerWaalsContact CG-OG 3.26Å; D53-S55 PolarHBondContact O-N 3.31Å; D53-S55 PolarHBondContact OD1-OG 3.18Å; D53-Y56 HydrophobicContact CB-CD2 3.51Å; D53-Y56 HydrophobicContact CB-CE2 3.63Å; D53-Y56 PolarHBondContact O-N 2.76Å
54	E	68.4	Low	65.8	Low	140 Å²	140	116.6 Å²	116.6	65%	0.654	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-57.2	-23.8	179	-73.5	-130.9	120.7	0	0	112.9	Y56 K57	E54-Y56 PolarHBondContact O-N 3.45Å; E54-K57 WeakPolarHBondContact O-CB 3.27Å; E54-K57 PolarHBondContact O-N 3.37Å; E54-K57 VanDerWaalsContact O-N 3.15Å; E54-K57 IonicContact OE1-NZ 2.79Å; E54-K57 PolarHBondContact OE1-NZ 3.05Å
55	S	70.3	Confident	66.4	Low	54 Å²	54	122 Å²	122	38%	0.378	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-58	-32.3	175.5	57.4	0	0	0	0	113	D53 K57 T58 I59	D53-S55 VanDerWaalsContact CG-OG 3.26Å; D53-S55 PolarHBondContact O-N 3.31Å; D53-S55 PolarHBondContact OD1-OG 3.18Å; S55-K57 PolarHBondContact O-N 3.2Å; S55-T58 PolarHBondContact O-N 3.14Å; S55-T58 VanDerWaalsContact O-N 3.09Å; S55-I59 PolarHBondContact O-N 3.09Å
56	Y	66.9	Low	66.9	Low	115 Å²	115	119.3 Å²	119.3	45%	0.451	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-70.2	-14.6	178.8	-69.9	-63	0	0	0	114.5	D53 E54 T58 I59 R61	D53-Y56 HydrophobicContact CB-CD2 3.51Å; D53-Y56 HydrophobicContact CB-CE2 3.63Å; D53-Y56 PolarHBondContact O-N 2.76Å; E54-Y56 PolarHBondContact O-N 3.45Å; Y56-T58 VanDerWaalsContact C-N 3.26Å; Y56-I59 WeakPolarHBondContact CA-O 3.42Å; Y56-R61 HydrophobicContact CD1-CB 3.9Å; Y56-R61 HydrophobicContact CE1-CB 3.71Å; Y56-R61 HydrophobicContact CE1-CG 3.96Å
57	K	73.7	Confident	67.5	Low	164 Å²	164	111.7 Å²	111.7	71%	0.713	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-69.1	-27.5	171	-63.1	176.1	-178.4	170.2	0	111.9	E54 S55	E54-K57 WeakPolarHBondContact O-CB 3.27Å; E54-K57 PolarHBondContact O-N 3.37Å; E54-K57 VanDerWaalsContact O-N 3.15Å; E54-K57 IonicContact OE1-NZ 2.79Å; E54-K57 PolarHBondContact OE1-NZ 3.05Å; S55-K57 PolarHBondContact O-N 3.2Å
58	T	78.6	Confident	68.3	Low	125 Å²	125	107.3 Å²	107.3	77%	0.767	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-39	-176.3	-43.2	0	0	0	0	111.8	S55 Y56	S55-T58 PolarHBondContact O-N 3.14Å; S55-T58 VanDerWaalsContact O-N 3.09Å; Y56-T58 VanDerWaalsContact C-N 3.26Å
59	I	77.6	Confident	69.4	Low	100 Å²	100	112.2 Å²	112.2	51%	0.513	57%	0.568	S	S	.	*	S	Bend	trans	-113.9	108.1	179.5	-58	174.7	0	0	0	107.9	S55 Y56 F62	S55-I59 PolarHBondContact O-N 3.09Å; Y56-I59 WeakPolarHBondContact CA-O 3.42Å; I59-F62 HydrophobicContact CG2-CD1 4.19Å; I59-F62 HydrophobicContact CG2-CE1 4.3Å
60	P	75.8	Confident	70.7	Confident	100 Å²	100	115.8 Å²	115.8	65%	0.649	57%	0.574	S	S	*	*			trans	-61.2	145.1	177.4	25.7	-32.4	0	0	0	109.7	F62	P60-F62 PolarHBondContact O-N 3.23Å
61	R	72	Confident	72.2	Confident	108 Å²	108	115.3 Å²	115.3	41%	0.408	57%	0.565	S	S	.	*			trans	-59.1	110.6	175.9	-173.8	174.8	-179.7	174.8	4.5	109.8	Y56 Y63 Y64	Y56-R61 HydrophobicContact CD1-CB 3.9Å; Y56-R61 HydrophobicContact CE1-CB 3.71Å; Y56-R61 HydrophobicContact CE1-CG 3.96Å; R61-Y63 PolarHBondContact NE-O 3.21Å; R61-Y63 VanDerWaalsContact NE-O 3.17Å; R61-Y64 HydrophobicContact CG-CE1 4.18Å; R61-Y64 WeakPolarHBondContact O-CE2 3.41Å; R61-Y64 PolarHBondContact O-OH 3.47Å
62	F	74.7	Confident	73.5	Confident	179 Å²	179	112.9 Å²	112.9	79%	0.785	56%	0.559	S	S	*	*			trans	-100.3	-15.5	-177.4	62.2	-92	0	0	0	113.1	I59 P60	I59-F62 HydrophobicContact CG2-CD1 4.19Å; I59-F62 HydrophobicContact CG2-CE1 4.3Å; P60-F62 PolarHBondContact O-N 3.23Å
63	Y	76.3	Confident	74.8	Confident	154 Å²	154	114.3 Å²	114.3	60%	0.604	56%	0.561	S	S	*	*			trans	-118.9	127	177.9	-177.5	-102.8	0	0	0	111.7	R61 K65	R61-Y63 PolarHBondContact NE-O 3.21Å; R61-Y63 VanDerWaalsContact NE-O 3.17Å; Y63-K65 HydrophobicContact CE1-CB 4.04Å
64	Y	73.1	Confident	75.7	Confident	146 Å²	146	113.8 Å²	113.8	57%	0.573	56%	0.558	S	S	*	*			trans	-116.6	111.9	174.1	-63.3	-89.1	0	0	0	107.5	R61 L66	R61-Y64 HydrophobicContact CG-CE1 4.18Å; R61-Y64 WeakPolarHBondContact O-CE2 3.41Å; R61-Y64 PolarHBondContact O-OH 3.47Å; Y64-L66 PolarHBondContact O-N 3.23Å
65	K	75.6	Confident	76.2	Confident	165 Å²	165	109.9 Å²	109.9	72%	0.717	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-61.2	132.8	175.8	-168.2	-178.2	177.2	-172.8	0	108.6	Y63	Y63-K65 HydrophobicContact CE1-CB 4.04Å
66	L	78.2	Confident	76.7	Confident	50 Å²	50	113.3 Å²	113.3	26%	0.262	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-71.9	147	174.4	-66.4	-179.1	0	0	0	110.4	Y64 A186 Q188	Y64-L66 PolarHBondContact O-N 3.23Å; L66-A186 HydrophobicContact CD1-CB 4.38Å; L66-Q188 VanDerWaalsContact CD1-CD 3.48Å; L66-Q188 HydrophobicContact CD1-CG 3.93Å
67	P	77.9	Confident	77.5	Confident	32 Å²	32	113.4 Å²	113.4	21%	0.208	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-55.3	140.2	168.9	-20.5	32	0	0	0	110.2	E71 L74 Q75	P67-E71 WeakPolarHBondContact CA-OE2 3.47Å; P67-E71 HydrophobicContact CB-CB 4.23Å; P67-L74 HydrophobicContact CB-CB 3.8Å; P67-L74 HydrophobicContact CG-CB 3.87Å; P67-Q75 HydrophobicContact CB-CG 4.08Å
68	A	75.3	Confident	77.9	Confident	45 Å²	45	109.1 Å²	109.1	37%	0.372	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-73.9	163.6	176.3	0	0	0	0	0	110.8	D70 E71 Q75	A68-D70 WeakPolarHBondContact CB-OD1 3.41Å; A68-D70 PolarHBondContact O-N 3.08Å; A68-E71 PolarHBondContact N-OE2 2.62Å; A68-E71 PolarHBondContact O-N 3.26Å; A68-Q75 PolarHBondContact O-NE2 2.97Å
69	E	70.9	Confident	78	Confident	177 Å²	177	106.9 Å²	106.9	83%	0.827	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.9	-174.7	-67.9	-175.6	172.9	0	0	113.7	E71	E69-E71 VanDerWaalsContact C-N 3.3Å
70	D	78.8	Confident	78.3	Confident	135 Å²	135	108.2 Å²	108.2	72%	0.722	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.3	173.2	55.2	-38.4	0	0	0	113.4	A68 V72	A68-D70 WeakPolarHBondContact CB-OD1 3.41Å; A68-D70 PolarHBondContact O-N 3.08Å; D70-V72 PolarHBondContact O-N 3.42Å
71	E	82.6	Confident	78.7	Confident	84 Å²	84	106.5 Å²	106.5	39%	0.393	51%	0.51	S	S	.	.			trans	-95.3	57.8	-177.1	-61.5	-178.4	156.1	0	0	112.8	P67 A68 E69 L73 L74 Q75	P67-E71 WeakPolarHBondContact CA-OE2 3.47Å; P67-E71 HydrophobicContact CB-CB 4.23Å; A68-E71 PolarHBondContact N-OE2 2.62Å; A68-E71 PolarHBondContact O-N 3.26Å; E69-E71 VanDerWaalsContact C-N 3.3Å; E71-L73 VanDerWaalsContact C-N 3.26Å; E71-L73 PolarHBondContact O-N 3.08Å; E71-L73 VanDerWaalsContact O-N 3.11Å; E71-L74 HydrophobicContact CB-CB 4.2Å; E71-L74 HydrophobicContact CB-CD1 4.13Å; E71-L74 HydrophobicContact CG-CD1 4.38Å; E71-L74 PolarHBondContact O-N 2.99Å; E71-L74 WeakPolarHBondContact OE2-CD1 3.26Å; E71-Q75 PolarHBondContact O-N 3.14Å; E71-Q75 VanDerWaalsContact O-N 3.11Å
72	V	80.5	Confident	79.3	Confident	79 Å²	79	103.7 Å²	103.7	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-51.9	-39.1	-174	-178.1	0	0	0	0	113.7	D70 Q75 K76	D70-V72 PolarHBondContact O-N 3.42Å; V72-Q75 PolarHBondContact O-N 3Å; V72-K76 HydrophobicContact CG1-CD 4.4Å; V72-K76 WeakPolarHBondContact O-CG 3.42Å; V72-K76 PolarHBondContact O-N 3.45Å
73	L	82.6	Confident	79.7	Confident	153 Å²	153	97.2 Å²	97.2	80%	0.801	48%	0.48	S	S	*	.	H	α-helix	trans	-66.7	-39.3	179.1	-76	169.6	0	0	0	112.6	E71 L77	E71-L73 VanDerWaalsContact C-N 3.26Å; E71-L73 PolarHBondContact O-N 3.08Å; E71-L73 VanDerWaalsContact O-N 3.11Å; L73-L77 VanDerWaalsContact O-CB 3.3Å; L73-L77 WeakPolarHBondContact O-CB 3.17Å; L73-L77 PolarHBondContact O-N 3.36Å
74	L	80.3	Confident	80.2	Confident	84 Å²	84	94 Å²	94	44%	0.44	48%	0.476	S	S	.	.	H	α-helix	trans	-71.9	-33.8	178.8	-72.5	173.9	0	0	0	111.3	P67 E71 R78	P67-L74 HydrophobicContact CB-CB 3.8Å; P67-L74 HydrophobicContact CG-CB 3.87Å; E71-L74 HydrophobicContact CB-CB 4.2Å; E71-L74 HydrophobicContact CB-CD1 4.13Å; E71-L74 HydrophobicContact CG-CD1 4.38Å; E71-L74 PolarHBondContact O-N 2.99Å; E71-L74 WeakPolarHBondContact OE2-CD1 3.26Å; L74-R78 VanDerWaalsContact O-CB 3.31Å; L74-R78 WeakPolarHBondContact O-CB 3.39Å; L74-R78 PolarHBondContact O-N 3.26Å
75	Q	79.1	Confident	80.9	Confident	58 Å²	58	92.8 Å²	92.8	27%	0.271	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-52.1	172.1	-67.9	-173.2	-21.3	0	0	111.4	P67 A68 E71 V72 L77 R78 E79	P67-Q75 HydrophobicContact CB-CG 4.08Å; A68-Q75 PolarHBondContact O-NE2 2.97Å; E71-Q75 PolarHBondContact O-N 3.14Å; E71-Q75 VanDerWaalsContact O-N 3.11Å; V72-Q75 PolarHBondContact O-N 3Å; Q75-L77 PolarHBondContact O-N 3.46Å; Q75-R78 WeakPolarHBondContact O-CA 3.09Å; Q75-R78 WeakPolarHBondContact O-CB 3.38Å; Q75-R78 PolarHBondContact O-N 3.46Å; Q75-R78 VanDerWaalsContact O-N 3.08Å; Q75-E79 WeakPolarHBondContact O-CG 3.22Å; Q75-E79 PolarHBondContact O-N 3.46Å
76	K	81.1	Confident	81.3	Confident	127 Å²	127	85.8 Å²	85.8	55%	0.552	44%	0.444	S	S	*	.	H	α-helix	trans	-61.2	-41.6	177.7	-73.1	-172.4	175.6	-171.5	0	113	V72 R78 E79 E80	V72-K76 HydrophobicContact CG1-CD 4.4Å; V72-K76 WeakPolarHBondContact O-CG 3.42Å; V72-K76 PolarHBondContact O-N 3.45Å; K76-R78 VanDerWaalsContact C-N 3.27Å; K76-R78 PolarHBondContact O-N 3.02Å; K76-E79 PolarHBondContact O-N 2.92Å; K76-E80 WeakPolarHBondContact O-CG 3.4Å; K76-E80 PolarHBondContact O-N 3.4Å
77	L	84.2	Confident	81.7	Confident	117 Å²	117	88.3 Å²	88.3	61%	0.613	45%	0.454	S	S	*	.	H	α-helix	trans	-60.5	-40.6	175.3	-179	66.6	0	0	0	111.2	L73 Q75 S81	L73-L77 VanDerWaalsContact O-CB 3.3Å; L73-L77 WeakPolarHBondContact O-CB 3.17Å; L73-L77 PolarHBondContact O-N 3.36Å; Q75-L77 PolarHBondContact O-N 3.46Å; L77-S81 VanDerWaalsContact O-CB 3.23Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3.43Å; L77-S81 PolarHBondContact O-OG 2.95Å
78	R	81.6	Confident	82.2	Confident	73 Å²	73	95.2 Å²	95.2	28%	0.275	48%	0.476	S	S	.	.	H	α-helix	trans	-65	-47.4	176.9	-176.4	-176.1	177.7	94.8	2.4	111	L74 Q75 K76 S81 R82 A186	L74-R78 VanDerWaalsContact O-CB 3.31Å; L74-R78 WeakPolarHBondContact O-CB 3.39Å; L74-R78 PolarHBondContact O-N 3.26Å; Q75-R78 WeakPolarHBondContact O-CA 3.09Å; Q75-R78 WeakPolarHBondContact O-CB 3.38Å; Q75-R78 PolarHBondContact O-N 3.46Å; Q75-R78 VanDerWaalsContact O-N 3.08Å; K76-R78 VanDerWaalsContact C-N 3.27Å; K76-R78 PolarHBondContact O-N 3.02Å; R78-S81 WeakPolarHBondContact CA-OG 3.29Å; R78-S81 PolarHBondContact O-N 3.23Å; R78-S81 PolarHBondContact O-OG 3.29Å; R78-R82 WeakPolarHBondContact O-CB 3.36Å; R78-R82 VanDerWaalsContact O-CG 3.24Å; R78-R82 WeakPolarHBondContact O-CG 3.22Å; R78-R82 PolarHBondContact O-N 3.4Å; R78-A186 PolarHBondContact NE-O 2.96Å; R78-A186 PolarHBondContact NH2-O 3.48Å
79	E	81.2	Confident	82.7	Confident	79 Å²	79	96.7 Å²	96.7	37%	0.369	47%	0.474	S	S	.	.	H	α-helix	trans	-54.8	-53.3	176	-71.9	166	-175.9	0	0	111.2	Q75 K76 S81 R82 A83 V185	Q75-E79 WeakPolarHBondContact O-CG 3.22Å; Q75-E79 PolarHBondContact O-N 3.46Å; K76-E79 PolarHBondContact O-N 2.92Å; E79-S81 PolarHBondContact O-N 3.29Å; E79-R82 PolarHBondContact O-N 3.09Å; E79-R82 VanDerWaalsContact O-N 3.14Å; E79-A83 PolarHBondContact O-N 3.3Å; E79-V185 HydrophobicContact CG-CG1 4.24Å; E79-V185 WeakPolarHBondContact OE1-CG1 3.38Å
80	E	83.5	Confident	83.5	Confident	127 Å²	127	90.8 Å²	90.8	59%	0.593	45%	0.452	S	S	*	.	H	α-helix	trans	-61.6	-45.7	178.6	-73	-61	150.3	0	0	112.2	K76 R82 A83 V84	K76-E80 WeakPolarHBondContact O-CG 3.4Å; K76-E80 PolarHBondContact O-N 3.4Å; E80-R82 PolarHBondContact O-N 3.07Å; E80-A83 PolarHBondContact O-N 3.1Å; E80-V84 WeakPolarHBondContact O-CG2 3.43Å; E80-V84 PolarHBondContact O-N 3.29Å
81	S	84.6	Confident	83.8	Confident	65 Å²	65	92.2 Å²	92.2	46%	0.455	45%	0.448	S	S	.	.	H	α-helix	trans	-59	-34.1	177.7	73.5	0	0	0	0	112.2	L77 R78 E79 F85	L77-S81 VanDerWaalsContact O-CB 3.23Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3.43Å; L77-S81 PolarHBondContact O-OG 2.95Å; R78-S81 WeakPolarHBondContact CA-OG 3.29Å; R78-S81 PolarHBondContact O-N 3.23Å; R78-S81 PolarHBondContact O-OG 3.29Å; E79-S81 PolarHBondContact O-N 3.29Å; S81-F85 WeakPolarHBondContact O-CB 3.28Å; S81-F85 PolarHBondContact O-N 3.16Å
82	R	83.4	Confident	84	Confident	48 Å²	48	92.4 Å²	92.4	18%	0.181	45%	0.449	C	S	.	.	H	α-helix	trans	-79.1	-41.3	178.9	-74.2	-178.8	63.9	-144.8	-8	112.1	R78 E79 E80 V84 F85 L86 S181 D184 V185	R78-R82 WeakPolarHBondContact O-CB 3.36Å; R78-R82 VanDerWaalsContact O-CG 3.24Å; R78-R82 WeakPolarHBondContact O-CG 3.22Å; R78-R82 PolarHBondContact O-N 3.4Å; E79-R82 PolarHBondContact O-N 3.09Å; E79-R82 VanDerWaalsContact O-N 3.14Å; E80-R82 PolarHBondContact O-N 3.07Å; R82-V84 VanDerWaalsContact C-N 3.29Å; R82-V84 PolarHBondContact O-N 3.25Å; R82-F85 PolarHBondContact O-N 3.33Å; R82-L86 WeakPolarHBondContact O-CB 3.38Å; R82-L86 VanDerWaalsContact O-CG 3.32Å; R82-L86 WeakPolarHBondContact O-CG 3.42Å; R82-L86 PolarHBondContact O-N 3.12Å; R82-S181 PolarHBondContact NH2-O 2.9Å; R82-D184 PolarHBondContact NH1-O 3.08Å; R82-D184 PolarHBondContact NH2-O 3.19Å; R82-D184 IonicContact NH2-OD2 2.6Å; R82-V185 VanDerWaalsContact NH1-C 3.33Å; R82-V185 PolarHBondContact NH1-O 3.13Å
83	A	83.9	Confident	84.3	Confident	44 Å²	44	89.8 Å²	89.8	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-56.2	-46.7	173	0	0	0	0	0	110.5	E79 E80 F85 L86 Q87	E79-A83 PolarHBondContact O-N 3.3Å; E80-A83 PolarHBondContact O-N 3.1Å; A83-F85 PolarHBondContact O-N 3.13Å; A83-L86 PolarHBondContact O-N 3.2Å; A83-Q87 WeakPolarHBondContact O-CB 3.27Å; A83-Q87 PolarHBondContact O-N 3.11Å
84	V	86	Confident	84.4	Confident	87 Å²	87	83 Å²	83	53%	0.527	40%	0.396	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175.9	174.7	0	0	0	0	111.8	E80 R82 Q87 R88	E80-V84 WeakPolarHBondContact O-CG2 3.43Å; E80-V84 PolarHBondContact O-N 3.29Å; R82-V84 VanDerWaalsContact C-N 3.29Å; R82-V84 PolarHBondContact O-N 3.25Å; V84-Q87 PolarHBondContact O-N 3.45Å; V84-R88 WeakPolarHBondContact O-CB 3.31Å; V84-R88 PolarHBondContact O-N 2.85Å
85	F	86.9	Confident	84.7	Confident	120 Å²	120	83.4 Å²	83.4	53%	0.526	40%	0.399	S	S	.	.	H	α-helix	trans	-61.5	-46.3	176.4	173.7	-97.3	0	0	0	112.2	S81 R82 A83 R88 K89	S81-F85 WeakPolarHBondContact O-CB 3.28Å; S81-F85 PolarHBondContact O-N 3.16Å; R82-F85 PolarHBondContact O-N 3.33Å; A83-F85 PolarHBondContact O-N 3.13Å; F85-R88 PolarHBondContact O-N 3.35Å; F85-K89 HydrophobicContact CD1-CG 4.46Å; F85-K89 HydrophobicContact CE1-CG 3.99Å; F85-K89 HydrophobicContact CE2-CG 4.31Å; F85-K89 HydrophobicContact CZ-CD 4.4Å; F85-K89 HydrophobicContact CZ-CG 3.92Å; F85-K89 WeakPolarHBondContact O-CG 2.75Å; F85-K89 PolarHBondContact O-N 2.99Å
86	L	85.7	Confident	84.9	Confident	18 Å²	18	86.8 Å²	86.8	9%	0.094	42%	0.419	C	S	.	.	H	α-helix	trans	-65.7	-39.9	178.1	-71.1	173.4	0	0	0	111.1	R82 A83 R88 K89 S90 I178 L182	R82-L86 WeakPolarHBondContact O-CB 3.38Å; R82-L86 VanDerWaalsContact O-CG 3.32Å; R82-L86 WeakPolarHBondContact O-CG 3.42Å; R82-L86 PolarHBondContact O-N 3.12Å; A83-L86 PolarHBondContact O-N 3.2Å; L86-R88 PolarHBondContact O-N 3.32Å; L86-K89 CarbonylContact O-C 3.59Å; L86-K89 PolarHBondContact O-N 3.18Å; L86-S90 WeakPolarHBondContact O-CB 3.42Å; L86-S90 PolarHBondContact O-N 2.85Å; L86-I178 HydrophobicContact CB-CG2 4.29Å; L86-I178 HydrophobicContact CD2-CG2 4.34Å; L86-L182 HydrophobicContact CB-CD2 4.12Å; L86-L182 HydrophobicContact CD1-CD2 3.65Å; L86-L182 HydrophobicContact CD1-CG 4.12Å
87	Q	86.4	Confident	85.2	Confident	103 Å²	103	87.8 Å²	87.8	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-62.2	-42.5	174.2	-167.3	-174.8	26.9	0	0	111.6	A83 V84 K89 S90 R91	A83-Q87 WeakPolarHBondContact O-CB 3.27Å; A83-Q87 PolarHBondContact O-N 3.11Å; V84-Q87 PolarHBondContact O-N 3.45Å; Q87-K89 VanDerWaalsContact C-N 3.33Å; Q87-K89 PolarHBondContact O-N 3.15Å; Q87-S90 WeakPolarHBondContact O-CB 3.4Å; Q87-S90 PolarHBondContact O-N 3.35Å; Q87-R91 VanDerWaalsContact CD-NH2 3.33Å; Q87-R91 WeakPolarHBondContact O-CG 3.32Å; Q87-R91 PolarHBondContact O-N 2.94Å
88	R	87.4	Confident	85.3	Confident	177 Å²	177	85.4 Å²	85.4	67%	0.668	41%	0.411	S	S	*	.	H	α-helix	trans	-61.2	-43.1	174.5	-175.7	178.3	177.8	171.1	3	111.3	V84 F85 L86 S90 R91 E92	V84-R88 WeakPolarHBondContact O-CB 3.31Å; V84-R88 PolarHBondContact O-N 2.85Å; F85-R88 PolarHBondContact O-N 3.35Å; L86-R88 PolarHBondContact O-N 3.32Å; R88-S90 VanDerWaalsContact C-N 3.35Å; R88-R91 PolarHBondContact O-N 3.34Å; R88-E92 PolarHBondContact O-N 3.36Å
89	K	86.7	Confident	85.6	Confident	76 Å²	76	82.8 Å²	82.8	33%	0.33	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-37.1	176.1	-74.1	-73.4	160.6	-153.6	0	112.5	F85 L86 Q87 R91 E92 I178	F85-K89 HydrophobicContact CD1-CG 4.46Å; F85-K89 HydrophobicContact CE1-CG 3.99Å; F85-K89 HydrophobicContact CE2-CG 4.31Å; F85-K89 HydrophobicContact CZ-CD 4.4Å; F85-K89 HydrophobicContact CZ-CG 3.92Å; F85-K89 WeakPolarHBondContact O-CG 2.75Å; F85-K89 PolarHBondContact O-N 2.99Å; L86-K89 CarbonylContact O-C 3.59Å; L86-K89 PolarHBondContact O-N 3.18Å; Q87-K89 VanDerWaalsContact C-N 3.33Å; Q87-K89 PolarHBondContact O-N 3.15Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.46Å; K89-E92 IonicContact NZ-OE1 2.79Å; K89-E92 PolarHBondContact NZ-OE1 3.06Å; K89-E92 IonicContact NZ-OE2 2.72Å; K89-E92 PolarHBondContact NZ-OE2 3.13Å; K89-E92 WeakPolarHBondContact O-CB 3.4Å; K89-E92 PolarHBondContact O-N 3.24Å; K89-I178 HydrophobicContact CB-CD1 3.91Å
90	S	87.2	Confident	85.8	Confident	52 Å²	52	85.6 Å²	85.6	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-41	174.6	-169	0	0	0	0	111.4	L86 Q87 R88 E92 L93	L86-S90 WeakPolarHBondContact O-CB 3.42Å; L86-S90 PolarHBondContact O-N 2.85Å; Q87-S90 WeakPolarHBondContact O-CB 3.4Å; Q87-S90 PolarHBondContact O-N 3.35Å; R88-S90 VanDerWaalsContact C-N 3.35Å; S90-E92 PolarHBondContact O-N 3.36Å; S90-L93 WeakPolarHBondContact O-CB 3.38Å; S90-L93 PolarHBondContact O-N 3.08Å; S90-L93 VanDerWaalsContact O-N 3.1Å
91	R	86.1	Confident	86.1	Confident	165 Å²	165	84.3 Å²	84.3	62%	0.623	41%	0.413	S	S	*	.	H	α-helix	trans	-68.3	-19.3	177.3	-68	175.1	-171.2	177.8	5.7	113.9	Q87 R88 K89 L93 K136	Q87-R91 VanDerWaalsContact CD-NH2 3.33Å; Q87-R91 WeakPolarHBondContact O-CG 3.32Å; Q87-R91 PolarHBondContact O-N 2.94Å; R88-R91 PolarHBondContact O-N 3.34Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.46Å; R91-L93 VanDerWaalsContact C-N 3.28Å; R91-K136 WeakPolarHBondContact O-CE 3.44Å; R91-K136 PolarHBondContact O-NZ 3.44Å
92	E	86.1	Confident	86.2	Confident	89 Å²	89	81.3 Å²	81.3	42%	0.416	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.3	173.8	-70.2	172.4	-168.5	0	0	112.2	R88 K89 S90	R88-E92 PolarHBondContact O-N 3.36Å; K89-E92 IonicContact NZ-OE1 2.79Å; K89-E92 PolarHBondContact NZ-OE1 3.06Å; K89-E92 IonicContact NZ-OE2 2.72Å; K89-E92 PolarHBondContact NZ-OE2 3.13Å; K89-E92 WeakPolarHBondContact O-CB 3.4Å; K89-E92 PolarHBondContact O-N 3.24Å; S90-E92 PolarHBondContact O-N 3.36Å
93	L	86.9	Confident	86.3	Confident	24 Å²	24	84.1 Å²	84.1	13%	0.126	40%	0.402	C	S	.	.	S	Bend	trans	-77.3	159.8	177.7	-59.7	-177.8	0	0	0	112.1	S90 R91 K136 H174 Q175 I178	S90-L93 WeakPolarHBondContact O-CB 3.38Å; S90-L93 PolarHBondContact O-N 3.08Å; S90-L93 VanDerWaalsContact O-N 3.1Å; R91-L93 VanDerWaalsContact C-N 3.28Å; L93-K136 WeakPolarHBondContact O-CD 3.16Å; L93-K136 PolarHBondContact O-NZ 3.39Å; L93-H174 HydrophobicContact CD1-CB 4.19Å; L93-H174 HydrophobicContact CD2-CB 3.62Å; L93-Q175 HydrophobicContact CD1-CB 3.92Å; L93-I178 HydrophobicContact CD1-CD1 3.83Å; L93-I178 HydrophobicContact CG-CD1 4.42Å
94	L	85.1	Confident	86.5	Confident	10 Å²	10	88 Å²	88	5%	0.052	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-79.1	128	177.3	-67.5	165.9	0	0	0	109.8	E98 L99 K136 C137 F140 V167 V171	L94-E98 VanDerWaalsContact CA-OE2 3.31Å; L94-E98 WeakPolarHBondContact CA-OE2 3.4Å; L94-E98 HydrophobicContact CD2-CB 3.99Å; L94-L99 HydrophobicContact CB-CD2 3.98Å; L94-L99 HydrophobicContact CB-CG 4.08Å; L94-L99 HydrophobicContact CD1-CD2 3.99Å; L94-K136 HydrophobicContact CD2-CB 3.86Å; L94-K136 HydrophobicContact CD2-CD 4.36Å; L94-C137 WeakPolarHBondContact CD2-SG 3.42Å; L94-F140 HydrophobicContact CD1-CD2 4.16Å; L94-F140 HydrophobicContact CD1-CE2 3.6Å; L94-F140 HydrophobicContact CD1-CZ 4.29Å; L94-F140 HydrophobicContact CG-CE2 4.35Å; L94-V167 HydrophobicContact CD1-CG1 3.74Å; L94-V171 HydrophobicContact CB-CG2 4.08Å; L94-V171 HydrophobicContact CD1-CG2 3.88Å; L94-V171 HydrophobicContact CG-CG2 4.3Å
95	D	85.2	Confident	86.5	Confident	93 Å²	93	85.5 Å²	85.5	50%	0.497	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-84.1	166.7	174.8	-59.4	-40.5	0	0	0	110.9	E97 E98 L99 K136	D95-E97 VanDerWaalsContact C-N 3.28Å; D95-E97 PolarHBondContact O-N 2.84Å; D95-E98 PolarHBondContact N-OE2 3.46Å; D95-E98 WeakPolarHBondContact O-CB 3.47Å; D95-E98 PolarHBondContact O-N 3.24Å; D95-L99 PolarHBondContact O-N 3.36Å; D95-K136 IonicContact OD2-NZ 3.4Å
96	N	84.6	Confident	86.5	Confident	129 Å²	129	79.8 Å²	79.8	69%	0.69	37%	0.37	S	S	*	.	H	α-helix	trans	-56.7	-39.6	-177.5	-71.8	-16.5	0	0	0	113.1	L99 Q100	N96-L99 PolarHBondContact O-N 3.29Å; N96-Q100 WeakPolarHBondContact O-CG 3.34Å; N96-Q100 PolarHBondContact O-N 3.14Å
97	E	86.1	Confident	86.5	Confident	148 Å²	148	82.1 Å²	82.1	69%	0.692	38%	0.382	S	S	*	.	H	α-helix	trans	-65.7	-39.1	175.9	-63.6	-178.8	-178.8	0	0	111.9	D95 Q100 N101	D95-E97 VanDerWaalsContact C-N 3.28Å; D95-E97 PolarHBondContact O-N 2.84Å; E97-Q100 PolarHBondContact O-N 3.11Å; E97-N101 WeakPolarHBondContact O-CB 3.43Å; E97-N101 VanDerWaalsContact O-CG 3.24Å; E97-N101 PolarHBondContact O-N 3.29Å; E97-N101 PolarHBondContact O-ND2 2.83Å
98	E	87.1	Confident	86.4	Confident	66 Å²	66	84.2 Å²	84.2	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-68.8	-36.3	177.8	-64	178.4	144.6	0	0	111.2	L94 D95 N101 L102 K136	L94-E98 VanDerWaalsContact CA-OE2 3.31Å; L94-E98 WeakPolarHBondContact CA-OE2 3.4Å; L94-E98 HydrophobicContact CD2-CB 3.99Å; D95-E98 PolarHBondContact N-OE2 3.46Å; D95-E98 WeakPolarHBondContact O-CB 3.47Å; D95-E98 PolarHBondContact O-N 3.24Å; E98-N101 PolarHBondContact O-N 3Å; E98-L102 WeakPolarHBondContact O-CB 3.48Å; E98-L102 PolarHBondContact O-N 3.48Å; E98-K136 VanDerWaalsContact CD-NZ 3.31Å; E98-K136 WeakPolarHBondContact OE1-CE 3.4Å; E98-K136 IonicContact OE1-NZ 3.2Å; E98-K136 PolarHBondContact OE1-NZ 3.3Å; E98-K136 WeakPolarHBondContact OE2-CD 3.44Å; E98-K136 IonicContact OE2-NZ 3.07Å; E98-K136 PolarHBondContact OE2-NZ 3.39Å
99	L	87.3	Confident	86.2	Confident	19 Å²	19	77.2 Å²	77.2	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-42.7	172.7	-70.5	173.3	0	0	0	111.9	L94 D95 N96 L102 W103 F164 V167	L94-L99 HydrophobicContact CB-CD2 3.98Å; L94-L99 HydrophobicContact CB-CG 4.08Å; L94-L99 HydrophobicContact CD1-CD2 3.99Å; D95-L99 PolarHBondContact O-N 3.36Å; N96-L99 PolarHBondContact O-N 3.29Å; L99-L102 WeakPolarHBondContact O-CB 3.07Å; L99-L102 PolarHBondContact O-N 3.34Å; L99-W103 PolarHBondContact O-N 3.34Å; L99-F164 WeakPolarHBondContact O-CE2 3.43Å; L99-V167 HydrophobicContact CD2-CG1 4.22Å
100	Q	86.8	Confident	86	Confident	138 Å²	138	77.5 Å²	77.5	65%	0.645	37%	0.367	S	S	*	.	H	α-helix	trans	-62.9	-42.6	174.4	-73.8	176.7	-4.4	0	0	111.9	N96 E97 L102 W103 F104	N96-Q100 WeakPolarHBondContact O-CG 3.34Å; N96-Q100 PolarHBondContact O-N 3.14Å; E97-Q100 PolarHBondContact O-N 3.11Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; Q100-L102 PolarHBondContact O-N 3.43Å; Q100-W103 WeakPolarHBondContact O-CB 3.43Å; Q100-W103 PolarHBondContact O-N 3.08Å; Q100-F104 PolarHBondContact O-N 3.45Å
101	N	87.9	Confident	85.5	Confident	99 Å²	99	76.9 Å²	76.9	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-40.6	174.7	-75.1	-39.7	0	0	0	111.9	E97 E98 F104 L105	E97-N101 WeakPolarHBondContact O-CB 3.43Å; E97-N101 VanDerWaalsContact O-CG 3.24Å; E97-N101 PolarHBondContact O-N 3.29Å; E97-N101 PolarHBondContact O-ND2 2.83Å; E98-N101 PolarHBondContact O-N 3Å; N101-F104 PolarHBondContact O-N 3.1Å; N101-L105 WeakPolarHBondContact O-CB 3.5Å; N101-L105 VanDerWaalsContact O-CG 3.29Å; N101-L105 WeakPolarHBondContact O-CG 3.43Å; N101-L105 PolarHBondContact O-N 2.92Å
102	L	87.4	Confident	84.4	Confident	2 Å²	2	73.6 Å²	73.6	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-45	174.8	176.9	64.3	0	0	0	111.4	E98 L99 Q100 L105 L106 V129 A133 F141 F164 V167	E98-L102 WeakPolarHBondContact O-CB 3.48Å; E98-L102 PolarHBondContact O-N 3.48Å; L99-L102 WeakPolarHBondContact O-CB 3.07Å; L99-L102 PolarHBondContact O-N 3.34Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; Q100-L102 PolarHBondContact O-N 3.43Å; L102-L105 PolarHBondContact O-N 2.98Å; L102-L106 HydrophobicContact CD1-CD1 4.23Å; L102-L106 HydrophobicContact CD1-CG 4.34Å; L102-L106 HydrophobicContact CG-CD1 4.03Å; L102-L106 VanDerWaalsContact O-CG 3.29Å; L102-L106 WeakPolarHBondContact O-CG 3.32Å; L102-L106 PolarHBondContact O-N 3.35Å; L102-V129 HydrophobicContact CD1-CG1 4.26Å; L102-A133 HydrophobicContact CD1-CB 3.96Å; L102-F141 HydrophobicContact CD1-CE2 3.88Å; L102-F141 HydrophobicContact CD1-CZ 3.78Å; L102-F164 HydrophobicContact CD2-CD2 4.46Å; L102-V167 HydrophobicContact CD2-CB 4.38Å; L102-V167 HydrophobicContact CD2-CG1 3.89Å; L102-V167 HydrophobicContact CD2-CG2 4.39Å
103	W	86.4	Confident	83.3	Confident	107 Å²	107	71.3 Å²	71.3	41%	0.405	35%	0.354	S	S	.	.	H	α-helix	trans	-57.5	-49.7	175.3	178.3	-95.8	0	0	0	111.5	L99 Q100 L105 L106 D107 I160 M161 F164	L99-W103 PolarHBondContact O-N 3.34Å; Q100-W103 WeakPolarHBondContact O-CB 3.43Å; Q100-W103 PolarHBondContact O-N 3.08Å; W103-L105 VanDerWaalsContact C-N 3.31Å; W103-L105 PolarHBondContact O-N 3.13Å; W103-L106 PolarHBondContact O-N 3.01Å; W103-L106 VanDerWaalsContact O-N 3.16Å; W103-D107 PolarHBondContact O-N 2.99Å; W103-I160 HydrophobicContact CZ3-CG2 4.35Å; W103-M161 HydrophobicContact CH2-SD 3.89Å; W103-M161 HydrophobicContact CZ3-SD 3.9Å; W103-F164 HydrophobicContact CB-CD2 4.36Å; W103-F164 HydrophobicContact CB-CE2 3.88Å; W103-F164 HydrophobicContact CB-CZ 4.2Å; W103-F164 HydrophobicContact CE3-CB 3.98Å; W103-F164 AromaticContact CE3-CD1 3.61Å; W103-F164 HydrophobicContact CE3-CD1 3.61Å; W103-F164 AromaticContact CE3-CD2 3.83Å; W103-F164 HydrophobicContact CE3-CD2 3.83Å; W103-F164 AromaticContact CE3-CE1 3.98Å; W103-F164 HydrophobicContact CE3-CE1 3.98Å; W103-F164 HydrophobicContact CE3-CE2 4.19Å; W103-F164 AromaticContact CE3-CG 3.52Å; W103-F164 HydrophobicContact CE3-CG 3.52Å; W103-F164 HydrophobicContact CE3-CZ 4.26Å; W103-F164 HydrophobicContact CZ3-CB 3.97Å; W103-F164 AromaticContact CZ3-CD1 3.84Å; W103-F164 HydrophobicContact CZ3-CD1 3.84Å; W103-F164 AromaticContact CZ3-CG 3.9Å; W103-F164 HydrophobicContact CZ3-CG 3.9Å
104	F	86.9	Confident	81.7	Confident	127 Å²	127	76 Å²	76	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-60.4	-39.5	178.5	-178.9	-98.1	0	0	0	112.8	Q100 N101 K108	Q100-F104 PolarHBondContact O-N 3.45Å; N101-F104 PolarHBondContact O-N 3.1Å; F104-K108 WeakPolarHBondContact O-CB 3.45Å; F104-K108 PolarHBondContact O-N 3.2Å
105	L	86.7	Confident	80.3	Confident	33 Å²	33	81.2 Å²	81.2	17%	0.173	42%	0.421	C	S	.	.	H	α-helix	trans	-67.1	-38.7	176.5	-73.1	173.3	0	0	0	112.3	N101 L102 W103 H109 V129 K132 A133	N101-L105 WeakPolarHBondContact O-CB 3.5Å; N101-L105 VanDerWaalsContact O-CG 3.29Å; N101-L105 WeakPolarHBondContact O-CG 3.43Å; N101-L105 PolarHBondContact O-N 2.92Å; L102-L105 PolarHBondContact O-N 2.98Å; W103-L105 VanDerWaalsContact C-N 3.31Å; W103-L105 PolarHBondContact O-N 3.13Å; L105-H109 PolarHBondContact O-CD2 3.4Å; L105-H109 PolarHBondContact O-N 3.43Å; L105-V129 HydrophobicContact CB-CG1 4.03Å; L105-K132 HydrophobicContact CD1-CB 4.23Å; L105-K132 HydrophobicContact CD2-CB 4.4Å; L105-A133 HydrophobicContact CD1-CB 4.28Å
106	L	86.2	Confident	79	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-65.3	-46.2	176	-70.8	165.9	0	0	0	110.9	L102 W103 K108 H109 Q110 I121 V129 I160 F163 F164	L102-L106 HydrophobicContact CD1-CD1 4.23Å; L102-L106 HydrophobicContact CD1-CG 4.34Å; L102-L106 HydrophobicContact CG-CD1 4.03Å; L102-L106 VanDerWaalsContact O-CG 3.29Å; L102-L106 WeakPolarHBondContact O-CG 3.32Å; L102-L106 PolarHBondContact O-N 3.35Å; W103-L106 PolarHBondContact O-N 3.01Å; W103-L106 VanDerWaalsContact O-N 3.16Å; L106-K108 PolarHBondContact O-N 3.38Å; L106-H109 CarbonylContact O-C 3.59Å; L106-H109 PolarHBondContact O-N 2.77Å; L106-Q110 PolarHBondContact O-N 3.02Å; L106-I121 HydrophobicContact CD2-CD1 3.92Å; L106-V129 HydrophobicContact CD2-CG1 3.94Å; L106-V129 HydrophobicContact CD2-CG2 4.5Å; L106-V129 HydrophobicContact CG-CG1 4.26Å; L106-I160 HydrophobicContact CB-CG1 4.45Å; L106-I160 HydrophobicContact CB-CG2 3.68Å; L106-I160 HydrophobicContact CD1-CG2 4.22Å; L106-I160 HydrophobicContact CG-CG2 4.45Å; L106-I160 WeakPolarHBondContact O-CD1 3.35Å; L106-F163 HydrophobicContact CD1-CD1 3.85Å; L106-F163 HydrophobicContact CD1-CE1 4.14Å; L106-F163 HydrophobicContact CD2-CD1 3.91Å; L106-F163 HydrophobicContact CD2-CE1 4.05Å; L106-F164 HydrophobicContact CD1-CB 4.47Å; L106-F164 HydrophobicContact CD1-CD2 4.28Å
107	D	85.2	Confident	77.9	Confident	68 Å²	68	81.7 Å²	81.7	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-40.3	179.1	-174.9	52.7	0	0	0	112.4	W103 H109 Q110	W103-D107 PolarHBondContact O-N 2.99Å; D107-H109 PolarHBondContact O-N 2.79Å; D107-Q110 WeakPolarHBondContact O-CB 3.44Å; D107-Q110 WeakPolarHBondContact O-CG 3.45Å; D107-Q110 PolarHBondContact O-N 3.08Å; D107-Q110 PolarHBondContact O-NE2 3.28Å; D107-Q110 PolarHBondContact OD1-NE2 3.15Å
108	K	86.2	Confident	77.3	Confident	146 Å²	146	80.4 Å²	80.4	64%	0.635	43%	0.429	S	S	*	.	H	α-helix	trans	-63.1	-29	175.9	-175	175.5	-178.3	174.4	0	113.6	F104 L106	F104-K108 WeakPolarHBondContact O-CB 3.45Å; F104-K108 PolarHBondContact O-N 3.2Å; L106-K108 PolarHBondContact O-N 3.38Å
109	H	82.7	Confident	76.9	Confident	31 Å²	31	78.6 Å²	78.6	14%	0.144	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	17.1	-176.8	-78.8	-78.9	0	0	0	112.5	L105 L106 D107 A125 Q128 V129 K132	L105-H109 PolarHBondContact O-CD2 3.4Å; L105-H109 PolarHBondContact O-N 3.43Å; L106-H109 CarbonylContact O-C 3.59Å; L106-H109 PolarHBondContact O-N 2.77Å; D107-H109 PolarHBondContact O-N 2.79Å; H109-A125 HydrophobicContact CB-CB 4.27Å; H109-Q128 PolarHBondContact CE1-OE1 2.91Å; H109-V129 HydrophobicContact CB-CG2 3.67Å; H109-K132 PolarHBondContact CE1-NZ 3.28Å; H109-K132 VanDerWaalsContact CE1-NZ 3.33Å; H109-K132 PolarHBondContact NE2-NZ 3.05Å
110	Q	82.4	Confident	76.8	Confident	82 Å²	82	78.8 Å²	78.8	38%	0.383	43%	0.426	S	S	.	.			trans	-66.5	145.9	177.4	74.8	-174	-45.8	0	0	112.3	L106 D107 A119 M120 I160	L106-Q110 PolarHBondContact O-N 3.02Å; D107-Q110 WeakPolarHBondContact O-CB 3.44Å; D107-Q110 WeakPolarHBondContact O-CG 3.45Å; D107-Q110 PolarHBondContact O-N 3.08Å; D107-Q110 PolarHBondContact O-NE2 3.28Å; D107-Q110 PolarHBondContact OD1-NE2 3.15Å; Q110-A119 VanDerWaalsContact OE1-CB 3.3Å; Q110-M120 WeakPolarHBondContact CA-O 3.49Å; Q110-I160 HydrophobicContact CB-CD1 3.61Å
111	V	76.6	Confident	76.8	Confident	38 Å²	38	72.2 Å²	72.2	23%	0.23	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-109.1	114.2	171.3	-176.9	0	0	0	0	106.7	M120 N122	V111-M120 PolarHBondContact N-O 3.37Å; V111-N122 HydrophobicContact CG2-CB 4.36Å
112	P	63.2	Low	76.7	Confident	96 Å²	96	69.9 Å²	69.9	62%	0.623	38%	0.383	S	S	*	.			trans	-56.9	136.2	-177.8	0.1	-2.9	0	0	0	110.9	R157	P112-R157 PolarHBondContact O-NH1 3.45Å
113	P	61.7	Low	76.6	Confident	42 Å²	42	74.3 Å²	74.3	27%	0.273	40%	0.401	S	S	.	.			trans	-68.1	152	169	31.7	-38.5	0	0	0	110.3	S115 G116 E118	P113-S115 VanDerWaalsContact C-N 3.32Å; P113-G116 WeakPolarHBondContact CG-O 3.5Å; P113-E118 VanDerWaalsContact CD-O 3.3Å; P113-E118 WeakPolarHBondContact CD-O 3.25Å; P113-E118 VanDerWaalsContact CG-O 3.24Å; P113-E118 WeakPolarHBondContact CG-O 3.14Å
114	V	54.9	Low	76.5	Confident	123 Å²	123	75.8 Å²	75.8	75%	0.745	41%	0.412	S	S	*	.	S	Bend	trans	-83	-15.2	176.8	-174.6	0	0	0	0	110.9
115	S	54.6	Low	76.4	Confident	119 Å²	119	70.1 Å²	70.1	83%	0.832	39%	0.389	S	S	*	.	S	Bend	trans	-158.4	96.1	176.5	-61.7	0	0	0	0	109.6	P113	P113-S115 VanDerWaalsContact C-N 3.32Å
116	G	57.6	Low	76.3	Confident	52 Å²	52	68.5 Å²	68.5	54%	0.536	38%	0.38	S	S	.	.	S	Bend	trans	146.8	156.5	178.2	0	0	0	0	0	111.9	P113 E118	P113-G116 WeakPolarHBondContact CG-O 3.5Å; G116-E118 VanDerWaalsContact C-N 3.34Å
117	D	63.1	Low	76.4	Confident	180 Å²	180	72.2 Å²	72.2	96%	0.963	40%	0.4	S	S	*	.	S	Bend	trans	-90.5	4.5	175.4	-80.5	-23.1	0	0	0	112.8
118	E	71.5	Confident	76.4	Confident	120 Å²	120	73.2 Å²	73.2	56%	0.561	40%	0.402	S	S	*	.			trans	-82.7	126.4	-176.7	-70.2	-167.2	176.2	0	0	113	P113 G116 M120	P113-E118 VanDerWaalsContact CD-O 3.3Å; P113-E118 WeakPolarHBondContact CD-O 3.25Å; P113-E118 VanDerWaalsContact CG-O 3.24Å; P113-E118 WeakPolarHBondContact CG-O 3.14Å; G116-E118 VanDerWaalsContact C-N 3.34Å; E118-M120 PolarHBondContact O-N 3.27Å
119	A	79.9	Confident	76.4	Confident	29 Å²	29	66.3 Å²	66.3	24%	0.24	37%	0.372	C	S	.	.			trans	-70	119.8	174.8	0	0	0	0	0	111.3	Q110 I160	Q110-A119 VanDerWaalsContact OE1-CB 3.3Å; A119-I160 HydrophobicContact CB-CB 4.4Å; A119-I160 HydrophobicContact CB-CD1 3.97Å; A119-I160 WeakPolarHBondContact O-CB 3.48Å; A119-I160 PolarHBondContact O-N 3.32Å
120	M	84.6	Confident	76.4	Confident	22 Å²	22	65.1 Å²	65.1	11%	0.108	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	156.2	-175.7	-61.1	-67.1	-79.9	0	0	111.7	Q110 V111 E118 R157 I158 S159	Q110-M120 WeakPolarHBondContact CA-O 3.49Å; V111-M120 PolarHBondContact N-O 3.37Å; E118-M120 PolarHBondContact O-N 3.27Å; M120-R157 HydrophobicContact CB-CB 4.25Å; M120-R157 HydrophobicContact CE-CB 3.91Å; M120-I158 CarbonylContact C-O 3.55Å; M120-I158 WeakPolarHBondContact CA-O 3.09Å; M120-S159 WeakPolarHBondContact SD-CA 3.29Å
121	I	86.1	Confident	76.6	Confident	0 Å²	0	69 Å²	69	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133.2	176.3	-165.6	170.6	0	0	0	111.9	L106 A125 V129 Y146 I158 I160	L106-I121 HydrophobicContact CD2-CD1 3.92Å; I121-A125 HydrophobicContact CD1-CB 3.98Å; I121-A125 HydrophobicContact CG1-CB 3.57Å; I121-V129 HydrophobicContact CD1-CG2 4.06Å; I121-Y146 PolarHBondContact O-OH 2.7Å; I121-Y146 VanDerWaalsContact O-OH 3.08Å; I121-I158 HydrophobicContact CG2-CD1 3.98Å; I121-I158 HydrophobicContact CG2-CG1 3.42Å; I121-I158 VanDerWaalsContact CG2-CG1 3.42Å; I121-I158 PolarHBondContact N-O 3.05Å; I121-I158 PolarHBondContact O-N 3.17Å; I121-I158 VanDerWaalsContact O-N 3.07Å; I121-I160 HydrophobicContact CB-CD1 4.26Å; I121-I160 HydrophobicContact CB-CG1 3.89Å; I121-I160 HydrophobicContact CG2-CG1 4.02Å
122	N	86.4	Confident	77	Confident	50 Å²	50	72.7 Å²	72.7	27%	0.267	40%	0.4	S	S	.	.			trans	-83.4	167.9	174.5	73	1.9	0	0	0	111.2	V111 E124 A125 Y126 Y146	V111-N122 HydrophobicContact CG2-CB 4.36Å; N122-E124 VanDerWaalsContact C-N 3.31Å; N122-E124 PolarHBondContact O-N 3.07Å; N122-A125 PolarHBondContact O-N 2.94Å; N122-A125 WeakPolarHBondContact OD1-CB 3.33Å; N122-A125 PolarHBondContact OD1-N 2.91Å; N122-Y126 WeakPolarHBondContact O-CB 3.49Å; N122-Y126 PolarHBondContact O-N 3.34Å; N122-Y146 VanDerWaalsContact C-OH 3.24Å; N122-Y146 WeakPolarHBondContact CA-OH 3.41Å
123	Y	85.1	Confident	77.7	Confident	96 Å²	96	69 Å²	69	38%	0.376	38%	0.377	S	S	.	.	H	α-helix	trans	-65.6	-33.2	-175.4	-172.9	-113.1	0	0	0	113.3	Y126 L127 Y146	Y123-Y126 HydrophobicContact CD2-CD1 4.17Å; Y123-Y126 HydrophobicContact CE2-CD1 4.16Å; Y123-Y126 WeakPolarHBondContact O-CB 3.31Å; Y123-Y126 PolarHBondContact O-N 3.48Å; Y123-L127 HydrophobicContact CD1-CD1 4.09Å; Y123-L127 HydrophobicContact CE1-CD1 3.63Å; Y123-L127 HydrophobicContact CE1-CG 4.18Å; Y123-L127 WeakPolarHBondContact O-CG 3.41Å; Y123-L127 PolarHBondContact O-N 2.98Å; Y123-Y146 AromaticContact CD2-CD1 3.65Å; Y123-Y146 HydrophobicContact CD2-CD1 3.65Å; Y123-Y146 AromaticContact CD2-CD2 3.82Å; Y123-Y146 HydrophobicContact CD2-CD2 3.82Å; Y123-Y146 AromaticContact CD2-CE1 3.9Å; Y123-Y146 HydrophobicContact CD2-CE1 3.9Å; Y123-Y146 HydrophobicContact CD2-CE2 4.08Å; Y123-Y146 AromaticContact CD2-CG 3.61Å; Y123-Y146 HydrophobicContact CD2-CG 3.61Å; Y123-Y146 HydrophobicContact CE2-CD1 4.33Å; Y123-Y146 HydrophobicContact CE2-CG 4.09Å; Y123-Y146 HydrophobicContact CG-CD1 4.49Å; Y123-Y146 HydrophobicContact CG-CE1 4.36Å; Y123-Y146 PolarHBondContact N-OH 3.34Å
124	E	84.8	Confident	78.6	Confident	137 Å²	137	68.3 Å²	68.3	64%	0.64	38%	0.378	S	S	*	.	H	α-helix	trans	-66.7	-47.2	177.7	-65.1	-179.5	174.9	0	0	111.8	N122 Y126 L127 Q128	N122-E124 VanDerWaalsContact C-N 3.31Å; N122-E124 PolarHBondContact O-N 3.07Å; E124-Y126 VanDerWaalsContact C-N 3.31Å; E124-Y126 PolarHBondContact O-N 2.95Å; E124-L127 PolarHBondContact O-N 3.04Å; E124-Q128 WeakPolarHBondContact O-CG 3.24Å; E124-Q128 PolarHBondContact O-N 2.69Å
125	A	84.2	Confident	79.9	Confident	8 Å²	8	67.3 Å²	67.3	7%	0.066	37%	0.373	C	S	.	.	H	α-helix	trans	-64.7	-37.1	175	0	0	0	0	0	111.3	H109 I121 N122 L127 Q128 V129	H109-A125 HydrophobicContact CB-CB 4.27Å; I121-A125 HydrophobicContact CD1-CB 3.98Å; I121-A125 HydrophobicContact CG1-CB 3.57Å; N122-A125 PolarHBondContact O-N 2.94Å; N122-A125 WeakPolarHBondContact OD1-CB 3.33Å; N122-A125 PolarHBondContact OD1-N 2.91Å; A125-L127 VanDerWaalsContact C-N 3.34Å; A125-L127 PolarHBondContact O-N 3.44Å; A125-Q128 PolarHBondContact O-N 2.86Å; A125-V129 VanDerWaalsContact O-CG2 3.31Å; A125-V129 WeakPolarHBondContact O-CG2 3.23Å; A125-V129 PolarHBondContact O-N 3.49Å
126	Y	86.3	Confident	81.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-44.4	173.6	176.7	-98.4	0	0	0	112.2	N122 Y123 E124 G130 F140 F141 T142 Y146 I158 F163	N122-Y126 WeakPolarHBondContact O-CB 3.49Å; N122-Y126 PolarHBondContact O-N 3.34Å; Y123-Y126 HydrophobicContact CD2-CD1 4.17Å; Y123-Y126 HydrophobicContact CE2-CD1 4.16Å; Y123-Y126 WeakPolarHBondContact O-CB 3.31Å; Y123-Y126 PolarHBondContact O-N 3.48Å; E124-Y126 VanDerWaalsContact C-N 3.31Å; E124-Y126 PolarHBondContact O-N 2.95Å; Y126-G130 PolarHBondContact O-N 2.78Å; Y126-F140 PolarHBondContact OH-O 3.2Å; Y126-F141 HydrophobicContact CD1-CD1 4.1Å; Y126-F141 AromaticContact CD2-CD1 3.74Å; Y126-F141 HydrophobicContact CD2-CD1 3.74Å; Y126-F141 AromaticContact CD2-CE1 3.78Å; Y126-F141 HydrophobicContact CD2-CE1 3.78Å; Y126-F141 HydrophobicContact CE1-CB 4.31Å; Y126-F141 AromaticContact CE1-CD1 3.91Å; Y126-F141 HydrophobicContact CE1-CD1 3.91Å; Y126-F141 AromaticContact CE2-CD1 3.54Å; Y126-F141 HydrophobicContact CE2-CD1 3.54Å; Y126-F141 AromaticContact CE2-CE1 3.81Å; Y126-F141 HydrophobicContact CE2-CE1 3.81Å; Y126-F141 HydrophobicContact CE2-CG 4.48Å; Y126-F141 HydrophobicContact CG-CD1 4.03Å; Y126-F141 HydrophobicContact CG-CE1 4.33Å; Y126-F141 AromaticContact CZ-CD1 3.65Å; Y126-F141 WeakPolarHBondContact O-CD1 3.08Å; Y126-F141 WeakPolarHBondContact O-CE1 3.27Å; Y126-F141 VanDerWaalsContact OH-CA 3.26Å; Y126-F141 WeakPolarHBondContact OH-CA 3.39Å; Y126-T142 PolarHBondContact OH-N 2.86Å; Y126-T142 VanDerWaalsContact OH-N 3.16Å; Y126-T142 PolarHBondContact OH-O 2.6Å; Y126-Y146 AromaticContact CD1-CD2 3.74Å; Y126-Y146 HydrophobicContact CD1-CD2 3.74Å; Y126-Y146 HydrophobicContact CD1-CE2 4.41Å; Y126-Y146 HydrophobicContact CD1-CG 4.47Å; Y126-Y146 AromaticContact CD2-CD2 3.79Å; Y126-Y146 HydrophobicContact CD2-CD2 3.79Å; Y126-Y146 HydrophobicContact CD2-CE2 4.21Å; Y126-Y146 HydrophobicContact CE1-CD2 4.03Å; Y126-Y146 HydrophobicContact CE2-CD2 4.07Å; Y126-Y146 AromaticContact CG-CD2 3.59Å; Y126-Y146 HydrophobicContact CG-CD2 3.59Å; Y126-Y146 AromaticContact CG-CE2 3.93Å; Y126-Y146 HydrophobicContact CG-CE2 3.93Å; Y126-I158 HydrophobicContact CD2-CD1 4.15Å; Y126-I158 HydrophobicContact CE2-CD1 4.28Å; Y126-F163 HydrophobicContact CE2-CD2 4.01Å; Y126-F163 HydrophobicContact CE2-CE1 4.24Å; Y126-F163 AromaticContact CE2-CE2 3.59Å; Y126-F163 HydrophobicContact CE2-CE2 3.59Å; Y126-F163 HydrophobicContact CE2-CG 4.5Å; Y126-F163 AromaticContact CE2-CZ 3.71Å; Y126-F163 HydrophobicContact CE2-CZ 3.71Å
127	L	86.4	Confident	82.5	Confident	77 Å²	77	61.7 Å²	61.7	40%	0.403	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-42.5	175.1	-68.8	175.6	0	0	0	112	Y123 E124 A125 V129 G130 E131	Y123-L127 HydrophobicContact CD1-CD1 4.09Å; Y123-L127 HydrophobicContact CE1-CD1 3.63Å; Y123-L127 HydrophobicContact CE1-CG 4.18Å; Y123-L127 WeakPolarHBondContact O-CG 3.41Å; Y123-L127 PolarHBondContact O-N 2.98Å; E124-L127 PolarHBondContact O-N 3.04Å; A125-L127 VanDerWaalsContact C-N 3.34Å; A125-L127 PolarHBondContact O-N 3.44Å; L127-V129 VanDerWaalsContact C-N 3.34Å; L127-V129 PolarHBondContact O-N 2.89Å; L127-G130 PolarHBondContact O-N 3.48Å; L127-G130 VanDerWaalsContact O-N 3.14Å; L127-E131 PolarHBondContact O-N 2.9Å
128	Q	85.2	Confident	83.4	Confident	90 Å²	90	60.9 Å²	60.9	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-40.4	177.3	-70.7	178.1	18.8	0	0	112.6	H109 E124 A125 E131 K132	H109-Q128 PolarHBondContact CE1-OE1 2.91Å; E124-Q128 WeakPolarHBondContact O-CG 3.24Å; E124-Q128 PolarHBondContact O-N 2.69Å; A125-Q128 PolarHBondContact O-N 2.86Å; Q128-E131 PolarHBondContact O-N 3.02Å; Q128-K132 WeakPolarHBondContact O-CG 3.28Å; Q128-K132 PolarHBondContact O-N 3.48Å
129	V	86.5	Confident	84	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.7	-42.3	174.3	175.5	0	0	0	0	109.8	L102 L105 L106 H109 I121 A125 L127 E131 K132 A133 F141	L102-V129 HydrophobicContact CD1-CG1 4.26Å; L105-V129 HydrophobicContact CB-CG1 4.03Å; L106-V129 HydrophobicContact CD2-CG1 3.94Å; L106-V129 HydrophobicContact CD2-CG2 4.5Å; L106-V129 HydrophobicContact CG-CG1 4.26Å; H109-V129 HydrophobicContact CB-CG2 3.67Å; I121-V129 HydrophobicContact CD1-CG2 4.06Å; A125-V129 VanDerWaalsContact O-CG2 3.31Å; A125-V129 WeakPolarHBondContact O-CG2 3.23Å; A125-V129 PolarHBondContact O-N 3.49Å; L127-V129 VanDerWaalsContact C-N 3.34Å; L127-V129 PolarHBondContact O-N 2.89Å; V129-E131 VanDerWaalsContact C-N 3.28Å; V129-E131 PolarHBondContact O-N 2.96Å; V129-K132 CarbonylContact O-C 3.59Å; V129-K132 PolarHBondContact O-N 3.49Å; V129-K132 VanDerWaalsContact O-N 3.07Å; V129-A133 HydrophobicContact CG1-CB 4.48Å; V129-A133 WeakPolarHBondContact O-CB 3.46Å; V129-A133 PolarHBondContact O-N 3.4Å; V129-F141 HydrophobicContact CB-CE1 4.06Å; V129-F141 HydrophobicContact CB-CZ 4.23Å; V129-F141 HydrophobicContact CG1-CE1 3.92Å; V129-F141 HydrophobicContact CG1-CZ 3.58Å
130	G	84.4	Confident	84.3	Confident	7 Å²	7	60.4 Å²	60.4	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-59.7	-33.7	176.8	0	0	0	0	0	114.5	Y126 L127 F141	Y126-G130 PolarHBondContact O-N 2.78Å; L127-G130 PolarHBondContact O-N 3.48Å; L127-G130 VanDerWaalsContact O-N 3.14Å; G130-F141 VanDerWaalsContact CA-CG 3.42Å
131	E	85.7	Confident	84.3	Confident	162 Å²	162	60.4 Å²	60.4	76%	0.757	30%	0.299	S	S	*	.	H	α-helix	trans	-70.6	-35.9	173.6	-70.6	-172.2	162.7	0	0	112.7	L127 Q128 V129	L127-E131 PolarHBondContact O-N 2.9Å; Q128-E131 PolarHBondContact O-N 3.02Å; V129-E131 VanDerWaalsContact C-N 3.28Å; V129-E131 PolarHBondContact O-N 2.96Å
132	K	84.6	Confident	84.3	Confident	117 Å²	117	63 Å²	63	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-85.7	-25.7	-177.7	-67	175.9	-171.6	173.4	0	113.9	L105 H109 Q128 V129 G134	L105-K132 HydrophobicContact CD1-CB 4.23Å; L105-K132 HydrophobicContact CD2-CB 4.4Å; H109-K132 PolarHBondContact CE1-NZ 3.28Å; H109-K132 VanDerWaalsContact CE1-NZ 3.33Å; H109-K132 PolarHBondContact NE2-NZ 3.05Å; Q128-K132 WeakPolarHBondContact O-CG 3.28Å; Q128-K132 PolarHBondContact O-N 3.48Å; V129-K132 CarbonylContact O-C 3.59Å; V129-K132 PolarHBondContact O-N 3.49Å; V129-K132 VanDerWaalsContact O-N 3.07Å; K132-G134 PolarHBondContact O-N 3.2Å; K132-G134 VanDerWaalsContact O-N 3.13Å
133	A	77.9	Confident	84.3	Confident	19 Å²	19	63.5 Å²	63.5	16%	0.157	33%	0.326	C	S	.	.	S	Bend	trans	-75.7	6.1	-173.5	0	0	0	0	0	114.5	L102 L105 V129 C137 F141	L102-A133 HydrophobicContact CD1-CB 3.96Å; L105-A133 HydrophobicContact CD1-CB 4.28Å; V129-A133 HydrophobicContact CG1-CB 4.48Å; V129-A133 WeakPolarHBondContact O-CB 3.46Å; V129-A133 PolarHBondContact O-N 3.4Å; A133-C137 HydrophobicContact CB-CB 3.62Å; A133-C137 VanDerWaalsContact O-CB 3.31Å; A133-C137 WeakPolarHBondContact O-CB 3.42Å; A133-C137 PolarHBondContact O-SG 3.43Å; A133-F141 HydrophobicContact CB-CE2 3.99Å; A133-F141 HydrophobicContact CB-CZ 4.5Å
134	G	81.1	Confident	84.3	Confident	27 Å²	27	67.7 Å²	67.7	28%	0.278	34%	0.341	S	S	.	.	H	α-helix	trans	83.7	173.2	175.3	0	0	0	0	0	114.8	K132 K136 C137	K132-G134 PolarHBondContact O-N 3.2Å; K132-G134 VanDerWaalsContact O-N 3.13Å; G134-K136 PolarHBondContact O-N 3.45Å; G134-C137 PolarHBondContact O-N 2.89Å
135	P	82.3	Confident	84.4	Confident	101 Å²	101	61.6 Å²	61.6	66%	0.656	31%	0.313	S	S	*	.	H	α-helix	trans	-69.5	-32.7	-172	26.5	-33.8	0	0	0	113.6	C137 R138	P135-C137 VanDerWaalsContact C-N 3.33Å; P135-C137 PolarHBondContact O-N 3.03Å; P135-R138 PolarHBondContact O-N 3.18Å
136	K	83.8	Confident	84.5	Confident	52 Å²	52	61.9 Å²	61.9	23%	0.226	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-37.2	178.3	-63.4	-178.2	-177.3	178.9	0	112	R91 L93 L94 D95 E98 G134 R138	R91-K136 WeakPolarHBondContact O-CE 3.44Å; R91-K136 PolarHBondContact O-NZ 3.44Å; L93-K136 WeakPolarHBondContact O-CD 3.16Å; L93-K136 PolarHBondContact O-NZ 3.39Å; L94-K136 HydrophobicContact CD2-CB 3.86Å; L94-K136 HydrophobicContact CD2-CD 4.36Å; D95-K136 IonicContact OD2-NZ 3.4Å; E98-K136 VanDerWaalsContact CD-NZ 3.31Å; E98-K136 WeakPolarHBondContact OE1-CE 3.4Å; E98-K136 IonicContact OE1-NZ 3.2Å; E98-K136 PolarHBondContact OE1-NZ 3.3Å; E98-K136 WeakPolarHBondContact OE2-CD 3.44Å; E98-K136 IonicContact OE2-NZ 3.07Å; E98-K136 PolarHBondContact OE2-NZ 3.39Å; G134-K136 PolarHBondContact O-N 3.45Å; K136-R138 VanDerWaalsContact C-N 3.32Å; K136-R138 PolarHBondContact O-N 3.18Å
137	C	81.8	Confident	84.4	Confident	2 Å²	2	65 Å²	65	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-71.1	-22.9	-178.5	-74.8	0	0	0	0	114	L94 A133 G134 P135 N139 F140 F141	L94-C137 WeakPolarHBondContact CD2-SG 3.42Å; A133-C137 HydrophobicContact CB-CB 3.62Å; A133-C137 VanDerWaalsContact O-CB 3.31Å; A133-C137 WeakPolarHBondContact O-CB 3.42Å; A133-C137 PolarHBondContact O-SG 3.43Å; G134-C137 PolarHBondContact O-N 2.89Å; P135-C137 VanDerWaalsContact C-N 3.33Å; P135-C137 PolarHBondContact O-N 3.03Å; C137-N139 PolarHBondContact O-N 3.37Å; C137-F140 WeakPolarHBondContact O-CB 3.41Å; C137-F140 WeakPolarHBondContact O-CD2 3.46Å; C137-F140 PolarHBondContact O-N 2.97Å; C137-F141 HydrophobicContact CB-CD2 4.11Å; C137-F141 HydrophobicContact CB-CE2 4Å; C137-F141 WeakPolarHBondContact O-CD2 3.45Å; C137-F141 PolarHBondContact O-N 3.07Å
138	R	82.6	Confident	84.3	Confident	163 Å²	163	68.4 Å²	68.4	62%	0.615	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-33.3	-173	-70.2	-178.6	177.1	176.9	-1.6	113.9	P135 K136 F140 F141	P135-R138 PolarHBondContact O-N 3.18Å; K136-R138 VanDerWaalsContact C-N 3.32Å; K136-R138 PolarHBondContact O-N 3.18Å; R138-F140 PolarHBondContact O-N 2.99Å; R138-F141 PolarHBondContact O-N 3.4Å
139	N	84.3	Confident	84.3	Confident	123 Å²	123	65.6 Å²	65.6	66%	0.658	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.8	179.5	-67.3	-22.9	0	0	0	113.7	C137	C137-N139 PolarHBondContact O-N 3.37Å
140	F	85.7	Confident	84.1	Confident	15 Å²	15	69.2 Å²	69.2	7%	0.066	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-27.3	175.1	-53.6	-78.9	0	0	0	112.2	L94 Y126 C137 R138 T142 F163 Y166 V167 K170 V171	L94-F140 HydrophobicContact CD1-CD2 4.16Å; L94-F140 HydrophobicContact CD1-CE2 3.6Å; L94-F140 HydrophobicContact CD1-CZ 4.29Å; L94-F140 HydrophobicContact CG-CE2 4.35Å; Y126-F140 PolarHBondContact OH-O 3.2Å; C137-F140 WeakPolarHBondContact O-CB 3.41Å; C137-F140 WeakPolarHBondContact O-CD2 3.46Å; C137-F140 PolarHBondContact O-N 2.97Å; R138-F140 PolarHBondContact O-N 2.99Å; F140-T142 VanDerWaalsContact C-N 3.34Å; F140-T142 PolarHBondContact O-N 3.14Å; F140-T142 VanDerWaalsContact O-N 3.11Å; F140-F163 HydrophobicContact CB-CZ 4.41Å; F140-Y166 HydrophobicContact CD1-CE1 4.37Å; F140-V167 HydrophobicContact CB-CG2 3.95Å; F140-V167 HydrophobicContact CD1-CG1 4.27Å; F140-V167 HydrophobicContact CD1-CG2 4.15Å; F140-V167 HydrophobicContact CD2-CG1 4.24Å; F140-V167 HydrophobicContact CE1-CG1 4.33Å; F140-V167 HydrophobicContact CE2-CG1 4.33Å; F140-V167 HydrophobicContact CG-CG1 4.23Å; F140-V167 HydrophobicContact CG-CG2 4.04Å; F140-V167 HydrophobicContact CZ-CG1 4.37Å; F140-K170 HydrophobicContact CD1-CD 3.94Å; F140-K170 HydrophobicContact CE1-CB 3.94Å; F140-K170 HydrophobicContact CE1-CD 3.63Å; F140-K170 HydrophobicContact CE1-CG 3.79Å; F140-V171 HydrophobicContact CE1-CG2 4.43Å; F140-V171 HydrophobicContact CE2-CG2 4.44Å; F140-V171 HydrophobicContact CZ-CG2 3.78Å
141	F	85	Confident	83.3	Confident	23 Å²	23	71.7 Å²	71.7	10%	0.101	37%	0.373	C	S	.	.			trans	-84.8	67.3	179.4	-73.5	-85.4	0	0	0	112.4	L102 Y126 V129 G130 A133 C137 R138 F163	L102-F141 HydrophobicContact CD1-CE2 3.88Å; L102-F141 HydrophobicContact CD1-CZ 3.78Å; Y126-F141 HydrophobicContact CD1-CD1 4.1Å; Y126-F141 AromaticContact CD2-CD1 3.74Å; Y126-F141 HydrophobicContact CD2-CD1 3.74Å; Y126-F141 AromaticContact CD2-CE1 3.78Å; Y126-F141 HydrophobicContact CD2-CE1 3.78Å; Y126-F141 HydrophobicContact CE1-CB 4.31Å; Y126-F141 AromaticContact CE1-CD1 3.91Å; Y126-F141 HydrophobicContact CE1-CD1 3.91Å; Y126-F141 AromaticContact CE2-CD1 3.54Å; Y126-F141 HydrophobicContact CE2-CD1 3.54Å; Y126-F141 AromaticContact CE2-CE1 3.81Å; Y126-F141 HydrophobicContact CE2-CE1 3.81Å; Y126-F141 HydrophobicContact CE2-CG 4.48Å; Y126-F141 HydrophobicContact CG-CD1 4.03Å; Y126-F141 HydrophobicContact CG-CE1 4.33Å; Y126-F141 AromaticContact CZ-CD1 3.65Å; Y126-F141 WeakPolarHBondContact O-CD1 3.08Å; Y126-F141 WeakPolarHBondContact O-CE1 3.27Å; Y126-F141 VanDerWaalsContact OH-CA 3.26Å; Y126-F141 WeakPolarHBondContact OH-CA 3.39Å; V129-F141 HydrophobicContact CB-CE1 4.06Å; V129-F141 HydrophobicContact CB-CZ 4.23Å; V129-F141 HydrophobicContact CG1-CE1 3.92Å; V129-F141 HydrophobicContact CG1-CZ 3.58Å; G130-F141 VanDerWaalsContact CA-CG 3.42Å; A133-F141 HydrophobicContact CB-CE2 3.99Å; A133-F141 HydrophobicContact CB-CZ 4.5Å; C137-F141 HydrophobicContact CB-CD2 4.11Å; C137-F141 HydrophobicContact CB-CE2 4Å; C137-F141 WeakPolarHBondContact O-CD2 3.45Å; C137-F141 PolarHBondContact O-N 3.07Å; R138-F141 PolarHBondContact O-N 3.4Å; F141-F163 HydrophobicContact CD1-CZ 4.2Å; F141-F163 HydrophobicContact CD2-CZ 4.44Å; F141-F163 AromaticContact CE1-CE1 3.82Å; F141-F163 HydrophobicContact CE1-CE1 3.82Å; F141-F163 AromaticContact CE1-CZ 3.81Å; F141-F163 HydrophobicContact CE1-CZ 3.81Å; F141-F163 HydrophobicContact CE2-CE1 4.26Å; F141-F163 HydrophobicContact CE2-CZ 4.06Å; F141-F163 AromaticContact CZ-CE1 3.59Å; F141-F163 HydrophobicContact CZ-CE1 3.59Å; F141-F163 AromaticContact CZ-CZ 3.72Å; F141-F163 HydrophobicContact CZ-CZ 3.72Å
142	T	87	Confident	82.3	Confident	55 Å²	55	70.1 Å²	70.1	34%	0.337	38%	0.38	S	S	.	.			trans	-120	147.3	178	65.1	0	0	0	0	111.6	Y126 F140 R144 V145 Y146	Y126-T142 PolarHBondContact OH-N 2.86Å; Y126-T142 VanDerWaalsContact OH-N 3.16Å; Y126-T142 PolarHBondContact OH-O 2.6Å; F140-T142 VanDerWaalsContact C-N 3.34Å; F140-T142 PolarHBondContact O-N 3.14Å; F140-T142 VanDerWaalsContact O-N 3.11Å; T142-R144 PolarHBondContact O-N 3.34Å; T142-R144 VanDerWaalsContact O-N 3.1Å; T142-V145 PolarHBondContact O-N 2.97Å; T142-V145 VanDerWaalsContact OG1-CG2 3.28Å; T142-V145 WeakPolarHBondContact OG1-CG2 3.42Å; T142-V145 PolarHBondContact OG1-N 3.1Å; T142-Y146 PolarHBondContact O-N 3.45Å
143	A	85	Confident	81.6	Confident	59 Å²	59	66.5 Å²	66.5	49%	0.488	37%	0.366	S	S	.	.	H	α-helix	trans	-54.8	-31.9	175.9	0	0	0	0	0	112.7	Y146 A147	A143-Y146 PolarHBondContact O-N 2.9Å; A143-A147 WeakPolarHBondContact O-CB 3.06Å; A143-A147 PolarHBondContact O-N 3.4Å
144	R	86.6	Confident	81.2	Confident	184 Å²	184	71.2 Å²	71.2	69%	0.694	40%	0.395	S	S	*	.	H	α-helix	trans	-67.4	-37.8	176	-171.9	177.8	-175.9	-171.8	1.1	112.7	T142 K148	T142-R144 PolarHBondContact O-N 3.34Å; T142-R144 VanDerWaalsContact O-N 3.1Å; R144-K148 WeakPolarHBondContact O-CB 3.47Å; R144-K148 VanDerWaalsContact O-CG 3.3Å; R144-K148 WeakPolarHBondContact O-CG 3.35Å; R144-K148 PolarHBondContact O-N 2.9Å
145	V	86.2	Confident	80.7	Confident	9 Å²	9	78 Å²	78	6%	0.055	41%	0.413	C	S	.	.	H	α-helix	trans	-69.8	-44.8	175.7	171.2	0	0	0	0	109.6	T142 A147 K148 L149 F163 Y166	T142-V145 PolarHBondContact O-N 2.97Å; T142-V145 VanDerWaalsContact OG1-CG2 3.28Å; T142-V145 WeakPolarHBondContact OG1-CG2 3.42Å; T142-V145 PolarHBondContact OG1-N 3.1Å; V145-A147 PolarHBondContact O-N 3.37Å; V145-K148 PolarHBondContact O-N 3.08Å; V145-L149 HydrophobicContact CG1-CD1 3.85Å; V145-L149 WeakPolarHBondContact O-CG 3.28Å; V145-L149 PolarHBondContact O-N 2.88Å; V145-L149 VanDerWaalsContact O-N 3.11Å; V145-F163 HydrophobicContact CG1-CD2 4.23Å; V145-F163 HydrophobicContact CG1-CE2 4.01Å; V145-Y166 HydrophobicContact CB-CE1 4.43Å; V145-Y166 HydrophobicContact CG1-CD1 3.84Å; V145-Y166 HydrophobicContact CG1-CE1 3.57Å; V145-Y166 HydrophobicContact CG2-CE1 3.9Å
146	Y	85.7	Confident	80.5	Confident	15 Å²	15	74.5 Å²	74.5	6%	0.059	40%	0.396	C	S	.	.	H	α-helix	trans	-56.6	-49.8	176.2	-164.1	-90.8	0	0	0	112.1	I121 N122 Y123 Y126 T142 A143 K148 L149 L150 G156 I158	I121-Y146 PolarHBondContact O-OH 2.7Å; I121-Y146 VanDerWaalsContact O-OH 3.08Å; N122-Y146 VanDerWaalsContact C-OH 3.24Å; N122-Y146 WeakPolarHBondContact CA-OH 3.41Å; Y123-Y146 AromaticContact CD2-CD1 3.65Å; Y123-Y146 HydrophobicContact CD2-CD1 3.65Å; Y123-Y146 AromaticContact CD2-CD2 3.82Å; Y123-Y146 HydrophobicContact CD2-CD2 3.82Å; Y123-Y146 AromaticContact CD2-CE1 3.9Å; Y123-Y146 HydrophobicContact CD2-CE1 3.9Å; Y123-Y146 HydrophobicContact CD2-CE2 4.08Å; Y123-Y146 AromaticContact CD2-CG 3.61Å; Y123-Y146 HydrophobicContact CD2-CG 3.61Å; Y123-Y146 HydrophobicContact CE2-CD1 4.33Å; Y123-Y146 HydrophobicContact CE2-CG 4.09Å; Y123-Y146 HydrophobicContact CG-CD1 4.49Å; Y123-Y146 HydrophobicContact CG-CE1 4.36Å; Y123-Y146 PolarHBondContact N-OH 3.34Å; Y126-Y146 AromaticContact CD1-CD2 3.74Å; Y126-Y146 HydrophobicContact CD1-CD2 3.74Å; Y126-Y146 HydrophobicContact CD1-CE2 4.41Å; Y126-Y146 HydrophobicContact CD1-CG 4.47Å; Y126-Y146 AromaticContact CD2-CD2 3.79Å; Y126-Y146 HydrophobicContact CD2-CD2 3.79Å; Y126-Y146 HydrophobicContact CD2-CE2 4.21Å; Y126-Y146 HydrophobicContact CE1-CD2 4.03Å; Y126-Y146 HydrophobicContact CE2-CD2 4.07Å; Y126-Y146 AromaticContact CG-CD2 3.59Å; Y126-Y146 HydrophobicContact CG-CD2 3.59Å; Y126-Y146 AromaticContact CG-CE2 3.93Å; Y126-Y146 HydrophobicContact CG-CE2 3.93Å; T142-Y146 PolarHBondContact O-N 3.45Å; A143-Y146 PolarHBondContact O-N 2.9Å; Y146-K148 VanDerWaalsContact C-N 3.28Å; Y146-K148 PolarHBondContact O-N 3.08Å; Y146-L149 PolarHBondContact O-N 2.91Å; Y146-L150 HydrophobicContact CE1-CD1 4.06Å; Y146-L150 PolarHBondContact O-N 3.22Å; Y146-L150 VanDerWaalsContact O-N 3.11Å; Y146-G156 PolarHBondContact OH-O 2.9Å; Y146-I158 HydrophobicContact CD1-CG2 4.44Å; Y146-I158 HydrophobicContact CD2-CD1 3.57Å; Y146-I158 HydrophobicContact CD2-CG1 4.21Å; Y146-I158 HydrophobicContact CD2-CG2 4.23Å; Y146-I158 HydrophobicContact CE1-CG2 4.14Å; Y146-I158 HydrophobicContact CE2-CB 4.42Å; Y146-I158 HydrophobicContact CE2-CD1 3.57Å; Y146-I158 HydrophobicContact CE2-CG1 3.7Å; Y146-I158 HydrophobicContact CE2-CG2 3.91Å; Y146-I158 HydrophobicContact CG-CG2 4.47Å
147	A	84.4	Confident	80.4	Confident	66 Å²	66	74.3 Å²	74.3	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-30.9	178.9	0	0	0	0	0	113.5	A143 V145	A143-A147 WeakPolarHBondContact O-CB 3.06Å; A143-A147 PolarHBondContact O-N 3.4Å; V145-A147 PolarHBondContact O-N 3.37Å
148	K	85	Confident	80.7	Confident	148 Å²	148	74.2 Å²	74.2	64%	0.643	39%	0.393	S	S	*	.	H	α-helix	trans	-71.9	-32.6	176	-82.9	-178.3	172.2	-163.9	0	113.2	R144 V145 Y146 L150	R144-K148 WeakPolarHBondContact O-CB 3.47Å; R144-K148 VanDerWaalsContact O-CG 3.3Å; R144-K148 WeakPolarHBondContact O-CG 3.35Å; R144-K148 PolarHBondContact O-N 2.9Å; V145-K148 PolarHBondContact O-N 3.08Å; Y146-K148 VanDerWaalsContact C-N 3.28Å; Y146-K148 PolarHBondContact O-N 3.08Å; K148-L150 VanDerWaalsContact C-N 3.33Å
149	L	84.4	Confident	80.9	Confident	30 Å²	30	66.7 Å²	66.7	16%	0.157	37%	0.366	C	S	.	.	H	α-helix	trans	-91	-1	-179.6	-64.7	172.5	0	0	0	112.5	V145 Y146 S151 I158 F163 Y166	V145-L149 HydrophobicContact CG1-CD1 3.85Å; V145-L149 WeakPolarHBondContact O-CG 3.28Å; V145-L149 PolarHBondContact O-N 2.88Å; V145-L149 VanDerWaalsContact O-N 3.11Å; Y146-L149 PolarHBondContact O-N 2.91Å; L149-S151 PolarHBondContact O-N 3.28Å; L149-I158 HydrophobicContact CB-CB 4.47Å; L149-I158 HydrophobicContact CB-CG2 4.22Å; L149-F163 HydrophobicContact CD1-CB 4.03Å; L149-F163 HydrophobicContact CD1-CD2 3.64Å; L149-F163 HydrophobicContact CD1-CG 4.33Å; L149-Y166 HydrophobicContact CD1-CG 4.43Å
150	L	83.1	Confident	81	Confident	76 Å²	76	61 Å²	61	40%	0.398	34%	0.335	S	S	.	.			trans	-72.5	96.3	176.8	-160.9	72.9	0	0	0	109.7	Y146 K148 G156 I158	Y146-L150 HydrophobicContact CE1-CD1 4.06Å; Y146-L150 PolarHBondContact O-N 3.22Å; Y146-L150 VanDerWaalsContact O-N 3.11Å; K148-L150 VanDerWaalsContact C-N 3.33Å; L150-G156 VanDerWaalsContact CD1-C 3.45Å; L150-I158 HydrophobicContact CD1-CG2 3.98Å
151	S	67.6	Low	81	Confident	60 Å²	60	65 Å²	65	42%	0.42	36%	0.355	S	S	.	.			trans	-93.8	98.1	177.3	57.4	0	0	0	0	110.3	L149 D153	L149-S151 PolarHBondContact O-N 3.28Å; S151-D153 PolarHBondContact O-N 3.24Å
152	S	63.5	Low	81.1	Confident	129 Å²	129	67.7 Å²	67.7	90%	0.902	37%	0.368	S	S	*	.	S	Bend	trans	41.6	24.2	163.3	-50.4	0	0	0	0	117.8	P154	S152-P154 WeakPolarHBondContact O-CD 3.46Å
153	D	71.4	Confident	81.2	Confident	41 Å²	41	65.1 Å²	65.1	22%	0.219	35%	0.352	C	S	.	.			trans	-85	123.2	-176.6	177	32.7	0	0	0	109.5	S151 Y155 G156 R157	S151-D153 PolarHBondContact O-N 3.24Å; D153-Y155 PolarHBondContact O-N 3.46Å; D153-Y155 PolarHBondContact OD1-N 3.41Å; D153-G156 PolarHBondContact O-N 3.35Å; D153-G156 PolarHBondContact OD2-N 3.02Å; D153-R157 WeakPolarHBondContact OD2-CA 3.48Å; D153-R157 WeakPolarHBondContact OD2-CB 3.33Å; D153-R157 WeakPolarHBondContact OD2-CG 3.48Å; D153-R157 PolarHBondContact OD2-N 2.93Å
154	P	67.8	Low	81.4	Confident	118 Å²	118	63.3 Å²	63.3	77%	0.766	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23	176.3	-25.9	34.8	0	0	0	114.1	S152	S152-P154 WeakPolarHBondContact O-CD 3.46Å
155	Y	70.8	Confident	81.5	Confident	168 Å²	168	56.7 Å²	56.7	66%	0.659	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	3.6	-178	-58.4	-80.3	0	0	0	113.9	D153 R157	D153-Y155 PolarHBondContact O-N 3.46Å; D153-Y155 PolarHBondContact OD1-N 3.41Å; Y155-R157 PolarHBondContact O-N 3.34Å
156	G	78.1	Confident	81.6	Confident	28 Å²	28	59.4 Å²	59.4	29%	0.289	32%	0.322	S	S	.	.			trans	64.5	34.6	175.6	0	0	0	0	0	114.4	Y146 L150 D153	Y146-G156 PolarHBondContact OH-O 2.9Å; L150-G156 VanDerWaalsContact CD1-C 3.45Å; D153-G156 PolarHBondContact O-N 3.35Å; D153-G156 PolarHBondContact OD2-N 3.02Å
157	R	83	Confident	81.8	Confident	48 Å²	48	58.7 Å²	58.7	18%	0.181	32%	0.319	C	S	.	.			trans	-99.7	159.5	177.9	-51.5	171.4	-169.6	-175.2	4.2	111	P112 M120 D153 Y155	P112-R157 PolarHBondContact O-NH1 3.45Å; M120-R157 HydrophobicContact CB-CB 4.25Å; M120-R157 HydrophobicContact CE-CB 3.91Å; D153-R157 WeakPolarHBondContact OD2-CA 3.48Å; D153-R157 WeakPolarHBondContact OD2-CB 3.33Å; D153-R157 WeakPolarHBondContact OD2-CG 3.48Å; D153-R157 PolarHBondContact OD2-N 2.93Å; Y155-R157 PolarHBondContact O-N 3.34Å
158	I	86.5	Confident	82	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.7	174.7	68.2	173.9	0	0	0	110.7	M120 I121 Y126 Y146 L149 L150 F163	M120-I158 CarbonylContact C-O 3.55Å; M120-I158 WeakPolarHBondContact CA-O 3.09Å; I121-I158 HydrophobicContact CG2-CD1 3.98Å; I121-I158 HydrophobicContact CG2-CG1 3.42Å; I121-I158 VanDerWaalsContact CG2-CG1 3.42Å; I121-I158 PolarHBondContact N-O 3.05Å; I121-I158 PolarHBondContact O-N 3.17Å; I121-I158 VanDerWaalsContact O-N 3.07Å; Y126-I158 HydrophobicContact CD2-CD1 4.15Å; Y126-I158 HydrophobicContact CE2-CD1 4.28Å; Y146-I158 HydrophobicContact CD1-CG2 4.44Å; Y146-I158 HydrophobicContact CD2-CD1 3.57Å; Y146-I158 HydrophobicContact CD2-CG1 4.21Å; Y146-I158 HydrophobicContact CD2-CG2 4.23Å; Y146-I158 HydrophobicContact CE1-CG2 4.14Å; Y146-I158 HydrophobicContact CE2-CB 4.42Å; Y146-I158 HydrophobicContact CE2-CD1 3.57Å; Y146-I158 HydrophobicContact CE2-CG1 3.7Å; Y146-I158 HydrophobicContact CE2-CG2 3.91Å; Y146-I158 HydrophobicContact CG-CG2 4.47Å; L149-I158 HydrophobicContact CB-CB 4.47Å; L149-I158 HydrophobicContact CB-CG2 4.22Å; L150-I158 HydrophobicContact CD1-CG2 3.98Å; I158-F163 HydrophobicContact CD1-CB 4.12Å; I158-F163 HydrophobicContact CD1-CG 4.4Å
159	S	87.4	Confident	82.1	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.042	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.1	173.5	171.1	0	0	0	0	110.5	M120 M161 Q162 F163	M120-S159 WeakPolarHBondContact SD-CA 3.29Å; S159-M161 VanDerWaalsContact C-N 3.25Å; S159-M161 PolarHBondContact O-N 3.37Å; S159-M161 PolarHBondContact OG-N 3.15Å; S159-Q162 PolarHBondContact O-N 3.13Å; S159-Q162 PolarHBondContact OG-N 2.91Å; S159-F163 PolarHBondContact O-N 3.18Å
160	I	87.3	Confident	82.3	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-41.3	176.5	-74.1	168.4	0	0	0	109.9	W103 L106 Q110 A119 I121 Q162 F163 F164	W103-I160 HydrophobicContact CZ3-CG2 4.35Å; L106-I160 HydrophobicContact CB-CG1 4.45Å; L106-I160 HydrophobicContact CB-CG2 3.68Å; L106-I160 HydrophobicContact CD1-CG2 4.22Å; L106-I160 HydrophobicContact CG-CG2 4.45Å; L106-I160 WeakPolarHBondContact O-CD1 3.35Å; Q110-I160 HydrophobicContact CB-CD1 3.61Å; A119-I160 HydrophobicContact CB-CB 4.4Å; A119-I160 HydrophobicContact CB-CD1 3.97Å; A119-I160 WeakPolarHBondContact O-CB 3.48Å; A119-I160 PolarHBondContact O-N 3.32Å; I121-I160 HydrophobicContact CB-CD1 4.26Å; I121-I160 HydrophobicContact CB-CG1 3.89Å; I121-I160 HydrophobicContact CG2-CG1 4.02Å; I160-Q162 PolarHBondContact O-N 2.89Å; I160-F163 PolarHBondContact O-N 2.65Å; I160-F164 WeakPolarHBondContact O-CB 3.47Å; I160-F164 PolarHBondContact O-N 3.44Å
161	M	85.9	Confident	82.6	Confident	98 Å²	98	58.8 Å²	58.8	48%	0.483	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-44.5	179	-171.5	58.8	171.5	0	0	111.5	W103 S159 F163 F164 N165	W103-M161 HydrophobicContact CH2-SD 3.89Å; W103-M161 HydrophobicContact CZ3-SD 3.9Å; S159-M161 VanDerWaalsContact C-N 3.25Å; S159-M161 PolarHBondContact O-N 3.37Å; S159-M161 PolarHBondContact OG-N 3.15Å; M161-F163 PolarHBondContact O-N 3.41Å; M161-F164 PolarHBondContact O-N 3.44Å; M161-N165 VanDerWaalsContact O-CB 3.3Å; M161-N165 WeakPolarHBondContact O-CB 3.34Å; M161-N165 PolarHBondContact O-N 3.18Å; M161-N165 PolarHBondContact O-ND2 2.94Å
162	Q	86.8	Confident	83.5	Confident	81 Å²	81	59.7 Å²	59.7	38%	0.379	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-41.3	177.4	-67.1	178.8	2.1	0	0	112.3	S159 I160 Y166	S159-Q162 PolarHBondContact O-N 3.13Å; S159-Q162 PolarHBondContact OG-N 2.91Å; I160-Q162 PolarHBondContact O-N 2.89Å; Q162-Y166 WeakPolarHBondContact O-CB 3.35Å; Q162-Y166 PolarHBondContact O-N 3.32Å
163	F	89.2	Confident	84.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-44.3	175.7	176.1	-110.3	0	0	0	112.1	L106 Y126 F140 F141 V145 L149 I158 S159 I160 M161 N165 Y166 V167	L106-F163 HydrophobicContact CD1-CD1 3.85Å; L106-F163 HydrophobicContact CD1-CE1 4.14Å; L106-F163 HydrophobicContact CD2-CD1 3.91Å; L106-F163 HydrophobicContact CD2-CE1 4.05Å; Y126-F163 HydrophobicContact CE2-CD2 4.01Å; Y126-F163 HydrophobicContact CE2-CE1 4.24Å; Y126-F163 AromaticContact CE2-CE2 3.59Å; Y126-F163 HydrophobicContact CE2-CE2 3.59Å; Y126-F163 HydrophobicContact CE2-CG 4.5Å; Y126-F163 AromaticContact CE2-CZ 3.71Å; Y126-F163 HydrophobicContact CE2-CZ 3.71Å; F140-F163 HydrophobicContact CB-CZ 4.41Å; F141-F163 HydrophobicContact CD1-CZ 4.2Å; F141-F163 HydrophobicContact CD2-CZ 4.44Å; F141-F163 AromaticContact CE1-CE1 3.82Å; F141-F163 HydrophobicContact CE1-CE1 3.82Å; F141-F163 AromaticContact CE1-CZ 3.81Å; F141-F163 HydrophobicContact CE1-CZ 3.81Å; F141-F163 HydrophobicContact CE2-CE1 4.26Å; F141-F163 HydrophobicContact CE2-CZ 4.06Å; F141-F163 AromaticContact CZ-CE1 3.59Å; F141-F163 HydrophobicContact CZ-CE1 3.59Å; F141-F163 AromaticContact CZ-CZ 3.72Å; F141-F163 HydrophobicContact CZ-CZ 3.72Å; V145-F163 HydrophobicContact CG1-CD2 4.23Å; V145-F163 HydrophobicContact CG1-CE2 4.01Å; L149-F163 HydrophobicContact CD1-CB 4.03Å; L149-F163 HydrophobicContact CD1-CD2 3.64Å; L149-F163 HydrophobicContact CD1-CG 4.33Å; I158-F163 HydrophobicContact CD1-CB 4.12Å; I158-F163 HydrophobicContact CD1-CG 4.4Å; S159-F163 PolarHBondContact O-N 3.18Å; I160-F163 PolarHBondContact O-N 2.65Å; M161-F163 PolarHBondContact O-N 3.41Å; F163-N165 PolarHBondContact O-N 3.19Å; F163-Y166 WeakPolarHBondContact O-CB 3.47Å; F163-Y166 PolarHBondContact O-N 2.89Å; F163-Y166 VanDerWaalsContact O-N 3.16Å; F163-V167 HydrophobicContact CD2-CG2 4.44Å; F163-V167 HydrophobicContact CE1-CG2 4.04Å; F163-V167 HydrophobicContact CE2-CG2 3.93Å; F163-V167 HydrophobicContact CZ-CG2 3.72Å; F163-V167 WeakPolarHBondContact O-CG2 3.34Å; F163-V167 PolarHBondContact O-N 2.94Å
164	F	88.9	Confident	85.5	Confident	22 Å²	22	58.5 Å²	58.5	10%	0.096	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-45.2	177.7	-173	-105.3	0	0	0	111.4	L99 L102 W103 L106 I160 M161 Y166 V167 M168	L99-F164 WeakPolarHBondContact O-CE2 3.43Å; L102-F164 HydrophobicContact CD2-CD2 4.46Å; W103-F164 HydrophobicContact CB-CD2 4.36Å; W103-F164 HydrophobicContact CB-CE2 3.88Å; W103-F164 HydrophobicContact CB-CZ 4.2Å; W103-F164 HydrophobicContact CE3-CB 3.98Å; W103-F164 AromaticContact CE3-CD1 3.61Å; W103-F164 HydrophobicContact CE3-CD1 3.61Å; W103-F164 AromaticContact CE3-CD2 3.83Å; W103-F164 HydrophobicContact CE3-CD2 3.83Å; W103-F164 AromaticContact CE3-CE1 3.98Å; W103-F164 HydrophobicContact CE3-CE1 3.98Å; W103-F164 HydrophobicContact CE3-CE2 4.19Å; W103-F164 AromaticContact CE3-CG 3.52Å; W103-F164 HydrophobicContact CE3-CG 3.52Å; W103-F164 HydrophobicContact CE3-CZ 4.26Å; W103-F164 HydrophobicContact CZ3-CB 3.97Å; W103-F164 AromaticContact CZ3-CD1 3.84Å; W103-F164 HydrophobicContact CZ3-CD1 3.84Å; W103-F164 AromaticContact CZ3-CG 3.9Å; W103-F164 HydrophobicContact CZ3-CG 3.9Å; L106-F164 HydrophobicContact CD1-CB 4.47Å; L106-F164 HydrophobicContact CD1-CD2 4.28Å; I160-F164 WeakPolarHBondContact O-CB 3.47Å; I160-F164 PolarHBondContact O-N 3.44Å; M161-F164 PolarHBondContact O-N 3.44Å; F164-Y166 VanDerWaalsContact C-N 3.29Å; F164-Y166 PolarHBondContact O-N 3.24Å; F164-V167 PolarHBondContact O-N 3.07Å; F164-V167 VanDerWaalsContact O-N 3.12Å; F164-M168 HydrophobicContact CD1-CE 4.15Å; F164-M168 HydrophobicContact CD1-CG 4.04Å; F164-M168 HydrophobicContact CD1-SD 4.17Å; F164-M168 HydrophobicContact CE1-CE 3.86Å; F164-M168 HydrophobicContact CE1-CG 3.7Å; F164-M168 HydrophobicContact CE1-SD 3.44Å; F164-M168 WeakPolarHBondContact CE1-SD 3.25Å; F164-M168 HydrophobicContact CZ-CG 3.98Å; F164-M168 HydrophobicContact CZ-SD 3.93Å; F164-M168 WeakPolarHBondContact O-CG 3.3Å; F164-M168 PolarHBondContact O-N 3.03Å
165	N	88.1	Confident	86.6	Confident	45 Å²	45	58.5 Å²	58.5	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-37.5	173.7	-72.7	-18.9	0	0	0	112.3	M161 F163 R169	M161-N165 VanDerWaalsContact O-CB 3.3Å; M161-N165 WeakPolarHBondContact O-CB 3.34Å; M161-N165 PolarHBondContact O-N 3.18Å; M161-N165 PolarHBondContact O-ND2 2.94Å; F163-N165 PolarHBondContact O-N 3.19Å; N165-R169 VanDerWaalsContact O-CB 3.31Å; N165-R169 WeakPolarHBondContact O-CB 3.47Å; N165-R169 WeakPolarHBondContact O-CG 3.12Å; N165-R169 PolarHBondContact O-N 3.11Å
166	Y	89.6	Confident	87.4	Confident	66 Å²	66	51.2 Å²	51.2	26%	0.259	24%	0.238	S	C	.	.	H	α-helix	trans	-61.4	-45.6	173.1	170.6	-95.3	0	0	0	112	F140 V145 L149 Q162 F163 F164 K170	F140-Y166 HydrophobicContact CD1-CE1 4.37Å; V145-Y166 HydrophobicContact CB-CE1 4.43Å; V145-Y166 HydrophobicContact CG1-CD1 3.84Å; V145-Y166 HydrophobicContact CG1-CE1 3.57Å; V145-Y166 HydrophobicContact CG2-CE1 3.9Å; L149-Y166 HydrophobicContact CD1-CG 4.43Å; Q162-Y166 WeakPolarHBondContact O-CB 3.35Å; Q162-Y166 PolarHBondContact O-N 3.32Å; F163-Y166 WeakPolarHBondContact O-CB 3.47Å; F163-Y166 PolarHBondContact O-N 2.89Å; F163-Y166 VanDerWaalsContact O-N 3.16Å; F164-Y166 VanDerWaalsContact C-N 3.29Å; F164-Y166 PolarHBondContact O-N 3.24Å; Y166-K170 HydrophobicContact CE1-CD 4.23Å; Y166-K170 WeakPolarHBondContact O-CB 3.49Å; Y166-K170 PolarHBondContact O-N 3.01Å; Y166-K170 VanDerWaalsContact O-N 3.07Å; Y166-K170 PolarHBondContact OH-NZ 3.45Å
167	V	89.8	Confident	88	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-49.3	177.5	177.1	0	0	0	0	110.3	L94 L99 L102 F140 F163 F164 R169 K170 V171	L94-V167 HydrophobicContact CD1-CG1 3.74Å; L99-V167 HydrophobicContact CD2-CG1 4.22Å; L102-V167 HydrophobicContact CD2-CB 4.38Å; L102-V167 HydrophobicContact CD2-CG1 3.89Å; L102-V167 HydrophobicContact CD2-CG2 4.39Å; F140-V167 HydrophobicContact CB-CG2 3.95Å; F140-V167 HydrophobicContact CD1-CG1 4.27Å; F140-V167 HydrophobicContact CD1-CG2 4.15Å; F140-V167 HydrophobicContact CD2-CG1 4.24Å; F140-V167 HydrophobicContact CE1-CG1 4.33Å; F140-V167 HydrophobicContact CE2-CG1 4.33Å; F140-V167 HydrophobicContact CG-CG1 4.23Å; F140-V167 HydrophobicContact CG-CG2 4.04Å; F140-V167 HydrophobicContact CZ-CG1 4.37Å; F163-V167 HydrophobicContact CD2-CG2 4.44Å; F163-V167 HydrophobicContact CE1-CG2 4.04Å; F163-V167 HydrophobicContact CE2-CG2 3.93Å; F163-V167 HydrophobicContact CZ-CG2 3.72Å; F163-V167 WeakPolarHBondContact O-CG2 3.34Å; F163-V167 PolarHBondContact O-N 2.94Å; F164-V167 PolarHBondContact O-N 3.07Å; F164-V167 VanDerWaalsContact O-N 3.12Å; V167-R169 PolarHBondContact O-N 3.02Å; V167-K170 PolarHBondContact O-N 3.27Å; V167-V171 HydrophobicContact CG1-CG2 4.21Å; V167-V171 WeakPolarHBondContact O-CG2 3.31Å; V167-V171 PolarHBondContact O-N 3.35Å
168	M	87.8	Confident	88.3	Confident	78 Å²	78	54.4 Å²	54.4	38%	0.384	24%	0.243	S	C	.	.	H	α-helix	trans	-56.8	-51.4	178.1	-73	-146.5	-58.5	0	0	112	F164 K170 V171 W172	F164-M168 HydrophobicContact CD1-CE 4.15Å; F164-M168 HydrophobicContact CD1-CG 4.04Å; F164-M168 HydrophobicContact CD1-SD 4.17Å; F164-M168 HydrophobicContact CE1-CE 3.86Å; F164-M168 HydrophobicContact CE1-CG 3.7Å; F164-M168 HydrophobicContact CE1-SD 3.44Å; F164-M168 WeakPolarHBondContact CE1-SD 3.25Å; F164-M168 HydrophobicContact CZ-CG 3.98Å; F164-M168 HydrophobicContact CZ-SD 3.93Å; F164-M168 WeakPolarHBondContact O-CG 3.3Å; F164-M168 PolarHBondContact O-N 3.03Å; M168-K170 VanDerWaalsContact C-N 3.26Å; M168-K170 PolarHBondContact O-N 3.07Å; M168-V171 PolarHBondContact O-N 3.07Å; M168-W172 VanDerWaalsContact O-CB 3.25Å; M168-W172 WeakPolarHBondContact O-CB 3.18Å; M168-W172 PolarHBondContact O-N 2.81Å
169	R	87	Confident	88.4	Confident	179 Å²	179	55.5 Å²	55.5	68%	0.675	25%	0.253	S	S	*	.	H	α-helix	trans	-57.5	-40	178.3	-74.8	175	-177.2	177.6	0.8	112	N165 V167 L173	N165-R169 VanDerWaalsContact O-CB 3.31Å; N165-R169 WeakPolarHBondContact O-CB 3.47Å; N165-R169 WeakPolarHBondContact O-CG 3.12Å; N165-R169 PolarHBondContact O-N 3.11Å; V167-R169 PolarHBondContact O-N 3.02Å; R169-L173 WeakPolarHBondContact O-CB 3.36Å; R169-L173 VanDerWaalsContact O-CG 3.31Å; R169-L173 WeakPolarHBondContact O-CG 3.33Å; R169-L173 PolarHBondContact O-N 2.68Å
170	K	88.5	Confident	88.5	Confident	60 Å²	60	55.2 Å²	55.2	26%	0.261	25%	0.251	S	S	.	.	H	α-helix	trans	-73.4	-40.2	-179.2	-172.1	167.4	172.1	-168.5	0	112.6	F140 Y166 V167 M168 W172 H174	F140-K170 HydrophobicContact CD1-CD 3.94Å; F140-K170 HydrophobicContact CE1-CB 3.94Å; F140-K170 HydrophobicContact CE1-CD 3.63Å; F140-K170 HydrophobicContact CE1-CG 3.79Å; Y166-K170 HydrophobicContact CE1-CD 4.23Å; Y166-K170 WeakPolarHBondContact O-CB 3.49Å; Y166-K170 PolarHBondContact O-N 3.01Å; Y166-K170 VanDerWaalsContact O-N 3.07Å; Y166-K170 PolarHBondContact OH-NZ 3.45Å; V167-K170 PolarHBondContact O-N 3.27Å; M168-K170 VanDerWaalsContact C-N 3.26Å; M168-K170 PolarHBondContact O-N 3.07Å; K170-W172 VanDerWaalsContact C-N 3.35Å; K170-H174 PolarHBondContact O-CD2 3.06Å; K170-H174 PolarHBondContact O-N 2.72Å; K170-H174 VanDerWaalsContact O-N 3.14Å
171	V	89.8	Confident	88.6	Confident	5 Å²	5	56 Å²	56	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-47.9	172.8	171.9	0	0	0	0	109.8	L94 F140 V167 M168 H174 Q175	L94-V171 HydrophobicContact CB-CG2 4.08Å; L94-V171 HydrophobicContact CD1-CG2 3.88Å; L94-V171 HydrophobicContact CG-CG2 4.3Å; F140-V171 HydrophobicContact CE1-CG2 4.43Å; F140-V171 HydrophobicContact CE2-CG2 4.44Å; F140-V171 HydrophobicContact CZ-CG2 3.78Å; V167-V171 HydrophobicContact CG1-CG2 4.21Å; V167-V171 WeakPolarHBondContact O-CG2 3.31Å; V167-V171 PolarHBondContact O-N 3.35Å; M168-V171 PolarHBondContact O-N 3.07Å; V171-H174 PolarHBondContact O-N 2.95Å; V171-Q175 WeakPolarHBondContact O-CB 3.35Å; V171-Q175 PolarHBondContact O-N 3.09Å
172	W	87.1	Confident	88.7	Confident	78 Å²	78	56.1 Å²	56.1	30%	0.295	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-49.5	177.2	178.5	92.2	0	0	0	112.1	M168 K170 H174 Q175 T176 D253 L256	M168-W172 VanDerWaalsContact O-CB 3.25Å; M168-W172 WeakPolarHBondContact O-CB 3.18Å; M168-W172 PolarHBondContact O-N 2.81Å; K170-W172 VanDerWaalsContact C-N 3.35Å; W172-H174 VanDerWaalsContact C-N 3.26Å; W172-H174 PolarHBondContact O-N 3.15Å; W172-Q175 WeakPolarHBondContact O-CB 3.46Å; W172-Q175 PolarHBondContact O-N 3.25Å; W172-T176 WeakPolarHBondContact O-CB 3.41Å; W172-T176 PolarHBondContact O-N 2.96Å; W172-T176 PolarHBondContact O-OG1 3.35Å; W172-T176 VanDerWaalsContact O-OG1 3.04Å; W172-D253 WeakPolarHBondContact CH2-OD1 3.35Å; W172-L256 HydrophobicContact CH2-CD1 4.22Å; W172-L256 HydrophobicContact CZ2-CD1 3.33Å
173	L	87.6	Confident	88.7	Confident	70 Å²	70	54.3 Å²	54.3	37%	0.366	25%	0.249	S	C	.	.	H	α-helix	trans	-57	-40.6	177.1	-81.2	171.9	0	0	0	112.1	R169 R177	R169-L173 WeakPolarHBondContact O-CB 3.36Å; R169-L173 VanDerWaalsContact O-CG 3.31Å; R169-L173 WeakPolarHBondContact O-CG 3.33Å; R169-L173 PolarHBondContact O-N 2.68Å; L173-R177 WeakPolarHBondContact O-CB 3.4Å; L173-R177 PolarHBondContact O-N 3.46Å
174	H	89.4	Confident	88.6	Confident	76 Å²	76	54.7 Å²	54.7	35%	0.352	25%	0.251	S	S	.	.	H	α-helix	trans	-69.3	-40.8	176.2	-73.8	-54.9	0	0	0	112.3	L93 K170 V171 W172 R177 I178	L93-H174 HydrophobicContact CD1-CB 4.19Å; L93-H174 HydrophobicContact CD2-CB 3.62Å; K170-H174 PolarHBondContact O-CD2 3.06Å; K170-H174 PolarHBondContact O-N 2.72Å; K170-H174 VanDerWaalsContact O-N 3.14Å; V171-H174 PolarHBondContact O-N 2.95Å; W172-H174 VanDerWaalsContact C-N 3.26Å; W172-H174 PolarHBondContact O-N 3.15Å; H174-R177 PolarHBondContact O-N 3.3Å; H174-I178 WeakPolarHBondContact O-CB 3.49Å; H174-I178 WeakPolarHBondContact O-CG1 3.45Å; H174-I178 PolarHBondContact O-N 3.05Å
175	Q	89.3	Confident	87.8	Confident	117 Å²	117	57.6 Å²	57.6	55%	0.547	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-49.4	177.3	-172.8	176.8	1.2	0	0	111.2	L93 V171 W172 R177 I178 G179	L93-Q175 HydrophobicContact CD1-CB 3.92Å; V171-Q175 WeakPolarHBondContact O-CB 3.35Å; V171-Q175 PolarHBondContact O-N 3.09Å; W172-Q175 WeakPolarHBondContact O-CB 3.46Å; W172-Q175 PolarHBondContact O-N 3.25Å; Q175-R177 VanDerWaalsContact C-N 3.34Å; Q175-R177 PolarHBondContact O-N 2.72Å; Q175-I178 PolarHBondContact O-N 3.3Å; Q175-I178 VanDerWaalsContact O-N 3.17Å; Q175-G179 PolarHBondContact O-N 3.15Å
176	T	88.8	Confident	87.1	Confident	15 Å²	15	56.8 Å²	56.8	9%	0.092	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-41	177.5	-52.7	0	0	0	0	111.2	W172 I178 G179 L180 L247 L252	W172-T176 WeakPolarHBondContact O-CB 3.41Å; W172-T176 PolarHBondContact O-N 2.96Å; W172-T176 PolarHBondContact O-OG1 3.35Å; W172-T176 VanDerWaalsContact O-OG1 3.04Å; T176-I178 PolarHBondContact O-N 2.85Å; T176-G179 PolarHBondContact O-N 3.35Å; T176-L180 HydrophobicContact CG2-CD1 4.29Å; T176-L180 WeakPolarHBondContact O-CG 3.45Å; T176-L180 PolarHBondContact O-N 2.73Å; T176-L247 HydrophobicContact CG2-CD2 3.72Å; T176-L252 HydrophobicContact CG2-CD2 3.78Å
177	R	90.9	Very high	86.5	Confident	121 Å²	121	55 Å²	55	46%	0.457	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-44.3	173.3	-175.5	174.3	172.2	-172.9	-2.3	112.3	L173 H174 Q175 S181 I243 L247	L173-R177 WeakPolarHBondContact O-CB 3.4Å; L173-R177 PolarHBondContact O-N 3.46Å; H174-R177 PolarHBondContact O-N 3.3Å; Q175-R177 VanDerWaalsContact C-N 3.34Å; Q175-R177 PolarHBondContact O-N 2.72Å; R177-S181 VanDerWaalsContact O-CB 3.27Å; R177-S181 WeakPolarHBondContact O-CB 3.37Å; R177-S181 PolarHBondContact O-N 2.99Å; R177-S181 PolarHBondContact O-OG 2.59Å; R177-I243 HydrophobicContact CG-CG2 4.3Å; R177-L247 HydrophobicContact CB-CD1 3.59Å; R177-L247 HydrophobicContact CG-CD1 3.81Å
178	I	88.8	Confident	86.1	Confident	23 Å²	23	59.4 Å²	59.4	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-45.6	177.5	-71.2	167.9	0	0	0	109.6	L86 K89 L93 H174 Q175 T176 S181 L182	L86-I178 HydrophobicContact CB-CG2 4.29Å; L86-I178 HydrophobicContact CD2-CG2 4.34Å; K89-I178 HydrophobicContact CB-CD1 3.91Å; L93-I178 HydrophobicContact CD1-CD1 3.83Å; L93-I178 HydrophobicContact CG-CD1 4.42Å; H174-I178 WeakPolarHBondContact O-CB 3.49Å; H174-I178 WeakPolarHBondContact O-CG1 3.45Å; H174-I178 PolarHBondContact O-N 3.05Å; Q175-I178 PolarHBondContact O-N 3.3Å; Q175-I178 VanDerWaalsContact O-N 3.17Å; T176-I178 PolarHBondContact O-N 2.85Å; I178-S181 WeakPolarHBondContact O-CB 3.15Å; I178-S181 PolarHBondContact O-N 2.79Å; I178-S181 VanDerWaalsContact O-N 3.13Å; I178-L182 PolarHBondContact O-N 2.86Å; I178-L182 VanDerWaalsContact O-N 3.17Å
179	G	88.1	Confident	86.1	Confident	22 Å²	22	57.4 Å²	57.4	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-54.1	-55.1	176	0	0	0	0	0	112.1	Q175 T176 S181 L182 Y183	Q175-G179 PolarHBondContact O-N 3.15Å; T176-G179 PolarHBondContact O-N 3.35Å; G179-S181 VanDerWaalsContact C-N 3.27Å; G179-S181 PolarHBondContact O-N 3.07Å; G179-L182 WeakPolarHBondContact O-CB 3.35Å; G179-L182 PolarHBondContact O-N 2.79Å; G179-L182 VanDerWaalsContact O-N 3.15Å; G179-Y183 VanDerWaalsContact O-CD2 3.23Å; G179-Y183 WeakPolarHBondContact O-CD2 3.26Å; G179-Y183 WeakPolarHBondContact O-CE2 3.21Å
180	L	90.3	Very high	86.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-35.8	176.5	-69.2	171.7	0	0	0	112.5	T176 L182 Y183 L191 Y199 I243 I246 L247	T176-L180 HydrophobicContact CG2-CD1 4.29Å; T176-L180 WeakPolarHBondContact O-CG 3.45Å; T176-L180 PolarHBondContact O-N 2.73Å; L180-L182 PolarHBondContact O-N 3.19Å; L180-Y183 PolarHBondContact O-N 2.97Å; L180-L191 HydrophobicContact CB-CD1 4.3Å; L180-L191 HydrophobicContact CD2-CD1 3.9Å; L180-Y199 HydrophobicContact CD2-CD1 3.79Å; L180-Y199 HydrophobicContact CD2-CD2 4.11Å; L180-Y199 HydrophobicContact CD2-CE1 3.71Å; L180-Y199 HydrophobicContact CD2-CE2 4.03Å; L180-Y199 HydrophobicContact CD2-CG 3.98Å; L180-I243 HydrophobicContact CB-CG1 4.48Å; L180-I243 HydrophobicContact CB-CG2 3.9Å; L180-I243 HydrophobicContact CD1-CG2 4.03Å; L180-I246 HydrophobicContact CD1-CB 4.33Å; L180-I246 HydrophobicContact CD1-CG2 3.83Å; L180-L247 HydrophobicContact CD1-CD2 4.14Å; L180-L247 HydrophobicContact CD1-CG 4.33Å
181	S	89.9	Confident	86.5	Confident	19 Å²	19	47.5 Å²	47.5	13%	0.133	25%	0.252	C	S	.	.	H	α-helix	trans	-69.4	-16.6	179.7	-59.5	0	0	0	0	113.9	R82 R177 I178 G179 Y183	R82-S181 PolarHBondContact NH2-O 2.9Å; R177-S181 VanDerWaalsContact O-CB 3.27Å; R177-S181 WeakPolarHBondContact O-CB 3.37Å; R177-S181 PolarHBondContact O-N 2.99Å; R177-S181 PolarHBondContact O-OG 2.59Å; I178-S181 WeakPolarHBondContact O-CB 3.15Å; I178-S181 PolarHBondContact O-N 2.79Å; I178-S181 VanDerWaalsContact O-N 3.13Å; G179-S181 VanDerWaalsContact C-N 3.27Å; G179-S181 PolarHBondContact O-N 3.07Å; S181-Y183 VanDerWaalsContact C-N 3.31Å
182	L	87.6	Confident	86.6	Confident	101 Å²	101	53.2 Å²	53.2	53%	0.529	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-30.8	173.6	-69	166.3	0	0	0	111.6	L86 I178 G179 L180	L86-L182 HydrophobicContact CB-CD2 4.12Å; L86-L182 HydrophobicContact CD1-CD2 3.65Å; L86-L182 HydrophobicContact CD1-CG 4.12Å; I178-L182 PolarHBondContact O-N 2.86Å; I178-L182 VanDerWaalsContact O-N 3.17Å; G179-L182 WeakPolarHBondContact O-CB 3.35Å; G179-L182 PolarHBondContact O-N 2.79Å; G179-L182 VanDerWaalsContact O-N 3.15Å; L180-L182 PolarHBondContact O-N 3.19Å
183	Y	87.3	Confident	86.9	Confident	44 Å²	44	51.7 Å²	51.7	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-86.1	-15.1	179.8	-56.9	-91.2	0	0	0	113.1	G179 L180 S181 V185 N198 Y199 E202	G179-Y183 VanDerWaalsContact O-CD2 3.23Å; G179-Y183 WeakPolarHBondContact O-CD2 3.26Å; G179-Y183 WeakPolarHBondContact O-CE2 3.21Å; L180-Y183 PolarHBondContact O-N 2.97Å; S181-Y183 VanDerWaalsContact C-N 3.31Å; Y183-V185 PolarHBondContact O-N 3.39Å; Y183-N198 HydrophobicContact CD1-CB 4.09Å; Y183-N198 HydrophobicContact CE1-CB 4.25Å; Y183-Y199 HydrophobicContact CD2-CD2 4.01Å; Y183-Y199 HydrophobicContact CD2-CG 4.46Å; Y183-Y199 AromaticContact CE2-CD2 3.48Å; Y183-Y199 HydrophobicContact CE2-CD2 3.48Å; Y183-Y199 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y199 HydrophobicContact CE2-CE2 4.4Å; Y183-Y199 HydrophobicContact CE2-CG 4.24Å; Y183-Y199 AromaticContact CZ-CD2 3.97Å; Y183-E202 PolarHBondContact OH-OE2 2.92Å
184	D	86.8	Confident	87.1	Confident	7 Å²	7	51 Å²	51	4%	0.037	27%	0.271	C	S	.	.			trans	-76.5	85.7	171.8	175.5	10	0	0	0	109.9	R82 A186 G187 Q188 G189 L191 I243	R82-D184 PolarHBondContact NH1-O 3.08Å; R82-D184 PolarHBondContact NH2-O 3.19Å; R82-D184 IonicContact NH2-OD2 2.6Å; D184-A186 VanDerWaalsContact C-N 3.27Å; D184-A186 PolarHBondContact O-N 3.41Å; D184-A186 PolarHBondContact OD1-N 3.13Å; D184-G187 VanDerWaalsContact CG-N 3.3Å; D184-G187 PolarHBondContact O-N 3.3Å; D184-G187 WeakPolarHBondContact OD1-CA 3.42Å; D184-G187 PolarHBondContact OD1-N 3.48Å; D184-G187 VanDerWaalsContact OD2-C 3.27Å; D184-G187 WeakPolarHBondContact OD2-CA 3.22Å; D184-G187 PolarHBondContact OD2-N 2.9Å; D184-Q188 PolarHBondContact OD1-N 2.82Å; D184-Q188 PolarHBondContact OD2-N 3.04Å; D184-G189 WeakPolarHBondContact OD2-CA 3.16Å; D184-G189 PolarHBondContact OD2-N 3.16Å; D184-L191 HydrophobicContact CB-CD2 3.85Å; D184-I243 HydrophobicContact CB-CD1 4.19Å
185	V	72.4	Confident	87.3	Confident	83 Å²	83	48.5 Å²	48.5	50%	0.503	26%	0.26	S	S	.	.	S	Bend	trans	-58.4	-37.9	-179.4	-178	0	0	0	0	111.9	E79 R82 Y183	E79-V185 HydrophobicContact CG-CG1 4.24Å; E79-V185 WeakPolarHBondContact OE1-CG1 3.38Å; R82-V185 VanDerWaalsContact NH1-C 3.33Å; R82-V185 PolarHBondContact NH1-O 3.13Å; Y183-V185 PolarHBondContact O-N 3.39Å
186	A	73	Confident	87.5	Confident	29 Å²	29	43 Å²	43	24%	0.24	23%	0.234	C	C	.	.	S	Bend	trans	-78.3	-29.9	-176.3	0	0	0	0	0	113.5	L66 R78 D184 Q188	L66-A186 HydrophobicContact CD1-CB 4.38Å; R78-A186 PolarHBondContact NE-O 2.96Å; R78-A186 PolarHBondContact NH2-O 3.48Å; D184-A186 VanDerWaalsContact C-N 3.27Å; D184-A186 PolarHBondContact O-N 3.41Å; D184-A186 PolarHBondContact OD1-N 3.13Å; A186-Q188 HydrophobicContact CB-CG 3.93Å
187	G	77.3	Confident	87.8	Confident	27 Å²	27	45.4 Å²	45.4	28%	0.278	25%	0.245	S	C	.	.			trans	77.6	33.8	179	0	0	0	0	0	112.4	D184	D184-G187 VanDerWaalsContact CG-N 3.3Å; D184-G187 PolarHBondContact O-N 3.3Å; D184-G187 WeakPolarHBondContact OD1-CA 3.42Å; D184-G187 PolarHBondContact OD1-N 3.48Å; D184-G187 VanDerWaalsContact OD2-C 3.27Å; D184-G187 WeakPolarHBondContact OD2-CA 3.22Å; D184-G187 PolarHBondContact OD2-N 2.9Å
188	Q	81.6	Confident	87.9	Confident	94 Å²	94	43.7 Å²	43.7	44%	0.439	24%	0.244	S	C	.	.	S	Bend	trans	-98	-0.6	-178	-63.5	-171.2	-59	0	0	111.8	L66 D184 A186 Y190	L66-Q188 VanDerWaalsContact CD1-CD 3.48Å; L66-Q188 HydrophobicContact CD1-CG 3.93Å; D184-Q188 PolarHBondContact OD1-N 2.82Å; D184-Q188 PolarHBondContact OD2-N 3.04Å; A186-Q188 HydrophobicContact CB-CG 3.93Å; Q188-Y190 HydrophobicContact CB-CD1 3.51Å; Q188-Y190 HydrophobicContact CB-CE1 3.2Å; Q188-Y190 HydrophobicContact CG-CE1 4.03Å; Q188-Y190 PolarHBondContact OE1-OH 3.34Å
189	G	86.8	Confident	88.1	Confident	35 Å²	35	43.7 Å²	43.7	36%	0.361	24%	0.243	S	C	.	.	S	Bend	trans	80.7	18.2	177.6	0	0	0	0	0	113.7	D184 K242 I243	D184-G189 WeakPolarHBondContact OD2-CA 3.16Å; D184-G189 PolarHBondContact OD2-N 3.16Å; G189-K242 WeakPolarHBondContact O-CA 3.43Å; G189-I243 PolarHBondContact O-N 3.05Å
190	Y	90.9	Very high	88.4	Confident	30 Å²	30	42.7 Å²	42.7	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.2	176.8	67.5	-103.1	0	0	0	110.8	Q188 R192 K240 I241	Q188-Y190 HydrophobicContact CB-CD1 3.51Å; Q188-Y190 HydrophobicContact CB-CE1 3.2Å; Q188-Y190 HydrophobicContact CG-CE1 4.03Å; Q188-Y190 PolarHBondContact OE1-OH 3.34Å; Y190-R192 HydrophobicContact CE2-CG 4.24Å; Y190-K240 HydrophobicContact CD2-CB 3.81Å; Y190-K240 HydrophobicContact CD2-CD 3.86Å; Y190-K240 HydrophobicContact CD2-CG 3.72Å; Y190-K240 HydrophobicContact CE1-CD 4.16Å; Y190-K240 HydrophobicContact CE2-CB 4.27Å; Y190-K240 HydrophobicContact CE2-CD 3.49Å; Y190-K240 VanDerWaalsContact CE2-CD 3.49Å; Y190-K240 HydrophobicContact CE2-CG 3.67Å; Y190-K240 HydrophobicContact CG-CB 4.2Å; Y190-K240 HydrophobicContact CG-CD 4.36Å; Y190-K240 HydrophobicContact CG-CG 4.46Å; Y190-K240 PolarHBondContact OH-NZ 2.66Å; Y190-K240 VanDerWaalsContact OH-NZ 3.11Å; Y190-I241 CarbonylContact C-O 3.48Å; Y190-I241 WeakPolarHBondContact CA-O 3.46Å; Y190-I241 VanDerWaalsContact CB-O 3.29Å; Y190-I241 WeakPolarHBondContact CB-O 3.28Å
191	L	92.8	Very high	88.5	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.7	175.9	-62.2	-179.9	0	0	0	109.7	L180 D184 D195 L196 I241 I243 I246	L180-L191 HydrophobicContact CB-CD1 4.3Å; L180-L191 HydrophobicContact CD2-CD1 3.9Å; D184-L191 HydrophobicContact CB-CD2 3.85Å; L191-D195 HydrophobicContact CB-CB 4.19Å; L191-D195 HydrophobicContact CD2-CB 3.94Å; L191-L196 HydrophobicContact CD1-CD1 4.27Å; L191-I241 PolarHBondContact N-O 3.08Å; L191-I241 PolarHBondContact O-N 2.86Å; L191-I243 HydrophobicContact CD1-CG1 4.36Å; L191-I243 HydrophobicContact CD2-CD1 4.45Å; L191-I243 HydrophobicContact CD2-CG1 4.46Å; L191-I243 HydrophobicContact CG-CD1 4.49Å; L191-I243 HydrophobicContact CG-CG1 3.98Å; L191-I246 HydrophobicContact CD1-CD1 3.87Å
192	R	92.9	Very high	88.6	Confident	126 Å²	126	51.7 Å²	51.7	48%	0.475	28%	0.275	S	S	.	.			trans	-89	172.1	167.5	-60.2	-179.2	-175.7	-174.1	2.3	109.8	Y190 S194 D195 L196	Y190-R192 HydrophobicContact CE2-CG 4.24Å; R192-S194 PolarHBondContact O-N 3.44Å; R192-D195 WeakPolarHBondContact CB-OD2 3.42Å; R192-D195 PolarHBondContact N-OD2 3.43Å; R192-D195 PolarHBondContact O-N 3.13Å; R192-D195 VanDerWaalsContact O-N 3.09Å; R192-L196 PolarHBondContact O-N 2.83Å; R192-L196 VanDerWaalsContact O-N 3.12Å
193	E	92.4	Very high	88.7	Confident	45 Å²	45	47.3 Å²	47.3	21%	0.21	25%	0.252	C	S	.	.	H	α-helix	trans	-55.9	-49.9	-179.2	-160.9	169.1	-158.1	0	0	111.4	D195 L196 E197 V226 R227 F230 K331	E193-D195 VanDerWaalsContact C-N 3.26Å; E193-D195 PolarHBondContact O-N 2.91Å; E193-L196 PolarHBondContact O-N 2.92Å; E193-E197 VanDerWaalsContact O-CG 3.27Å; E193-E197 WeakPolarHBondContact O-CG 3.23Å; E193-E197 PolarHBondContact O-N 3.26Å; E193-V226 HydrophobicContact CG-CG1 3.67Å; E193-R227 IonicContact OE1-CZ 3.06Å; E193-R227 IonicContact OE1-NH1 3.48Å; E193-R227 PolarHBondContact OE1-NH1 3.15Å; E193-F230 HydrophobicContact CB-CE2 4.05Å; E193-F230 HydrophobicContact CB-CZ 4.04Å; E193-F230 HydrophobicContact CG-CD2 4.36Å; E193-F230 HydrophobicContact CG-CE2 4.19Å; E193-F230 VanDerWaalsContact N-CZ 3.29Å; E193-K331 WeakPolarHBondContact OE1-CE 3.36Å; E193-K331 IonicContact OE1-NZ 2.8Å; E193-K331 PolarHBondContact OE1-NZ 3.42Å; E193-K331 IonicContact OE2-NZ 3.42Å; E193-K331 PolarHBondContact OE2-NZ 3.46Å
194	S	92.8	Very high	88.9	Confident	57 Å²	57	45.3 Å²	45.3	40%	0.399	24%	0.244	S	C	.	.	H	α-helix	trans	-56.4	-37.1	175.7	55.5	0	0	0	0	113.9	R192 N198	R192-S194 PolarHBondContact O-N 3.44Å; S194-N198 VanDerWaalsContact O-CG 3.25Å; S194-N198 PolarHBondContact O-N 3.09Å; S194-N198 VanDerWaalsContact O-N 3.1Å; S194-N198 PolarHBondContact O-ND2 3.1Å
195	D	93.3	Very high	89.1	Confident	22 Å²	22	49.3 Å²	49.3	12%	0.118	27%	0.271	C	S	.	.	H	α-helix	trans	-71	-40.4	-176.7	-51.1	-27.5	0	0	0	109.9	L191 R192 E193 Y199	L191-D195 HydrophobicContact CB-CB 4.19Å; L191-D195 HydrophobicContact CD2-CB 3.94Å; R192-D195 WeakPolarHBondContact CB-OD2 3.42Å; R192-D195 PolarHBondContact N-OD2 3.43Å; R192-D195 PolarHBondContact O-N 3.13Å; R192-D195 VanDerWaalsContact O-N 3.09Å; E193-D195 VanDerWaalsContact C-N 3.26Å; E193-D195 PolarHBondContact O-N 2.91Å; D195-Y199 PolarHBondContact O-N 3.37Å; D195-Y199 VanDerWaalsContact O-N 3.14Å
196	L	93.1	Very high	89.9	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-75	-34.2	177.2	-166.5	63.7	0	0	0	112.2	L191 R192 E193 Y199 I200 V226 F229 F230 I246	L191-L196 HydrophobicContact CD1-CD1 4.27Å; R192-L196 PolarHBondContact O-N 2.83Å; R192-L196 VanDerWaalsContact O-N 3.12Å; E193-L196 PolarHBondContact O-N 2.92Å; L196-Y199 HydrophobicContact CD1-CD1 3.93Å; L196-Y199 PolarHBondContact O-N 3.35Å; L196-I200 HydrophobicContact CG-CD1 4.33Å; L196-I200 WeakPolarHBondContact O-CG1 3.23Å; L196-I200 PolarHBondContact O-N 2.95Å; L196-V226 HydrophobicContact CB-CG2 4.36Å; L196-V226 HydrophobicContact CD2-CG1 4.32Å; L196-V226 HydrophobicContact CD2-CG2 4.44Å; L196-V226 HydrophobicContact CG-CG2 4.17Å; L196-F229 HydrophobicContact CD2-CB 3.66Å; L196-F229 HydrophobicContact CD2-CD2 4Å; L196-F229 HydrophobicContact CD2-CG 3.89Å; L196-F230 HydrophobicContact CB-CE2 4.42Å; L196-F230 HydrophobicContact CD2-CD2 4.42Å; L196-F230 HydrophobicContact CD2-CE2 4.08Å; L196-I246 HydrophobicContact CD1-CD1 4.44Å
197	E	94.4	Very high	90.7	Very high	66 Å²	66	47.5 Å²	47.5	31%	0.308	26%	0.257	S	S	.	.	H	α-helix	trans	-57.8	-48.1	171.8	-74	174.5	172.4	0	0	111	E193 Y199 I200 L201 V222 V226	E193-E197 VanDerWaalsContact O-CG 3.27Å; E193-E197 WeakPolarHBondContact O-CG 3.23Å; E193-E197 PolarHBondContact O-N 3.26Å; E197-Y199 PolarHBondContact O-N 3.37Å; E197-I200 PolarHBondContact O-N 2.97Å; E197-L201 VanDerWaalsContact O-CB 3.27Å; E197-L201 WeakPolarHBondContact O-CB 3.49Å; E197-L201 PolarHBondContact O-N 2.71Å; E197-V222 HydrophobicContact CB-CG1 3.74Å; E197-V222 HydrophobicContact CG-CG1 3.85Å; E197-V226 HydrophobicContact CB-CG2 4.37Å; E197-V226 HydrophobicContact CG-CB 4.38Å; E197-V226 HydrophobicContact CG-CG1 4.26Å; E197-V226 HydrophobicContact CG-CG2 3.78Å
198	N	93.4	Very high	91.3	Very high	84 Å²	84	48 Å²	48	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-42.7	176.8	-70.8	-37.8	0	0	0	111.9	Y183 S194 L201 E202	Y183-N198 HydrophobicContact CD1-CB 4.09Å; Y183-N198 HydrophobicContact CE1-CB 4.25Å; S194-N198 VanDerWaalsContact O-CG 3.25Å; S194-N198 PolarHBondContact O-N 3.09Å; S194-N198 VanDerWaalsContact O-N 3.1Å; S194-N198 PolarHBondContact O-ND2 3.1Å; N198-L201 PolarHBondContact O-N 3.3Å; N198-E202 PolarHBondContact O-N 3.24Å
199	Y	93.3	Very high	91.6	Very high	23 Å²	23	45.5 Å²	45.5	9%	0.09	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-48.7	176.4	172.2	-108.4	0	0	0	112.3	L180 Y183 D195 L196 E197 E202 L203	L180-Y199 HydrophobicContact CD2-CD1 3.79Å; L180-Y199 HydrophobicContact CD2-CD2 4.11Å; L180-Y199 HydrophobicContact CD2-CE1 3.71Å; L180-Y199 HydrophobicContact CD2-CE2 4.03Å; L180-Y199 HydrophobicContact CD2-CG 3.98Å; Y183-Y199 HydrophobicContact CD2-CD2 4.01Å; Y183-Y199 HydrophobicContact CD2-CG 4.46Å; Y183-Y199 AromaticContact CE2-CD2 3.48Å; Y183-Y199 HydrophobicContact CE2-CD2 3.48Å; Y183-Y199 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y199 HydrophobicContact CE2-CE2 4.4Å; Y183-Y199 HydrophobicContact CE2-CG 4.24Å; Y183-Y199 AromaticContact CZ-CD2 3.97Å; D195-Y199 PolarHBondContact O-N 3.37Å; D195-Y199 VanDerWaalsContact O-N 3.14Å; L196-Y199 HydrophobicContact CD1-CD1 3.93Å; L196-Y199 PolarHBondContact O-N 3.35Å; E197-Y199 PolarHBondContact O-N 3.37Å; Y199-E202 PolarHBondContact O-N 3.38Å; Y199-L203 HydrophobicContact CE1-CD2 4.38Å; Y199-L203 WeakPolarHBondContact O-CB 3.22Å; Y199-L203 PolarHBondContact O-N 3.12Å
200	I	93.6	Very high	91.7	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-40.3	180	-65	-179.9	0	0	0	110.4	L196 E197 E202 L203 I204 Y221 V222 A225 V226 F229 L255	L196-I200 HydrophobicContact CG-CD1 4.33Å; L196-I200 WeakPolarHBondContact O-CG1 3.23Å; L196-I200 PolarHBondContact O-N 2.95Å; E197-I200 PolarHBondContact O-N 2.97Å; I200-E202 VanDerWaalsContact C-N 3.33Å; I200-E202 PolarHBondContact O-N 2.92Å; I200-L203 WeakPolarHBondContact O-CB 3.47Å; I200-L203 PolarHBondContact O-N 3.44Å; I200-I204 WeakPolarHBondContact O-CG1 3.49Å; I200-I204 PolarHBondContact O-N 3.05Å; I200-Y221 HydrophobicContact CG2-CE1 4.17Å; I200-V222 HydrophobicContact CG2-CG2 4.24Å; I200-A225 HydrophobicContact CD1-CB 3.63Å; I200-A225 HydrophobicContact CG2-CB 4.17Å; I200-V226 HydrophobicContact CD1-CG2 3.56Å; I200-V226 HydrophobicContact CG1-CG2 4.43Å; I200-F229 HydrophobicContact CD1-CD2 4.46Å; I200-F229 HydrophobicContact CD1-CE2 4.32Å; I200-L255 HydrophobicContact CG1-CD2 4.48Å
201	L	93.1	Very high	91.4	Very high	88 Å²	88	47.7 Å²	47.7	46%	0.461	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-41.7	178.8	-172.6	147.2	0	0	0	112.4	E197 N198 L203 V222	E197-L201 VanDerWaalsContact O-CB 3.27Å; E197-L201 WeakPolarHBondContact O-CB 3.49Å; E197-L201 PolarHBondContact O-N 2.71Å; N198-L201 PolarHBondContact O-N 3.3Å; L201-L203 VanDerWaalsContact C-N 3.3Å; L201-V222 HydrophobicContact CB-CG2 4.09Å
202	E	91.1	Very high	90.9	Very high	119 Å²	119	51.5 Å²	51.5	56%	0.556	29%	0.288	S	S	*	.	H	α-helix	trans	-72.8	-23.4	174.9	-71.8	-175	-176.9	0	0	113.1	Y183 N198 Y199 I200 P205	Y183-E202 PolarHBondContact OH-OE2 2.92Å; N198-E202 PolarHBondContact O-N 3.24Å; Y199-E202 PolarHBondContact O-N 3.38Å; I200-E202 VanDerWaalsContact C-N 3.33Å; I200-E202 PolarHBondContact O-N 2.92Å; E202-P205 WeakPolarHBondContact O-CD 3.34Å
203	L	91.3	Very high	90.8	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-75.5	-35	177.2	-169.4	68.9	0	0	0	112.2	Y199 I200 L201 T206 L207 L255 L256	Y199-L203 HydrophobicContact CE1-CD2 4.38Å; Y199-L203 WeakPolarHBondContact O-CB 3.22Å; Y199-L203 PolarHBondContact O-N 3.12Å; I200-L203 WeakPolarHBondContact O-CB 3.47Å; I200-L203 PolarHBondContact O-N 3.44Å; L201-L203 VanDerWaalsContact C-N 3.3Å; L203-T206 WeakPolarHBondContact CD1-OG1 3.3Å; L203-T206 WeakPolarHBondContact O-CA 3.36Å; L203-T206 WeakPolarHBondContact O-CB 3.48Å; L203-T206 PolarHBondContact O-N 3.46Å; L203-T206 PolarHBondContact O-OG1 3.11Å; L203-L207 HydrophobicContact CD2-CD1 4.12Å; L203-L207 HydrophobicContact CG-CD1 4Å; L203-L207 HydrophobicContact CG-CD2 4.24Å; L203-L207 HydrophobicContact CG-CG 4.13Å; L203-L255 HydrophobicContact CD2-CD1 4.44Å; L203-L255 HydrophobicContact CD2-CD2 3.67Å; L203-L255 HydrophobicContact CD2-CG 3.88Å; L203-L256 HydrophobicContact CD1-CD2 4.27Å; L203-L256 HydrophobicContact CD2-CD2 4.22Å
204	I	91.7	Very high	90.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-46.6	-50.7	-175.2	-71.4	164.1	0	0	0	113.4	I200 T206 L207 L210 Y218 Y221 V222	I200-I204 WeakPolarHBondContact O-CG1 3.49Å; I200-I204 PolarHBondContact O-N 3.05Å; I204-T206 PolarHBondContact O-N 3.31Å; I204-L207 PolarHBondContact O-N 3.01Å; I204-L210 HydrophobicContact CG1-CD1 4.17Å; I204-L210 HydrophobicContact CG2-CB 4.36Å; I204-Y218 HydrophobicContact CD1-CG 4.37Å; I204-Y218 HydrophobicContact CG2-CE1 4.21Å; I204-Y218 HydrophobicContact CG2-CE2 4.22Å; I204-Y221 HydrophobicContact CD1-CD1 3.77Å; I204-Y221 HydrophobicContact CD1-CE1 4.22Å; I204-Y221 HydrophobicContact CG1-CD1 4.08Å; I204-Y221 HydrophobicContact CG1-CE1 4.01Å; I204-V222 HydrophobicContact CD1-CG2 3.8Å
205	P	89.9	Confident	90.4	Very high	91 Å²	91	56.2 Å²	56.2	59%	0.591	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-67	-9.8	-178.2	-18.9	33.1	0	0	0	114.6	E202	E202-P205 WeakPolarHBondContact O-CD 3.34Å
206	T	89.2	Confident	90.2	Very high	72 Å²	72	59 Å²	59	44%	0.442	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-96.9	-1.3	176.9	74.1	0	0	0	0	112.8	L203 I204 P208	L203-T206 WeakPolarHBondContact CD1-OG1 3.3Å; L203-T206 WeakPolarHBondContact O-CA 3.36Å; L203-T206 WeakPolarHBondContact O-CB 3.48Å; L203-T206 PolarHBondContact O-N 3.46Å; L203-T206 PolarHBondContact O-OG1 3.11Å; I204-T206 PolarHBondContact O-N 3.31Å; T206-P208 WeakPolarHBondContact O-CD 3.4Å
207	L	90.8	Very high	90.1	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	33%	0.331	C	S	.	.			trans	-108.6	99.8	-177.5	-58.3	-178.6	0	0	0	109.1	L203 I204 Q209 L210 L255 L258 R259	L203-L207 HydrophobicContact CD2-CD1 4.12Å; L203-L207 HydrophobicContact CG-CD1 4Å; L203-L207 HydrophobicContact CG-CD2 4.24Å; L203-L207 HydrophobicContact CG-CG 4.13Å; I204-L207 PolarHBondContact O-N 3.01Å; L207-Q209 PolarHBondContact O-N 3Å; L207-Q209 VanDerWaalsContact O-N 3.12Å; L207-L210 HydrophobicContact CB-CB 4.25Å; L207-L210 HydrophobicContact CB-CD1 3.92Å; L207-L210 HydrophobicContact CB-CG 3.96Å; L207-L210 HydrophobicContact CD1-CD1 3.46Å; L207-L210 VanDerWaalsContact CD1-CD1 3.46Å; L207-L210 HydrophobicContact CD1-CG 4.29Å; L207-L210 HydrophobicContact CG-CD1 4.27Å; L207-L210 PolarHBondContact O-N 3.05Å; L207-L255 HydrophobicContact CD1-CD1 4.24Å; L207-L258 HydrophobicContact CB-CB 4.33Å; L207-L258 HydrophobicContact CD1-CB 4.31Å; L207-L258 HydrophobicContact CD1-CD1 4.31Å; L207-L258 HydrophobicContact CD2-CB 4.23Å; L207-R259 HydrophobicContact CD2-CB 4.45Å; L207-R259 HydrophobicContact CD2-CG 3.33Å
208	P	89.2	Confident	90	Very high	38 Å²	38	59 Å²	59	25%	0.247	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-56	-33.4	-177.7	-26.5	36.4	0	0	0	113.2	T206 L210 D211 L258 E261	T206-P208 WeakPolarHBondContact O-CD 3.4Å; P208-L210 PolarHBondContact O-N 2.88Å; P208-L210 VanDerWaalsContact O-N 3.12Å; P208-D211 WeakPolarHBondContact O-CB 3.31Å; P208-D211 PolarHBondContact O-N 3.08Å; P208-L258 WeakPolarHBondContact CD-O 3.34Å; P208-E261 HydrophobicContact CB-CG 3.88Å; P208-E261 HydrophobicContact CG-CG 3.83Å
209	Q	88.2	Confident	90	Very high	41 Å²	41	59.4 Å²	59.4	19%	0.192	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-67.3	-11.4	178.5	-59.5	-56.8	-25.4	0	0	114	L207 L258 D260 E261 L263	L207-Q209 PolarHBondContact O-N 3Å; L207-Q209 VanDerWaalsContact O-N 3.12Å; Q209-L258 HydrophobicContact CB-CB 4.24Å; Q209-L258 HydrophobicContact CB-CD2 4.22Å; Q209-L258 WeakPolarHBondContact CG-O 3.3Å; Q209-D260 PolarHBondContact NE2-O 3.09Å; Q209-E261 PolarHBondContact NE2-O 3.32Å; Q209-E261 VanDerWaalsContact NE2-O 3.08Å; Q209-L263 HydrophobicContact CG-CB 4.43Å; Q209-L263 HydrophobicContact CG-CD1 3.86Å
210	L	88.3	Confident	89.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-107	-2.4	177.8	-57.5	-175.8	0	0	0	113.4	I204 L207 P208 G212 L213 Y221 L258 A275	I204-L210 HydrophobicContact CG1-CD1 4.17Å; I204-L210 HydrophobicContact CG2-CB 4.36Å; L207-L210 HydrophobicContact CB-CB 4.25Å; L207-L210 HydrophobicContact CB-CD1 3.92Å; L207-L210 HydrophobicContact CB-CG 3.96Å; L207-L210 HydrophobicContact CD1-CD1 3.46Å; L207-L210 VanDerWaalsContact CD1-CD1 3.46Å; L207-L210 HydrophobicContact CD1-CG 4.29Å; L207-L210 HydrophobicContact CG-CD1 4.27Å; L207-L210 PolarHBondContact O-N 3.05Å; P208-L210 PolarHBondContact O-N 2.88Å; P208-L210 VanDerWaalsContact O-N 3.12Å; L210-G212 PolarHBondContact O-N 3.19Å; L210-G212 VanDerWaalsContact O-N 3.11Å; L210-L213 HydrophobicContact CB-CD1 4.16Å; L210-L213 HydrophobicContact CD2-CD1 3.92Å; L210-L213 WeakPolarHBondContact O-CB 3.47Å; L210-L213 PolarHBondContact O-N 3.44Å; L210-Y221 HydrophobicContact CD1-CE1 3.67Å; L210-Y221 HydrophobicContact CD1-CE2 4.28Å; L210-Y221 VanDerWaalsContact CD1-CZ 3.48Å; L210-Y221 VanDerWaalsContact CD1-OH 3.26Å; L210-Y221 WeakPolarHBondContact CD1-OH 3.1Å; L210-Y221 HydrophobicContact CD2-CE2 3.9Å; L210-L258 HydrophobicContact CD1-CD1 4.42Å; L210-L258 HydrophobicContact CD2-CD1 4.24Å; L210-L258 HydrophobicContact CG-CD1 4.37Å; L210-A275 HydrophobicContact CD2-CB 3.96Å
211	D	84.6	Confident	90	Very high	111 Å²	111	61.8 Å²	61.8	59%	0.594	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.7	-177.1	-80.6	-14.9	0	0	0	113.2	P208 L213	P208-D211 WeakPolarHBondContact O-CB 3.31Å; P208-D211 PolarHBondContact O-N 3.08Å; D211-L213 VanDerWaalsContact C-N 3.28Å; D211-L213 PolarHBondContact O-N 3.07Å
212	G	82.9	Confident	90.1	Very high	81 Å²	81	57.9 Å²	57.9	84%	0.835	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-6.7	177.4	0	0	0	0	0	115.2	L210	L210-G212 PolarHBondContact O-N 3.19Å; L210-G212 VanDerWaalsContact O-N 3.11Å
213	L	89.4	Confident	90.3	Very high	14 Å²	14	53.3 Å²	53.3	7%	0.073	31%	0.307	C	S	.	.	S	Bend	trans	-76	135.3	-177.6	-71	-179.3	0	0	0	112.1	L210 D211 F217 Y218 Y221 A275 L279	L210-L213 HydrophobicContact CB-CD1 4.16Å; L210-L213 HydrophobicContact CD2-CD1 3.92Å; L210-L213 WeakPolarHBondContact O-CB 3.47Å; L210-L213 PolarHBondContact O-N 3.44Å; D211-L213 VanDerWaalsContact C-N 3.28Å; D211-L213 PolarHBondContact O-N 3.07Å; L213-F217 HydrophobicContact CD1-CD1 4.32Å; L213-F217 HydrophobicContact CD2-CD1 3.82Å; L213-F217 HydrophobicContact CD2-CE1 4.14Å; L213-Y218 HydrophobicContact CB-CD1 4.38Å; L213-Y218 HydrophobicContact CB-CE1 3.87Å; L213-Y218 WeakPolarHBondContact O-CE1 3.29Å; L213-Y221 HydrophobicContact CD1-CD2 3.84Å; L213-Y221 HydrophobicContact CD1-CE2 4.28Å; L213-Y221 HydrophobicContact CD1-CG 4.07Å; L213-A275 HydrophobicContact CD1-CB 4.23Å; L213-A275 HydrophobicContact CD2-CB 3.69Å; L213-A275 HydrophobicContact CG-CB 3.93Å; L213-L279 HydrophobicContact CD2-CD1 4.11Å; L213-L279 HydrophobicContact CD2-CG 4.28Å
214	E	89.6	Confident	90.4	Very high	142 Å²	142	53 Å²	53	66%	0.664	31%	0.305	S	S	*	.			trans	-67.4	141.6	172.8	-63.3	-171.4	173.9	0	0	111.5	S216 F217 Y218	E214-S216 WeakPolarHBondContact CB-OG 3.32Å; E214-S216 PolarHBondContact O-N 3.01Å; E214-S216 PolarHBondContact OE2-OG 3.03Å; E214-F217 WeakPolarHBondContact O-CA 3.5Å; E214-F217 WeakPolarHBondContact O-CB 3.48Å; E214-F217 PolarHBondContact O-N 3.5Å; E214-Y218 VanDerWaalsContact O-CD1 3.23Å; E214-Y218 WeakPolarHBondContact O-CD1 3.46Å
215	K	88	Confident	90.6	Very high	172 Å²	172	53 Å²	53	75%	0.748	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-61.3	-28.4	179	-65.7	-175.5	179.3	-177.9	0	113.5	F217 Y218	K215-F217 PolarHBondContact O-N 3.48Å; K215-Y218 HydrophobicContact CG-CE2 4.14Å; K215-Y218 PolarHBondContact O-N 3.09Å
216	S	89.3	Confident	90.9	Very high	79 Å²	79	48.7 Å²	48.7	55%	0.552	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-61.2	-31.4	172.3	46	0	0	0	0	112.2	E214	E214-S216 WeakPolarHBondContact CB-OG 3.32Å; E214-S216 PolarHBondContact O-N 3.01Å; E214-S216 PolarHBondContact OE2-OG 3.03Å
217	F	91.8	Very high	91.1	Very high	15 Å²	15	46.7 Å²	46.7	7%	0.066	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-85.3	-13.3	-178.3	-172.7	-111.1	0	0	0	113.3	L213 E214 K215 S219 F220 Y221 A278 L279 Y282	L213-F217 HydrophobicContact CD1-CD1 4.32Å; L213-F217 HydrophobicContact CD2-CD1 3.82Å; L213-F217 HydrophobicContact CD2-CE1 4.14Å; E214-F217 WeakPolarHBondContact O-CA 3.5Å; E214-F217 WeakPolarHBondContact O-CB 3.48Å; E214-F217 PolarHBondContact O-N 3.5Å; K215-F217 PolarHBondContact O-N 3.48Å; F217-S219 VanDerWaalsContact C-N 3.29Å; F217-S219 PolarHBondContact O-N 3.17Å; F217-F220 HydrophobicContact CD2-CB 3.83Å; F217-F220 HydrophobicContact CD2-CD2 4.31Å; F217-F220 HydrophobicContact CD2-CG 4.44Å; F217-F220 HydrophobicContact CE2-CB 3.65Å; F217-F220 HydrophobicContact CE2-CG 4.49Å; F217-F220 HydrophobicContact CZ-CB 4.35Å; F217-F220 PolarHBondContact O-N 3.31Å; F217-Y221 HydrophobicContact CE1-CD2 4.32Å; F217-Y221 PolarHBondContact O-N 3.41Å; F217-A278 HydrophobicContact CE1-CB 4.25Å; F217-A278 HydrophobicContact CZ-CB 4.33Å; F217-L279 HydrophobicContact CD1-CD2 4.11Å; F217-L279 HydrophobicContact CD2-CD2 4.38Å; F217-L279 HydrophobicContact CE1-CD2 3.83Å; F217-L279 HydrophobicContact CE1-CG 4.24Å; F217-L279 HydrophobicContact CE2-CD2 4.16Å; F217-L279 HydrophobicContact CG-CD2 4.37Å; F217-L279 HydrophobicContact CZ-CD2 3.87Å; F217-L279 HydrophobicContact CZ-CG 4.43Å; F217-Y282 HydrophobicContact CD2-CD1 4.03Å; F217-Y282 HydrophobicContact CD2-CE1 4.2Å; F217-Y282 HydrophobicContact CD2-CG 4.46Å; F217-Y282 AromaticContact CE2-CD1 3.48Å; F217-Y282 HydrophobicContact CE2-CD1 3.48Å; F217-Y282 VanDerWaalsContact CE2-CD1 3.48Å; F217-Y282 HydrophobicContact CE2-CD2 4.22Å; F217-Y282 HydrophobicContact CE2-CE1 4.07Å; F217-Y282 AromaticContact CE2-CG 3.56Å; F217-Y282 HydrophobicContact CE2-CG 3.56Å; F217-Y282 HydrophobicContact CZ-CD1 4.5Å; F217-Y282 HydrophobicContact CZ-CG 4.37Å
218	Y	92.4	Very high	91.3	Very high	55 Å²	55	47.6 Å²	47.6	22%	0.216	27%	0.266	C	S	.	.	H	α-helix	trans	-56.7	-40.9	-175.1	-74.9	9.6	0	0	0	112.6	I204 L213 E214 K215 F220 Y221 V222	I204-Y218 HydrophobicContact CD1-CG 4.37Å; I204-Y218 HydrophobicContact CG2-CE1 4.21Å; I204-Y218 HydrophobicContact CG2-CE2 4.22Å; L213-Y218 HydrophobicContact CB-CD1 4.38Å; L213-Y218 HydrophobicContact CB-CE1 3.87Å; L213-Y218 WeakPolarHBondContact O-CE1 3.29Å; E214-Y218 VanDerWaalsContact O-CD1 3.23Å; E214-Y218 WeakPolarHBondContact O-CD1 3.46Å; K215-Y218 HydrophobicContact CG-CE2 4.14Å; K215-Y218 PolarHBondContact O-N 3.09Å; Y218-F220 VanDerWaalsContact C-N 3.32Å; Y218-F220 PolarHBondContact O-N 3.28Å; Y218-Y221 PolarHBondContact O-N 2.51Å; Y218-V222 WeakPolarHBondContact O-CB 3.44Å; Y218-V222 WeakPolarHBondContact O-CG2 3Å; Y218-V222 PolarHBondContact O-N 3.11Å
219	S	91.9	Very high	91.6	Very high	91 Å²	91	45.9 Å²	45.9	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-40.4	177.5	-54.8	0	0	0	0	112.5	F217 C223	F217-S219 VanDerWaalsContact C-N 3.29Å; F217-S219 PolarHBondContact O-N 3.17Å; S219-C223 WeakPolarHBondContact O-CB 3.08Å; S219-C223 PolarHBondContact O-N 2.76Å
220	F	92.5	Very high	91.9	Very high	73 Å²	73	44.6 Å²	44.6	32%	0.32	25%	0.248	S	C	.	.	H	α-helix	trans	-73.2	-39.4	178.3	-65.5	-76.8	0	0	0	111.8	F217 Y218 C223 T224 Y282 Y330	F217-F220 HydrophobicContact CD2-CB 3.83Å; F217-F220 HydrophobicContact CD2-CD2 4.31Å; F217-F220 HydrophobicContact CD2-CG 4.44Å; F217-F220 HydrophobicContact CE2-CB 3.65Å; F217-F220 HydrophobicContact CE2-CG 4.49Å; F217-F220 HydrophobicContact CZ-CB 4.35Å; F217-F220 PolarHBondContact O-N 3.31Å; Y218-F220 VanDerWaalsContact C-N 3.32Å; Y218-F220 PolarHBondContact O-N 3.28Å; F220-C223 PolarHBondContact O-N 2.96Å; F220-T224 WeakPolarHBondContact O-CB 3.29Å; F220-T224 PolarHBondContact O-N 2.8Å; F220-T224 PolarHBondContact O-OG1 2.8Å; F220-Y282 HydrophobicContact CB-CD2 4.34Å; F220-Y282 HydrophobicContact CB-CE2 4.34Å; F220-Y282 HydrophobicContact CD1-CD2 4.04Å; F220-Y282 AromaticContact CD1-CE2 3.46Å; F220-Y282 HydrophobicContact CD1-CE2 3.46Å; F220-Y282 VanDerWaalsContact CD1-CE2 3.46Å; F220-Y282 HydrophobicContact CD2-CE2 4.18Å; F220-Y282 AromaticContact CE1-CE2 3.67Å; F220-Y282 HydrophobicContact CE1-CE2 3.67Å; F220-Y282 HydrophobicContact CE2-CE2 4.35Å; F220-Y282 HydrophobicContact CG-CD2 4.21Å; F220-Y282 AromaticContact CG-CE2 3.73Å; F220-Y282 HydrophobicContact CG-CE2 3.73Å; F220-Y282 HydrophobicContact CZ-CE2 4.11Å; F220-Y330 HydrophobicContact CB-CE1 4.36Å; F220-Y330 AromaticContact CD1-CD1 3.84Å; F220-Y330 HydrophobicContact CD1-CD1 3.84Å; F220-Y330 HydrophobicContact CD1-CE1 4.02Å; F220-Y330 HydrophobicContact CD1-CG 4.47Å; F220-Y330 HydrophobicContact CE1-CD1 4.5Å
221	Y	95.1	Very high	92.1	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-50.6	174.4	178.6	-94	0	0	0	111.4	I200 I204 L210 L213 F217 Y218 C223 T224 A225 F273 A278	I200-Y221 HydrophobicContact CG2-CE1 4.17Å; I204-Y221 HydrophobicContact CD1-CD1 3.77Å; I204-Y221 HydrophobicContact CD1-CE1 4.22Å; I204-Y221 HydrophobicContact CG1-CD1 4.08Å; I204-Y221 HydrophobicContact CG1-CE1 4.01Å; L210-Y221 HydrophobicContact CD1-CE1 3.67Å; L210-Y221 HydrophobicContact CD1-CE2 4.28Å; L210-Y221 VanDerWaalsContact CD1-CZ 3.48Å; L210-Y221 VanDerWaalsContact CD1-OH 3.26Å; L210-Y221 WeakPolarHBondContact CD1-OH 3.1Å; L210-Y221 HydrophobicContact CD2-CE2 3.9Å; L213-Y221 HydrophobicContact CD1-CD2 3.84Å; L213-Y221 HydrophobicContact CD1-CE2 4.28Å; L213-Y221 HydrophobicContact CD1-CG 4.07Å; F217-Y221 HydrophobicContact CE1-CD2 4.32Å; F217-Y221 PolarHBondContact O-N 3.41Å; Y218-Y221 PolarHBondContact O-N 2.51Å; Y221-C223 VanDerWaalsContact C-N 3.32Å; Y221-C223 PolarHBondContact O-N 3.37Å; Y221-T224 WeakPolarHBondContact O-CB 3.35Å; Y221-T224 PolarHBondContact O-N 2.94Å; Y221-T224 VanDerWaalsContact O-N 3.1Å; Y221-A225 HydrophobicContact CE1-CB 4.48Å; Y221-A225 PolarHBondContact O-N 2.88Å; Y221-F273 VanDerWaalsContact CE2-O 3.26Å; Y221-F273 WeakPolarHBondContact CE2-O 3.44Å; Y221-F273 PolarHBondContact OH-O 2.98Å; Y221-A278 HydrophobicContact CD2-CB 3.67Å; Y221-A278 HydrophobicContact CE2-CB 4Å
222	V	95.3	Very high	92.6	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-46.8	178.7	171.5	0	0	0	0	110	E197 I200 L201 I204 Y218 T224 A225 V226	E197-V222 HydrophobicContact CB-CG1 3.74Å; E197-V222 HydrophobicContact CG-CG1 3.85Å; I200-V222 HydrophobicContact CG2-CG2 4.24Å; L201-V222 HydrophobicContact CB-CG2 4.09Å; I204-V222 HydrophobicContact CD1-CG2 3.8Å; Y218-V222 WeakPolarHBondContact O-CB 3.44Å; Y218-V222 WeakPolarHBondContact O-CG2 3Å; Y218-V222 PolarHBondContact O-N 3.11Å; V222-T224 PolarHBondContact O-N 2.71Å; V222-A225 PolarHBondContact O-N 3.04Å; V222-V226 HydrophobicContact CG1-CG2 4.16Å; V222-V226 WeakPolarHBondContact O-CB 3.22Å; V222-V226 VanDerWaalsContact O-CG2 3.24Å; V222-V226 WeakPolarHBondContact O-CG2 3.46Å; V222-V226 PolarHBondContact O-N 3.31Å
223	C	94.5	Very high	93	Very high	23 Å²	23	39.5 Å²	39.5	16%	0.155	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-52.7	173.3	-174.6	0	0	0	0	110.9	S219 F220 Y221 A225 V226 R227	S219-C223 WeakPolarHBondContact O-CB 3.08Å; S219-C223 PolarHBondContact O-N 2.76Å; F220-C223 PolarHBondContact O-N 2.96Å; Y221-C223 VanDerWaalsContact C-N 3.32Å; Y221-C223 PolarHBondContact O-N 3.37Å; C223-A225 VanDerWaalsContact C-N 3.31Å; C223-A225 PolarHBondContact O-N 2.87Å; C223-V226 PolarHBondContact O-N 2.97Å; C223-R227 WeakPolarHBondContact O-CB 3.33Å; C223-R227 WeakPolarHBondContact O-CG 3.45Å; C223-R227 PolarHBondContact O-N 3.27Å
224	T	94.4	Very high	93.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-55.4	-43.2	-179.9	-53.7	0	0	0	0	112.9	F220 Y221 V222 W272 A278 Y330 L334	F220-T224 WeakPolarHBondContact O-CB 3.29Å; F220-T224 PolarHBondContact O-N 2.8Å; F220-T224 PolarHBondContact O-OG1 2.8Å; Y221-T224 WeakPolarHBondContact O-CB 3.35Å; Y221-T224 PolarHBondContact O-N 2.94Å; Y221-T224 VanDerWaalsContact O-N 3.1Å; V222-T224 PolarHBondContact O-N 2.71Å; T224-W272 HydrophobicContact CG2-CZ2 4.12Å; T224-A278 HydrophobicContact CG2-CB 4.48Å; T224-Y330 PolarHBondContact OG1-OH 3.01Å; T224-L334 HydrophobicContact CG2-CD2 3.96Å
225	A	95.4	Very high	92.8	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-48.5	178.5	0	0	0	0	0	111.9	I200 Y221 V222 C223 R227 K228 F229 F273	I200-A225 HydrophobicContact CD1-CB 3.63Å; I200-A225 HydrophobicContact CG2-CB 4.17Å; Y221-A225 HydrophobicContact CE1-CB 4.48Å; Y221-A225 PolarHBondContact O-N 2.88Å; V222-A225 PolarHBondContact O-N 3.04Å; C223-A225 VanDerWaalsContact C-N 3.31Å; C223-A225 PolarHBondContact O-N 2.87Å; A225-R227 VanDerWaalsContact C-N 3.35Å; A225-R227 PolarHBondContact O-N 3.24Å; A225-K228 PolarHBondContact O-N 3.1Å; A225-F229 WeakPolarHBondContact O-CD2 3.44Å; A225-F273 HydrophobicContact CB-CD1 3.84Å; A225-F273 HydrophobicContact CB-CE1 3.99Å
226	V	95.4	Very high	92.5	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-41.1	-179.8	171.1	0	0	0	0	111.5	E193 L196 E197 I200 V222 C223 K228 F229 F230	E193-V226 HydrophobicContact CG-CG1 3.67Å; L196-V226 HydrophobicContact CB-CG2 4.36Å; L196-V226 HydrophobicContact CD2-CG1 4.32Å; L196-V226 HydrophobicContact CD2-CG2 4.44Å; L196-V226 HydrophobicContact CG-CG2 4.17Å; E197-V226 HydrophobicContact CB-CG2 4.37Å; E197-V226 HydrophobicContact CG-CB 4.38Å; E197-V226 HydrophobicContact CG-CG1 4.26Å; E197-V226 HydrophobicContact CG-CG2 3.78Å; I200-V226 HydrophobicContact CD1-CG2 3.56Å; I200-V226 HydrophobicContact CG1-CG2 4.43Å; V222-V226 HydrophobicContact CG1-CG2 4.16Å; V222-V226 WeakPolarHBondContact O-CB 3.22Å; V222-V226 VanDerWaalsContact O-CG2 3.24Å; V222-V226 WeakPolarHBondContact O-CG2 3.46Å; V222-V226 PolarHBondContact O-N 3.31Å; C223-V226 PolarHBondContact O-N 2.97Å; V226-K228 VanDerWaalsContact C-N 3.27Å; V226-K228 PolarHBondContact O-N 2.86Å; V226-F229 PolarHBondContact O-N 3.44Å; V226-F229 VanDerWaalsContact O-N 3.1Å; V226-F230 HydrophobicContact CG1-CD2 3.61Å; V226-F230 HydrophobicContact CG1-CE2 3.87Å; V226-F230 PolarHBondContact O-N 2.78Å
227	R	94.2	Very high	92.4	Very high	31 Å²	31	34.9 Å²	34.9	12%	0.117	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-37.1	178.2	-66.4	-48.1	-85.4	175.5	-8.5	112.1	E193 C223 A225 F229 F230 F231 K331 L334 D335 L338	E193-R227 IonicContact OE1-CZ 3.06Å; E193-R227 IonicContact OE1-NH1 3.48Å; E193-R227 PolarHBondContact OE1-NH1 3.15Å; C223-R227 WeakPolarHBondContact O-CB 3.33Å; C223-R227 WeakPolarHBondContact O-CG 3.45Å; C223-R227 PolarHBondContact O-N 3.27Å; A225-R227 VanDerWaalsContact C-N 3.35Å; A225-R227 PolarHBondContact O-N 3.24Å; R227-F229 PolarHBondContact O-N 2.92Å; R227-F230 PolarHBondContact O-N 2.64Å; R227-F231 WeakPolarHBondContact O-CB 3.4Å; R227-F231 PolarHBondContact O-N 3.14Å; R227-K331 HydrophobicContact CG-CG 4.43Å; R227-K331 VanDerWaalsContact NE-CG 3.28Å; R227-L334 HydrophobicContact CB-CB 4.28Å; R227-L334 HydrophobicContact CB-CD1 4.17Å; R227-L334 HydrophobicContact CG-CB 4.25Å; R227-L334 HydrophobicContact CG-CD1 3.73Å; R227-D335 IonicContact CZ-OD1 3.86Å; R227-D335 IonicContact CZ-OD2 2.78Å; R227-D335 IonicContact NE-OD1 3.95Å; R227-D335 PolarHBondContact NE-OD1 3.22Å; R227-D335 VanDerWaalsContact NE-OD1 3.16Å; R227-D335 VanDerWaalsContact NH2-CG 3.3Å; R227-D335 IonicContact NH2-OD1 3.54Å; R227-D335 PolarHBondContact NH2-OD1 3.22Å; R227-D335 IonicContact NH2-OD2 3.49Å; R227-D335 PolarHBondContact NH2-OD2 2.83Å; R227-L338 HydrophobicContact CB-CD1 4.38Å
228	K	94.6	Very high	92.2	Very high	20 Å²	20	38.2 Å²	38.2	9%	0.087	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-45	174.5	-176.9	163.6	174.8	-176	0	111.9	A225 V226 F232 F251 D254 W272 F273 L338	A225-K228 PolarHBondContact O-N 3.1Å; V226-K228 VanDerWaalsContact C-N 3.27Å; V226-K228 PolarHBondContact O-N 2.86Å; K228-F232 HydrophobicContact CG-CD2 4.08Å; K228-F232 HydrophobicContact CG-CE2 4.14Å; K228-F232 VanDerWaalsContact O-CD2 3.25Å; K228-F232 WeakPolarHBondContact O-CD2 3.4Å; K228-F232 PolarHBondContact O-N 3.01Å; K228-F251 VanDerWaalsContact CE-CD1 3.5Å; K228-D254 IonicContact NZ-OD2 2.71Å; K228-W272 HydrophobicContact CD-CB 3.92Å; K228-W272 HydrophobicContact CD-CD2 4.28Å; K228-W272 HydrophobicContact CD-CG 3.5Å; K228-F273 HydrophobicContact CB-CE1 4.35Å; K228-F273 HydrophobicContact CB-CZ 4.29Å; K228-F273 HydrophobicContact CD-CE1 4.28Å; K228-F273 HydrophobicContact CD-CE2 4.01Å; K228-F273 HydrophobicContact CD-CZ 3.69Å; K228-F273 HydrophobicContact CG-CZ 4.11Å; K228-L338 HydrophobicContact CB-CD2 4.46Å; K228-L338 HydrophobicContact CG-CD2 4.45Å
229	F	95.1	Very high	92.1	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-47.5	176.7	-71.9	-84.6	0	0	0	112.2	L196 I200 A225 V226 R227 L233 I241 I246 F251 L252 L255 F273	L196-F229 HydrophobicContact CD2-CB 3.66Å; L196-F229 HydrophobicContact CD2-CD2 4Å; L196-F229 HydrophobicContact CD2-CG 3.89Å; I200-F229 HydrophobicContact CD1-CD2 4.46Å; I200-F229 HydrophobicContact CD1-CE2 4.32Å; A225-F229 WeakPolarHBondContact O-CD2 3.44Å; V226-F229 PolarHBondContact O-N 3.44Å; V226-F229 VanDerWaalsContact O-N 3.1Å; R227-F229 PolarHBondContact O-N 2.92Å; F229-L233 HydrophobicContact CD1-CD1 3.99Å; F229-L233 WeakPolarHBondContact O-CB 3.33Å; F229-L233 WeakPolarHBondContact O-CG 3.31Å; F229-L233 PolarHBondContact O-N 3.09Å; F229-I241 HydrophobicContact CB-CD1 3.98Å; F229-I246 HydrophobicContact CD1-CG2 4.45Å; F229-I246 HydrophobicContact CE1-CG2 4.19Å; F229-F251 HydrophobicContact CD1-CB 4.44Å; F229-F251 HydrophobicContact CE1-CB 3.86Å; F229-F251 HydrophobicContact CZ-CB 4.07Å; F229-L252 HydrophobicContact CE1-CB 4.49Å; F229-L255 HydrophobicContact CE2-CD2 4.34Å; F229-L255 HydrophobicContact CZ-CD2 4.33Å; F229-F273 HydrophobicContact CD2-CE1 4.28Å; F229-F273 HydrophobicContact CD2-CZ 4.34Å; F229-F273 AromaticContact CE2-CE1 3.63Å; F229-F273 HydrophobicContact CE2-CE1 3.63Å; F229-F273 AromaticContact CE2-CZ 3.64Å; F229-F273 HydrophobicContact CE2-CZ 3.64Å; F229-F273 HydrophobicContact CZ-CE1 4.34Å; F229-F273 AromaticContact CZ-CZ 3.95Å; F229-F273 HydrophobicContact CZ-CZ 3.95Å
230	F	94.5	Very high	92.1	Very high	14 Å²	14	37.2 Å²	37.2	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-37.6	-178.9	-87.8	-87.1	0	0	0	113.2	E193 L196 V226 R227 F232 D234 I241	E193-F230 HydrophobicContact CB-CE2 4.05Å; E193-F230 HydrophobicContact CB-CZ 4.04Å; E193-F230 HydrophobicContact CG-CD2 4.36Å; E193-F230 HydrophobicContact CG-CE2 4.19Å; E193-F230 VanDerWaalsContact N-CZ 3.29Å; L196-F230 HydrophobicContact CB-CE2 4.42Å; L196-F230 HydrophobicContact CD2-CD2 4.42Å; L196-F230 HydrophobicContact CD2-CE2 4.08Å; V226-F230 HydrophobicContact CG1-CD2 3.61Å; V226-F230 HydrophobicContact CG1-CE2 3.87Å; V226-F230 PolarHBondContact O-N 2.78Å; R227-F230 PolarHBondContact O-N 2.64Å; F230-F232 PolarHBondContact O-N 3.47Å; F230-D234 HydrophobicContact CD1-CB 4.22Å; F230-D234 WeakPolarHBondContact O-CA 3.4Å; F230-D234 WeakPolarHBondContact O-CB 3.33Å; F230-D234 PolarHBondContact O-N 3.25Å; F230-D234 VanDerWaalsContact O-N 3.08Å; F230-I241 HydrophobicContact CB-CD1 4.37Å; F230-I241 HydrophobicContact CD1-CD1 3.87Å; F230-I241 HydrophobicContact CD1-CG1 3.97Å; F230-I241 HydrophobicContact CD2-CD1 3.59Å; F230-I241 HydrophobicContact CD2-CG1 4.49Å; F230-I241 HydrophobicContact CE1-CD1 3.89Å; F230-I241 HydrophobicContact CE1-CG1 3.74Å; F230-I241 HydrophobicContact CE2-CD1 3.6Å; F230-I241 HydrophobicContact CE2-CG1 4.29Å; F230-I241 HydrophobicContact CG-CD1 3.72Å; F230-I241 HydrophobicContact CG-CG1 4.33Å; F230-I241 HydrophobicContact CZ-CD1 3.74Å; F230-I241 HydrophobicContact CZ-CG1 3.9Å
231	F	94.3	Very high	92.2	Very high	20 Å²	20	33.8 Å²	33.8	9%	0.088	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-44.3	-179.5	-174.4	-92.4	0	0	0	111.9	R227 D335 L338 A339 A347 A348 Y351	R227-F231 WeakPolarHBondContact O-CB 3.4Å; R227-F231 PolarHBondContact O-N 3.14Å; F231-D335 HydrophobicContact CD2-CB 4.14Å; F231-D335 HydrophobicContact CE2-CB 4.25Å; F231-D335 VanDerWaalsContact CE2-O 3.29Å; F231-D335 WeakPolarHBondContact CE2-O 3.4Å; F231-L338 HydrophobicContact CB-CD1 3.85Å; F231-L338 HydrophobicContact CD1-CB 3.97Å; F231-L338 HydrophobicContact CD2-CB 4.27Å; F231-L338 HydrophobicContact CD2-CD1 4.47Å; F231-L338 HydrophobicContact CE1-CB 4.1Å; F231-L338 HydrophobicContact CE2-CB 4.38Å; F231-L338 HydrophobicContact CG-CB 4.06Å; F231-L338 HydrophobicContact CG-CD1 4.05Å; F231-L338 HydrophobicContact CZ-CB 4.31Å; F231-A339 HydrophobicContact CE2-CB 4.21Å; F231-A339 HydrophobicContact CZ-CB 3.69Å; F231-A347 HydrophobicContact CE1-CB 4.46Å; F231-A348 HydrophobicContact CE1-CB 4.17Å; F231-A348 HydrophobicContact CZ-CB 4.36Å; F231-Y351 AromaticContact CE2-CD2 3.93Å; F231-Y351 HydrophobicContact CE2-CD2 3.93Å; F231-Y351 HydrophobicContact CE2-CG 4.22Å; F231-Y351 HydrophobicContact CZ-CG 4.43Å
232	F	93.8	Very high	92.1	Very high	26 Å²	26	39.4 Å²	39.4	11%	0.114	21%	0.205	C	C	.	.	H	α-helix	trans	-91.8	-34.3	-176.1	-68.9	-68.4	0	0	0	114.3	K228 F230 F251 L338 N342 E345 A347	K228-F232 HydrophobicContact CG-CD2 4.08Å; K228-F232 HydrophobicContact CG-CE2 4.14Å; K228-F232 VanDerWaalsContact O-CD2 3.25Å; K228-F232 WeakPolarHBondContact O-CD2 3.4Å; K228-F232 PolarHBondContact O-N 3.01Å; F230-F232 PolarHBondContact O-N 3.47Å; F232-F251 HydrophobicContact CB-CE2 3.53Å; F232-F251 HydrophobicContact CB-CZ 3.96Å; F232-F251 AromaticContact CD2-CE2 3.75Å; F232-F251 HydrophobicContact CD2-CE2 3.75Å; F232-F251 AromaticContact CD2-CZ 3.66Å; F232-F251 HydrophobicContact CD2-CZ 3.66Å; F232-F251 HydrophobicContact CE2-CZ 4.35Å; F232-F251 AromaticContact CG-CE2 3.84Å; F232-F251 HydrophobicContact CG-CE2 3.84Å; F232-F251 AromaticContact CG-CZ 3.79Å; F232-F251 HydrophobicContact CG-CZ 3.79Å; F232-L338 HydrophobicContact CE2-CD2 4.25Å; F232-N342 HydrophobicContact CE1-CB 4.1Å; F232-N342 HydrophobicContact CZ-CB 3.77Å; F232-N342 WeakPolarHBondContact CZ-OD1 3.37Å; F232-E345 HydrophobicContact CD1-CB 4.32Å; F232-E345 HydrophobicContact CD1-CG 4.48Å; F232-E345 HydrophobicContact CE1-CB 3.8Å; F232-E345 HydrophobicContact CE1-CG 3.91Å; F232-A347 HydrophobicContact CD1-CB 3.96Å
233	L	92.8	Very high	91.9	Very high	39 Å²	39	39.3 Å²	39.3	20%	0.204	20%	0.204	C	C	.	.	H	α-helix	trans	-94.6	-11.3	-175.4	-54.8	179.5	0	0	0	113.7	F229 P235 I241 I246 C249	F229-L233 HydrophobicContact CD1-CD1 3.99Å; F229-L233 WeakPolarHBondContact O-CB 3.33Å; F229-L233 WeakPolarHBondContact O-CG 3.31Å; F229-L233 PolarHBondContact O-N 3.09Å; L233-P235 VanDerWaalsContact C-CD 3.4Å; L233-I241 HydrophobicContact CB-CD1 4.26Å; L233-I241 HydrophobicContact CB-CG1 4.29Å; L233-I241 HydrophobicContact CB-CG2 3.64Å; L233-I241 HydrophobicContact CD1-CG2 3.77Å; L233-I241 HydrophobicContact CG-CG2 4.38Å; L233-I246 HydrophobicContact CD1-CG1 3.98Å; L233-C249 HydrophobicContact CD1-CB 4.34Å; L233-C249 HydrophobicContact CD2-CB 4.03Å
234	D	91.9	Very high	91.8	Very high	12 Å²	12	44.3 Å²	44.3	6%	0.064	23%	0.225	C	C	.	.			trans	-126.7	63.7	174.7	-174.4	27.8	0	0	0	111.9	F230 V236 R237 T238 G239 I241	F230-D234 HydrophobicContact CD1-CB 4.22Å; F230-D234 WeakPolarHBondContact O-CA 3.4Å; F230-D234 WeakPolarHBondContact O-CB 3.33Å; F230-D234 PolarHBondContact O-N 3.25Å; F230-D234 VanDerWaalsContact O-N 3.08Å; D234-V236 PolarHBondContact O-N 2.83Å; D234-V236 VanDerWaalsContact O-N 3.08Å; D234-R237 PolarHBondContact O-N 3.11Å; D234-R237 PolarHBondContact OD1-N 3.25Å; D234-R237 VanDerWaalsContact OD2-C 3.28Å; D234-R237 WeakPolarHBondContact OD2-CA 3.44Å; D234-T238 WeakPolarHBondContact OD1-CB 3.36Å; D234-T238 PolarHBondContact OD1-N 3.43Å; D234-T238 PolarHBondContact OD1-OG1 3.24Å; D234-T238 PolarHBondContact OD2-N 3.43Å; D234-T238 PolarHBondContact OD2-OG1 2.89Å; D234-G239 WeakPolarHBondContact OD2-CA 3.14Å; D234-G239 PolarHBondContact OD2-N 3.34Å; D234-I241 HydrophobicContact CB-CG1 4.21Å
235	P	82.4	Confident	91.7	Very high	55 Å²	55	47.2 Å²	47.2	36%	0.357	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.1	-175.9	23.6	-34	0	0	0	113.9	L233 Q350	L233-P235 VanDerWaalsContact C-CD 3.4Å; P235-Q350 PolarHBondContact O-NE2 2.99Å
236	V	82.2	Confident	91.6	Very high	112 Å²	112	47.2 Å²	47.2	68%	0.679	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	0.3	178.3	-168.7	0	0	0	0	111.8	D234 T238	D234-V236 PolarHBondContact O-N 2.83Å; D234-V236 VanDerWaalsContact O-N 3.08Å; V236-T238 VanDerWaalsContact C-N 3.32Å; V236-T238 HydrophobicContact CB-CG2 4.21Å; V236-T238 HydrophobicContact CG1-CG2 4.46Å; V236-T238 PolarHBondContact O-N 3.16Å
237	R	86.2	Confident	91.4	Very high	131 Å²	131	48.7 Å²	48.7	49%	0.494	25%	0.248	S	C	.	.			trans	54.7	44.3	179.6	-53.3	-172.5	-176.9	-156.2	1.3	113.2	D234 G239	D234-R237 PolarHBondContact O-N 3.11Å; D234-R237 PolarHBondContact OD1-N 3.25Å; D234-R237 VanDerWaalsContact OD2-C 3.28Å; D234-R237 WeakPolarHBondContact OD2-CA 3.44Å; R237-G239 PolarHBondContact O-N 2.87Å
238	T	88.1	Confident	91.2	Very high	85 Å²	85	51.4 Å²	51.4	52%	0.521	28%	0.277	S	S	.	.			trans	-69.5	-14.7	175.3	65.7	0	0	0	0	113.5	D234 V236 K240	D234-T238 WeakPolarHBondContact OD1-CB 3.36Å; D234-T238 PolarHBondContact OD1-N 3.43Å; D234-T238 PolarHBondContact OD1-OG1 3.24Å; D234-T238 PolarHBondContact OD2-N 3.43Å; D234-T238 PolarHBondContact OD2-OG1 2.89Å; V236-T238 VanDerWaalsContact C-N 3.32Å; V236-T238 HydrophobicContact CB-CG2 4.21Å; V236-T238 HydrophobicContact CG1-CG2 4.46Å; V236-T238 PolarHBondContact O-N 3.16Å; T238-K240 VanDerWaalsContact C-N 3.27Å; T238-K240 PolarHBondContact OG1-N 2.8Å; T238-K240 PolarHBondContact OG1-O 3.24Å
239	G	89.6	Confident	91.1	Very high	35 Å²	35	51 Å²	51	36%	0.361	28%	0.277	S	S	.	.	S	Bend	trans	73.1	19.1	-172.9	0	0	0	0	0	112.8	D234 R237	D234-G239 WeakPolarHBondContact OD2-CA 3.14Å; D234-G239 PolarHBondContact OD2-N 3.34Å; R237-G239 PolarHBondContact O-N 2.87Å
240	K	92.2	Very high	90.8	Very high	89 Å²	89	54.1 Å²	54.1	39%	0.387	30%	0.299	S	S	.	.			trans	-141.7	124.1	-174.4	-60.6	178.5	-176.9	-170.8	0	111.3	Y190 T238	Y190-K240 HydrophobicContact CD2-CB 3.81Å; Y190-K240 HydrophobicContact CD2-CD 3.86Å; Y190-K240 HydrophobicContact CD2-CG 3.72Å; Y190-K240 HydrophobicContact CE1-CD 4.16Å; Y190-K240 HydrophobicContact CE2-CB 4.27Å; Y190-K240 HydrophobicContact CE2-CD 3.49Å; Y190-K240 VanDerWaalsContact CE2-CD 3.49Å; Y190-K240 HydrophobicContact CE2-CG 3.67Å; Y190-K240 HydrophobicContact CG-CB 4.2Å; Y190-K240 HydrophobicContact CG-CD 4.36Å; Y190-K240 HydrophobicContact CG-CG 4.46Å; Y190-K240 PolarHBondContact OH-NZ 2.66Å; Y190-K240 VanDerWaalsContact OH-NZ 3.11Å; T238-K240 VanDerWaalsContact C-N 3.27Å; T238-K240 PolarHBondContact OG1-N 2.8Å; T238-K240 PolarHBondContact OG1-O 3.24Å
241	I	93.8	Very high	90.7	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.1	174.6	-54.7	171.5	0	0	0	109.3	Y190 L191 F229 F230 L233 D234 I246	Y190-I241 CarbonylContact C-O 3.48Å; Y190-I241 WeakPolarHBondContact CA-O 3.46Å; Y190-I241 VanDerWaalsContact CB-O 3.29Å; Y190-I241 WeakPolarHBondContact CB-O 3.28Å; L191-I241 PolarHBondContact N-O 3.08Å; L191-I241 PolarHBondContact O-N 2.86Å; F229-I241 HydrophobicContact CB-CD1 3.98Å; F230-I241 HydrophobicContact CB-CD1 4.37Å; F230-I241 HydrophobicContact CD1-CD1 3.87Å; F230-I241 HydrophobicContact CD1-CG1 3.97Å; F230-I241 HydrophobicContact CD2-CD1 3.59Å; F230-I241 HydrophobicContact CD2-CG1 4.49Å; F230-I241 HydrophobicContact CE1-CD1 3.89Å; F230-I241 HydrophobicContact CE1-CG1 3.74Å; F230-I241 HydrophobicContact CE2-CD1 3.6Å; F230-I241 HydrophobicContact CE2-CG1 4.29Å; F230-I241 HydrophobicContact CG-CD1 3.72Å; F230-I241 HydrophobicContact CG-CG1 4.33Å; F230-I241 HydrophobicContact CZ-CD1 3.74Å; F230-I241 HydrophobicContact CZ-CG1 3.9Å; L233-I241 HydrophobicContact CB-CD1 4.26Å; L233-I241 HydrophobicContact CB-CG1 4.29Å; L233-I241 HydrophobicContact CB-CG2 3.64Å; L233-I241 HydrophobicContact CD1-CG2 3.77Å; L233-I241 HydrophobicContact CG-CG2 4.38Å; D234-I241 HydrophobicContact CB-CG1 4.21Å; I241-I246 HydrophobicContact CB-CD1 4.31Å; I241-I246 HydrophobicContact CB-CG1 4.44Å; I241-I246 HydrophobicContact CG2-CD1 3.91Å; I241-I246 HydrophobicContact CG2-CG1 3.53Å
242	K	92.8	Very high	90.6	Very high	120 Å²	120	54.2 Å²	54.2	52%	0.522	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	139.5	175.5	-58.8	174.8	-172.2	158	0	110.2	G189 Q244 D245 I246	G189-K242 WeakPolarHBondContact O-CA 3.43Å; K242-Q244 PolarHBondContact O-N 3.21Å; K242-Q244 VanDerWaalsContact O-N 3.15Å; K242-D245 HydrophobicContact CB-CB 4.4Å; K242-D245 WeakPolarHBondContact CB-OD2 3.35Å; K242-D245 PolarHBondContact O-N 2.79Å; K242-I246 PolarHBondContact O-N 3.43Å
243	I	92.6	Very high	90.4	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-33.2	176.2	-64	171.9	0	0	0	111	R177 L180 D184 G189 L191 D245 I246 L247	R177-I243 HydrophobicContact CG-CG2 4.3Å; L180-I243 HydrophobicContact CB-CG1 4.48Å; L180-I243 HydrophobicContact CB-CG2 3.9Å; L180-I243 HydrophobicContact CD1-CG2 4.03Å; D184-I243 HydrophobicContact CB-CD1 4.19Å; G189-I243 PolarHBondContact O-N 3.05Å; L191-I243 HydrophobicContact CD1-CG1 4.36Å; L191-I243 HydrophobicContact CD2-CD1 4.45Å; L191-I243 HydrophobicContact CD2-CG1 4.46Å; L191-I243 HydrophobicContact CG-CD1 4.49Å; L191-I243 HydrophobicContact CG-CG1 3.98Å; I243-D245 VanDerWaalsContact C-N 3.32Å; I243-D245 PolarHBondContact O-N 3.12Å; I243-I246 PolarHBondContact O-N 3.27Å; I243-L247 HydrophobicContact CG2-CD1 4.02Å; I243-L247 HydrophobicContact CG2-CG 4.42Å; I243-L247 VanDerWaalsContact O-CG 3.29Å; I243-L247 WeakPolarHBondContact O-CG 3.46Å; I243-L247 PolarHBondContact O-N 3.19Å
244	Q	92.1	Very high	90.3	Very high	127 Å²	127	57.5 Å²	57.5	59%	0.593	32%	0.318	S	S	*	.	H	α-helix	trans	-64.2	-37.4	176.7	-66	-178.8	-4.1	0	0	112.6	K242 L247 A248	K242-Q244 PolarHBondContact O-N 3.21Å; K242-Q244 VanDerWaalsContact O-N 3.15Å; Q244-L247 PolarHBondContact O-N 3.28Å; Q244-A248 WeakPolarHBondContact O-CB 3.26Å; Q244-A248 PolarHBondContact O-N 2.91Å; Q244-A248 VanDerWaalsContact O-N 3.13Å
245	D	92.9	Very high	90.3	Very high	64 Å²	64	57 Å²	57	34%	0.342	32%	0.315	S	S	.	.	H	α-helix	trans	-73	-35.2	-179.5	-58.1	-21.5	0	0	0	110.1	K242 I243 A248 C249	K242-D245 HydrophobicContact CB-CB 4.4Å; K242-D245 WeakPolarHBondContact CB-OD2 3.35Å; K242-D245 PolarHBondContact O-N 2.79Å; I243-D245 VanDerWaalsContact C-N 3.32Å; I243-D245 PolarHBondContact O-N 3.12Å; D245-A248 PolarHBondContact O-N 2.97Å; D245-C249 PolarHBondContact O-N 3.07Å; D245-C249 VanDerWaalsContact O-N 3.13Å
246	I	93.4	Very high	90.6	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-41.8	172	-59.9	172.2	0	0	0	111.2	L180 L191 L196 F229 L233 I241 K242 I243 A248 C249 L252	L180-I246 HydrophobicContact CD1-CB 4.33Å; L180-I246 HydrophobicContact CD1-CG2 3.83Å; L191-I246 HydrophobicContact CD1-CD1 3.87Å; L196-I246 HydrophobicContact CD1-CD1 4.44Å; F229-I246 HydrophobicContact CD1-CG2 4.45Å; F229-I246 HydrophobicContact CE1-CG2 4.19Å; L233-I246 HydrophobicContact CD1-CG1 3.98Å; I241-I246 HydrophobicContact CB-CD1 4.31Å; I241-I246 HydrophobicContact CB-CG1 4.44Å; I241-I246 HydrophobicContact CG2-CD1 3.91Å; I241-I246 HydrophobicContact CG2-CG1 3.53Å; K242-I246 PolarHBondContact O-N 3.43Å; I243-I246 PolarHBondContact O-N 3.27Å; I246-A248 PolarHBondContact O-N 3.1Å; I246-C249 PolarHBondContact O-SG 3.33Å; I246-L252 HydrophobicContact CG2-CD2 4.23Å
247	L	90.9	Very high	91	Very high	33 Å²	33	53.8 Å²	53.8	17%	0.173	29%	0.289	C	S	.	.	H	α-helix	trans	-71.8	-18.9	178.4	-68.7	167.7	0	0	0	113.6	T176 R177 L180 I243 Q244 L252	T176-L247 HydrophobicContact CG2-CD2 3.72Å; R177-L247 HydrophobicContact CB-CD1 3.59Å; R177-L247 HydrophobicContact CG-CD1 3.81Å; L180-L247 HydrophobicContact CD1-CD2 4.14Å; L180-L247 HydrophobicContact CD1-CG 4.33Å; I243-L247 HydrophobicContact CG2-CD1 4.02Å; I243-L247 HydrophobicContact CG2-CG 4.42Å; I243-L247 VanDerWaalsContact O-CG 3.29Å; I243-L247 WeakPolarHBondContact O-CG 3.46Å; I243-L247 PolarHBondContact O-N 3.19Å; Q244-L247 PolarHBondContact O-N 3.28Å; L247-L252 HydrophobicContact CD2-CD2 4.07Å
248	A	90.3	Very high	91.1	Very high	87 Å²	87	47.5 Å²	47.5	72%	0.719	27%	0.265	S	S	*	.	H	α-helix	trans	-97.6	-10.7	-179	0	0	0	0	0	112.9	Q244 D245 I246	Q244-A248 WeakPolarHBondContact O-CB 3.26Å; Q244-A248 PolarHBondContact O-N 2.91Å; Q244-A248 VanDerWaalsContact O-N 3.13Å; D245-A248 PolarHBondContact O-N 2.97Å; I246-A248 PolarHBondContact O-N 3.1Å
249	C	90.9	Very high	91.1	Very high	13 Å²	13	49.3 Å²	49.3	9%	0.088	26%	0.263	C	S	.	.	S	Bend	trans	-85.9	147	180	77.4	0	0	0	0	111.4	L233 D245 I246 F251	L233-C249 HydrophobicContact CD1-CB 4.34Å; L233-C249 HydrophobicContact CD2-CB 4.03Å; D245-C249 PolarHBondContact O-N 3.07Å; D245-C249 VanDerWaalsContact O-N 3.13Å; I246-C249 PolarHBondContact O-SG 3.33Å; C249-F251 HydrophobicContact CB-CD2 4.09Å; C249-F251 PolarHBondContact O-N 2.82Å
250	S	90.4	Very high	90.9	Very high	67 Å²	67	51.8 Å²	51.8	47%	0.469	27%	0.268	S	S	.	.	H	α-helix	trans	-68.3	-22.3	174.9	55.2	0	0	0	0	112.8	L252 D253 D254	S250-L252 PolarHBondContact O-N 3.01Å; S250-D253 WeakPolarHBondContact O-CA 3.22Å; S250-D253 WeakPolarHBondContact O-CB 3.31Å; S250-D253 PolarHBondContact O-N 3.06Å; S250-D254 PolarHBondContact O-N 3.46Å
251	F	91.7	Very high	90.4	Very high	34 Å²	34	55 Å²	55	15%	0.149	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-30.4	-176.9	-48.2	-36.6	0	0	0	113.2	K228 F229 F232 C249 D253 L255 F273	K228-F251 VanDerWaalsContact CE-CD1 3.5Å; F229-F251 HydrophobicContact CD1-CB 4.44Å; F229-F251 HydrophobicContact CE1-CB 3.86Å; F229-F251 HydrophobicContact CZ-CB 4.07Å; F232-F251 HydrophobicContact CB-CE2 3.53Å; F232-F251 HydrophobicContact CB-CZ 3.96Å; F232-F251 AromaticContact CD2-CE2 3.75Å; F232-F251 HydrophobicContact CD2-CE2 3.75Å; F232-F251 AromaticContact CD2-CZ 3.66Å; F232-F251 HydrophobicContact CD2-CZ 3.66Å; F232-F251 HydrophobicContact CE2-CZ 4.35Å; F232-F251 AromaticContact CG-CE2 3.84Å; F232-F251 HydrophobicContact CG-CE2 3.84Å; F232-F251 AromaticContact CG-CZ 3.79Å; F232-F251 HydrophobicContact CG-CZ 3.79Å; C249-F251 HydrophobicContact CB-CD2 4.09Å; C249-F251 PolarHBondContact O-N 2.82Å; F251-D253 VanDerWaalsContact C-N 3.32Å; F251-L255 WeakPolarHBondContact O-CB 3.34Å; F251-L255 PolarHBondContact O-N 3.12Å; F251-F273 HydrophobicContact CB-CE2 3.84Å; F251-F273 HydrophobicContact CB-CZ 3.88Å; F251-F273 WeakPolarHBondContact O-CE2 3.27Å
252	L	90.9	Very high	90	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-36.7	175.1	-176.2	62.4	0	0	0	111.2	T176 F229 I246 L247 S250 L255 L256	T176-L252 HydrophobicContact CG2-CD2 3.78Å; F229-L252 HydrophobicContact CE1-CB 4.49Å; I246-L252 HydrophobicContact CG2-CD2 4.23Å; L247-L252 HydrophobicContact CD2-CD2 4.07Å; S250-L252 PolarHBondContact O-N 3.01Å; L252-L255 PolarHBondContact O-N 2.89Å; L252-L256 HydrophobicContact CD1-CD1 4.02Å; L252-L256 HydrophobicContact CD1-CG 4.43Å; L252-L256 HydrophobicContact CG-CD1 3.95Å; L252-L256 WeakPolarHBondContact O-CB 3.42Å; L252-L256 VanDerWaalsContact O-CG 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 3.35Å
253	D	90.1	Very high	89.6	Confident	87 Å²	87	58.6 Å²	58.6	47%	0.465	30%	0.303	S	S	.	.	H	α-helix	trans	-65.9	-46.8	174.7	-61.2	-34.7	0	0	0	109.9	W172 S250 F251 L255 L256 E257	W172-D253 WeakPolarHBondContact CH2-OD1 3.35Å; S250-D253 WeakPolarHBondContact O-CA 3.22Å; S250-D253 WeakPolarHBondContact O-CB 3.31Å; S250-D253 PolarHBondContact O-N 3.06Å; F251-D253 VanDerWaalsContact C-N 3.32Å; D253-L255 VanDerWaalsContact C-N 3.3Å; D253-L255 PolarHBondContact O-N 3.47Å; D253-L256 CarbonylContact O-C 3.43Å; D253-L256 PolarHBondContact O-N 3.05Å; D253-L256 VanDerWaalsContact O-N 3.1Å; D253-E257 PolarHBondContact O-N 3.16Å
254	D	91.6	Very high	89.3	Confident	47 Å²	47	60.9 Å²	60.9	25%	0.251	32%	0.32	S	S	.	.	H	α-helix	trans	-55.4	-44.1	175	-58.9	-17.7	0	0	0	111.6	K228 S250 L256 E257 N271 F273	K228-D254 IonicContact NZ-OD2 2.71Å; S250-D254 PolarHBondContact O-N 3.46Å; D254-L256 VanDerWaalsContact C-N 3.34Å; D254-L256 PolarHBondContact O-N 3.38Å; D254-E257 WeakPolarHBondContact O-CB 3.42Å; D254-N271 PolarHBondContact O-ND2 2.78Å; D254-F273 HydrophobicContact CB-CD2 3.69Å; D254-F273 HydrophobicContact CB-CE2 3.93Å
255	L	91.7	Very high	88.9	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-38.2	179	179.3	65.2	0	0	0	112	I200 L203 L207 F229 F251 L252 D253 L258 F273	I200-L255 HydrophobicContact CG1-CD2 4.48Å; L203-L255 HydrophobicContact CD2-CD1 4.44Å; L203-L255 HydrophobicContact CD2-CD2 3.67Å; L203-L255 HydrophobicContact CD2-CG 3.88Å; L207-L255 HydrophobicContact CD1-CD1 4.24Å; F229-L255 HydrophobicContact CE2-CD2 4.34Å; F229-L255 HydrophobicContact CZ-CD2 4.33Å; F251-L255 WeakPolarHBondContact O-CB 3.34Å; F251-L255 PolarHBondContact O-N 3.12Å; L252-L255 PolarHBondContact O-N 2.89Å; D253-L255 VanDerWaalsContact C-N 3.3Å; D253-L255 PolarHBondContact O-N 3.47Å; L255-L258 HydrophobicContact CD1-CD1 4.31Å; L255-L258 WeakPolarHBondContact O-CB 3.15Å; L255-L258 WeakPolarHBondContact O-CG 3.49Å; L255-F273 HydrophobicContact CB-CD1 4.47Å; L255-F273 HydrophobicContact CB-CD2 4.12Å; L255-F273 HydrophobicContact CB-CE2 4.42Å; L255-F273 HydrophobicContact CB-CG 4.14Å; L255-F273 HydrophobicContact CD1-CB 3.92Å; L255-F273 HydrophobicContact CD1-CD1 3.91Å; L255-F273 HydrophobicContact CD1-CG 3.97Å
256	L	88.9	Confident	88.5	Confident	20 Å²	20	67.4 Å²	67.4	11%	0.105	35%	0.345	C	S	.	.	H	α-helix	trans	-83.8	-19.4	-177.2	-68.8	171.6	0	0	0	113	W172 L203 L252 D253 D254 L258 R259	W172-L256 HydrophobicContact CH2-CD1 4.22Å; W172-L256 HydrophobicContact CZ2-CD1 3.33Å; L203-L256 HydrophobicContact CD1-CD2 4.27Å; L203-L256 HydrophobicContact CD2-CD2 4.22Å; L252-L256 HydrophobicContact CD1-CD1 4.02Å; L252-L256 HydrophobicContact CD1-CG 4.43Å; L252-L256 HydrophobicContact CG-CD1 3.95Å; L252-L256 WeakPolarHBondContact O-CB 3.42Å; L252-L256 VanDerWaalsContact O-CG 3.27Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 3.35Å; D253-L256 CarbonylContact O-C 3.43Å; D253-L256 PolarHBondContact O-N 3.05Å; D253-L256 VanDerWaalsContact O-N 3.1Å; D254-L256 VanDerWaalsContact C-N 3.34Å; D254-L256 PolarHBondContact O-N 3.38Å; L256-L258 PolarHBondContact O-N 2.77Å; L256-R259 VanDerWaalsContact O-CB 3.29Å; L256-R259 WeakPolarHBondContact O-CB 3.47Å; L256-R259 WeakPolarHBondContact O-CG 3.43Å; L256-R259 PolarHBondContact O-N 3.45Å; L256-R259 VanDerWaalsContact O-N 3.1Å
257	E	89.4	Confident	88.1	Confident	80 Å²	80	69.2 Å²	69.2	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-55.5	-33.8	169	-160.9	-172.8	-164.7	0	0	110.8	D253 D254 R259 D260 L263 N271	D253-E257 PolarHBondContact O-N 3.16Å; D254-E257 WeakPolarHBondContact O-CB 3.42Å; E257-R259 PolarHBondContact O-N 3Å; E257-D260 WeakPolarHBondContact O-CB 3.31Å; E257-D260 PolarHBondContact O-N 3.42Å; E257-L263 HydrophobicContact CG-CD1 4.18Å; E257-L263 HydrophobicContact CG-CD2 4.02Å; E257-L263 HydrophobicContact CG-CG 4.42Å; E257-L263 WeakPolarHBondContact O-CD1 3.42Å; E257-N271 PolarHBondContact OE2-ND2 3.31Å; E257-N271 VanDerWaalsContact OE2-ND2 3.15Å
258	L	88.9	Confident	87.8	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-5.9	177.1	-56.5	179.1	0	0	0	114.8	L207 P208 Q209 L210 L255 L256 D260 L263 F273	L207-L258 HydrophobicContact CB-CB 4.33Å; L207-L258 HydrophobicContact CD1-CB 4.31Å; L207-L258 HydrophobicContact CD1-CD1 4.31Å; L207-L258 HydrophobicContact CD2-CB 4.23Å; P208-L258 WeakPolarHBondContact CD-O 3.34Å; Q209-L258 HydrophobicContact CB-CB 4.24Å; Q209-L258 HydrophobicContact CB-CD2 4.22Å; Q209-L258 WeakPolarHBondContact CG-O 3.3Å; L210-L258 HydrophobicContact CD1-CD1 4.42Å; L210-L258 HydrophobicContact CD2-CD1 4.24Å; L210-L258 HydrophobicContact CG-CD1 4.37Å; L255-L258 HydrophobicContact CD1-CD1 4.31Å; L255-L258 WeakPolarHBondContact O-CB 3.15Å; L255-L258 WeakPolarHBondContact O-CG 3.49Å; L256-L258 PolarHBondContact O-N 2.77Å; L258-D260 VanDerWaalsContact C-N 3.31Å; L258-L263 HydrophobicContact CD2-CD1 4.34Å; L258-F273 HydrophobicContact CD1-CB 3.77Å; L258-F273 VanDerWaalsContact CD1-O 3.26Å; L258-F273 WeakPolarHBondContact CD1-O 3.4Å
259	R	87.8	Confident	87.6	Confident	123 Å²	123	71.2 Å²	71.2	46%	0.464	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-22.4	169.2	-69.9	-177.9	170.8	-167.3	-3.6	112.9	L207 L256 E257 E261	L207-R259 HydrophobicContact CD2-CB 4.45Å; L207-R259 HydrophobicContact CD2-CG 3.33Å; L256-R259 VanDerWaalsContact O-CB 3.29Å; L256-R259 WeakPolarHBondContact O-CB 3.47Å; L256-R259 WeakPolarHBondContact O-CG 3.43Å; L256-R259 PolarHBondContact O-N 3.45Å; L256-R259 VanDerWaalsContact O-N 3.1Å; E257-R259 PolarHBondContact O-N 3Å; R259-E261 PolarHBondContact O-N 3.04Å
260	D	86.8	Confident	87.4	Confident	87 Å²	87	75.3 Å²	75.3	47%	0.465	38%	0.381	S	S	.	.			trans	-75.3	121.2	178.9	-168	-11.1	0	0	0	110	Q209 E257 L258 E262 L263	Q209-D260 PolarHBondContact NE2-O 3.09Å; E257-D260 WeakPolarHBondContact O-CB 3.31Å; E257-D260 PolarHBondContact O-N 3.42Å; L258-D260 VanDerWaalsContact C-N 3.31Å; D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact OD1-N 3.15Å; D260-L263 HydrophobicContact CB-CD1 4.28Å; D260-L263 HydrophobicContact CB-CG 4.15Å
261	E	80.6	Confident	87.4	Confident	156 Å²	156	72.5 Å²	72.5	73%	0.729	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-28	179.3	-67.1	-178.5	-175.7	0	0	111.9	P208 Q209 R259 L263	P208-E261 HydrophobicContact CB-CG 3.88Å; P208-E261 HydrophobicContact CG-CG 3.83Å; Q209-E261 PolarHBondContact NE2-O 3.32Å; Q209-E261 VanDerWaalsContact NE2-O 3.08Å; R259-E261 PolarHBondContact O-N 3.04Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 PolarHBondContact O-N 3.26Å
262	E	84.4	Confident	87.4	Confident	179 Å²	179	71.6 Å²	71.6	84%	0.836	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	16.5	-174	-61.7	-170.5	166.3	0	0	113.5	D260 S264	D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact OD1-N 3.15Å; E262-S264 PolarHBondContact O-N 2.99Å
263	L	84.6	Confident	87.5	Confident	17 Å²	17	71.7 Å²	71.7	9%	0.089	36%	0.356	C	S	.	.			trans	-56	124.1	178.4	-104.3	163.9	0	0	0	112.2	Q209 E257 L258 D260 E261 S267 Q268	Q209-L263 HydrophobicContact CG-CB 4.43Å; Q209-L263 HydrophobicContact CG-CD1 3.86Å; E257-L263 HydrophobicContact CG-CD1 4.18Å; E257-L263 HydrophobicContact CG-CD2 4.02Å; E257-L263 HydrophobicContact CG-CG 4.42Å; E257-L263 WeakPolarHBondContact O-CD1 3.42Å; L258-L263 HydrophobicContact CD2-CD1 4.34Å; D260-L263 HydrophobicContact CB-CD1 4.28Å; D260-L263 HydrophobicContact CB-CG 4.15Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 PolarHBondContact O-N 3.26Å; L263-S267 VanDerWaalsContact CD2-CB 3.49Å; L263-Q268 HydrophobicContact CB-CG 4.32Å; L263-Q268 PolarHBondContact O-NE2 3.42Å
264	S	86.9	Confident	87.7	Confident	55 Å²	55	67.6 Å²	67.6	39%	0.385	33%	0.334	S	S	.	.			trans	-63.3	151.4	177.6	88	0	0	0	0	111.5	E262 E266 S267 Q268	E262-S264 PolarHBondContact O-N 2.99Å; S264-E266 VanDerWaalsContact C-N 3.26Å; S264-E266 PolarHBondContact O-N 3.42Å; S264-S267 WeakPolarHBondContact O-CB 3.43Å; S264-S267 PolarHBondContact O-N 3.07Å; S264-S267 WeakPolarHBondContact OG-CB 3.28Å; S264-S267 PolarHBondContact OG-N 3.32Å; S264-S267 PolarHBondContact OG-OG 3Å; S264-Q268 WeakPolarHBondContact O-CG 3.38Å; S264-Q268 PolarHBondContact O-N 3.41Å
265	K	83.9	Confident	87.6	Confident	168 Å²	168	66 Å²	66	73%	0.73	33%	0.327	S	S	*	.	H	α-helix	trans	-60.8	-36.2	177.2	-66.9	-176.3	179.8	-179.5	0	112.5	Q268 E269	K265-Q268 WeakPolarHBondContact O-CB 3.21Å; K265-Q268 PolarHBondContact O-N 2.93Å; K265-E269 WeakPolarHBondContact O-CG 3.42Å; K265-E269 PolarHBondContact O-N 2.82Å
266	E	84.9	Confident	87.6	Confident	160 Å²	160	68.8 Å²	68.8	75%	0.748	35%	0.346	S	S	*	.	H	α-helix	trans	-66.2	-41.1	177.8	-64.4	174.9	-172.9	0	0	111.4	S264 Q268 E269 S270	S264-E266 VanDerWaalsContact C-N 3.26Å; S264-E266 PolarHBondContact O-N 3.42Å; E266-Q268 VanDerWaalsContact C-N 3.31Å; E266-Q268 PolarHBondContact O-N 3.48Å; E266-E269 PolarHBondContact O-N 3.37Å; E266-S270 PolarHBondContact O-N 2.83Å; E266-S270 VanDerWaalsContact O-N 3.09Å; E266-S270 PolarHBondContact O-OG 3.49Å
267	S	84.9	Confident	87.8	Confident	38 Å²	38	67.9 Å²	67.9	27%	0.266	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-40	172.7	-57.3	0	0	0	0	111.2	L263 S264 S270 N271	L263-S267 VanDerWaalsContact CD2-CB 3.49Å; S264-S267 WeakPolarHBondContact O-CB 3.43Å; S264-S267 PolarHBondContact O-N 3.07Å; S264-S267 WeakPolarHBondContact OG-CB 3.28Å; S264-S267 PolarHBondContact OG-N 3.32Å; S264-S267 PolarHBondContact OG-OG 3Å; S267-S270 WeakPolarHBondContact CA-OG 3.31Å; S267-S270 PolarHBondContact O-N 3.4Å; S267-S270 PolarHBondContact O-OG 3.16Å; S267-N271 WeakPolarHBondContact O-CB 3.44Å; S267-N271 PolarHBondContact O-N 2.96Å
268	Q	84.4	Confident	87.9	Confident	34 Å²	34	64.1 Å²	64.1	16%	0.159	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-40.9	175.7	-67.1	178	10.1	0	0	112.4	L263 S264 K265 E266 S270 N271 S274	L263-Q268 HydrophobicContact CB-CG 4.32Å; L263-Q268 PolarHBondContact O-NE2 3.42Å; S264-Q268 WeakPolarHBondContact O-CG 3.38Å; S264-Q268 PolarHBondContact O-N 3.41Å; K265-Q268 WeakPolarHBondContact O-CB 3.21Å; K265-Q268 PolarHBondContact O-N 2.93Å; E266-Q268 VanDerWaalsContact C-N 3.31Å; E266-Q268 PolarHBondContact O-N 3.48Å; Q268-S270 VanDerWaalsContact C-N 3.34Å; Q268-S270 PolarHBondContact O-N 3.32Å; Q268-N271 PolarHBondContact O-N 3.36Å; Q268-S274 WeakPolarHBondContact O-CB 3.47Å; Q268-S274 PolarHBondContact O-OG 3.45Å
269	E	84.9	Confident	88.1	Confident	128 Å²	128	68.1 Å²	68.1	60%	0.598	34%	0.344	S	S	*	.	H	α-helix	trans	-69.6	-30.8	-179.6	-74.9	178.5	-173.4	0	0	113.3	K265 E266 S277	K265-E269 WeakPolarHBondContact O-CG 3.42Å; K265-E269 PolarHBondContact O-N 2.82Å; E266-E269 PolarHBondContact O-N 3.37Å; E269-S277 PolarHBondContact O-OG 2.61Å
270	S	87.4	Confident	88.3	Confident	100 Å²	100	67.3 Å²	67.3	70%	0.699	34%	0.342	S	S	*	.	H	α-helix	trans	-81	-28.8	175.3	56	0	0	0	0	113.1	E266 S267 Q268 W272	E266-S270 PolarHBondContact O-N 2.83Å; E266-S270 VanDerWaalsContact O-N 3.09Å; E266-S270 PolarHBondContact O-OG 3.49Å; S267-S270 WeakPolarHBondContact CA-OG 3.31Å; S267-S270 PolarHBondContact O-N 3.4Å; S267-S270 PolarHBondContact O-OG 3.16Å; Q268-S270 VanDerWaalsContact C-N 3.34Å; Q268-S270 PolarHBondContact O-N 3.32Å; S270-W272 PolarHBondContact O-N 3.05Å
271	N	90.9	Very high	88.6	Confident	7 Å²	7	63.2 Å²	63.2	4%	0.037	32%	0.319	C	S	.	.			trans	-77.4	119.5	178.4	-170.8	-31.9	0	0	0	111.3	D254 E257 S267 Q268 F273 S274 S277	D254-N271 PolarHBondContact O-ND2 2.78Å; E257-N271 PolarHBondContact OE2-ND2 3.31Å; E257-N271 VanDerWaalsContact OE2-ND2 3.15Å; S267-N271 WeakPolarHBondContact O-CB 3.44Å; S267-N271 PolarHBondContact O-N 2.96Å; Q268-N271 PolarHBondContact O-N 3.36Å; N271-F273 VanDerWaalsContact C-N 3.28Å; N271-F273 PolarHBondContact O-N 2.98Å; N271-F273 WeakPolarHBondContact OD1-CB 3.46Å; N271-F273 PolarHBondContact OD1-N 3.42Å; N271-S274 WeakPolarHBondContact O-CB 3.45Å; N271-S274 PolarHBondContact O-N 3.49Å; N271-S274 PolarHBondContact O-OG 2.89Å; N271-S277 VanDerWaalsContact O-CB 3.28Å; N271-S277 WeakPolarHBondContact O-CB 3.01Å; N271-S277 PolarHBondContact O-OG 3.15Å
272	W	91.1	Very high	89.2	Confident	16 Å²	16	57.9 Å²	57.9	6%	0.061	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.3	179	179.4	-93.2	0	0	0	113.8	T224 K228 S270 S274 S277 V281 V337 L338 E341	T224-W272 HydrophobicContact CG2-CZ2 4.12Å; K228-W272 HydrophobicContact CD-CB 3.92Å; K228-W272 HydrophobicContact CD-CD2 4.28Å; K228-W272 HydrophobicContact CD-CG 3.5Å; S270-W272 PolarHBondContact O-N 3.05Å; W272-S274 VanDerWaalsContact C-N 3.26Å; W272-S274 PolarHBondContact O-N 2.81Å; W272-S277 WeakPolarHBondContact O-CB 3.37Å; W272-V281 HydrophobicContact CH2-CG1 4.34Å; W272-V281 HydrophobicContact CH2-CG2 3.53Å; W272-V281 HydrophobicContact CZ2-CG2 4.25Å; W272-V281 HydrophobicContact CZ3-CG2 3.77Å; W272-V337 HydrophobicContact CH2-CG1 4.04Å; W272-L338 HydrophobicContact CD2-CD2 4.44Å; W272-L338 HydrophobicContact CH2-CD2 3.93Å; W272-L338 HydrophobicContact CH2-CG 4.48Å; W272-L338 HydrophobicContact CZ2-CD2 3.58Å; W272-L338 HydrophobicContact CZ2-CG 4.17Å; W272-E341 VanDerWaalsContact CZ3-OE2 3.3Å; W272-E341 WeakPolarHBondContact CZ3-OE2 3.37Å
273	F	93.8	Very high	89.6	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.009	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-7.1	-176.3	-61	-76.9	0	0	0	112.7	Y221 A225 K228 F229 F251 D254 L255 L258 N271	Y221-F273 VanDerWaalsContact CE2-O 3.26Å; Y221-F273 WeakPolarHBondContact CE2-O 3.44Å; Y221-F273 PolarHBondContact OH-O 2.98Å; A225-F273 HydrophobicContact CB-CD1 3.84Å; A225-F273 HydrophobicContact CB-CE1 3.99Å; K228-F273 HydrophobicContact CB-CE1 4.35Å; K228-F273 HydrophobicContact CB-CZ 4.29Å; K228-F273 HydrophobicContact CD-CE1 4.28Å; K228-F273 HydrophobicContact CD-CE2 4.01Å; K228-F273 HydrophobicContact CD-CZ 3.69Å; K228-F273 HydrophobicContact CG-CZ 4.11Å; F229-F273 HydrophobicContact CD2-CE1 4.28Å; F229-F273 HydrophobicContact CD2-CZ 4.34Å; F229-F273 AromaticContact CE2-CE1 3.63Å; F229-F273 HydrophobicContact CE2-CE1 3.63Å; F229-F273 AromaticContact CE2-CZ 3.64Å; F229-F273 HydrophobicContact CE2-CZ 3.64Å; F229-F273 HydrophobicContact CZ-CE1 4.34Å; F229-F273 AromaticContact CZ-CZ 3.95Å; F229-F273 HydrophobicContact CZ-CZ 3.95Å; F251-F273 HydrophobicContact CB-CE2 3.84Å; F251-F273 HydrophobicContact CB-CZ 3.88Å; F251-F273 WeakPolarHBondContact O-CE2 3.27Å; D254-F273 HydrophobicContact CB-CD2 3.69Å; D254-F273 HydrophobicContact CB-CE2 3.93Å; L255-F273 HydrophobicContact CB-CD1 4.47Å; L255-F273 HydrophobicContact CB-CD2 4.12Å; L255-F273 HydrophobicContact CB-CE2 4.42Å; L255-F273 HydrophobicContact CB-CG 4.14Å; L255-F273 HydrophobicContact CD1-CB 3.92Å; L255-F273 HydrophobicContact CD1-CD1 3.91Å; L255-F273 HydrophobicContact CD1-CG 3.97Å; L258-F273 HydrophobicContact CD1-CB 3.77Å; L258-F273 VanDerWaalsContact CD1-O 3.26Å; L258-F273 WeakPolarHBondContact CD1-O 3.4Å; N271-F273 VanDerWaalsContact C-N 3.28Å; N271-F273 PolarHBondContact O-N 2.98Å; N271-F273 WeakPolarHBondContact OD1-CB 3.46Å; N271-F273 PolarHBondContact OD1-N 3.42Å
274	S	92.9	Very high	90	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.007	28%	0.275	C	S	.	.	S	Bend	trans	-64.7	152	178.3	78.4	0	0	0	0	111.5	Q268 N271 W272 S277 A278	Q268-S274 WeakPolarHBondContact O-CB 3.47Å; Q268-S274 PolarHBondContact O-OG 3.45Å; N271-S274 WeakPolarHBondContact O-CB 3.45Å; N271-S274 PolarHBondContact O-N 3.49Å; N271-S274 PolarHBondContact O-OG 2.89Å; W272-S274 VanDerWaalsContact C-N 3.26Å; W272-S274 PolarHBondContact O-N 2.81Å; S274-S277 PolarHBondContact O-N 3.5Å; S274-S277 WeakPolarHBondContact OG-CB 3.24Å; S274-S277 PolarHBondContact OG-N 3.23Å; S274-S277 PolarHBondContact OG-OG 3.09Å; S274-S277 VanDerWaalsContact OG-OG 3.13Å; S274-A278 PolarHBondContact O-N 3.22Å
275	A	91.3	Very high	90.3	Very high	13 Å²	13	50.4 Å²	50.4	11%	0.107	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-45	175.1	0	0	0	0	0	112.6	L210 L213 S277 A278 L279	L210-A275 HydrophobicContact CD2-CB 3.96Å; L213-A275 HydrophobicContact CD1-CB 4.23Å; L213-A275 HydrophobicContact CD2-CB 3.69Å; L213-A275 HydrophobicContact CG-CB 3.93Å; A275-S277 PolarHBondContact O-N 3.43Å; A275-A278 PolarHBondContact O-N 2.87Å; A275-L279 VanDerWaalsContact O-CB 3.31Å; A275-L279 WeakPolarHBondContact O-CB 3.42Å; A275-L279 VanDerWaalsContact O-CG 3.24Å; A275-L279 WeakPolarHBondContact O-CG 3.3Å; A275-L279 PolarHBondContact O-N 3.03Å
276	P	91.6	Very high	90.7	Very high	60 Å²	60	45.7 Å²	45.7	39%	0.39	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-43.4	175.9	-25.9	35.2	0	0	0	113.7	L279 R280	P276-L279 PolarHBondContact O-N 3.13Å; P276-R280 VanDerWaalsContact O-CB 3.31Å; P276-R280 WeakPolarHBondContact O-CB 3.4Å; P276-R280 PolarHBondContact O-N 3.49Å
277	S	91.8	Very high	91	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-46.4	179.6	-68.9	0	0	0	0	112	E269 N271 W272 S274 A275 L279 R280 V281	E269-S277 PolarHBondContact O-OG 2.61Å; N271-S277 VanDerWaalsContact O-CB 3.28Å; N271-S277 WeakPolarHBondContact O-CB 3.01Å; N271-S277 PolarHBondContact O-OG 3.15Å; W272-S277 WeakPolarHBondContact O-CB 3.37Å; S274-S277 PolarHBondContact O-N 3.5Å; S274-S277 WeakPolarHBondContact OG-CB 3.24Å; S274-S277 PolarHBondContact OG-N 3.23Å; S274-S277 PolarHBondContact OG-OG 3.09Å; S274-S277 VanDerWaalsContact OG-OG 3.13Å; A275-S277 PolarHBondContact O-N 3.43Å; S277-L279 PolarHBondContact O-N 3.29Å; S277-R280 WeakPolarHBondContact O-CB 2.93Å; S277-R280 PolarHBondContact O-N 2.93Å; S277-V281 WeakPolarHBondContact O-CG2 3.15Å; S277-V281 PolarHBondContact O-N 3.16Å; S277-V281 VanDerWaalsContact O-N 3.09Å
278	A	92.8	Very high	91.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-42	177.3	0	0	0	0	0	112	F217 Y221 T224 S274 A275 V281 Y282	F217-A278 HydrophobicContact CE1-CB 4.25Å; F217-A278 HydrophobicContact CZ-CB 4.33Å; Y221-A278 HydrophobicContact CD2-CB 3.67Å; Y221-A278 HydrophobicContact CE2-CB 4Å; T224-A278 HydrophobicContact CG2-CB 4.48Å; S274-A278 PolarHBondContact O-N 3.22Å; A275-A278 PolarHBondContact O-N 2.87Å; A278-V281 PolarHBondContact O-N 3.46Å; A278-Y282 WeakPolarHBondContact O-CB 2.95Å; A278-Y282 PolarHBondContact O-N 2.79Å
279	L	92.1	Very high	91.8	Very high	84 Å²	84	41.9 Å²	41.9	44%	0.44	22%	0.223	S	C	.	.	H	α-helix	trans	-67.4	-34	175.8	-72.7	171.1	0	0	0	112.3	L213 F217 A275 P276 S277 G283	L213-L279 HydrophobicContact CD2-CD1 4.11Å; L213-L279 HydrophobicContact CD2-CG 4.28Å; F217-L279 HydrophobicContact CD1-CD2 4.11Å; F217-L279 HydrophobicContact CD2-CD2 4.38Å; F217-L279 HydrophobicContact CE1-CD2 3.83Å; F217-L279 HydrophobicContact CE1-CG 4.24Å; F217-L279 HydrophobicContact CE2-CD2 4.16Å; F217-L279 HydrophobicContact CG-CD2 4.37Å; F217-L279 HydrophobicContact CZ-CD2 3.87Å; F217-L279 HydrophobicContact CZ-CG 4.43Å; A275-L279 VanDerWaalsContact O-CB 3.31Å; A275-L279 WeakPolarHBondContact O-CB 3.42Å; A275-L279 VanDerWaalsContact O-CG 3.24Å; A275-L279 WeakPolarHBondContact O-CG 3.3Å; A275-L279 PolarHBondContact O-N 3.03Å; P276-L279 PolarHBondContact O-N 3.13Å; S277-L279 PolarHBondContact O-N 3.29Å; L279-G283 WeakPolarHBondContact O-CA 3.47Å; L279-G283 PolarHBondContact O-N 3.49Å
280	R	92.4	Very high	92.1	Very high	107 Å²	107	41.8 Å²	41.8	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-50	174.5	179.9	-178.4	70.7	-143.5	0.6	110.9	P276 S277 G283 Q284	P276-R280 VanDerWaalsContact O-CB 3.31Å; P276-R280 WeakPolarHBondContact O-CB 3.4Å; P276-R280 PolarHBondContact O-N 3.49Å; S277-R280 WeakPolarHBondContact O-CB 2.93Å; S277-R280 PolarHBondContact O-N 2.93Å; R280-G283 PolarHBondContact O-N 2.94Å; R280-Q284 VanDerWaalsContact O-CG 3.32Å; R280-Q284 WeakPolarHBondContact O-CG 3.42Å; R280-Q284 PolarHBondContact O-N 3.44Å
281	V	93.4	Very high	92.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-44.3	-178.7	176.3	0	0	0	0	110.9	W272 S277 A278 Q284 Y285 Y333 L334	W272-V281 HydrophobicContact CH2-CG1 4.34Å; W272-V281 HydrophobicContact CH2-CG2 3.53Å; W272-V281 HydrophobicContact CZ2-CG2 4.25Å; W272-V281 HydrophobicContact CZ3-CG2 3.77Å; S277-V281 WeakPolarHBondContact O-CG2 3.15Å; S277-V281 PolarHBondContact O-N 3.16Å; S277-V281 VanDerWaalsContact O-N 3.09Å; A278-V281 PolarHBondContact O-N 3.46Å; V281-Q284 PolarHBondContact O-N 2.87Å; V281-Y285 PolarHBondContact O-N 3.3Å; V281-Y285 VanDerWaalsContact O-N 3.12Å; V281-Y333 HydrophobicContact CG1-CE1 4.03Å; V281-L334 HydrophobicContact CG1-CD2 3.68Å
282	Y	93.3	Very high	92.2	Very high	45 Å²	45	48 Å²	48	18%	0.176	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-39.4	176.3	-175.6	-111.3	0	0	0	112.7	F217 F220 A278 Q284 Y285 L286 Y330	F217-Y282 HydrophobicContact CD2-CD1 4.03Å; F217-Y282 HydrophobicContact CD2-CE1 4.2Å; F217-Y282 HydrophobicContact CD2-CG 4.46Å; F217-Y282 AromaticContact CE2-CD1 3.48Å; F217-Y282 HydrophobicContact CE2-CD1 3.48Å; F217-Y282 VanDerWaalsContact CE2-CD1 3.48Å; F217-Y282 HydrophobicContact CE2-CD2 4.22Å; F217-Y282 HydrophobicContact CE2-CE1 4.07Å; F217-Y282 AromaticContact CE2-CG 3.56Å; F217-Y282 HydrophobicContact CE2-CG 3.56Å; F217-Y282 HydrophobicContact CZ-CD1 4.5Å; F217-Y282 HydrophobicContact CZ-CG 4.37Å; F220-Y282 HydrophobicContact CB-CD2 4.34Å; F220-Y282 HydrophobicContact CB-CE2 4.34Å; F220-Y282 HydrophobicContact CD1-CD2 4.04Å; F220-Y282 AromaticContact CD1-CE2 3.46Å; F220-Y282 HydrophobicContact CD1-CE2 3.46Å; F220-Y282 VanDerWaalsContact CD1-CE2 3.46Å; F220-Y282 HydrophobicContact CD2-CE2 4.18Å; F220-Y282 AromaticContact CE1-CE2 3.67Å; F220-Y282 HydrophobicContact CE1-CE2 3.67Å; F220-Y282 HydrophobicContact CE2-CE2 4.35Å; F220-Y282 HydrophobicContact CG-CD2 4.21Å; F220-Y282 AromaticContact CG-CE2 3.73Å; F220-Y282 HydrophobicContact CG-CE2 3.73Å; F220-Y282 HydrophobicContact CZ-CE2 4.11Å; A278-Y282 WeakPolarHBondContact O-CB 2.95Å; A278-Y282 PolarHBondContact O-N 2.79Å; Y282-Q284 VanDerWaalsContact C-N 3.32Å; Y282-Q284 PolarHBondContact O-N 3.44Å; Y282-Y285 VanDerWaalsContact O-CB 3.31Å; Y282-Y285 WeakPolarHBondContact O-CB 3.48Å; Y282-Y285 PolarHBondContact O-N 3.32Å; Y282-Y285 VanDerWaalsContact O-N 3.16Å; Y282-L286 HydrophobicContact CD1-CD1 3.93Å; Y282-L286 HydrophobicContact CD1-CG 4.34Å; Y282-L286 HydrophobicContact CE1-CD1 3.48Å; Y282-L286 VanDerWaalsContact CE1-CD1 3.48Å; Y282-L286 HydrophobicContact CE1-CD2 4.42Å; Y282-L286 HydrophobicContact CE1-CG 3.99Å; Y282-L286 PolarHBondContact O-N 3.42Å; Y282-Y330 HydrophobicContact CD2-CD2 4.29Å; Y282-Y330 HydrophobicContact CD2-CE1 4.41Å; Y282-Y330 AromaticContact CD2-CE2 3.77Å; Y282-Y330 HydrophobicContact CD2-CE2 3.77Å; Y282-Y330 AromaticContact CD2-CZ 3.83Å
283	G	91.9	Very high	92.1	Very high	24 Å²	24	50.5 Å²	50.5	25%	0.247	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-37.8	175.3	0	0	0	0	0	112.4	L279 R280 Y285 L286 N287	L279-G283 WeakPolarHBondContact O-CA 3.47Å; L279-G283 PolarHBondContact O-N 3.49Å; R280-G283 PolarHBondContact O-N 2.94Å; G283-Y285 VanDerWaalsContact C-N 3.35Å; G283-L286 PolarHBondContact O-N 3.32Å; G283-N287 WeakPolarHBondContact O-CB 3.27Å; G283-N287 PolarHBondContact O-N 2.94Å; G283-N287 PolarHBondContact O-ND2 3.24Å; G283-N287 VanDerWaalsContact O-ND2 3.16Å
284	Q	92.6	Very high	91.8	Very high	65 Å²	65	52.2 Å²	52.2	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-42.6	171.4	-74.8	173.7	-9.4	0	0	111.7	R280 V281 Y282 N287 L288 Y333	R280-Q284 VanDerWaalsContact O-CG 3.32Å; R280-Q284 WeakPolarHBondContact O-CG 3.42Å; R280-Q284 PolarHBondContact O-N 3.44Å; V281-Q284 PolarHBondContact O-N 2.87Å; Y282-Q284 VanDerWaalsContact C-N 3.32Å; Y282-Q284 PolarHBondContact O-N 3.44Å; Q284-N287 PolarHBondContact O-N 3.48Å; Q284-L288 VanDerWaalsContact O-CG 3.31Å; Q284-L288 WeakPolarHBondContact O-CG 3.27Å; Q284-L288 PolarHBondContact O-N 3.22Å; Q284-L288 VanDerWaalsContact O-N 3.15Å; Q284-Y333 WeakPolarHBondContact CB-OH 3.33Å
285	Y	93.6	Very high	91.8	Very high	5 Å²	5	54.8 Å²	54.8	2%	0.02	29%	0.286	C	S	.	.	H	α-helix	trans	-57.7	-50.4	175.1	-177.2	-97.8	0	0	0	111.8	V281 Y282 G283 N287 L288 D289 G294 M295 L296 Y330 Y333	V281-Y285 PolarHBondContact O-N 3.3Å; V281-Y285 VanDerWaalsContact O-N 3.12Å; Y282-Y285 VanDerWaalsContact O-CB 3.31Å; Y282-Y285 WeakPolarHBondContact O-CB 3.48Å; Y282-Y285 PolarHBondContact O-N 3.32Å; Y282-Y285 VanDerWaalsContact O-N 3.16Å; G283-Y285 VanDerWaalsContact C-N 3.35Å; Y285-N287 VanDerWaalsContact C-N 3.28Å; Y285-N287 PolarHBondContact O-N 2.99Å; Y285-L288 PolarHBondContact O-N 3.07Å; Y285-L288 VanDerWaalsContact O-N 3.09Å; Y285-D289 PolarHBondContact O-N 3.36Å; Y285-G294 PolarHBondContact OH-O 2.84Å; Y285-M295 WeakPolarHBondContact OH-CA 3.4Å; Y285-L296 HydrophobicContact CD2-CD1 3.47Å; Y285-L296 VanDerWaalsContact CD2-CD1 3.47Å; Y285-L296 HydrophobicContact CD2-CG 3.96Å; Y285-L296 HydrophobicContact CE2-CD1 3.46Å; Y285-L296 VanDerWaalsContact CE2-CD1 3.46Å; Y285-L296 HydrophobicContact CE2-CD2 4.39Å; Y285-L296 HydrophobicContact CE2-CG 3.53Å; Y285-Y330 AromaticContact CD1-CD2 3.91Å; Y285-Y330 HydrophobicContact CD1-CD2 3.91Å; Y285-Y330 AromaticContact CD2-CD2 3.72Å; Y285-Y330 HydrophobicContact CD2-CD2 3.72Å; Y285-Y330 HydrophobicContact CD2-CE2 4.47Å; Y285-Y330 HydrophobicContact CE1-CD2 4.25Å; Y285-Y330 HydrophobicContact CE2-CD2 4.04Å; Y285-Y330 AromaticContact CG-CD2 3.62Å; Y285-Y330 HydrophobicContact CG-CD2 3.62Å; Y285-Y330 HydrophobicContact CG-CE2 4.16Å; Y285-Y330 PolarHBondContact OH-N 3.14Å; Y285-Y333 AromaticContact CD2-CD1 3.52Å; Y285-Y333 HydrophobicContact CD2-CD1 3.52Å; Y285-Y333 HydrophobicContact CD2-CD2 4.1Å; Y285-Y333 AromaticContact CD2-CE1 4Å; Y285-Y333 HydrophobicContact CD2-CE1 4Å; Y285-Y333 AromaticContact CD2-CG 3.56Å; Y285-Y333 HydrophobicContact CD2-CG 3.56Å; Y285-Y333 HydrophobicContact CE2-CD1 4.34Å; Y285-Y333 HydrophobicContact CE2-CG 4.08Å; Y285-Y333 HydrophobicContact CG-CD1 4.25Å; Y285-Y333 HydrophobicContact CG-CE1 4.4Å
286	L	92.1	Very high	91.9	Very high	69 Å²	69	54.2 Å²	54.2	36%	0.361	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-30.7	178.1	-68	179.8	0	0	0	113.7	Y282 G283 L288	Y282-L286 HydrophobicContact CD1-CD1 3.93Å; Y282-L286 HydrophobicContact CD1-CG 4.34Å; Y282-L286 HydrophobicContact CE1-CD1 3.48Å; Y282-L286 VanDerWaalsContact CE1-CD1 3.48Å; Y282-L286 HydrophobicContact CE1-CD2 4.42Å; Y282-L286 HydrophobicContact CE1-CG 3.99Å; Y282-L286 PolarHBondContact O-N 3.42Å; G283-L286 PolarHBondContact O-N 3.32Å; L286-L288 VanDerWaalsContact C-N 3.3Å
287	N	92.7	Very high	92	Very high	131 Å²	131	52.3 Å²	52.3	70%	0.701	27%	0.27	S	S	*	.	H	α-helix	trans	-72.8	-26	176.2	-73.2	-27.5	0	0	0	112.6	G283 Q284 Y285	G283-N287 WeakPolarHBondContact O-CB 3.27Å; G283-N287 PolarHBondContact O-N 2.94Å; G283-N287 PolarHBondContact O-ND2 3.24Å; G283-N287 VanDerWaalsContact O-ND2 3.16Å; Q284-N287 PolarHBondContact O-N 3.48Å; Y285-N287 VanDerWaalsContact C-N 3.28Å; Y285-N287 PolarHBondContact O-N 2.99Å
288	L	92.8	Very high	92.1	Very high	16 Å²	16	54.8 Å²	54.8	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-80.9	-42.1	176.6	-65.7	168.2	0	0	0	111	Q284 Y285 L286 K290 L296 E300 R303 Y304 Y333	Q284-L288 VanDerWaalsContact O-CG 3.31Å; Q284-L288 WeakPolarHBondContact O-CG 3.27Å; Q284-L288 PolarHBondContact O-N 3.22Å; Q284-L288 VanDerWaalsContact O-N 3.15Å; Y285-L288 PolarHBondContact O-N 3.07Å; Y285-L288 VanDerWaalsContact O-N 3.09Å; L286-L288 VanDerWaalsContact C-N 3.3Å; L288-K290 PolarHBondContact O-N 3.28Å; L288-L296 HydrophobicContact CB-CD1 4.33Å; L288-L296 HydrophobicContact CB-CD2 3.62Å; L288-L296 HydrophobicContact CD1-CD1 4.31Å; L288-E300 WeakPolarHBondContact CD2-O 3.22Å; L288-E300 WeakPolarHBondContact O-CB 3.34Å; L288-E300 WeakPolarHBondContact O-CG 3.49Å; L288-R303 HydrophobicContact CD2-CB 3.93Å; L288-Y304 HydrophobicContact CD1-CD2 4.06Å; L288-Y333 HydrophobicContact CD1-CE2 3.99Å
289	D	93.2	Very high	92	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	31%	0.307	C	S	.	.			trans	-70.3	91.6	176.7	178.5	5.3	0	0	0	110.9	Y285 H292 N293 G294 L296	Y285-D289 PolarHBondContact O-N 3.36Å; D289-H292 PolarHBondContact O-CE1 3.11Å; D289-H292 VanDerWaalsContact O-CE1 3.32Å; D289-H292 PolarHBondContact O-ND1 3.33Å; D289-H292 WeakPolarHBondContact OD1-CA 3.49Å; D289-H292 PolarHBondContact OD1-N 3.13Å; D289-H292 WeakPolarHBondContact OD2-CA 3.18Å; D289-N293 PolarHBondContact OD1-N 3.34Å; D289-G294 WeakPolarHBondContact OD2-CA 3.24Å; D289-G294 PolarHBondContact OD2-N 2.75Å; D289-L296 HydrophobicContact CB-CD2 3.77Å
290	K	91	Very high	92	Very high	127 Å²	127	57.3 Å²	57.3	55%	0.552	29%	0.289	S	S	*	.	S	Bend	trans	-86.6	-27.6	-174.3	-76	-164.1	176.5	176.8	0	113.3	L288 H292 E300 R303	L288-K290 PolarHBondContact O-N 3.28Å; K290-H292 VanDerWaalsContact C-N 3.28Å; K290-E300 PolarHBondContact N-OE1 2.64Å; K290-R303 VanDerWaalsContact CD-NH1 3.3Å
291	D	90.6	Very high	92	Very high	92 Å²	92	52.2 Å²	52.2	49%	0.492	27%	0.27	S	S	.	.	S	Bend	trans	-86.9	-7.1	176.9	71.7	-1.9	0	0	0	112.2	N293	D291-N293 PolarHBondContact O-N 3.21Å; D291-N293 VanDerWaalsContact OD1-CB 3.28Å; D291-N293 WeakPolarHBondContact OD1-CB 3.44Å; D291-N293 PolarHBondContact OD1-N 3.47Å; D291-N293 VanDerWaalsContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD1-ND2 3.44Å; D291-N293 PolarHBondContact OD1-OD1 3.2Å; D291-N293 PolarHBondContact OD2-ND2 3.02Å
292	H	89	Confident	91.9	Very high	146 Å²	146	54.4 Å²	54.4	68%	0.676	29%	0.285	S	S	*	.			trans	58.1	33.7	178.5	-58.3	-45.4	0	0	0	111.9	D289 K290 G294	D289-H292 PolarHBondContact O-CE1 3.11Å; D289-H292 VanDerWaalsContact O-CE1 3.32Å; D289-H292 PolarHBondContact O-ND1 3.33Å; D289-H292 WeakPolarHBondContact OD1-CA 3.49Å; D289-H292 PolarHBondContact OD1-N 3.13Å; D289-H292 WeakPolarHBondContact OD2-CA 3.18Å; K290-H292 VanDerWaalsContact C-N 3.28Å; H292-G294 VanDerWaalsContact C-N 3.27Å
293	N	90	Very high	91.8	Very high	68 Å²	68	58 Å²	58	36%	0.364	30%	0.299	S	S	.	.	S	Bend	trans	-82.3	-9.2	178.8	78.9	15.3	0	0	0	112.3	D289 D291 M295 E327	D289-N293 PolarHBondContact OD1-N 3.34Å; D291-N293 PolarHBondContact O-N 3.21Å; D291-N293 VanDerWaalsContact OD1-CB 3.28Å; D291-N293 WeakPolarHBondContact OD1-CB 3.44Å; D291-N293 PolarHBondContact OD1-N 3.47Å; D291-N293 VanDerWaalsContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD1-ND2 3.44Å; D291-N293 PolarHBondContact OD1-OD1 3.2Å; D291-N293 PolarHBondContact OD2-ND2 3.02Å; N293-M295 WeakPolarHBondContact OD1-CA 3.34Å; N293-M295 WeakPolarHBondContact OD1-CB 3.32Å; N293-M295 PolarHBondContact OD1-N 3.35Å; N293-M295 PolarHBondContact OD1-O 3.41Å; N293-M295 VanDerWaalsContact OD1-O 3.09Å; N293-E327 PolarHBondContact ND2-OE1 2.87Å; N293-E327 PolarHBondContact ND2-OE2 2.84Å; N293-E327 VanDerWaalsContact ND2-OE2 3.14Å
294	G	86.8	Confident	91.7	Very high	37 Å²	37	58.3 Å²	58.3	38%	0.381	29%	0.293	S	S	.	.	S	Bend	trans	86	5.3	178	0	0	0	0	0	114.4	Y285 D289 H292	Y285-G294 PolarHBondContact OH-O 2.84Å; D289-G294 WeakPolarHBondContact OD2-CA 3.24Å; D289-G294 PolarHBondContact OD2-N 2.75Å; H292-G294 VanDerWaalsContact C-N 3.27Å
295	M	93.2	Very high	91.3	Very high	56 Å²	56	58.4 Å²	58.4	28%	0.276	31%	0.311	S	S	.	.	S	Bend	trans	-127.3	167.6	176.1	-58.3	-67.2	-175.8	0	0	109.6	Y285 N293 Y324 E327 M328 D329	Y285-M295 WeakPolarHBondContact OH-CA 3.4Å; N293-M295 WeakPolarHBondContact OD1-CA 3.34Å; N293-M295 WeakPolarHBondContact OD1-CB 3.32Å; N293-M295 PolarHBondContact OD1-N 3.35Å; N293-M295 PolarHBondContact OD1-O 3.41Å; N293-M295 VanDerWaalsContact OD1-O 3.09Å; M295-Y324 HydrophobicContact CE-CD2 4.29Å; M295-E327 HydrophobicContact CB-CB 3.66Å; M295-E327 HydrophobicContact CG-CB 4.45Å; M295-M328 CarbonylContact C-O 3.56Å; M295-M328 WeakPolarHBondContact CA-O 3.39Å; M295-D329 HydrophobicContact CE-CB 4.12Å; M295-D329 WeakPolarHBondContact SD-CA 3.39Å; M295-D329 HydrophobicContact SD-CB 3.53Å; M295-D329 VanDerWaalsContact SD-CB 3.53Å
296	L	93.4	Very high	90.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-118.1	122.7	177.7	-67.7	179.3	0	0	0	111.6	Y285 L288 D289 E300 L301 F318 E327 M328 Y333	Y285-L296 HydrophobicContact CD2-CD1 3.47Å; Y285-L296 VanDerWaalsContact CD2-CD1 3.47Å; Y285-L296 HydrophobicContact CD2-CG 3.96Å; Y285-L296 HydrophobicContact CE2-CD1 3.46Å; Y285-L296 VanDerWaalsContact CE2-CD1 3.46Å; Y285-L296 HydrophobicContact CE2-CD2 4.39Å; Y285-L296 HydrophobicContact CE2-CG 3.53Å; L288-L296 HydrophobicContact CB-CD1 4.33Å; L288-L296 HydrophobicContact CB-CD2 3.62Å; L288-L296 HydrophobicContact CD1-CD1 4.31Å; D289-L296 HydrophobicContact CB-CD2 3.77Å; L296-E300 HydrophobicContact CD2-CB 4.19Å; L296-L301 HydrophobicContact CD1-CD1 4.21Å; L296-F318 WeakPolarHBondContact O-CE1 3.31Å; L296-F318 WeakPolarHBondContact O-CZ 3.29Å; L296-E327 CarbonylContact O-C 3.56Å; L296-E327 WeakPolarHBondContact O-CA 3.16Å; L296-M328 HydrophobicContact CB-CE 4.41Å; L296-M328 HydrophobicContact CD1-CE 4.22Å; L296-M328 PolarHBondContact N-O 3.33Å; L296-M328 PolarHBondContact O-N 2.89Å; L296-Y333 HydrophobicContact CD1-CD2 3.72Å; L296-Y333 HydrophobicContact CD1-CE2 4.22Å; L296-Y333 HydrophobicContact CD1-CG 4.25Å
297	S	93.9	Very high	90.3	Very high	21 Å²	21	61.9 Å²	61.9	15%	0.147	34%	0.341	C	S	.	.			trans	-72.9	165.2	166.5	63.9	0	0	0	0	111.9	E299 E300 L301 F318	S297-E299 VanDerWaalsContact C-N 3.29Å; S297-E299 PolarHBondContact O-N 2.76Å; S297-E300 WeakPolarHBondContact CB-OE2 3.28Å; S297-E300 PolarHBondContact N-OE2 3.34Å; S297-E300 PolarHBondContact O-N 2.71Å; S297-E300 WeakPolarHBondContact OG-CB 3.45Å; S297-E300 VanDerWaalsContact OG-CD 3.25Å; S297-E300 VanDerWaalsContact OG-CG 3.23Å; S297-E300 WeakPolarHBondContact OG-CG 3.34Å; S297-E300 PolarHBondContact OG-N 3.42Å; S297-E300 PolarHBondContact OG-OE2 3.31Å; S297-L301 PolarHBondContact O-N 3.13Å; S297-F318 VanDerWaalsContact C-CZ 3.49Å
298	K	92.6	Very high	90	Very high	53 Å²	53	57 Å²	57	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-40.5	175.3	-175.7	-170.4	173.7	-166.5	0	111.6	E300 L301 S302 L314 D315 F318	K298-E300 VanDerWaalsContact C-N 3.29Å; K298-E300 PolarHBondContact O-N 3.31Å; K298-L301 PolarHBondContact O-N 3.44Å; K298-S302 WeakPolarHBondContact O-CB 3.43Å; K298-S302 PolarHBondContact O-N 3.2Å; K298-L314 HydrophobicContact CG-CB 4.31Å; K298-D315 VanDerWaalsContact CE-OD1 3.28Å; K298-D315 WeakPolarHBondContact CE-OD1 3.26Å; K298-D315 IonicContact NZ-OD1 2.8Å; K298-D315 PolarHBondContact NZ-OD1 3.41Å; K298-D315 IonicContact NZ-OD2 3.91Å; K298-D315 PolarHBondContact NZ-OD2 3.48Å; K298-F318 VanDerWaalsContact CA-CZ 3.5Å; K298-F318 HydrophobicContact CB-CD2 4.11Å; K298-F318 HydrophobicContact CB-CE1 4.48Å; K298-F318 HydrophobicContact CB-CE2 3.93Å; K298-F318 HydrophobicContact CB-CG 4.46Å; K298-F318 HydrophobicContact CB-CZ 4.14Å; K298-F318 HydrophobicContact CG-CD2 4.19Å; K298-F318 HydrophobicContact CG-CE2 4.21Å
299	E	91.4	Very high	89.8	Confident	124 Å²	124	56.9 Å²	56.9	58%	0.579	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-35.9	178.9	-68.7	72.4	-159.8	0	0	111.6	S297 S302	S297-E299 VanDerWaalsContact C-N 3.29Å; S297-E299 PolarHBondContact O-N 2.76Å; E299-S302 PolarHBondContact O-OG 2.7Å
300	E	92.8	Very high	89.7	Confident	13 Å²	13	56.7 Å²	56.7	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-72.4	-48.8	175.7	-72.2	167.1	142.6	0	0	111.4	L288 K290 L296 S297 K298 S302 R303	L288-E300 WeakPolarHBondContact CD2-O 3.22Å; L288-E300 WeakPolarHBondContact O-CB 3.34Å; L288-E300 WeakPolarHBondContact O-CG 3.49Å; K290-E300 PolarHBondContact N-OE1 2.64Å; L296-E300 HydrophobicContact CD2-CB 4.19Å; S297-E300 WeakPolarHBondContact CB-OE2 3.28Å; S297-E300 PolarHBondContact N-OE2 3.34Å; S297-E300 PolarHBondContact O-N 2.71Å; S297-E300 WeakPolarHBondContact OG-CB 3.45Å; S297-E300 VanDerWaalsContact OG-CD 3.25Å; S297-E300 VanDerWaalsContact OG-CG 3.23Å; S297-E300 WeakPolarHBondContact OG-CG 3.34Å; S297-E300 PolarHBondContact OG-N 3.42Å; S297-E300 PolarHBondContact OG-OE2 3.31Å; K298-E300 VanDerWaalsContact C-N 3.29Å; K298-E300 PolarHBondContact O-N 3.31Å; E300-S302 PolarHBondContact O-N 3.27Å; E300-R303 WeakPolarHBondContact O-CB 3.46Å; E300-R303 PolarHBondContact O-N 3.14Å
301	L	92.6	Very high	89.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-27.3	177.8	-166.4	68.2	0	0	0	112.5	L296 S297 K298 R303 Y304 L314 V317 F318 M328 Y333 F336	L296-L301 HydrophobicContact CD1-CD1 4.21Å; S297-L301 PolarHBondContact O-N 3.13Å; K298-L301 PolarHBondContact O-N 3.44Å; L301-R303 PolarHBondContact O-N 2.96Å; L301-R303 VanDerWaalsContact O-N 3.07Å; L301-Y304 WeakPolarHBondContact O-CB 3.33Å; L301-Y304 PolarHBondContact O-N 3.18Å; L301-L314 HydrophobicContact CD2-CD2 4.04Å; L301-L314 HydrophobicContact CG-CD2 4.25Å; L301-V317 HydrophobicContact CD2-CG1 4.29Å; L301-F318 HydrophobicContact CB-CE2 4.1Å; L301-F318 HydrophobicContact CB-CZ 4.24Å; L301-F318 HydrophobicContact CD2-CE2 3.6Å; L301-F318 HydrophobicContact CD2-CZ 4.18Å; L301-F318 HydrophobicContact CG-CE2 4.49Å; L301-M328 HydrophobicContact CD1-CE 3.67Å; L301-M328 HydrophobicContact CD2-CE 3.62Å; L301-M328 HydrophobicContact CG-CE 4.2Å; L301-Y333 HydrophobicContact CD1-CD2 4.07Å; L301-Y333 HydrophobicContact CD1-CE2 4.27Å; L301-F336 HydrophobicContact CD1-CD1 4.25Å; L301-F336 HydrophobicContact CD1-CE1 3.95Å; L301-F336 HydrophobicContact CD1-CZ 4.46Å; L301-F336 HydrophobicContact CD2-CE1 4.38Å; L301-F336 HydrophobicContact CD2-CE2 4.34Å; L301-F336 HydrophobicContact CD2-CZ 4.17Å; L301-F336 HydrophobicContact CG-CE1 4.36Å; L301-F336 HydrophobicContact CG-CZ 4.39Å
302	S	90.9	Very high	89.8	Confident	46 Å²	46	50.1 Å²	50.1	32%	0.322	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.5	175.4	78.5	0	0	0	0	114	K298 E299 E300 Y304 A307	K298-S302 WeakPolarHBondContact O-CB 3.43Å; K298-S302 PolarHBondContact O-N 3.2Å; E299-S302 PolarHBondContact O-OG 2.7Å; E300-S302 PolarHBondContact O-N 3.27Å; S302-Y304 VanDerWaalsContact C-N 3.33Å; S302-A307 VanDerWaalsContact O-CA 3.31Å; S302-A307 WeakPolarHBondContact O-CA 3.5Å; S302-A307 WeakPolarHBondContact O-CB 3.48Å
303	R	90.3	Very high	90	Very high	120 Å²	120	43.2 Å²	43.2	45%	0.453	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	3	176.9	-57.4	-176.2	-172.8	127.1	4.8	113.4	L288 K290 E300 L301	L288-R303 HydrophobicContact CD2-CB 3.93Å; K290-R303 VanDerWaalsContact CD-NH1 3.3Å; E300-R303 WeakPolarHBondContact O-CB 3.46Å; E300-R303 PolarHBondContact O-N 3.14Å; L301-R303 PolarHBondContact O-N 2.96Å; L301-R303 VanDerWaalsContact O-N 3.07Å
304	Y	89.6	Confident	90.1	Very high	31 Å²	31	40.1 Å²	40.1	12%	0.122	24%	0.243	C	C	.	.	S	Bend	trans	-59.9	138.2	177.3	178.7	-95.3	0	0	0	111.4	L288 L301 S302 T306 A307 L309 Y333 F336 V337 L340	L288-Y304 HydrophobicContact CD1-CD2 4.06Å; L301-Y304 WeakPolarHBondContact O-CB 3.33Å; L301-Y304 PolarHBondContact O-N 3.18Å; S302-Y304 VanDerWaalsContact C-N 3.33Å; Y304-T306 PolarHBondContact O-N 3.12Å; Y304-A307 PolarHBondContact O-N 3.22Å; Y304-L309 HydrophobicContact CD1-CD1 4.16Å; Y304-Y333 HydrophobicContact CD2-CE2 4.04Å; Y304-Y333 HydrophobicContact CE2-CE2 4.14Å; Y304-F336 AromaticContact CD1-CE1 3.84Å; Y304-F336 HydrophobicContact CD1-CE1 3.84Å; Y304-F336 HydrophobicContact CD1-CZ 4.38Å; Y304-F336 HydrophobicContact CD2-CE1 4.32Å; Y304-F336 HydrophobicContact CE1-CE1 4.06Å; Y304-F336 AromaticContact CG-CE1 3.98Å; Y304-F336 HydrophobicContact CG-CE1 3.98Å; Y304-V337 HydrophobicContact CE2-CG2 3.86Å; Y304-L340 HydrophobicContact CD1-CD1 4.27Å; Y304-L340 HydrophobicContact CE1-CD1 3.85Å
305	G	84.6	Confident	90.4	Very high	67 Å²	67	41 Å²	41	69%	0.691	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	-119.3	-179.2	0	0	0	0	0	112.2
306	T	81.8	Confident	90.4	Very high	94 Å²	94	39.2 Å²	39.2	58%	0.577	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	7.8	178.1	53.5	0	0	0	0	113.5	Y304 T308	Y304-T306 PolarHBondContact O-N 3.12Å; T306-T308 PolarHBondContact O-N 3.09Å; T306-T308 WeakPolarHBondContact OG1-CG2 3.17Å; T306-T308 PolarHBondContact OG1-OG1 3.42Å
307	A	84.3	Confident	90.4	Very high	53 Å²	53	39.2 Å²	39.2	44%	0.438	23%	0.229	S	C	.	.	S	Bend	trans	58.6	31.8	-176.7	0	0	0	0	0	114.2	S302 Y304	S302-A307 VanDerWaalsContact O-CA 3.31Å; S302-A307 WeakPolarHBondContact O-CA 3.5Å; S302-A307 WeakPolarHBondContact O-CB 3.48Å; Y304-A307 PolarHBondContact O-N 3.22Å
308	T	85.1	Confident	90.3	Very high	29 Å²	29	39.4 Å²	39.4	18%	0.178	23%	0.227	C	C	.	.			trans	-104.5	-2.7	-175.8	46.7	0	0	0	0	113.4	T306 D429 L430 N431	T306-T308 PolarHBondContact O-N 3.09Å; T306-T308 WeakPolarHBondContact OG1-CG2 3.17Å; T306-T308 PolarHBondContact OG1-OG1 3.42Å; T308-D429 VanDerWaalsContact CB-OD1 3.24Å; T308-D429 WeakPolarHBondContact CB-OD1 3.36Å; T308-D429 PolarHBondContact OG1-OD1 2.9Å; T308-L430 PolarHBondContact O-N 3.46Å; T308-N431 HydrophobicContact CG2-CB 4.15Å
309	L	90	Very high	90.2	Very high	13 Å²	13	42.7 Å²	42.7	7%	0.068	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-63.8	137.7	171.4	-66.7	176.1	0	0	0	110.3	Y304 F313 L314 F336 L340 I428 D429	Y304-L309 HydrophobicContact CD1-CD1 4.16Å; L309-F313 HydrophobicContact CD2-CD1 4.24Å; L309-F313 HydrophobicContact CD2-CE1 4.32Å; L309-L314 HydrophobicContact CB-CD2 4.4Å; L309-L314 HydrophobicContact CB-CG 4.39Å; L309-L314 HydrophobicContact CD1-CD2 4.21Å; L309-F336 HydrophobicContact CD1-CE2 4.49Å; L309-F336 HydrophobicContact CD1-CZ 3.67Å; L309-L340 HydrophobicContact CD1-CD1 4.03Å; L309-I428 HydrophobicContact CD2-CG1 4.44Å; L309-D429 HydrophobicContact CD2-CB 4.08Å
310	T	90.8	Very high	90.1	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.			trans	-70	144.1	-179.2	60.5	0	0	0	0	111.5	V312 F313 L314 A375 I376 I428	T310-V312 PolarHBondContact O-N 3.45Å; T310-F313 PolarHBondContact O-N 2.99Å; T310-F313 VanDerWaalsContact O-N 3.15Å; T310-F313 VanDerWaalsContact OG1-CB 3.23Å; T310-F313 WeakPolarHBondContact OG1-CB 3.49Å; T310-F313 PolarHBondContact OG1-N 3.45Å; T310-L314 WeakPolarHBondContact O-CG 3.47Å; T310-L314 PolarHBondContact O-N 2.86Å; T310-L314 VanDerWaalsContact O-N 3.07Å; T310-A375 HydrophobicContact CG2-CB 4.01Å; T310-I376 HydrophobicContact CG2-CD1 4.41Å; T310-I376 HydrophobicContact CG2-CG1 3.53Å; T310-I428 PolarHBondContact N-O 3.3Å; T310-I428 PolarHBondContact OG1-O 3.03Å
311	S	90.4	Very high	89.9	Confident	60 Å²	60	39.1 Å²	39.1	42%	0.42	23%	0.228	S	C	.	.	H	α-helix	trans	-58.2	-36.3	176.2	53.2	0	0	0	0	112.2	L314 D315	S311-L314 PolarHBondContact O-N 2.93Å; S311-D315 PolarHBondContact O-N 2.89Å
312	V	92.7	Very high	89.5	Confident	21 Å²	21	44.8 Å²	44.8	13%	0.127	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-42	177.3	175.9	0	0	0	0	111.8	T310 D315 R316 Y371 F372 A375	T310-V312 PolarHBondContact O-N 3.45Å; V312-D315 WeakPolarHBondContact O-CB 3.25Å; V312-D315 PolarHBondContact O-N 3.45Å; V312-R316 WeakPolarHBondContact O-CG 3.26Å; V312-R316 PolarHBondContact O-N 3.17Å; V312-Y371 HydrophobicContact CG1-CD1 3.76Å; V312-Y371 HydrophobicContact CG1-CE1 3.1Å; V312-F372 HydrophobicContact CG1-CD1 3.8Å; V312-F372 HydrophobicContact CG1-CE1 3.85Å; V312-A375 HydrophobicContact CB-CB 4.03Å; V312-A375 HydrophobicContact CG2-CB 3.64Å
313	F	93.1	Very high	89.4	Confident	1 Å²	1	45 Å²	45	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-45	174.1	175.3	-111.7	0	0	0	111.4	L309 T310 D315 R316 V317 F336 L340 I352 L355 I428	L309-F313 HydrophobicContact CD2-CD1 4.24Å; L309-F313 HydrophobicContact CD2-CE1 4.32Å; T310-F313 PolarHBondContact O-N 2.99Å; T310-F313 VanDerWaalsContact O-N 3.15Å; T310-F313 VanDerWaalsContact OG1-CB 3.23Å; T310-F313 WeakPolarHBondContact OG1-CB 3.49Å; T310-F313 PolarHBondContact OG1-N 3.45Å; F313-D315 VanDerWaalsContact C-N 3.31Å; F313-D315 PolarHBondContact O-N 2.93Å; F313-R316 WeakPolarHBondContact O-CB 3.26Å; F313-R316 PolarHBondContact O-N 3.05Å; F313-R316 VanDerWaalsContact O-N 3.07Å; F313-V317 HydrophobicContact CD1-CG2 4.35Å; F313-V317 HydrophobicContact CE1-CG2 3.99Å; F313-V317 HydrophobicContact CE2-CG2 4.37Å; F313-V317 HydrophobicContact CZ-CG2 3.99Å; F313-V317 WeakPolarHBondContact O-CG2 3.39Å; F313-V317 PolarHBondContact O-N 3.4Å; F313-F336 AromaticContact CE1-CE2 3.93Å; F313-F336 HydrophobicContact CE1-CE2 3.93Å; F313-F336 HydrophobicContact CZ-CE2 4.46Å; F313-L340 HydrophobicContact CE1-CD2 4.5Å; F313-L340 HydrophobicContact CZ-CD2 4.49Å; F313-I352 HydrophobicContact CE2-CG2 4.07Å; F313-L355 HydrophobicContact CE2-CB 4.05Å; F313-L355 HydrophobicContact CE2-CD1 3.51Å; F313-L355 HydrophobicContact CE2-CG 4.44Å; F313-L355 HydrophobicContact CZ-CD1 3.72Å; F313-I428 HydrophobicContact CB-CB 4.26Å; F313-I428 HydrophobicContact CB-CG2 4.46Å; F313-I428 HydrophobicContact CD1-CB 4.05Å; F313-I428 HydrophobicContact CD2-CB 3.86Å; F313-I428 HydrophobicContact CD2-CG2 3.43Å; F313-I428 VanDerWaalsContact CD2-CG2 3.43Å; F313-I428 HydrophobicContact CE1-CB 4.35Å; F313-I428 HydrophobicContact CE1-CD1 4.33Å; F313-I428 HydrophobicContact CE2-CB 4.19Å; F313-I428 HydrophobicContact CE2-CD1 4.49Å; F313-I428 HydrophobicContact CE2-CG2 3.67Å; F313-I428 HydrophobicContact CG-CB 3.79Å; F313-I428 HydrophobicContact CG-CG2 3.89Å; F313-I428 HydrophobicContact CZ-CB 4.42Å; F313-I428 HydrophobicContact CZ-CD1 4.15Å; F313-I428 HydrophobicContact CZ-CG2 4.31Å
314	L	92.8	Very high	89.2	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-38.4	176.9	-64.8	172.2	0	0	0	112	K298 L301 L309 T310 S311 R316 V317 F318	K298-L314 HydrophobicContact CG-CB 4.31Å; L301-L314 HydrophobicContact CD2-CD2 4.04Å; L301-L314 HydrophobicContact CG-CD2 4.25Å; L309-L314 HydrophobicContact CB-CD2 4.4Å; L309-L314 HydrophobicContact CB-CG 4.39Å; L309-L314 HydrophobicContact CD1-CD2 4.21Å; T310-L314 WeakPolarHBondContact O-CG 3.47Å; T310-L314 PolarHBondContact O-N 2.86Å; T310-L314 VanDerWaalsContact O-N 3.07Å; S311-L314 PolarHBondContact O-N 2.93Å; L314-R316 VanDerWaalsContact C-N 3.28Å; L314-R316 PolarHBondContact O-N 2.94Å; L314-V317 WeakPolarHBondContact O-CB 3.43Å; L314-V317 PolarHBondContact O-N 2.88Å; L314-F318 WeakPolarHBondContact O-CD2 3.4Å; L314-F318 PolarHBondContact O-N 3.27Å; L314-F318 VanDerWaalsContact O-N 3.14Å
315	D	92.8	Very high	89	Confident	56 Å²	56	52.3 Å²	52.3	30%	0.299	30%	0.299	S	S	.	.	H	α-helix	trans	-56.4	-43.6	172.2	-82.6	-48.3	0	0	0	111.8	K298 S311 V312 F313 F318 Q319	K298-D315 VanDerWaalsContact CE-OD1 3.28Å; K298-D315 WeakPolarHBondContact CE-OD1 3.26Å; K298-D315 IonicContact NZ-OD1 2.8Å; K298-D315 PolarHBondContact NZ-OD1 3.41Å; K298-D315 IonicContact NZ-OD2 3.91Å; K298-D315 PolarHBondContact NZ-OD2 3.48Å; S311-D315 PolarHBondContact O-N 2.89Å; V312-D315 WeakPolarHBondContact O-CB 3.25Å; V312-D315 PolarHBondContact O-N 3.45Å; F313-D315 VanDerWaalsContact C-N 3.31Å; F313-D315 PolarHBondContact O-N 2.93Å; D315-F318 PolarHBondContact O-N 3.3Å; D315-Q319 WeakPolarHBondContact O-CB 3.48Å; D315-Q319 WeakPolarHBondContact O-CG 3.44Å; D315-Q319 PolarHBondContact O-N 2.85Å
316	R	92.8	Very high	89.1	Confident	17 Å²	17	51.1 Å²	51.1	6%	0.064	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-37.4	177.4	-66.5	-64.1	-61	147	1.2	112.4	V312 F313 L314 F318 Q319 E320 L355 F372	V312-R316 WeakPolarHBondContact O-CG 3.26Å; V312-R316 PolarHBondContact O-N 3.17Å; F313-R316 WeakPolarHBondContact O-CB 3.26Å; F313-R316 PolarHBondContact O-N 3.05Å; F313-R316 VanDerWaalsContact O-N 3.07Å; L314-R316 VanDerWaalsContact C-N 3.28Å; L314-R316 PolarHBondContact O-N 2.94Å; R316-F318 PolarHBondContact O-N 3.03Å; R316-Q319 PolarHBondContact O-N 3.29Å; R316-E320 IonicContact CZ-OE1 2.94Å; R316-E320 IonicContact NH1-OE1 3.9Å; R316-E320 PolarHBondContact NH1-OE1 3.24Å; R316-E320 IonicContact NH2-OE1 2.71Å; R316-E320 PolarHBondContact NH2-OE1 2.9Å; R316-E320 WeakPolarHBondContact O-CB 3.33Å; R316-E320 PolarHBondContact O-N 3.2Å; R316-L355 HydrophobicContact CB-CB 4.39Å; R316-L355 PolarHBondContact NE-O 3.21Å; R316-F372 HydrophobicContact CG-CE1 4.05Å; R316-F372 HydrophobicContact CG-CZ 3.98Å
317	V	93.3	Very high	89.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-56.2	-51.6	174.5	174.4	0	0	0	0	110.3	L301 F313 L314 Q319 E320 C321 F336 L355	L301-V317 HydrophobicContact CD2-CG1 4.29Å; F313-V317 HydrophobicContact CD1-CG2 4.35Å; F313-V317 HydrophobicContact CE1-CG2 3.99Å; F313-V317 HydrophobicContact CE2-CG2 4.37Å; F313-V317 HydrophobicContact CZ-CG2 3.99Å; F313-V317 WeakPolarHBondContact O-CG2 3.39Å; F313-V317 PolarHBondContact O-N 3.4Å; L314-V317 WeakPolarHBondContact O-CB 3.43Å; L314-V317 PolarHBondContact O-N 2.88Å; V317-Q319 VanDerWaalsContact C-N 3.31Å; V317-Q319 PolarHBondContact O-N 3.06Å; V317-E320 PolarHBondContact O-N 3.14Å; V317-C321 WeakPolarHBondContact O-CB 3.29Å; V317-C321 PolarHBondContact O-N 2.85Å; V317-C321 PolarHBondContact O-SG 2.88Å; V317-F336 HydrophobicContact CG1-CD2 4.16Å; V317-F336 HydrophobicContact CG1-CE2 4.49Å; V317-F336 HydrophobicContact CG2-CD2 4.15Å; V317-F336 HydrophobicContact CG2-CE2 3.96Å; V317-L355 HydrophobicContact CG2-CD1 3.72Å
318	F	92.9	Very high	90.1	Very high	25 Å²	25	46.7 Å²	46.7	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-72.9	-20.2	-178.3	-79.5	-99.1	0	0	0	114	L296 S297 K298 L301 L314 D315 R316 T323 G326 M328	L296-F318 WeakPolarHBondContact O-CE1 3.31Å; L296-F318 WeakPolarHBondContact O-CZ 3.29Å; S297-F318 VanDerWaalsContact C-CZ 3.49Å; K298-F318 VanDerWaalsContact CA-CZ 3.5Å; K298-F318 HydrophobicContact CB-CD2 4.11Å; K298-F318 HydrophobicContact CB-CE1 4.48Å; K298-F318 HydrophobicContact CB-CE2 3.93Å; K298-F318 HydrophobicContact CB-CG 4.46Å; K298-F318 HydrophobicContact CB-CZ 4.14Å; K298-F318 HydrophobicContact CG-CD2 4.19Å; K298-F318 HydrophobicContact CG-CE2 4.21Å; L301-F318 HydrophobicContact CB-CE2 4.1Å; L301-F318 HydrophobicContact CB-CZ 4.24Å; L301-F318 HydrophobicContact CD2-CE2 3.6Å; L301-F318 HydrophobicContact CD2-CZ 4.18Å; L301-F318 HydrophobicContact CG-CE2 4.49Å; L314-F318 WeakPolarHBondContact O-CD2 3.4Å; L314-F318 PolarHBondContact O-N 3.27Å; L314-F318 VanDerWaalsContact O-N 3.14Å; D315-F318 PolarHBondContact O-N 3.3Å; R316-F318 PolarHBondContact O-N 3.03Å; F318-T323 HydrophobicContact CB-CG2 4.33Å; F318-T323 HydrophobicContact CD1-CG2 3.7Å; F318-T323 HydrophobicContact CE1-CG2 4.41Å; F318-T323 HydrophobicContact CG-CG2 4.32Å; F318-G326 WeakPolarHBondContact CD1-O 3.08Å; F318-G326 VanDerWaalsContact CE1-O 3.26Å; F318-G326 WeakPolarHBondContact CE1-O 3.33Å; F318-M328 HydrophobicContact CE1-CB 4.03Å; F318-M328 HydrophobicContact CZ-CB 4.21Å
319	Q	90.3	Very high	90.5	Very high	121 Å²	121	46.7 Å²	46.7	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-80.6	-39.1	174.2	-74.3	168.1	16.5	0	0	113.2	D315 R316 V317	D315-Q319 WeakPolarHBondContact O-CB 3.48Å; D315-Q319 WeakPolarHBondContact O-CG 3.44Å; D315-Q319 PolarHBondContact O-N 2.85Å; R316-Q319 PolarHBondContact O-N 3.29Å; V317-Q319 VanDerWaalsContact C-N 3.31Å; V317-Q319 PolarHBondContact O-N 3.06Å
320	E	88.7	Confident	90.6	Very high	46 Å²	46	46.8 Å²	46.8	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-95.9	-24.7	-173.5	-72.2	-65.3	151.8	0	0	113.7	R316 V317 K354 L355	R316-E320 IonicContact CZ-OE1 2.94Å; R316-E320 IonicContact NH1-OE1 3.9Å; R316-E320 PolarHBondContact NH1-OE1 3.24Å; R316-E320 IonicContact NH2-OE1 2.71Å; R316-E320 PolarHBondContact NH2-OE1 2.9Å; R316-E320 WeakPolarHBondContact O-CB 3.33Å; R316-E320 PolarHBondContact O-N 3.2Å; V317-E320 PolarHBondContact O-N 3.14Å; E320-K354 VanDerWaalsContact OE2-CE 3.28Å; E320-K354 WeakPolarHBondContact OE2-CE 3.39Å; E320-K354 IonicContact OE2-NZ 3.45Å; E320-K354 PolarHBondContact OE2-NZ 2.81Å; E320-L355 HydrophobicContact CB-CD2 3.65Å; E320-L355 HydrophobicContact CG-CD2 4.14Å
321	C	88.1	Confident	90.7	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.108	26%	0.261	C	S	.	.	S	Bend	trans	-88.5	162	179	-59.4	0	0	0	0	111.8	V317 T323 T332 Y351	V317-C321 WeakPolarHBondContact O-CB 3.29Å; V317-C321 PolarHBondContact O-N 2.85Å; V317-C321 PolarHBondContact O-SG 2.88Å; C321-T323 PolarHBondContact O-N 3.27Å; C321-T332 HydrophobicContact CB-CG2 3.57Å; C321-Y351 PolarHBondContact SG-OH 3.04Å
322	L	84.8	Confident	90.8	Very high	119 Å²	119	47.2 Å²	47.2	62%	0.623	24%	0.243	S	C	*	.			trans	-67.5	118.2	174.5	-76.2	153.3	0	0	0	108.8
323	T	88.1	Confident	90.9	Very high	50 Å²	50	46.2 Å²	46.2	31%	0.307	24%	0.237	S	C	.	.			trans	-127.3	146.8	176.3	55.9	0	0	0	0	109.9	F318 C321 E327	F318-T323 HydrophobicContact CB-CG2 4.33Å; F318-T323 HydrophobicContact CD1-CG2 3.7Å; F318-T323 HydrophobicContact CE1-CG2 4.41Å; F318-T323 HydrophobicContact CG-CG2 4.32Å; C321-T323 PolarHBondContact O-N 3.27Å; T323-E327 CarbonylContact C-O 3.44Å; T323-E327 WeakPolarHBondContact CA-O 3.24Å; T323-E327 WeakPolarHBondContact CB-O 3.31Å
324	Y	87.3	Confident	91	Very high	130 Å²	130	46.1 Å²	46.1	51%	0.51	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-113.2	112.4	176.1	-61	-82.2	0	0	0	107.4	M295 G326 E327 D329	M295-Y324 HydrophobicContact CE-CD2 4.29Å; Y324-G326 PolarHBondContact O-N 2.81Å; Y324-G326 VanDerWaalsContact O-N 3.08Å; Y324-E327 PolarHBondContact N-O 3.1Å; Y324-E327 PolarHBondContact O-N 3.46Å; Y324-D329 HydrophobicContact CE2-CB 4.33Å
325	D	85.1	Confident	91.1	Very high	176 Å²	176	46.4 Å²	46.4	94%	0.941	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	30.9	-175.8	-63.7	-34.6	0	0	0	114.5
326	G	87.1	Confident	91.2	Very high	42 Å²	42	43.8 Å²	43.8	43%	0.433	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	6.3	-179	0	0	0	0	0	114.6	F318 Y324	F318-G326 WeakPolarHBondContact CD1-O 3.08Å; F318-G326 VanDerWaalsContact CE1-O 3.26Å; F318-G326 WeakPolarHBondContact CE1-O 3.33Å; Y324-G326 PolarHBondContact O-N 2.81Å; Y324-G326 VanDerWaalsContact O-N 3.08Å
327	E	91.3	Very high	91.2	Very high	51 Å²	51	43 Å²	43	24%	0.238	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-113	151.6	177.4	-54.1	-173.8	142	0	0	111.8	N293 M295 L296 T323 Y324	N293-E327 PolarHBondContact ND2-OE1 2.87Å; N293-E327 PolarHBondContact ND2-OE2 2.84Å; N293-E327 VanDerWaalsContact ND2-OE2 3.14Å; M295-E327 HydrophobicContact CB-CB 3.66Å; M295-E327 HydrophobicContact CG-CB 4.45Å; L296-E327 CarbonylContact O-C 3.56Å; L296-E327 WeakPolarHBondContact O-CA 3.16Å; T323-E327 CarbonylContact C-O 3.44Å; T323-E327 WeakPolarHBondContact CA-O 3.24Å; T323-E327 WeakPolarHBondContact CB-O 3.31Å; Y324-E327 PolarHBondContact N-O 3.1Å; Y324-E327 PolarHBondContact O-N 3.46Å
328	M	93.9	Very high	91.3	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-105.9	136.2	-175	-178.1	178.1	56.3	0	0	110.9	M295 L296 L301 F318 T332 Y333	M295-M328 CarbonylContact C-O 3.56Å; M295-M328 WeakPolarHBondContact CA-O 3.39Å; L296-M328 HydrophobicContact CB-CE 4.41Å; L296-M328 HydrophobicContact CD1-CE 4.22Å; L296-M328 PolarHBondContact N-O 3.33Å; L296-M328 PolarHBondContact O-N 2.89Å; L301-M328 HydrophobicContact CD1-CE 3.67Å; L301-M328 HydrophobicContact CD2-CE 3.62Å; L301-M328 HydrophobicContact CG-CE 4.2Å; F318-M328 HydrophobicContact CE1-CB 4.03Å; F318-M328 HydrophobicContact CZ-CB 4.21Å; M328-T332 VanDerWaalsContact CG-CB 3.47Å; M328-T332 HydrophobicContact CG-CG2 3.54Å; M328-T332 HydrophobicContact SD-CG2 3.58Å; M328-T332 VanDerWaalsContact SD-CG2 3.58Å; M328-Y333 HydrophobicContact CE-CD2 4.14Å
329	D	93.4	Very high	91.3	Very high	29 Å²	29	41.7 Å²	41.7	16%	0.155	22%	0.216	C	C	.	.			trans	-81.9	164.5	176.7	71.4	-12.5	0	0	0	113.1	M295 Y324 K331 T332 Y333	M295-D329 HydrophobicContact CE-CB 4.12Å; M295-D329 WeakPolarHBondContact SD-CA 3.39Å; M295-D329 HydrophobicContact SD-CB 3.53Å; M295-D329 VanDerWaalsContact SD-CB 3.53Å; Y324-D329 HydrophobicContact CE2-CB 4.33Å; D329-K331 PolarHBondContact O-N 3.44Å; D329-K331 VanDerWaalsContact O-N 3.15Å; D329-T332 PolarHBondContact O-N 2.85Å; D329-T332 VanDerWaalsContact O-N 3.13Å; D329-T332 WeakPolarHBondContact OD1-CB 3.46Å; D329-T332 PolarHBondContact OD1-N 3.35Å; D329-T332 PolarHBondContact OD1-OG1 3.48Å; D329-Y333 PolarHBondContact O-N 2.67Å
330	Y	92.9	Very high	91.4	Very high	16 Å²	16	36.5 Å²	36.5	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-54.6	-35.8	178	-178.2	-117.1	0	0	0	112.6	F220 T224 Y282 Y285 Y333 L334	F220-Y330 HydrophobicContact CB-CE1 4.36Å; F220-Y330 AromaticContact CD1-CD1 3.84Å; F220-Y330 HydrophobicContact CD1-CD1 3.84Å; F220-Y330 HydrophobicContact CD1-CE1 4.02Å; F220-Y330 HydrophobicContact CD1-CG 4.47Å; F220-Y330 HydrophobicContact CE1-CD1 4.5Å; T224-Y330 PolarHBondContact OG1-OH 3.01Å; Y282-Y330 HydrophobicContact CD2-CD2 4.29Å; Y282-Y330 HydrophobicContact CD2-CE1 4.41Å; Y282-Y330 AromaticContact CD2-CE2 3.77Å; Y282-Y330 HydrophobicContact CD2-CE2 3.77Å; Y282-Y330 AromaticContact CD2-CZ 3.83Å; Y285-Y330 AromaticContact CD1-CD2 3.91Å; Y285-Y330 HydrophobicContact CD1-CD2 3.91Å; Y285-Y330 AromaticContact CD2-CD2 3.72Å; Y285-Y330 HydrophobicContact CD2-CD2 3.72Å; Y285-Y330 HydrophobicContact CD2-CE2 4.47Å; Y285-Y330 HydrophobicContact CE1-CD2 4.25Å; Y285-Y330 HydrophobicContact CE2-CD2 4.04Å; Y285-Y330 AromaticContact CG-CD2 3.62Å; Y285-Y330 HydrophobicContact CG-CD2 3.62Å; Y285-Y330 HydrophobicContact CG-CE2 4.16Å; Y285-Y330 PolarHBondContact OH-N 3.14Å; Y330-Y333 HydrophobicContact CD2-CD1 4.04Å; Y330-Y333 HydrophobicContact CE2-CD1 4.08Å; Y330-Y333 HydrophobicContact CE2-CE1 4.43Å; Y330-Y333 WeakPolarHBondContact O-CB 3.16Å; Y330-Y333 PolarHBondContact O-N 3.46Å; Y330-L334 HydrophobicContact CD1-CD1 3.96Å; Y330-L334 HydrophobicContact CD1-CG 4.4Å; Y330-L334 HydrophobicContact CE1-CD1 3.54Å; Y330-L334 HydrophobicContact CE1-CD2 4.35Å; Y330-L334 HydrophobicContact CE1-CG 4.02Å; Y330-L334 HydrophobicContact CE2-CD2 4.24Å; Y330-L334 HydrophobicContact CE2-CG 4.22Å; Y330-L334 WeakPolarHBondContact O-CG 3.4Å; Y330-L334 PolarHBondContact O-N 3.01Å
331	K	92.6	Very high	91.5	Very high	61 Å²	61	38.2 Å²	38.2	27%	0.265	20%	0.199	S	C	.	.	H	α-helix	trans	-65.4	-42.4	-179.7	-173.2	172.3	-179.5	166.4	0	112.3	E193 R227 D329 D335	E193-K331 WeakPolarHBondContact OE1-CE 3.36Å; E193-K331 IonicContact OE1-NZ 2.8Å; E193-K331 PolarHBondContact OE1-NZ 3.42Å; E193-K331 IonicContact OE2-NZ 3.42Å; E193-K331 PolarHBondContact OE2-NZ 3.46Å; R227-K331 HydrophobicContact CG-CG 4.43Å; R227-K331 VanDerWaalsContact NE-CG 3.28Å; D329-K331 PolarHBondContact O-N 3.44Å; D329-K331 VanDerWaalsContact O-N 3.15Å; K331-D335 PolarHBondContact O-N 3.47Å
332	T	93.3	Very high	91.7	Very high	7 Å²	7	40 Å²	40	4%	0.043	21%	0.208	C	C	.	.	H	α-helix	trans	-74.4	-35.1	176.1	-56.4	0	0	0	0	111.2	C321 M328 D329 L334 D335 F336	C321-T332 HydrophobicContact CB-CG2 3.57Å; M328-T332 VanDerWaalsContact CG-CB 3.47Å; M328-T332 HydrophobicContact CG-CG2 3.54Å; M328-T332 HydrophobicContact SD-CG2 3.58Å; M328-T332 VanDerWaalsContact SD-CG2 3.58Å; D329-T332 PolarHBondContact O-N 2.85Å; D329-T332 VanDerWaalsContact O-N 3.13Å; D329-T332 WeakPolarHBondContact OD1-CB 3.46Å; D329-T332 PolarHBondContact OD1-N 3.35Å; D329-T332 PolarHBondContact OD1-OG1 3.48Å; T332-L334 VanDerWaalsContact C-N 3.31Å; T332-L334 PolarHBondContact O-N 3.47Å; T332-D335 PolarHBondContact O-N 3.03Å; T332-F336 PolarHBondContact O-N 2.9Å; T332-F336 VanDerWaalsContact O-N 3.09Å
333	Y	94.9	Very high	92	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.2	-42.1	170.6	170.7	-101.3	0	0	0	112.1	V281 Q284 Y285 L288 L296 L301 Y304 M328 D329 Y330 D335 F336 V337	V281-Y333 HydrophobicContact CG1-CE1 4.03Å; Q284-Y333 WeakPolarHBondContact CB-OH 3.33Å; Y285-Y333 AromaticContact CD2-CD1 3.52Å; Y285-Y333 HydrophobicContact CD2-CD1 3.52Å; Y285-Y333 HydrophobicContact CD2-CD2 4.1Å; Y285-Y333 AromaticContact CD2-CE1 4Å; Y285-Y333 HydrophobicContact CD2-CE1 4Å; Y285-Y333 AromaticContact CD2-CG 3.56Å; Y285-Y333 HydrophobicContact CD2-CG 3.56Å; Y285-Y333 HydrophobicContact CE2-CD1 4.34Å; Y285-Y333 HydrophobicContact CE2-CG 4.08Å; Y285-Y333 HydrophobicContact CG-CD1 4.25Å; Y285-Y333 HydrophobicContact CG-CE1 4.4Å; L288-Y333 HydrophobicContact CD1-CE2 3.99Å; L296-Y333 HydrophobicContact CD1-CD2 3.72Å; L296-Y333 HydrophobicContact CD1-CE2 4.22Å; L296-Y333 HydrophobicContact CD1-CG 4.25Å; L301-Y333 HydrophobicContact CD1-CD2 4.07Å; L301-Y333 HydrophobicContact CD1-CE2 4.27Å; Y304-Y333 HydrophobicContact CD2-CE2 4.04Å; Y304-Y333 HydrophobicContact CE2-CE2 4.14Å; M328-Y333 HydrophobicContact CE-CD2 4.14Å; D329-Y333 PolarHBondContact O-N 2.67Å; Y330-Y333 HydrophobicContact CD2-CD1 4.04Å; Y330-Y333 HydrophobicContact CE2-CD1 4.08Å; Y330-Y333 HydrophobicContact CE2-CE1 4.43Å; Y330-Y333 WeakPolarHBondContact O-CB 3.16Å; Y330-Y333 PolarHBondContact O-N 3.46Å; Y333-D335 PolarHBondContact O-N 2.86Å; Y333-F336 WeakPolarHBondContact O-CB 3.36Å; Y333-F336 PolarHBondContact O-N 3.1Å; Y333-F336 VanDerWaalsContact O-N 3.15Å; Y333-V337 HydrophobicContact CD1-CG2 4.13Å; Y333-V337 HydrophobicContact CD2-CG2 4.16Å; Y333-V337 HydrophobicContact CE1-CG2 3.64Å; Y333-V337 HydrophobicContact CE2-CG2 3.66Å; Y333-V337 HydrophobicContact CG-CG2 4.38Å; Y333-V337 WeakPolarHBondContact O-CG2 3.26Å; Y333-V337 PolarHBondContact O-N 2.91Å
334	L	94.8	Very high	92	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-43.8	176.1	-75.4	172	0	0	0	112.3	T224 R227 V281 Y330 T332 F336 V337 L338	T224-L334 HydrophobicContact CG2-CD2 3.96Å; R227-L334 HydrophobicContact CB-CB 4.28Å; R227-L334 HydrophobicContact CB-CD1 4.17Å; R227-L334 HydrophobicContact CG-CB 4.25Å; R227-L334 HydrophobicContact CG-CD1 3.73Å; V281-L334 HydrophobicContact CG1-CD2 3.68Å; Y330-L334 HydrophobicContact CD1-CD1 3.96Å; Y330-L334 HydrophobicContact CD1-CG 4.4Å; Y330-L334 HydrophobicContact CE1-CD1 3.54Å; Y330-L334 HydrophobicContact CE1-CD2 4.35Å; Y330-L334 HydrophobicContact CE1-CG 4.02Å; Y330-L334 HydrophobicContact CE2-CD2 4.24Å; Y330-L334 HydrophobicContact CE2-CG 4.22Å; Y330-L334 WeakPolarHBondContact O-CG 3.4Å; Y330-L334 PolarHBondContact O-N 3.01Å; T332-L334 VanDerWaalsContact C-N 3.31Å; T332-L334 PolarHBondContact O-N 3.47Å; L334-F336 PolarHBondContact O-N 3.27Å; L334-V337 PolarHBondContact O-N 2.87Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 VanDerWaalsContact O-CG 3.23Å; L334-L338 WeakPolarHBondContact O-CG 3.24Å; L334-L338 PolarHBondContact O-N 2.95Å
335	D	94.1	Very high	92.2	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-38.6	176	-64.3	-9.9	0	0	0	110.9	R227 F231 K331 T332 Y333 A339 Y351	R227-D335 IonicContact CZ-OD1 3.86Å; R227-D335 IonicContact CZ-OD2 2.78Å; R227-D335 IonicContact NE-OD1 3.95Å; R227-D335 PolarHBondContact NE-OD1 3.22Å; R227-D335 VanDerWaalsContact NE-OD1 3.16Å; R227-D335 VanDerWaalsContact NH2-CG 3.3Å; R227-D335 IonicContact NH2-OD1 3.54Å; R227-D335 PolarHBondContact NH2-OD1 3.22Å; R227-D335 IonicContact NH2-OD2 3.49Å; R227-D335 PolarHBondContact NH2-OD2 2.83Å; F231-D335 HydrophobicContact CD2-CB 4.14Å; F231-D335 HydrophobicContact CE2-CB 4.25Å; F231-D335 VanDerWaalsContact CE2-O 3.29Å; F231-D335 WeakPolarHBondContact CE2-O 3.4Å; K331-D335 PolarHBondContact O-N 3.47Å; T332-D335 PolarHBondContact O-N 3.03Å; Y333-D335 PolarHBondContact O-N 2.86Å; D335-A339 WeakPolarHBondContact O-CB 3.46Å; D335-A339 PolarHBondContact O-N 3.47Å; D335-Y351 HydrophobicContact CB-CE2 4Å
336	F	94.5	Very high	92.5	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-47.1	176.7	172.2	-95.2	0	0	0	112.3	L301 Y304 L309 F313 V317 T332 Y333 L334 A339 L340	L301-F336 HydrophobicContact CD1-CD1 4.25Å; L301-F336 HydrophobicContact CD1-CE1 3.95Å; L301-F336 HydrophobicContact CD1-CZ 4.46Å; L301-F336 HydrophobicContact CD2-CE1 4.38Å; L301-F336 HydrophobicContact CD2-CE2 4.34Å; L301-F336 HydrophobicContact CD2-CZ 4.17Å; L301-F336 HydrophobicContact CG-CE1 4.36Å; L301-F336 HydrophobicContact CG-CZ 4.39Å; Y304-F336 AromaticContact CD1-CE1 3.84Å; Y304-F336 HydrophobicContact CD1-CE1 3.84Å; Y304-F336 HydrophobicContact CD1-CZ 4.38Å; Y304-F336 HydrophobicContact CD2-CE1 4.32Å; Y304-F336 HydrophobicContact CE1-CE1 4.06Å; Y304-F336 AromaticContact CG-CE1 3.98Å; Y304-F336 HydrophobicContact CG-CE1 3.98Å; L309-F336 HydrophobicContact CD1-CE2 4.49Å; L309-F336 HydrophobicContact CD1-CZ 3.67Å; F313-F336 AromaticContact CE1-CE2 3.93Å; F313-F336 HydrophobicContact CE1-CE2 3.93Å; F313-F336 HydrophobicContact CZ-CE2 4.46Å; V317-F336 HydrophobicContact CG1-CD2 4.16Å; V317-F336 HydrophobicContact CG1-CE2 4.49Å; V317-F336 HydrophobicContact CG2-CD2 4.15Å; V317-F336 HydrophobicContact CG2-CE2 3.96Å; T332-F336 PolarHBondContact O-N 2.9Å; T332-F336 VanDerWaalsContact O-N 3.09Å; Y333-F336 WeakPolarHBondContact O-CB 3.36Å; Y333-F336 PolarHBondContact O-N 3.1Å; Y333-F336 VanDerWaalsContact O-N 3.15Å; L334-F336 PolarHBondContact O-N 3.27Å; F336-A339 PolarHBondContact O-N 3.18Å; F336-L340 HydrophobicContact CD1-CD1 4.16Å; F336-L340 HydrophobicContact CD2-CD1 4.34Å; F336-L340 HydrophobicContact CE1-CD1 3.51Å; F336-L340 HydrophobicContact CE2-CD1 3.72Å; F336-L340 HydrophobicContact CE2-CG 4.37Å; F336-L340 HydrophobicContact CZ-CD1 3.28Å; F336-L340 HydrophobicContact CZ-CG 4.34Å; F336-L340 WeakPolarHBondContact O-CG 3.39Å; F336-L340 PolarHBondContact O-N 3.23Å
337	V	94.2	Very high	92.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-47.3	177.3	174.3	0	0	0	0	110.9	W272 Y304 Y333 L334 A339 L340 E341	W272-V337 HydrophobicContact CH2-CG1 4.04Å; Y304-V337 HydrophobicContact CE2-CG2 3.86Å; Y333-V337 HydrophobicContact CD1-CG2 4.13Å; Y333-V337 HydrophobicContact CD2-CG2 4.16Å; Y333-V337 HydrophobicContact CE1-CG2 3.64Å; Y333-V337 HydrophobicContact CE2-CG2 3.66Å; Y333-V337 HydrophobicContact CG-CG2 4.38Å; Y333-V337 WeakPolarHBondContact O-CG2 3.26Å; Y333-V337 PolarHBondContact O-N 2.91Å; L334-V337 PolarHBondContact O-N 2.87Å; V337-A339 VanDerWaalsContact C-N 3.28Å; V337-A339 PolarHBondContact O-N 3.45Å; V337-L340 PolarHBondContact O-N 3Å; V337-L340 VanDerWaalsContact O-N 3.13Å; V337-E341 HydrophobicContact CG1-CG 4.14Å; V337-E341 PolarHBondContact O-N 3.25Å
338	L	94.4	Very high	92.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59	-40.2	177.9	-72.2	169.2	0	0	0	111.7	R227 K228 F231 F232 W272 L334 N342	R227-L338 HydrophobicContact CB-CD1 4.38Å; K228-L338 HydrophobicContact CB-CD2 4.46Å; K228-L338 HydrophobicContact CG-CD2 4.45Å; F231-L338 HydrophobicContact CB-CD1 3.85Å; F231-L338 HydrophobicContact CD1-CB 3.97Å; F231-L338 HydrophobicContact CD2-CB 4.27Å; F231-L338 HydrophobicContact CD2-CD1 4.47Å; F231-L338 HydrophobicContact CE1-CB 4.1Å; F231-L338 HydrophobicContact CE2-CB 4.38Å; F231-L338 HydrophobicContact CG-CB 4.06Å; F231-L338 HydrophobicContact CG-CD1 4.05Å; F231-L338 HydrophobicContact CZ-CB 4.31Å; F232-L338 HydrophobicContact CE2-CD2 4.25Å; W272-L338 HydrophobicContact CD2-CD2 4.44Å; W272-L338 HydrophobicContact CH2-CD2 3.93Å; W272-L338 HydrophobicContact CH2-CG 4.48Å; W272-L338 HydrophobicContact CZ2-CD2 3.58Å; W272-L338 HydrophobicContact CZ2-CG 4.17Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 VanDerWaalsContact O-CG 3.23Å; L334-L338 WeakPolarHBondContact O-CG 3.24Å; L334-L338 PolarHBondContact O-N 2.95Å; L338-N342 WeakPolarHBondContact O-CB 3.31Å; L338-N342 PolarHBondContact O-N 3.19Å; L338-N342 PolarHBondContact O-OD1 3.27Å
339	A	94.1	Very high	92.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-42.8	175.8	0	0	0	0	0	112.5	F231 D335 F336 V337 R343 Y351 I352	F231-A339 HydrophobicContact CE2-CB 4.21Å; F231-A339 HydrophobicContact CZ-CB 3.69Å; D335-A339 WeakPolarHBondContact O-CB 3.46Å; D335-A339 PolarHBondContact O-N 3.47Å; F336-A339 PolarHBondContact O-N 3.18Å; V337-A339 VanDerWaalsContact C-N 3.28Å; V337-A339 PolarHBondContact O-N 3.45Å; A339-R343 PolarHBondContact O-N 3.31Å; A339-Y351 HydrophobicContact CB-CD1 3.34Å; A339-Y351 HydrophobicContact CB-CE1 3.81Å; A339-Y351 HydrophobicContact CB-CG 3.8Å; A339-I352 HydrophobicContact CB-CG1 4.27Å
340	L	91.8	Very high	92.8	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.058	16%	0.163	C	C	.	.	H	α-helix	trans	-78.9	-30.3	-175.9	-70.9	-173.9	0	0	0	114.1	Y304 L309 F313 F336 V337 R343 I352 I428	Y304-L340 HydrophobicContact CD1-CD1 4.27Å; Y304-L340 HydrophobicContact CE1-CD1 3.85Å; L309-L340 HydrophobicContact CD1-CD1 4.03Å; F313-L340 HydrophobicContact CE1-CD2 4.5Å; F313-L340 HydrophobicContact CZ-CD2 4.49Å; F336-L340 HydrophobicContact CD1-CD1 4.16Å; F336-L340 HydrophobicContact CD2-CD1 4.34Å; F336-L340 HydrophobicContact CE1-CD1 3.51Å; F336-L340 HydrophobicContact CE2-CD1 3.72Å; F336-L340 HydrophobicContact CE2-CG 4.37Å; F336-L340 HydrophobicContact CZ-CD1 3.28Å; F336-L340 HydrophobicContact CZ-CG 4.34Å; F336-L340 WeakPolarHBondContact O-CG 3.39Å; F336-L340 PolarHBondContact O-N 3.23Å; V337-L340 PolarHBondContact O-N 3Å; V337-L340 VanDerWaalsContact O-N 3.13Å; L340-R343 WeakPolarHBondContact O-CG 3.32Å; L340-R343 PolarHBondContact O-NE 2.89Å; L340-I352 HydrophobicContact CD2-CD1 4.35Å; L340-I428 HydrophobicContact CD2-CD1 3.72Å
341	E	91.2	Very high	92.8	Very high	82 Å²	82	33.8 Å²	33.8	38%	0.383	16%	0.163	S	C	.	.	H	α-helix	trans	-78.7	-29.8	175.8	-69.9	-170.3	-176.9	0	0	111.9	W272 V337	W272-E341 VanDerWaalsContact CZ3-OE2 3.3Å; W272-E341 WeakPolarHBondContact CZ3-OE2 3.37Å; V337-E341 HydrophobicContact CG1-CG 4.14Å; V337-E341 PolarHBondContact O-N 3.25Å
342	N	91.7	Very high	92.9	Very high	55 Å²	55	30.9 Å²	30.9	29%	0.294	15%	0.15	S	C	.	.			trans	-113.5	40.7	-176.6	-58.7	115.7	0	0	0	113.8	F232 L338 K344 E345 A348	F232-N342 HydrophobicContact CE1-CB 4.1Å; F232-N342 HydrophobicContact CZ-CB 3.77Å; F232-N342 WeakPolarHBondContact CZ-OD1 3.37Å; L338-N342 WeakPolarHBondContact O-CB 3.31Å; L338-N342 PolarHBondContact O-N 3.19Å; L338-N342 PolarHBondContact O-OD1 3.27Å; N342-K344 PolarHBondContact O-N 3.42Å; N342-E345 HydrophobicContact CB-CB 4.43Å; N342-E345 HydrophobicContact CB-CG 4.14Å; N342-E345 WeakPolarHBondContact O-CB 3.45Å; N342-E345 PolarHBondContact O-N 3.45Å; N342-A348 WeakPolarHBondContact O-CB 3.23Å
343	R	90.8	Very high	92.9	Very high	52 Å²	52	31.1 Å²	31.1	20%	0.196	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-18.8	-176.3	-62.8	175.9	-158	172.9	0	115.7	A339 L340 L349 I352 D421 S425	A339-R343 PolarHBondContact O-N 3.31Å; L340-R343 WeakPolarHBondContact O-CG 3.32Å; L340-R343 PolarHBondContact O-NE 2.89Å; R343-L349 WeakPolarHBondContact O-CD2 3.38Å; R343-L349 VanDerWaalsContact O-CG 3.25Å; R343-L349 WeakPolarHBondContact O-CG 3.36Å; R343-I352 HydrophobicContact CG-CD1 4.08Å; R343-D421 HydrophobicContact CB-CB 3.9Å; R343-S425 PolarHBondContact NH1-OG 2.81Å
344	K	89.3	Confident	92.7	Very high	164 Å²	164	35.4 Å²	35.4	71%	0.713	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-25.4	176.5	-67.6	-179.1	178.9	-178.8	0	113	N342 D421	N342-K344 PolarHBondContact O-N 3.42Å; K344-D421 WeakPolarHBondContact CE-OD2 3.3Å; K344-D421 HydrophobicContact CG-CB 3.84Å; K344-D421 VanDerWaalsContact CG-OD2 3.31Å; K344-D421 WeakPolarHBondContact CG-OD2 3.4Å
345	E	91.7	Very high	92.6	Very high	98 Å²	98	35.6 Å²	35.6	46%	0.458	17%	0.17	S	C	.	.	S	Bend	trans	-75.1	139.8	-176.2	-70.8	-62.8	156.5	0	0	111.3	F232 N342 A347 A348 L349	F232-E345 HydrophobicContact CD1-CB 4.32Å; F232-E345 HydrophobicContact CD1-CG 4.48Å; F232-E345 HydrophobicContact CE1-CB 3.8Å; F232-E345 HydrophobicContact CE1-CG 3.91Å; N342-E345 HydrophobicContact CB-CB 4.43Å; N342-E345 HydrophobicContact CB-CG 4.14Å; N342-E345 WeakPolarHBondContact O-CB 3.45Å; N342-E345 PolarHBondContact O-N 3.45Å; E345-A347 VanDerWaalsContact C-N 3.25Å; E345-A347 PolarHBondContact O-N 3Å; E345-A348 HydrophobicContact CB-CB 4.38Å; E345-A348 PolarHBondContact O-N 3.41Å; E345-A348 VanDerWaalsContact O-N 3.1Å; E345-L349 PolarHBondContact O-N 2.82Å
346	P	91.6	Very high	92.6	Very high	65 Å²	65	35.2 Å²	35.2	42%	0.422	17%	0.168	S	C	.	.	H	α-helix	trans	-57.3	-35.6	-179.6	-26.2	34.5	0	0	0	114	L349 Q350 V415	P346-L349 PolarHBondContact O-N 3.36Å; P346-Q350 WeakPolarHBondContact O-CB 3.47Å; P346-Q350 PolarHBondContact O-N 2.87Å; P346-V415 HydrophobicContact CB-CG1 4.43Å; P346-V415 HydrophobicContact CB-CG2 4.27Å; P346-V415 HydrophobicContact CG-CG1 4.28Å
347	A	91.6	Very high	92.5	Very high	15 Å²	15	35.5 Å²	35.5	12%	0.124	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-40.1	178.3	0	0	0	0	0	112.1	F231 F232 E345 Q350 Y351	F231-A347 HydrophobicContact CE1-CB 4.46Å; F232-A347 HydrophobicContact CD1-CB 3.96Å; E345-A347 VanDerWaalsContact C-N 3.25Å; E345-A347 PolarHBondContact O-N 3Å; A347-Q350 PolarHBondContact O-N 3.45Å; A347-Y351 PolarHBondContact O-N 3.2Å
348	A	93.5	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-43.5	174.8	0	0	0	0	0	111.5	F231 N342 E345 Q350 Y351 I352	F231-A348 HydrophobicContact CE1-CB 4.17Å; F231-A348 HydrophobicContact CZ-CB 4.36Å; N342-A348 WeakPolarHBondContact O-CB 3.23Å; E345-A348 HydrophobicContact CB-CB 4.38Å; E345-A348 PolarHBondContact O-N 3.41Å; E345-A348 VanDerWaalsContact O-N 3.1Å; A348-Q350 VanDerWaalsContact C-N 3.29Å; A348-Q350 PolarHBondContact O-N 3.03Å; A348-Y351 WeakPolarHBondContact O-CB 3.27Å; A348-Y351 PolarHBondContact O-N 3.14Å; A348-I352 WeakPolarHBondContact O-CG1 3.37Å; A348-I352 PolarHBondContact O-N 2.76Å
349	L	93.1	Very high	91.6	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-40.8	173.7	-72	175.9	0	0	0	111.8	R343 E345 P346 I352 F353 L411 V415 V424	R343-L349 WeakPolarHBondContact O-CD2 3.38Å; R343-L349 VanDerWaalsContact O-CG 3.25Å; R343-L349 WeakPolarHBondContact O-CG 3.36Å; E345-L349 PolarHBondContact O-N 2.82Å; P346-L349 PolarHBondContact O-N 3.36Å; L349-I352 PolarHBondContact O-N 3.23Å; L349-F353 WeakPolarHBondContact O-CA 3.46Å; L349-F353 WeakPolarHBondContact O-CB 3.31Å; L349-F353 PolarHBondContact O-N 3.31Å; L349-L411 HydrophobicContact CB-CD1 4.16Å; L349-V415 HydrophobicContact CD1-CG2 4.11Å; L349-V424 HydrophobicContact CD2-CG2 3.97Å
350	Q	92.7	Very high	91.3	Very high	68 Å²	68	47.5 Å²	47.5	32%	0.318	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-43.3	175.5	-177.7	179.2	-12.2	0	0	111.9	P235 P346 A347 A348 K354 L411	P235-Q350 PolarHBondContact O-NE2 2.99Å; P346-Q350 WeakPolarHBondContact O-CB 3.47Å; P346-Q350 PolarHBondContact O-N 2.87Å; A347-Q350 PolarHBondContact O-N 3.45Å; A348-Q350 VanDerWaalsContact C-N 3.29Å; A348-Q350 PolarHBondContact O-N 3.03Å; Q350-K354 PolarHBondContact O-N 3.38Å; Q350-K354 VanDerWaalsContact O-N 3.08Å; Q350-L411 HydrophobicContact CB-CD1 4.31Å; Q350-L411 HydrophobicContact CB-CD2 3.76Å; Q350-L411 HydrophobicContact CG-CD2 3.71Å
351	Y	93.2	Very high	91.1	Very high	15 Å²	15	51 Å²	51	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-57.6	-52.4	175.4	178.3	-83.1	0	0	0	110.6	F231 C321 D335 A339 A347 A348 K354 L355	F231-Y351 AromaticContact CE2-CD2 3.93Å; F231-Y351 HydrophobicContact CE2-CD2 3.93Å; F231-Y351 HydrophobicContact CE2-CG 4.22Å; F231-Y351 HydrophobicContact CZ-CG 4.43Å; C321-Y351 PolarHBondContact SG-OH 3.04Å; D335-Y351 HydrophobicContact CB-CE2 4Å; A339-Y351 HydrophobicContact CB-CD1 3.34Å; A339-Y351 HydrophobicContact CB-CE1 3.81Å; A339-Y351 HydrophobicContact CB-CG 3.8Å; A347-Y351 PolarHBondContact O-N 3.2Å; A348-Y351 WeakPolarHBondContact O-CB 3.27Å; A348-Y351 PolarHBondContact O-N 3.14Å; Y351-K354 WeakPolarHBondContact O-CB 3.44Å; Y351-K354 PolarHBondContact O-N 2.85Å; Y351-L355 HydrophobicContact CD1-CD1 4.05Å; Y351-L355 HydrophobicContact CE1-CD1 3.58Å; Y351-L355 HydrophobicContact CE1-CG 4.39Å; Y351-L355 PolarHBondContact O-N 3.42Å
352	I	93.9	Very high	91.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.5	-37.1	-175.9	-56.3	167	0	0	0	111.3	F313 A339 L340 R343 A348 L349 K354 L355 L356 V424 I428	F313-I352 HydrophobicContact CE2-CG2 4.07Å; A339-I352 HydrophobicContact CB-CG1 4.27Å; L340-I352 HydrophobicContact CD2-CD1 4.35Å; R343-I352 HydrophobicContact CG-CD1 4.08Å; A348-I352 WeakPolarHBondContact O-CG1 3.37Å; A348-I352 PolarHBondContact O-N 2.76Å; L349-I352 PolarHBondContact O-N 3.23Å; I352-K354 VanDerWaalsContact C-N 3.27Å; I352-K354 PolarHBondContact O-N 3.37Å; I352-L355 WeakPolarHBondContact O-CA 3.35Å; I352-L355 WeakPolarHBondContact O-CB 3.4Å; I352-L355 PolarHBondContact O-N 3.18Å; I352-L356 HydrophobicContact CG2-CD1 4.22Å; I352-L356 HydrophobicContact CG2-CG 4.28Å; I352-L356 WeakPolarHBondContact O-CG 3.5Å; I352-L356 PolarHBondContact O-N 2.96Å; I352-V424 HydrophobicContact CB-CG1 3.97Å; I352-V424 HydrophobicContact CD1-CG1 3.68Å; I352-V424 HydrophobicContact CG1-CG1 4.37Å; I352-V424 HydrophobicContact CG2-CB 4.44Å; I352-V424 HydrophobicContact CG2-CG1 3.27Å; I352-V424 HydrophobicContact CG2-CG2 4.3Å; I352-I428 HydrophobicContact CG2-CD1 4.43Å; I352-I428 HydrophobicContact CG2-CG2 4.27Å
353	F	93.5	Very high	91.2	Very high	13 Å²	13	49 Å²	49	6%	0.057	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-40.8	175.5	-176.2	-89.8	0	0	0	111.7	L349 L355 L356 D357 L364 L411 L414	L349-F353 WeakPolarHBondContact O-CA 3.46Å; L349-F353 WeakPolarHBondContact O-CB 3.31Å; L349-F353 PolarHBondContact O-N 3.31Å; F353-L355 PolarHBondContact O-N 3Å; F353-L356 PolarHBondContact O-N 3.24Å; F353-L356 VanDerWaalsContact O-N 3.13Å; F353-D357 HydrophobicContact CD1-CB 4.46Å; F353-D357 HydrophobicContact CE1-CB 4.19Å; F353-D357 WeakPolarHBondContact O-CB 3.31Å; F353-D357 PolarHBondContact O-N 3.48Å; F353-L364 HydrophobicContact CD2-CD1 4.04Å; F353-L364 HydrophobicContact CD2-CG 4.18Å; F353-L364 HydrophobicContact CE2-CD1 3.9Å; F353-L364 HydrophobicContact CE2-CD2 4.34Å; F353-L364 HydrophobicContact CE2-CG 3.63Å; F353-L364 HydrophobicContact CZ-CG 4.18Å; F353-L411 HydrophobicContact CB-CD1 3.92Å; F353-L411 HydrophobicContact CD1-CB 4.05Å; F353-L411 HydrophobicContact CD2-CB 4.25Å; F353-L411 HydrophobicContact CE1-CB 4.18Å; F353-L411 HydrophobicContact CE2-CB 4.33Å; F353-L411 HydrophobicContact CG-CB 4.08Å; F353-L411 HydrophobicContact CG-CD1 4.16Å; F353-L411 HydrophobicContact CZ-CB 4.3Å; F353-L414 HydrophobicContact CD2-CD1 3.52Å; F353-L414 HydrophobicContact CE2-CD1 3.92Å
354	K	92.1	Very high	91.3	Very high	90 Å²	90	46.6 Å²	46.6	39%	0.391	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-36.6	174.3	-168.9	-170.5	174	-155.4	0	111.9	E320 Q350 Y351 I352	E320-K354 VanDerWaalsContact OE2-CE 3.28Å; E320-K354 WeakPolarHBondContact OE2-CE 3.39Å; E320-K354 IonicContact OE2-NZ 3.45Å; E320-K354 PolarHBondContact OE2-NZ 2.81Å; Q350-K354 PolarHBondContact O-N 3.38Å; Q350-K354 VanDerWaalsContact O-N 3.08Å; Y351-K354 WeakPolarHBondContact O-CB 3.44Å; Y351-K354 PolarHBondContact O-N 2.85Å; I352-K354 VanDerWaalsContact C-N 3.27Å; I352-K354 PolarHBondContact O-N 3.37Å
355	L	92.7	Very high	91.4	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-37.7	176.1	-57.7	177.9	0	0	0	112	F313 R316 V317 E320 Y351 I352 F353	F313-L355 HydrophobicContact CE2-CB 4.05Å; F313-L355 HydrophobicContact CE2-CD1 3.51Å; F313-L355 HydrophobicContact CE2-CG 4.44Å; F313-L355 HydrophobicContact CZ-CD1 3.72Å; R316-L355 HydrophobicContact CB-CB 4.39Å; R316-L355 PolarHBondContact NE-O 3.21Å; V317-L355 HydrophobicContact CG2-CD1 3.72Å; E320-L355 HydrophobicContact CB-CD2 3.65Å; E320-L355 HydrophobicContact CG-CD2 4.14Å; Y351-L355 HydrophobicContact CD1-CD1 4.05Å; Y351-L355 HydrophobicContact CE1-CD1 3.58Å; Y351-L355 HydrophobicContact CE1-CG 4.39Å; Y351-L355 PolarHBondContact O-N 3.42Å; I352-L355 WeakPolarHBondContact O-CA 3.35Å; I352-L355 WeakPolarHBondContact O-CB 3.4Å; I352-L355 PolarHBondContact O-N 3.18Å; F353-L355 PolarHBondContact O-N 3Å
356	L	92.6	Very high	91.4	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-74.7	-30.7	178.8	-64	176.9	0	0	0	113.2	I352 F353 M358 L364 F372 V424 L427 I428	I352-L356 HydrophobicContact CG2-CD1 4.22Å; I352-L356 HydrophobicContact CG2-CG 4.28Å; I352-L356 WeakPolarHBondContact O-CG 3.5Å; I352-L356 PolarHBondContact O-N 2.96Å; F353-L356 PolarHBondContact O-N 3.24Å; F353-L356 VanDerWaalsContact O-N 3.13Å; L356-M358 VanDerWaalsContact C-N 3.33Å; L356-M358 PolarHBondContact O-N 3.47Å; L356-L364 HydrophobicContact CB-CD1 4.09Å; L356-L364 HydrophobicContact CB-CD2 3.75Å; L356-L364 HydrophobicContact CD1-CD1 4.15Å; L356-L364 WeakPolarHBondContact O-CD2 3.41Å; L356-F372 HydrophobicContact CB-CE2 4.19Å; L356-F372 HydrophobicContact CB-CZ 4.5Å; L356-F372 HydrophobicContact CD2-CD1 3.96Å; L356-F372 HydrophobicContact CD2-CD2 3.76Å; L356-F372 HydrophobicContact CD2-CE1 3.84Å; L356-F372 HydrophobicContact CD2-CE2 3.67Å; L356-F372 HydrophobicContact CD2-CG 3.94Å; L356-F372 HydrophobicContact CD2-CZ 3.71Å; L356-F372 WeakPolarHBondContact O-CE2 3.19Å; L356-V424 HydrophobicContact CD1-CG2 4.17Å; L356-L427 HydrophobicContact CD1-CD1 4.15Å; L356-L427 HydrophobicContact CD2-CB 4.41Å; L356-I428 HydrophobicContact CD2-CG2 3.93Å
357	D	92.3	Very high	91.4	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.043	21%	0.209	C	C	.	.			trans	-79	78.9	178.4	-174.3	8.4	0	0	0	111.3	F353 E359 N360 Q361 G362 L364	F353-D357 HydrophobicContact CD1-CB 4.46Å; F353-D357 HydrophobicContact CE1-CB 4.19Å; F353-D357 WeakPolarHBondContact O-CB 3.31Å; F353-D357 PolarHBondContact O-N 3.48Å; D357-E359 PolarHBondContact O-N 2.79Å; D357-N360 PolarHBondContact O-N 3.3Å; D357-N360 PolarHBondContact OD1-N 3.17Å; D357-N360 VanDerWaalsContact OD1-N 3.09Å; D357-N360 WeakPolarHBondContact OD2-CA 3.41Å; D357-Q361 PolarHBondContact OD1-N 3.15Å; D357-Q361 VanDerWaalsContact OD1-N 3.14Å; D357-Q361 PolarHBondContact OD2-N 2.96Å; D357-G362 WeakPolarHBondContact OD2-CA 3.43Å; D357-G362 PolarHBondContact OD2-N 3.1Å; D357-L364 HydrophobicContact CB-CD2 4.24Å
358	M	85.5	Confident	91.4	Very high	45 Å²	45	40.6 Å²	40.6	22%	0.222	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.4	-178.5	-64	-172	-72.1	0	0	114.2	L356 F367 Y371 F372	L356-M358 VanDerWaalsContact C-N 3.33Å; L356-M358 PolarHBondContact O-N 3.47Å; M358-F367 HydrophobicContact CE-CD1 4.32Å; M358-F367 HydrophobicContact CE-CE1 4.07Å; M358-Y371 HydrophobicContact CE-CD1 3.58Å; M358-Y371 HydrophobicContact CE-CE1 4.23Å; M358-Y371 HydrophobicContact CE-CG 3.79Å; M358-Y371 HydrophobicContact SD-CD1 3.28Å; M358-Y371 WeakPolarHBondContact SD-CD1 3.16Å; M358-Y371 HydrophobicContact SD-CE1 3.32Å; M358-Y371 WeakPolarHBondContact SD-CE1 3.38Å; M358-Y371 HydrophobicContact SD-CG 3.99Å; M358-F372 HydrophobicContact CG-CE2 4.29Å; M358-F372 HydrophobicContact CG-CZ 4.29Å
359	E	84.9	Confident	91.3	Very high	106 Å²	106	40.7 Å²	40.7	50%	0.495	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	1	-174.6	-61.6	-174.5	161.6	0	0	112.4	D357 Q361	D357-E359 PolarHBondContact O-N 2.79Å; E359-Q361 HydrophobicContact CB-CG 3.72Å; E359-Q361 PolarHBondContact O-N 3.1Å; E359-Q361 PolarHBondContact OE2-NE2 3.43Å; E359-Q361 PolarHBondContact OE2-OE1 3.49Å
360	N	86.9	Confident	91.3	Very high	100 Å²	100	42 Å²	42	54%	0.535	21%	0.212	S	C	.	.			trans	49.3	37.7	-174.5	-74	-65.4	0	0	0	112.8	D357	D357-N360 PolarHBondContact O-N 3.3Å; D357-N360 PolarHBondContact OD1-N 3.17Å; D357-N360 VanDerWaalsContact OD1-N 3.09Å; D357-N360 WeakPolarHBondContact OD2-CA 3.41Å
361	Q	88.5	Confident	91.3	Very high	85 Å²	85	43.1 Å²	43.1	40%	0.397	21%	0.214	S	C	.	.	S	Bend	trans	-87.1	-9.7	-177.7	-70.2	-179.8	1.5	0	0	113	D357 E359 Y363	D357-Q361 PolarHBondContact OD1-N 3.15Å; D357-Q361 VanDerWaalsContact OD1-N 3.14Å; D357-Q361 PolarHBondContact OD2-N 2.96Å; E359-Q361 HydrophobicContact CB-CG 3.72Å; E359-Q361 PolarHBondContact O-N 3.1Å; E359-Q361 PolarHBondContact OE2-NE2 3.43Å; E359-Q361 PolarHBondContact OE2-OE1 3.49Å; Q361-Y363 VanDerWaalsContact C-N 3.35Å; Q361-Y363 HydrophobicContact CB-CD1 3.96Å; Q361-Y363 HydrophobicContact CB-CE1 3.63Å; Q361-Y363 WeakPolarHBondContact O-CD1 3.47Å; Q361-Y363 PolarHBondContact OE1-OH 3.21Å
362	G	91.6	Very high	91.3	Very high	40 Å²	40	42.5 Å²	42.5	41%	0.412	21%	0.211	S	C	.	.	S	Bend	trans	82.2	9.7	-175.6	0	0	0	0	0	114.1	D357	D357-G362 WeakPolarHBondContact OD2-CA 3.43Å; D357-G362 PolarHBondContact OD2-N 3.1Å
363	Y	93	Very high	91.2	Very high	54 Å²	54	42.6 Å²	42.6	21%	0.212	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	149.4	177.4	63.6	-93.8	0	0	0	112.5	Q361 N365 K408 I409	Q361-Y363 VanDerWaalsContact C-N 3.35Å; Q361-Y363 HydrophobicContact CB-CD1 3.96Å; Q361-Y363 HydrophobicContact CB-CE1 3.63Å; Q361-Y363 WeakPolarHBondContact O-CD1 3.47Å; Q361-Y363 PolarHBondContact OE1-OH 3.21Å; Y363-N365 HydrophobicContact CD2-CB 4.39Å; Y363-N365 HydrophobicContact CE2-CB 4.25Å; Y363-K408 HydrophobicContact CD1-CD 3.97Å; Y363-K408 HydrophobicContact CD2-CB 3.89Å; Y363-K408 HydrophobicContact CD2-CD 3.68Å; Y363-K408 HydrophobicContact CD2-CG 3.6Å; Y363-K408 HydrophobicContact CE1-CD 3.99Å; Y363-K408 HydrophobicContact CE2-CD 3.74Å; Y363-K408 HydrophobicContact CE2-CG 3.88Å; Y363-K408 HydrophobicContact CG-CB 4.03Å; Y363-K408 HydrophobicContact CG-CD 3.81Å; Y363-K408 HydrophobicContact CG-CG 4.06Å; Y363-K408 PolarHBondContact OH-NZ 3.49Å; Y363-I409 CarbonylContact C-O 3.52Å; Y363-I409 VanDerWaalsContact CA-O 3.31Å; Y363-I409 WeakPolarHBondContact CA-O 3.23Å
364	L	92.9	Very high	91.1	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.2	170.2	-55.4	176.9	0	0	0	109.3	F353 L356 D357 I409	F353-L364 HydrophobicContact CD2-CD1 4.04Å; F353-L364 HydrophobicContact CD2-CG 4.18Å; F353-L364 HydrophobicContact CE2-CD1 3.9Å; F353-L364 HydrophobicContact CE2-CD2 4.34Å; F353-L364 HydrophobicContact CE2-CG 3.63Å; F353-L364 HydrophobicContact CZ-CG 4.18Å; L356-L364 HydrophobicContact CB-CD1 4.09Å; L356-L364 HydrophobicContact CB-CD2 3.75Å; L356-L364 HydrophobicContact CD1-CD1 4.15Å; L356-L364 WeakPolarHBondContact O-CD2 3.41Å; D357-L364 HydrophobicContact CB-CD2 4.24Å; L364-I409 HydrophobicContact CB-CB 4.35Å; L364-I409 PolarHBondContact N-O 2.92Å; L364-I409 PolarHBondContact O-N 3.49Å
365	N	91	Very high	91	Very high	35 Å²	35	44.6 Å²	44.6	19%	0.187	22%	0.218	C	C	.	.			trans	-107.4	175	174.9	67.8	31.2	0	0	0	110.4	Y363 F367 S368 L369	Y363-N365 HydrophobicContact CD2-CB 4.39Å; Y363-N365 HydrophobicContact CE2-CB 4.25Å; N365-F367 PolarHBondContact O-N 3.05Å; N365-F367 WeakPolarHBondContact OD1-CA 3.38Å; N365-F367 VanDerWaalsContact OD1-CB 3.28Å; N365-F367 WeakPolarHBondContact OD1-CB 3.42Å; N365-F367 PolarHBondContact OD1-N 3.45Å; N365-S368 PolarHBondContact O-N 2.51Å; N365-S368 VanDerWaalsContact O-N 3.14Å; N365-S368 PolarHBondContact OD1-N 3.05Å; N365-S368 PolarHBondContact OD1-OG 2.91Å; N365-L369 PolarHBondContact O-N 3.39Å; N365-L369 VanDerWaalsContact O-N 3.1Å
366	V	91.6	Very high	90.8	Very high	53 Å²	53	44.5 Å²	44.5	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-58.3	-33.7	179.4	179.3	0	0	0	0	112.4	N370 F390 K394 F398	V366-N370 WeakPolarHBondContact O-CB 3.36Å; V366-N370 PolarHBondContact O-N 2.85Å; V366-F390 HydrophobicContact CG1-CE1 3.78Å; V366-F390 HydrophobicContact CG1-CZ 3.95Å; V366-K394 HydrophobicContact CB-CD 4.41Å; V366-K394 HydrophobicContact CG1-CD 3.56Å; V366-K394 HydrophobicContact CG1-CG 4.48Å; V366-K394 HydrophobicContact CG2-CD 4Å; V366-F398 HydrophobicContact CG2-CE2 4.21Å; V366-F398 HydrophobicContact CG2-CZ 4.23Å
367	F	91.4	Very high	90.6	Very high	124 Å²	124	46.1 Å²	46.1	54%	0.544	22%	0.224	S	C	.	.	H	α-helix	trans	-67.1	-45.1	177.4	175.4	-91.7	0	0	0	111.3	M358 N365 L369 N370 Y371	M358-F367 HydrophobicContact CE-CD1 4.32Å; M358-F367 HydrophobicContact CE-CE1 4.07Å; N365-F367 PolarHBondContact O-N 3.05Å; N365-F367 WeakPolarHBondContact OD1-CA 3.38Å; N365-F367 VanDerWaalsContact OD1-CB 3.28Å; N365-F367 WeakPolarHBondContact OD1-CB 3.42Å; N365-F367 PolarHBondContact OD1-N 3.45Å; F367-L369 PolarHBondContact O-N 3.45Å; F367-N370 PolarHBondContact O-N 3.05Å; F367-Y371 WeakPolarHBondContact O-CB 3.29Å; F367-Y371 PolarHBondContact O-N 3.49Å
368	S	91.6	Very high	90.4	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.028	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-47.6	175.7	-53	0	0	0	0	111.1	N365 N370 Y371 F372	N365-S368 PolarHBondContact O-N 2.51Å; N365-S368 VanDerWaalsContact O-N 3.14Å; N365-S368 PolarHBondContact OD1-N 3.05Å; N365-S368 PolarHBondContact OD1-OG 2.91Å; S368-N370 PolarHBondContact O-N 3.05Å; S368-Y371 WeakPolarHBondContact O-CB 3.49Å; S368-Y371 PolarHBondContact O-N 3.41Å; S368-F372 VanDerWaalsContact O-CD2 3.22Å; S368-F372 WeakPolarHBondContact O-CD2 3.46Å; S368-F372 PolarHBondContact O-N 3.4Å
369	L	92.1	Very high	90.4	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-46	177.6	-62.8	177.7	0	0	0	112	N365 F367 Y371 F372 F373 F390 I397 F398 I409 L427	N365-L369 PolarHBondContact O-N 3.39Å; N365-L369 VanDerWaalsContact O-N 3.1Å; F367-L369 PolarHBondContact O-N 3.45Å; L369-Y371 VanDerWaalsContact C-N 3.3Å; L369-Y371 PolarHBondContact O-N 3.01Å; L369-F372 PolarHBondContact O-N 3.21Å; L369-F373 VanDerWaalsContact O-CB 3.26Å; L369-F373 WeakPolarHBondContact O-CB 3.41Å; L369-F373 PolarHBondContact O-N 3.48Å; L369-F390 HydrophobicContact CB-CE2 4.02Å; L369-F390 HydrophobicContact CB-CZ 4.1Å; L369-I397 HydrophobicContact CD1-CG2 4.28Å; L369-F398 HydrophobicContact CD1-CD2 4.38Å; L369-F398 HydrophobicContact CD1-CE2 3.68Å; L369-F398 HydrophobicContact CD1-CZ 4.46Å; L369-I409 HydrophobicContact CD1-CD1 4.29Å; L369-L427 HydrophobicContact CD2-CD1 3.52Å; L369-L427 HydrophobicContact CD2-CD2 3.95Å; L369-L427 HydrophobicContact CD2-CG 4.37Å
370	N	92.8	Very high	90.5	Very high	34 Å²	34	46.6 Å²	46.6	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-37.4	178.7	-170.8	23.8	0	0	0	112	V366 F367 S368 F373 R374 F390	V366-N370 WeakPolarHBondContact O-CB 3.36Å; V366-N370 PolarHBondContact O-N 2.85Å; F367-N370 PolarHBondContact O-N 3.05Å; S368-N370 PolarHBondContact O-N 3.05Å; N370-F373 PolarHBondContact O-N 3.39Å; N370-R374 WeakPolarHBondContact O-CB 3.45Å; N370-R374 VanDerWaalsContact O-CG 3.25Å; N370-R374 WeakPolarHBondContact O-CG 3.39Å; N370-R374 PolarHBondContact O-N 3.07Å; N370-F390 HydrophobicContact CB-CD1 4.24Å; N370-F390 HydrophobicContact CB-CD2 4.3Å; N370-F390 HydrophobicContact CB-CE1 3.73Å; N370-F390 HydrophobicContact CB-CE2 3.81Å; N370-F390 HydrophobicContact CB-CZ 3.5Å
371	Y	92.8	Very high	90.4	Very high	91 Å²	91	47.9 Å²	47.9	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-48.9	179.8	177.3	-102.5	0	0	0	111.9	V312 M358 F367 S368 L369	V312-Y371 HydrophobicContact CG1-CD1 3.76Å; V312-Y371 HydrophobicContact CG1-CE1 3.1Å; M358-Y371 HydrophobicContact CE-CD1 3.58Å; M358-Y371 HydrophobicContact CE-CE1 4.23Å; M358-Y371 HydrophobicContact CE-CG 3.79Å; M358-Y371 HydrophobicContact SD-CD1 3.28Å; M358-Y371 WeakPolarHBondContact SD-CD1 3.16Å; M358-Y371 HydrophobicContact SD-CE1 3.32Å; M358-Y371 WeakPolarHBondContact SD-CE1 3.38Å; M358-Y371 HydrophobicContact SD-CG 3.99Å; F367-Y371 WeakPolarHBondContact O-CB 3.29Å; F367-Y371 PolarHBondContact O-N 3.49Å; S368-Y371 WeakPolarHBondContact O-CB 3.49Å; S368-Y371 PolarHBondContact O-N 3.41Å; L369-Y371 VanDerWaalsContact C-N 3.3Å; L369-Y371 PolarHBondContact O-N 3.01Å
372	F	93.1	Very high	90.2	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-69	-41.7	175.9	-71.7	-75.6	0	0	0	112.1	V312 R316 L356 M358 S368 L369 R374 A375 L427	V312-F372 HydrophobicContact CG1-CD1 3.8Å; V312-F372 HydrophobicContact CG1-CE1 3.85Å; R316-F372 HydrophobicContact CG-CE1 4.05Å; R316-F372 HydrophobicContact CG-CZ 3.98Å; L356-F372 HydrophobicContact CB-CE2 4.19Å; L356-F372 HydrophobicContact CB-CZ 4.5Å; L356-F372 HydrophobicContact CD2-CD1 3.96Å; L356-F372 HydrophobicContact CD2-CD2 3.76Å; L356-F372 HydrophobicContact CD2-CE1 3.84Å; L356-F372 HydrophobicContact CD2-CE2 3.67Å; L356-F372 HydrophobicContact CD2-CG 3.94Å; L356-F372 HydrophobicContact CD2-CZ 3.71Å; L356-F372 WeakPolarHBondContact O-CE2 3.19Å; M358-F372 HydrophobicContact CG-CE2 4.29Å; M358-F372 HydrophobicContact CG-CZ 4.29Å; S368-F372 VanDerWaalsContact O-CD2 3.22Å; S368-F372 WeakPolarHBondContact O-CD2 3.46Å; S368-F372 PolarHBondContact O-N 3.4Å; L369-F372 PolarHBondContact O-N 3.21Å; F372-R374 VanDerWaalsContact C-N 3.3Å; F372-R374 PolarHBondContact O-N 3.46Å; F372-A375 WeakPolarHBondContact O-CB 3.14Å; F372-A375 PolarHBondContact O-N 3.36Å; F372-A375 VanDerWaalsContact O-N 3.16Å; F372-L427 HydrophobicContact CB-CB 4.36Å; F372-L427 HydrophobicContact CB-CD2 4.39Å
373	F	92.1	Very high	89.8	Confident	1 Å²	1	54.8 Å²	54.8	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-32.1	-178.4	-171.4	-109	0	0	0	113.4	L369 N370 A375 I376 Q377 V388 F390 V393 F433	L369-F373 VanDerWaalsContact O-CB 3.26Å; L369-F373 WeakPolarHBondContact O-CB 3.41Å; L369-F373 PolarHBondContact O-N 3.48Å; N370-F373 PolarHBondContact O-N 3.39Å; F373-A375 VanDerWaalsContact C-N 3.26Å; F373-A375 PolarHBondContact O-N 3.41Å; F373-I376 WeakPolarHBondContact O-CB 3.36Å; F373-I376 PolarHBondContact O-N 2.9Å; F373-I376 VanDerWaalsContact O-N 3.08Å; F373-Q377 HydrophobicContact CD1-CG 3.81Å; F373-Q377 HydrophobicContact CE1-CG 3.5Å; F373-Q377 VanDerWaalsContact CE1-CG 3.5Å; F373-Q377 HydrophobicContact CZ-CG 4.04Å; F373-Q377 PolarHBondContact O-N 3.29Å; F373-V388 HydrophobicContact CZ-CB 4.4Å; F373-F390 HydrophobicContact CB-CD2 4.01Å; F373-F390 HydrophobicContact CB-CE2 4.33Å; F373-F390 HydrophobicContact CD1-CB 3.9Å; F373-F390 AromaticContact CD1-CD2 3.63Å; F373-F390 HydrophobicContact CD1-CD2 3.63Å; F373-F390 HydrophobicContact CD1-CG 4.23Å; F373-F390 HydrophobicContact CE1-CB 4.06Å; F373-F390 HydrophobicContact CE1-CD2 4.39Å; F373-F390 HydrophobicContact CG-CD2 4.01Å; F373-V393 HydrophobicContact CD2-CG1 4.16Å; F373-V393 HydrophobicContact CE1-CG2 4.4Å; F373-V393 HydrophobicContact CE2-CB 4.23Å; F373-V393 HydrophobicContact CE2-CG1 3.95Å; F373-V393 HydrophobicContact CE2-CG2 3.86Å; F373-V393 HydrophobicContact CZ-CB 4.2Å; F373-V393 HydrophobicContact CZ-CG1 4.42Å; F373-V393 HydrophobicContact CZ-CG2 3.63Å; F373-F433 HydrophobicContact CE2-CD2 4.2Å; F373-F433 AromaticContact CE2-CE2 3.7Å; F373-F433 HydrophobicContact CE2-CE2 3.7Å; F373-F433 AromaticContact CE2-CZ 3.92Å; F373-F433 HydrophobicContact CE2-CZ 3.92Å; F373-F433 HydrophobicContact CZ-CE2 4.32Å; F373-F433 HydrophobicContact CZ-CZ 4.15Å
374	R	91.4	Very high	89.2	Confident	141 Å²	141	57.8 Å²	57.8	53%	0.532	28%	0.281	S	S	.	.	H	α-helix	trans	-57.8	-38.6	174.7	-82.2	173.7	179.1	-163.2	-2.8	112.8	N370 F372 I376 Q377 E378	N370-R374 WeakPolarHBondContact O-CB 3.45Å; N370-R374 VanDerWaalsContact O-CG 3.25Å; N370-R374 WeakPolarHBondContact O-CG 3.39Å; N370-R374 PolarHBondContact O-N 3.07Å; F372-R374 VanDerWaalsContact C-N 3.3Å; F372-R374 PolarHBondContact O-N 3.46Å; R374-I376 VanDerWaalsContact C-N 3.26Å; R374-I376 PolarHBondContact O-N 3.31Å; R374-Q377 PolarHBondContact O-N 3.13Å; R374-E378 WeakPolarHBondContact O-CG 3.24Å; R374-E378 PolarHBondContact O-N 3.14Å
375	A	90.2	Very high	88.5	Confident	5 Å²	5	60.3 Å²	60.3	4%	0.041	29%	0.292	C	S	.	.	H	α-helix	trans	-63.4	-36.1	177.7	0	0	0	0	0	111.6	T310 V312 F372 F373 E378 Q379	T310-A375 HydrophobicContact CG2-CB 4.01Å; V312-A375 HydrophobicContact CB-CB 4.03Å; V312-A375 HydrophobicContact CG2-CB 3.64Å; F372-A375 WeakPolarHBondContact O-CB 3.14Å; F372-A375 PolarHBondContact O-N 3.36Å; F372-A375 VanDerWaalsContact O-N 3.16Å; F373-A375 VanDerWaalsContact C-N 3.26Å; F373-A375 PolarHBondContact O-N 3.41Å; A375-E378 PolarHBondContact O-N 2.9Å; A375-Q379 PolarHBondContact O-N 2.67Å; A375-Q379 VanDerWaalsContact O-N 3.11Å
376	I	89.3	Confident	87.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-68.7	-46.4	176	-60.3	178.7	0	0	0	110.3	T310 F373 R374 E378 Q379 M380 I426 L430 F433	T310-I376 HydrophobicContact CG2-CD1 4.41Å; T310-I376 HydrophobicContact CG2-CG1 3.53Å; F373-I376 WeakPolarHBondContact O-CB 3.36Å; F373-I376 PolarHBondContact O-N 2.9Å; F373-I376 VanDerWaalsContact O-N 3.08Å; R374-I376 VanDerWaalsContact C-N 3.26Å; R374-I376 PolarHBondContact O-N 3.31Å; I376-E378 PolarHBondContact O-N 2.92Å; I376-Q379 PolarHBondContact O-N 2.88Å; I376-Q379 VanDerWaalsContact O-N 3.1Å; I376-M380 HydrophobicContact CG2-CG 4.41Å; I376-M380 HydrophobicContact CG2-SD 4.4Å; I376-M380 WeakPolarHBondContact O-CG 3.35Å; I376-M380 PolarHBondContact O-N 2.79Å; I376-I426 WeakPolarHBondContact CD1-O 3.41Å; I376-L430 HydrophobicContact CG2-CD1 3.86Å; I376-F433 HydrophobicContact CG2-CB 4.14Å; I376-F433 HydrophobicContact CG2-CD1 3.87Å; I376-F433 HydrophobicContact CG2-CG 4.01Å
377	Q	88.5	Confident	87.1	Confident	35 Å²	35	68.2 Å²	68.2	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-37	175.9	-69.2	-175.3	-46.8	0	0	112.4	F373 R374 K381 V388	F373-Q377 HydrophobicContact CD1-CG 3.81Å; F373-Q377 HydrophobicContact CE1-CG 3.5Å; F373-Q377 VanDerWaalsContact CE1-CG 3.5Å; F373-Q377 HydrophobicContact CZ-CG 4.04Å; F373-Q377 PolarHBondContact O-N 3.29Å; R374-Q377 PolarHBondContact O-N 3.13Å; Q377-K381 VanDerWaalsContact O-CG 3.27Å; Q377-K381 WeakPolarHBondContact O-CG 3.43Å; Q377-K381 PolarHBondContact O-N 3.47Å; Q377-K381 VanDerWaalsContact O-N 3.07Å; Q377-V388 PolarHBondContact NE2-O 3.12Å
378	E	88.3	Confident	86.8	Confident	122 Å²	122	63.9 Å²	63.9	57%	0.57	32%	0.315	S	S	*	.	H	α-helix	trans	-64.5	-44.4	174.6	-75.1	175.8	-175.5	0	0	111.7	R374 A375 I376 K381 L382	R374-E378 WeakPolarHBondContact O-CG 3.24Å; R374-E378 PolarHBondContact O-N 3.14Å; A375-E378 PolarHBondContact O-N 2.9Å; I376-E378 PolarHBondContact O-N 2.92Å; E378-K381 PolarHBondContact O-N 3.4Å; E378-L382 WeakPolarHBondContact O-CG 3.05Å; E378-L382 PolarHBondContact O-N 3.03Å; E378-L382 VanDerWaalsContact O-N 3.13Å
379	Q	85.6	Confident	86.6	Confident	42 Å²	42	66.3 Å²	66.3	20%	0.196	33%	0.332	C	S	.	.	H	α-helix	trans	-65.3	-40.9	175.3	-70.3	-169.8	-19.5	0	0	112.5	A375 I376 K381 L382 H383 L430	A375-Q379 PolarHBondContact O-N 2.67Å; A375-Q379 VanDerWaalsContact O-N 3.11Å; I376-Q379 PolarHBondContact O-N 2.88Å; I376-Q379 VanDerWaalsContact O-N 3.1Å; Q379-K381 VanDerWaalsContact C-N 3.31Å; Q379-K381 PolarHBondContact O-N 3.27Å; Q379-L382 WeakPolarHBondContact O-CB 3.44Å; Q379-L382 PolarHBondContact O-N 2.96Å; Q379-L382 VanDerWaalsContact O-N 3.13Å; Q379-H383 PolarHBondContact O-CD2 3.29Å; Q379-H383 VanDerWaalsContact O-CD2 3.24Å; Q379-H383 PolarHBondContact O-N 3.33Å; Q379-L430 HydrophobicContact CB-CD1 4.3Å; Q379-L430 HydrophobicContact CB-CD2 3.98Å
380	M	85.4	Confident	86.5	Confident	5 Å²	5	67.8 Å²	67.8	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-42.1	174.4	-71	-177.2	79.8	0	0	112.3	I376 L382 H383 S384 Q385 E386 V388 L430 F433	I376-M380 HydrophobicContact CG2-CG 4.41Å; I376-M380 HydrophobicContact CG2-SD 4.4Å; I376-M380 WeakPolarHBondContact O-CG 3.35Å; I376-M380 PolarHBondContact O-N 2.79Å; M380-L382 VanDerWaalsContact C-N 3.33Å; M380-L382 PolarHBondContact O-N 2.95Å; M380-H383 CarbonylContact O-C 3.41Å; M380-H383 PolarHBondContact O-N 2.97Å; M380-H383 VanDerWaalsContact O-N 3.15Å; M380-S384 PolarHBondContact O-N 3.3Å; M380-Q385 HydrophobicContact CB-CB 4.33Å; M380-Q385 HydrophobicContact CE-CB 4.17Å; M380-Q385 PolarHBondContact O-N 3.48Å; M380-E386 WeakPolarHBondContact CE-O 3.24Å; M380-V388 HydrophobicContact CE-CG2 4.15Å; M380-L430 HydrophobicContact CG-CD1 3.58Å; M380-F433 HydrophobicContact CE-CE1 3.89Å; M380-F433 HydrophobicContact SD-CD1 3.91Å; M380-F433 HydrophobicContact SD-CE1 3.47Å; M380-F433 WeakPolarHBondContact SD-CE1 3.29Å; M380-F433 HydrophobicContact SD-CZ 4.5Å
381	K	86.1	Confident	86.4	Confident	127 Å²	127	70.8 Å²	70.8	55%	0.552	35%	0.352	S	S	*	.	H	α-helix	trans	-62.7	-39.6	176.1	-73.9	169.9	-173.4	173.1	0	112	Q377 E378 Q379 H383 S384	Q377-K381 VanDerWaalsContact O-CG 3.27Å; Q377-K381 WeakPolarHBondContact O-CG 3.43Å; Q377-K381 PolarHBondContact O-N 3.47Å; Q377-K381 VanDerWaalsContact O-N 3.07Å; E378-K381 PolarHBondContact O-N 3.4Å; Q379-K381 VanDerWaalsContact C-N 3.31Å; Q379-K381 PolarHBondContact O-N 3.27Å; K381-H383 VanDerWaalsContact C-N 3.26Å; K381-H383 PolarHBondContact O-N 3.48Å; K381-S384 PolarHBondContact O-N 3.38Å; K381-S384 VanDerWaalsContact O-N 3.08Å
382	L	84.6	Confident	86.3	Confident	143 Å²	143	70.7 Å²	70.7	75%	0.749	36%	0.357	S	S	*	.	H	α-helix	trans	-62.8	-36.1	175.1	-69.5	170.9	0	0	0	111.6	E378 Q379 M380 S384	E378-L382 WeakPolarHBondContact O-CG 3.05Å; E378-L382 PolarHBondContact O-N 3.03Å; E378-L382 VanDerWaalsContact O-N 3.13Å; Q379-L382 WeakPolarHBondContact O-CB 3.44Å; Q379-L382 PolarHBondContact O-N 2.96Å; Q379-L382 VanDerWaalsContact O-N 3.13Å; M380-L382 VanDerWaalsContact C-N 3.33Å; M380-L382 PolarHBondContact O-N 2.95Å; L382-S384 PolarHBondContact O-N 2.95Å
383	H	81.8	Confident	86.1	Confident	128 Å²	128	70.7 Å²	70.7	59%	0.593	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	10.7	174.4	-72.3	-76.2	0	0	0	114.2	Q379 M380 K381 Q385	Q379-H383 PolarHBondContact O-CD2 3.29Å; Q379-H383 VanDerWaalsContact O-CD2 3.24Å; Q379-H383 PolarHBondContact O-N 3.33Å; M380-H383 CarbonylContact O-C 3.41Å; M380-H383 PolarHBondContact O-N 2.97Å; M380-H383 VanDerWaalsContact O-N 3.15Å; K381-H383 VanDerWaalsContact C-N 3.26Å; K381-H383 PolarHBondContact O-N 3.48Å; H383-Q385 VanDerWaalsContact C-N 3.25Å; H383-Q385 HydrophobicContact CB-CG 4.41Å; H383-Q385 PolarHBondContact O-N 2.92Å
384	S	81.6	Confident	86.1	Confident	116 Å²	116	72 Å²	72	81%	0.811	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	33.5	179.5	-56.6	0	0	0	0	114.3	M380 K381 L382	M380-S384 PolarHBondContact O-N 3.3Å; K381-S384 PolarHBondContact O-N 3.38Å; K381-S384 VanDerWaalsContact O-N 3.08Å; L382-S384 PolarHBondContact O-N 2.95Å
385	Q	77.6	Confident	86.1	Confident	57 Å²	57	68.4 Å²	68.4	27%	0.266	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-95.9	154	175.3	-63.4	-175.2	-15.2	0	0	111.6	M380 H383 W434	M380-Q385 HydrophobicContact CB-CB 4.33Å; M380-Q385 HydrophobicContact CE-CB 4.17Å; M380-Q385 PolarHBondContact O-N 3.48Å; H383-Q385 VanDerWaalsContact C-N 3.25Å; H383-Q385 HydrophobicContact CB-CG 4.41Å; H383-Q385 PolarHBondContact O-N 2.92Å; Q385-W434 HydrophobicContact CG-CZ3 4.23Å
386	E	77.3	Confident	86.3	Confident	173 Å²	173	71.3 Å²	71.3	81%	0.808	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-68.5	133	177.5	-67.6	-165.1	163.1	0	0	110.8	M380 V388	M380-E386 WeakPolarHBondContact CE-O 3.24Å; E386-V388 PolarHBondContact O-N 3.12Å
387	P	76	Confident	86.4	Confident	81 Å²	81	71.4 Å²	71.4	53%	0.526	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-73.1	125	-178.6	28.6	-32.8	0	0	0	110.7
388	V	83.9	Confident	86.6	Confident	32 Å²	32	70.9 Å²	70.9	19%	0.194	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-75.7	143	173.1	-176.7	0	0	0	0	110.1	F373 Q377 M380 E386 F390 V393 F433	F373-V388 HydrophobicContact CZ-CB 4.4Å; Q377-V388 PolarHBondContact NE2-O 3.12Å; M380-V388 HydrophobicContact CE-CG2 4.15Å; E386-V388 PolarHBondContact O-N 3.12Å; V388-F390 PolarHBondContact O-N 3.33Å; V388-V393 HydrophobicContact CG1-CG2 3.75Å; V388-F433 HydrophobicContact CB-CZ 4.05Å; V388-F433 HydrophobicContact CG1-CZ 4.32Å; V388-F433 HydrophobicContact CG2-CE1 4.16Å; V388-F433 HydrophobicContact CG2-CZ 3.92Å
389	S	88.4	Confident	86.8	Confident	56 Å²	56	70.7 Å²	70.7	39%	0.392	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.8	177.3	176.3	0	0	0	0	110.8	Q391 D392 V393	S389-Q391 PolarHBondContact O-N 3.33Å; S389-Q391 PolarHBondContact OG-N 3Å; S389-D392 VanDerWaalsContact CB-OD2 3.25Å; S389-D392 WeakPolarHBondContact CB-OD2 3.3Å; S389-D392 PolarHBondContact O-N 2.93Å; S389-V393 PolarHBondContact O-N 3.16Å
390	F	90.4	Very high	87.1	Confident	33 Å²	33	70.4 Å²	70.4	15%	0.145	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-31.2	174	172	-108.2	0	0	0	112.2	V366 L369 N370 F373 V388 D392 K394	V366-F390 HydrophobicContact CG1-CE1 3.78Å; V366-F390 HydrophobicContact CG1-CZ 3.95Å; L369-F390 HydrophobicContact CB-CE2 4.02Å; L369-F390 HydrophobicContact CB-CZ 4.1Å; N370-F390 HydrophobicContact CB-CD1 4.24Å; N370-F390 HydrophobicContact CB-CD2 4.3Å; N370-F390 HydrophobicContact CB-CE1 3.73Å; N370-F390 HydrophobicContact CB-CE2 3.81Å; N370-F390 HydrophobicContact CB-CZ 3.5Å; F373-F390 HydrophobicContact CB-CD2 4.01Å; F373-F390 HydrophobicContact CB-CE2 4.33Å; F373-F390 HydrophobicContact CD1-CB 3.9Å; F373-F390 AromaticContact CD1-CD2 3.63Å; F373-F390 HydrophobicContact CD1-CD2 3.63Å; F373-F390 HydrophobicContact CD1-CG 4.23Å; F373-F390 HydrophobicContact CE1-CB 4.06Å; F373-F390 HydrophobicContact CE1-CD2 4.39Å; F373-F390 HydrophobicContact CG-CD2 4.01Å; V388-F390 PolarHBondContact O-N 3.33Å; F390-D392 VanDerWaalsContact C-N 3.29Å; F390-D392 PolarHBondContact O-N 3.26Å; F390-K394 HydrophobicContact CE1-CB 4.2Å; F390-K394 HydrophobicContact CE1-CD 4.03Å; F390-K394 HydrophobicContact CE1-CG 4.44Å; F390-K394 HydrophobicContact CE2-CB 4.24Å; F390-K394 HydrophobicContact CZ-CB 3.98Å; F390-K394 HydrophobicContact CZ-CD 4.23Å; F390-K394 HydrophobicContact CZ-CG 4.2Å; F390-K394 WeakPolarHBondContact O-CB 3.46Å; F390-K394 PolarHBondContact O-N 3.36Å
391	Q	90.3	Very high	87.4	Confident	96 Å²	96	70.5 Å²	70.5	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-40.5	-179	-177.1	61.4	37.1	0	0	111.1	S389 K394 D395	S389-Q391 PolarHBondContact O-N 3.33Å; S389-Q391 PolarHBondContact OG-N 3Å; Q391-K394 VanDerWaalsContact CD-CE 3.42Å; Q391-K394 PolarHBondContact O-N 3Å; Q391-D395 PolarHBondContact NE2-OD1 2.88Å; Q391-D395 PolarHBondContact NE2-OD2 3.43Å; Q391-D395 VanDerWaalsContact O-CG 3.28Å; Q391-D395 PolarHBondContact O-N 3.32Å
392	D	89.9	Confident	87.7	Confident	89 Å²	89	72.4 Å²	72.4	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-69.8	-49	-178.7	-56.5	-20.4	0	0	0	109.8	S389 F390 K394 D395 E396	S389-D392 VanDerWaalsContact CB-OD2 3.25Å; S389-D392 WeakPolarHBondContact CB-OD2 3.3Å; S389-D392 PolarHBondContact O-N 2.93Å; F390-D392 VanDerWaalsContact C-N 3.29Å; F390-D392 PolarHBondContact O-N 3.26Å; D392-K394 VanDerWaalsContact C-N 3.29Å; D392-K394 PolarHBondContact O-N 3.08Å; D392-D395 PolarHBondContact O-N 3.45Å; D392-D395 VanDerWaalsContact O-N 3.15Å; D392-E396 WeakPolarHBondContact O-CG 3.35Å; D392-E396 PolarHBondContact O-N 2.9Å
393	V	90.2	Very high	88.1	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-39.4	176.4	177.4	0	0	0	0	111.8	F373 V388 S389 E396 I397 I426 F433	F373-V393 HydrophobicContact CD2-CG1 4.16Å; F373-V393 HydrophobicContact CE1-CG2 4.4Å; F373-V393 HydrophobicContact CE2-CB 4.23Å; F373-V393 HydrophobicContact CE2-CG1 3.95Å; F373-V393 HydrophobicContact CE2-CG2 3.86Å; F373-V393 HydrophobicContact CZ-CB 4.2Å; F373-V393 HydrophobicContact CZ-CG1 4.42Å; F373-V393 HydrophobicContact CZ-CG2 3.63Å; V388-V393 HydrophobicContact CG1-CG2 3.75Å; S389-V393 PolarHBondContact O-N 3.16Å; V393-E396 PolarHBondContact O-N 2.69Å; V393-I397 HydrophobicContact CG1-CD1 3.87Å; V393-I397 HydrophobicContact CG1-CG1 4.4Å; V393-I397 WeakPolarHBondContact O-CB 3.45Å; V393-I397 VanDerWaalsContact O-CG1 3.26Å; V393-I397 WeakPolarHBondContact O-CG1 3.46Å; V393-I397 PolarHBondContact O-N 2.99Å; V393-I426 HydrophobicContact CG1-CG2 4.05Å; V393-F433 HydrophobicContact CG2-CE2 4.04Å; V393-F433 HydrophobicContact CG2-CZ 4.36Å
394	K	92.4	Very high	88.6	Confident	28 Å²	28	68.2 Å²	68.2	12%	0.122	35%	0.352	C	S	.	.	H	α-helix	trans	-61.2	-52.4	174.9	-179.9	-165.5	68.1	66.7	0	110.2	V366 F390 Q391 D392 E396 I397 F398	V366-K394 HydrophobicContact CB-CD 4.41Å; V366-K394 HydrophobicContact CG1-CD 3.56Å; V366-K394 HydrophobicContact CG1-CG 4.48Å; V366-K394 HydrophobicContact CG2-CD 4Å; F390-K394 HydrophobicContact CE1-CB 4.2Å; F390-K394 HydrophobicContact CE1-CD 4.03Å; F390-K394 HydrophobicContact CE1-CG 4.44Å; F390-K394 HydrophobicContact CE2-CB 4.24Å; F390-K394 HydrophobicContact CZ-CB 3.98Å; F390-K394 HydrophobicContact CZ-CD 4.23Å; F390-K394 HydrophobicContact CZ-CG 4.2Å; F390-K394 WeakPolarHBondContact O-CB 3.46Å; F390-K394 PolarHBondContact O-N 3.36Å; Q391-K394 VanDerWaalsContact CD-CE 3.42Å; Q391-K394 PolarHBondContact O-N 3Å; D392-K394 VanDerWaalsContact C-N 3.29Å; D392-K394 PolarHBondContact O-N 3.08Å; K394-E396 VanDerWaalsContact C-N 3.28Å; K394-E396 PolarHBondContact O-N 2.79Å; K394-I397 PolarHBondContact O-N 2.9Å; K394-F398 HydrophobicContact CG-CD2 3.89Å; K394-F398 HydrophobicContact CG-CE2 3.93Å; K394-F398 VanDerWaalsContact O-CD2 3.29Å; K394-F398 WeakPolarHBondContact O-CD2 3.33Å; K394-F398 PolarHBondContact O-N 3.11Å
395	D	91.5	Very high	89	Confident	65 Å²	65	65.9 Å²	65.9	35%	0.348	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-40.9	-178.4	-69.6	-25	0	0	0	110.7	Q391 D392 F398 D399	Q391-D395 PolarHBondContact NE2-OD1 2.88Å; Q391-D395 PolarHBondContact NE2-OD2 3.43Å; Q391-D395 VanDerWaalsContact O-CG 3.28Å; Q391-D395 PolarHBondContact O-N 3.32Å; D392-D395 PolarHBondContact O-N 3.45Å; D392-D395 VanDerWaalsContact O-N 3.15Å; D395-F398 PolarHBondContact O-N 3.27Å; D395-D399 WeakPolarHBondContact O-CB 3.35Å; D395-D399 PolarHBondContact O-N 3.08Å
396	E	92.7	Very high	89.6	Confident	67 Å²	67	67.4 Å²	67.4	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-44.9	173.5	-71.3	-170.3	-165.8	0	0	113.6	D392 V393 K394 F398 D399 M400 Y436 R439	D392-E396 WeakPolarHBondContact O-CG 3.35Å; D392-E396 PolarHBondContact O-N 2.9Å; V393-E396 PolarHBondContact O-N 2.69Å; K394-E396 VanDerWaalsContact C-N 3.28Å; K394-E396 PolarHBondContact O-N 2.79Å; E396-F398 VanDerWaalsContact C-N 3.33Å; E396-F398 PolarHBondContact O-N 3.39Å; E396-D399 PolarHBondContact O-N 3.4Å; E396-M400 WeakPolarHBondContact O-CB 3.4Å; E396-M400 VanDerWaalsContact O-CG 3.3Å; E396-M400 WeakPolarHBondContact O-CG 3.5Å; E396-M400 PolarHBondContact O-N 2.94Å; E396-Y436 WeakPolarHBondContact OE2-CE1 3.23Å; E396-Y436 VanDerWaalsContact OE2-CZ 3.26Å; E396-Y436 PolarHBondContact OE2-OH 2.87Å; E396-R439 IonicContact OE2-NH2 3.82Å; E396-R439 PolarHBondContact OE2-NH2 2.79Å
397	I	92.8	Very high	90.1	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-44.3	176.9	-72.2	170	0	0	0	110.7	L369 V393 K394 D399 M400 V401 I409 V423 I426 L427	L369-I397 HydrophobicContact CD1-CG2 4.28Å; V393-I397 HydrophobicContact CG1-CD1 3.87Å; V393-I397 HydrophobicContact CG1-CG1 4.4Å; V393-I397 WeakPolarHBondContact O-CB 3.45Å; V393-I397 VanDerWaalsContact O-CG1 3.26Å; V393-I397 WeakPolarHBondContact O-CG1 3.46Å; V393-I397 PolarHBondContact O-N 2.99Å; K394-I397 PolarHBondContact O-N 2.9Å; I397-D399 VanDerWaalsContact C-N 3.35Å; I397-M400 HydrophobicContact CG1-CE 4.08Å; I397-M400 PolarHBondContact O-N 3.11Å; I397-V401 HydrophobicContact CG2-CG2 4.44Å; I397-V401 WeakPolarHBondContact O-CB 3.38Å; I397-V401 VanDerWaalsContact O-CG2 3.3Å; I397-V401 WeakPolarHBondContact O-CG2 3.19Å; I397-V401 PolarHBondContact O-N 3Å; I397-I409 HydrophobicContact CG2-CD1 3.77Å; I397-V423 HydrophobicContact CG1-CG1 4.47Å; I397-V423 HydrophobicContact CG2-CG1 3.81Å; I397-V423 HydrophobicContact CG2-CG2 4.3Å; I397-I426 HydrophobicContact CD1-CG2 4.14Å; I397-L427 HydrophobicContact CD1-CD2 4.21Å
398	F	92.8	Very high	90.9	Very high	24 Å²	24	67 Å²	67	11%	0.105	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-35.7	178.7	-85.9	-92.9	0	0	0	112.1	V366 L369 K394 D395 E396 K402 P403 P406 I409	V366-F398 HydrophobicContact CG2-CE2 4.21Å; V366-F398 HydrophobicContact CG2-CZ 4.23Å; L369-F398 HydrophobicContact CD1-CD2 4.38Å; L369-F398 HydrophobicContact CD1-CE2 3.68Å; L369-F398 HydrophobicContact CD1-CZ 4.46Å; K394-F398 HydrophobicContact CG-CD2 3.89Å; K394-F398 HydrophobicContact CG-CE2 3.93Å; K394-F398 VanDerWaalsContact O-CD2 3.29Å; K394-F398 WeakPolarHBondContact O-CD2 3.33Å; K394-F398 PolarHBondContact O-N 3.11Å; D395-F398 PolarHBondContact O-N 3.27Å; E396-F398 VanDerWaalsContact C-N 3.33Å; E396-F398 PolarHBondContact O-N 3.39Å; F398-K402 WeakPolarHBondContact O-CA 3.35Å; F398-K402 PolarHBondContact O-N 2.89Å; F398-P403 HydrophobicContact CD1-CG 3.76Å; F398-P403 HydrophobicContact CE1-CG 4.04Å; F398-P406 WeakPolarHBondContact CD1-O 3.49Å; F398-P406 WeakPolarHBondContact CE1-O 3.46Å; F398-I409 HydrophobicContact CD1-CD1 4.46Å; F398-I409 HydrophobicContact CD1-CG1 4.48Å; F398-I409 HydrophobicContact CD2-CD1 4.38Å; F398-I409 HydrophobicContact CE1-CD1 4.23Å; F398-I409 HydrophobicContact CE1-CG1 4.07Å; F398-I409 HydrophobicContact CE2-CD1 4.18Å; F398-I409 HydrophobicContact CZ-CD1 4.11Å; F398-I409 HydrophobicContact CZ-CG1 4.26Å
399	D	92.5	Very high	91.4	Very high	118 Å²	118	65.5 Å²	65.5	63%	0.631	32%	0.32	S	S	*	.	H	α-helix	trans	-70.9	-33.3	175.5	-79.4	-15.1	0	0	0	113.1	D395 E396 I397 K402	D395-D399 WeakPolarHBondContact O-CB 3.35Å; D395-D399 PolarHBondContact O-N 3.08Å; E396-D399 PolarHBondContact O-N 3.4Å; I397-D399 VanDerWaalsContact C-N 3.35Å; D399-K402 WeakPolarHBondContact O-CE 3.38Å; D399-K402 WeakPolarHBondContact O-CG 3.47Å
400	M	91.4	Very high	91.7	Very high	37 Å²	37	65 Å²	65	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-69.3	-46.9	173.2	-76	-171.9	-72.3	0	0	111.6	E396 I397 Q419 T422 V423 I426 Y436	E396-M400 WeakPolarHBondContact O-CB 3.4Å; E396-M400 VanDerWaalsContact O-CG 3.3Å; E396-M400 WeakPolarHBondContact O-CG 3.5Å; E396-M400 PolarHBondContact O-N 2.94Å; I397-M400 HydrophobicContact CG1-CE 4.08Å; I397-M400 PolarHBondContact O-N 3.11Å; M400-Q419 HydrophobicContact CB-CB 4.38Å; M400-T422 HydrophobicContact SD-CG2 4.36Å; M400-V423 HydrophobicContact CE-CG2 4.09Å; M400-I426 HydrophobicContact CE-CD1 3.98Å; M400-Y436 HydrophobicContact CE-CE2 4.01Å; M400-Y436 WeakPolarHBondContact CE-OH 3.46Å; M400-Y436 HydrophobicContact SD-CE2 3.82Å
401	V	92.1	Very high	91.8	Very high	6 Å²	6	65.5 Å²	65.5	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-79.6	-35.1	-173.5	178.1	0	0	0	0	112.4	I397 P403 I409 D413 L414 V423	I397-V401 HydrophobicContact CG2-CG2 4.44Å; I397-V401 WeakPolarHBondContact O-CB 3.38Å; I397-V401 VanDerWaalsContact O-CG2 3.3Å; I397-V401 WeakPolarHBondContact O-CG2 3.19Å; I397-V401 PolarHBondContact O-N 3Å; V401-P403 HydrophobicContact CG1-CB 4.44Å; V401-I409 HydrophobicContact CG1-CG1 4.26Å; V401-I409 HydrophobicContact CG1-CG2 3.91Å; V401-I409 HydrophobicContact CG2-CD1 4.44Å; V401-D413 HydrophobicContact CG1-CB 3.74Å; V401-L414 HydrophobicContact CG1-CD2 4.42Å; V401-L414 HydrophobicContact CG2-CD2 3.73Å; V401-V423 HydrophobicContact CG2-CG2 3.77Å
402	K	91.9	Very high	91.9	Very high	168 Å²	168	66.7 Å²	66.7	73%	0.73	32%	0.324	S	S	*	.			trans	46.6	59.4	-174.2	-58.1	-175	-179.6	174.1	0	112.1	F398 D399	F398-K402 WeakPolarHBondContact O-CA 3.35Å; F398-K402 PolarHBondContact O-N 2.89Å; D399-K402 WeakPolarHBondContact O-CE 3.38Å; D399-K402 WeakPolarHBondContact O-CG 3.47Å
403	P	93	Very high	92.1	Very high	19 Å²	19	62.9 Å²	62.9	12%	0.123	30%	0.304	C	S	.	.			trans	-62.9	152.5	-175.1	28.3	-35.2	0	0	0	111.7	F398 V401 D405 K408 I409 D413	F398-P403 HydrophobicContact CD1-CG 3.76Å; F398-P403 HydrophobicContact CE1-CG 4.04Å; V401-P403 HydrophobicContact CG1-CB 4.44Å; P403-D405 VanDerWaalsContact C-N 3.27Å; P403-D405 WeakPolarHBondContact CB-O 3.39Å; P403-D405 WeakPolarHBondContact CG-O 3.43Å; P403-D405 PolarHBondContact O-N 2.9Å; P403-K408 VanDerWaalsContact CB-O 3.24Å; P403-K408 WeakPolarHBondContact CB-O 3.44Å; P403-I409 HydrophobicContact CB-CG1 4.23Å; P403-I409 HydrophobicContact CG-CG1 4.12Å; P403-D413 HydrophobicContact CB-CB 4.27Å
404	K	91.7	Very high	92.2	Very high	164 Å²	164	62.9 Å²	62.9	71%	0.713	30%	0.304	S	S	*	.	S	Bend	trans	-61.5	-37.6	175.7	-70.9	176.1	-177.7	170	0	112.6	D413	K404-D413 PolarHBondContact N-OD1 3.03Å
405	D	90.6	Very high	92.2	Very high	66 Å²	66	63.9 Å²	63.9	35%	0.353	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-100.6	120.3	171.6	-175.9	-27.9	0	0	0	108.3	P403 Y407 K408	P403-D405 VanDerWaalsContact C-N 3.27Å; P403-D405 WeakPolarHBondContact CB-O 3.39Å; P403-D405 WeakPolarHBondContact CG-O 3.43Å; P403-D405 PolarHBondContact O-N 2.9Å; D405-Y407 PolarHBondContact O-N 3.47Å; D405-Y407 PolarHBondContact OD1-N 2.94Å; D405-K408 HydrophobicContact CB-CB 4.09Å; D405-K408 PolarHBondContact O-N 3.31Å; D405-K408 VanDerWaalsContact O-N 3.11Å; D405-K408 VanDerWaalsContact O-O 3.13Å
406	P	89.9	Confident	92.2	Very high	90 Å²	90	65.6 Å²	65.6	58%	0.584	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-14.8	-177.8	-26.2	34.7	0	0	0	115.5	F398	F398-P406 WeakPolarHBondContact CD1-O 3.49Å; F398-P406 WeakPolarHBondContact CE1-O 3.46Å
407	Y	88.3	Confident	92.2	Very high	174 Å²	174	63.5 Å²	63.5	68%	0.682	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-3.2	-177.6	-58.8	-71.3	0	0	0	114.2	D405	D405-Y407 PolarHBondContact O-N 3.47Å; D405-Y407 PolarHBondContact OD1-N 2.94Å
408	K	92.7	Very high	92	Very high	71 Å²	71	68.4 Å²	68.4	31%	0.309	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-138.4	123.3	-171.6	-60	-175.9	178.5	-169	0	111.3	Y363 P403 D405	Y363-K408 HydrophobicContact CD1-CD 3.97Å; Y363-K408 HydrophobicContact CD2-CB 3.89Å; Y363-K408 HydrophobicContact CD2-CD 3.68Å; Y363-K408 HydrophobicContact CD2-CG 3.6Å; Y363-K408 HydrophobicContact CE1-CD 3.99Å; Y363-K408 HydrophobicContact CE2-CD 3.74Å; Y363-K408 HydrophobicContact CE2-CG 3.88Å; Y363-K408 HydrophobicContact CG-CB 4.03Å; Y363-K408 HydrophobicContact CG-CD 3.81Å; Y363-K408 HydrophobicContact CG-CG 4.06Å; Y363-K408 PolarHBondContact OH-NZ 3.49Å; P403-K408 VanDerWaalsContact CB-O 3.24Å; P403-K408 WeakPolarHBondContact CB-O 3.44Å; D405-K408 HydrophobicContact CB-CB 4.09Å; D405-K408 PolarHBondContact O-N 3.31Å; D405-K408 VanDerWaalsContact O-N 3.11Å; D405-K408 VanDerWaalsContact O-O 3.13Å
409	I	93.6	Very high	91.9	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112.9	174.2	-66	170	0	0	0	108.6	Y363 L364 L369 I397 F398 V401 P403 L414	Y363-I409 CarbonylContact C-O 3.52Å; Y363-I409 VanDerWaalsContact CA-O 3.31Å; Y363-I409 WeakPolarHBondContact CA-O 3.23Å; L364-I409 HydrophobicContact CB-CB 4.35Å; L364-I409 PolarHBondContact N-O 2.92Å; L364-I409 PolarHBondContact O-N 3.49Å; L369-I409 HydrophobicContact CD1-CD1 4.29Å; I397-I409 HydrophobicContact CG2-CD1 3.77Å; F398-I409 HydrophobicContact CD1-CD1 4.46Å; F398-I409 HydrophobicContact CD1-CG1 4.48Å; F398-I409 HydrophobicContact CD2-CD1 4.38Å; F398-I409 HydrophobicContact CE1-CD1 4.23Å; F398-I409 HydrophobicContact CE1-CG1 4.07Å; F398-I409 HydrophobicContact CE2-CD1 4.18Å; F398-I409 HydrophobicContact CZ-CD1 4.11Å; F398-I409 HydrophobicContact CZ-CG1 4.26Å; V401-I409 HydrophobicContact CG1-CG1 4.26Å; V401-I409 HydrophobicContact CG1-CG2 3.91Å; V401-I409 HydrophobicContact CG2-CD1 4.44Å; P403-I409 HydrophobicContact CB-CG1 4.23Å; P403-I409 HydrophobicContact CG-CG1 4.12Å; I409-L414 HydrophobicContact CG2-CD1 4.07Å; I409-L414 HydrophobicContact CG2-CD2 3.9Å; I409-L414 HydrophobicContact CG2-CG 3.65Å
410	T	94.9	Very high	91.8	Very high	46 Å²	46	65.6 Å²	65.6	28%	0.282	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	163	173.5	69.5	0	0	0	0	111.2	Q412 D413 L414	T410-Q412 PolarHBondContact O-N 3.31Å; T410-Q412 PolarHBondContact OG1-N 2.95Å; T410-D413 WeakPolarHBondContact CB-OD2 3.38Å; T410-D413 PolarHBondContact N-OD2 3.42Å; T410-D413 WeakPolarHBondContact O-CB 3.37Å; T410-D413 PolarHBondContact O-N 3.27Å; T410-D413 VanDerWaalsContact O-N 3.08Å; T410-D413 PolarHBondContact OG1-N 2.86Å; T410-D413 PolarHBondContact OG1-OD2 3.25Å; T410-L414 PolarHBondContact O-N 3.31Å; T410-L414 VanDerWaalsContact O-N 3.14Å
411	L	92.4	Very high	91.9	Very high	43 Å²	43	65.3 Å²	65.3	23%	0.225	33%	0.33	C	S	.	.	H	α-helix	trans	-54	-40.1	170.9	175.1	63.5	0	0	0	111.6	L349 Q350 F353 D413 L414 V415	L349-L411 HydrophobicContact CB-CD1 4.16Å; Q350-L411 HydrophobicContact CB-CD1 4.31Å; Q350-L411 HydrophobicContact CB-CD2 3.76Å; Q350-L411 HydrophobicContact CG-CD2 3.71Å; F353-L411 HydrophobicContact CB-CD1 3.92Å; F353-L411 HydrophobicContact CD1-CB 4.05Å; F353-L411 HydrophobicContact CD2-CB 4.25Å; F353-L411 HydrophobicContact CE1-CB 4.18Å; F353-L411 HydrophobicContact CE2-CB 4.33Å; F353-L411 HydrophobicContact CG-CB 4.08Å; F353-L411 HydrophobicContact CG-CD1 4.16Å; F353-L411 HydrophobicContact CZ-CB 4.3Å; L411-D413 VanDerWaalsContact C-N 3.29Å; L411-D413 PolarHBondContact O-N 3.03Å; L411-L414 PolarHBondContact O-N 3.42Å; L411-V415 HydrophobicContact CD1-CG2 4.25Å; L411-V415 HydrophobicContact CG-CG2 4.49Å; L411-V415 WeakPolarHBondContact O-CG2 3.41Å; L411-V415 PolarHBondContact O-N 2.85Å
412	Q	92.7	Very high	91.8	Very high	120 Å²	120	66.7 Å²	66.7	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-67.5	-32.5	-179.4	-164.5	170.6	32.3	0	0	111.9	T410 N416	T410-Q412 PolarHBondContact O-N 3.31Å; T410-Q412 PolarHBondContact OG1-N 2.95Å; Q412-N416 VanDerWaalsContact O-CB 3.29Å; Q412-N416 WeakPolarHBondContact O-CB 3.47Å; Q412-N416 PolarHBondContact O-N 3.32Å; Q412-N416 PolarHBondContact O-ND2 3.01Å; Q412-N416 VanDerWaalsContact O-ND2 3.08Å
413	D	93.8	Very high	91.9	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.053	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-41.9	174	-57.6	-50.7	0	0	0	111.1	V401 P403 K404 T410 L411 V415 N416 S417	V401-D413 HydrophobicContact CG1-CB 3.74Å; P403-D413 HydrophobicContact CB-CB 4.27Å; K404-D413 PolarHBondContact N-OD1 3.03Å; T410-D413 WeakPolarHBondContact CB-OD2 3.38Å; T410-D413 PolarHBondContact N-OD2 3.42Å; T410-D413 WeakPolarHBondContact O-CB 3.37Å; T410-D413 PolarHBondContact O-N 3.27Å; T410-D413 VanDerWaalsContact O-N 3.08Å; T410-D413 PolarHBondContact OG1-N 2.86Å; T410-D413 PolarHBondContact OG1-OD2 3.25Å; L411-D413 VanDerWaalsContact C-N 3.29Å; L411-D413 PolarHBondContact O-N 3.03Å; D413-V415 PolarHBondContact O-N 3.06Å; D413-N416 PolarHBondContact O-N 3.03Å; D413-S417 WeakPolarHBondContact O-CB 3.45Å; D413-S417 PolarHBondContact O-N 3.25Å
414	L	92.3	Very high	91.9	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-38.8	176	-71.7	167.7	0	0	0	113.2	F353 V401 I409 T410 L411 S417 V423	F353-L414 HydrophobicContact CD2-CD1 3.52Å; F353-L414 HydrophobicContact CE2-CD1 3.92Å; V401-L414 HydrophobicContact CG1-CD2 4.42Å; V401-L414 HydrophobicContact CG2-CD2 3.73Å; I409-L414 HydrophobicContact CG2-CD1 4.07Å; I409-L414 HydrophobicContact CG2-CD2 3.9Å; I409-L414 HydrophobicContact CG2-CG 3.65Å; T410-L414 PolarHBondContact O-N 3.31Å; T410-L414 VanDerWaalsContact O-N 3.14Å; L411-L414 PolarHBondContact O-N 3.42Å; L414-S417 PolarHBondContact O-OG 3.05Å; L414-V423 HydrophobicContact CD2-CB 4.11Å; L414-V423 HydrophobicContact CD2-CG1 3.92Å; L414-V423 HydrophobicContact CD2-CG2 4.44Å
415	V	92.1	Very high	91.9	Very high	49 Å²	49	50.9 Å²	50.9	30%	0.297	27%	0.271	S	S	.	.	H	α-helix	trans	-70.3	-42.2	176.9	173.7	0	0	0	0	110.7	P346 L349 L411 D413 S417 C418	P346-V415 HydrophobicContact CB-CG1 4.43Å; P346-V415 HydrophobicContact CB-CG2 4.27Å; P346-V415 HydrophobicContact CG-CG1 4.28Å; L349-V415 HydrophobicContact CD1-CG2 4.11Å; L411-V415 HydrophobicContact CD1-CG2 4.25Å; L411-V415 HydrophobicContact CG-CG2 4.49Å; L411-V415 WeakPolarHBondContact O-CG2 3.41Å; L411-V415 PolarHBondContact O-N 2.85Å; D413-V415 PolarHBondContact O-N 3.06Å; V415-S417 VanDerWaalsContact C-N 3.33Å; V415-S417 PolarHBondContact O-N 2.8Å; V415-C418 PolarHBondContact O-N 2.89Å
416	N	92.4	Very high	91.9	Very high	101 Å²	101	47.8 Å²	47.8	54%	0.54	25%	0.254	S	S	.	.	H	α-helix	trans	-72.1	-25.5	-178.7	-69.9	-21.6	0	0	0	113.5	Q412 D413 C418	Q412-N416 VanDerWaalsContact O-CB 3.29Å; Q412-N416 WeakPolarHBondContact O-CB 3.47Å; Q412-N416 PolarHBondContact O-N 3.32Å; Q412-N416 PolarHBondContact O-ND2 3.01Å; Q412-N416 VanDerWaalsContact O-ND2 3.08Å; D413-N416 PolarHBondContact O-N 3.03Å; N416-C418 PolarHBondContact O-N 3.19Å
417	S	91.5	Very high	91.9	Very high	24 Å²	24	43.7 Å²	43.7	17%	0.168	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-17.9	179.8	72.2	0	0	0	0	113.1	D413 L414 V415 Q419	D413-S417 WeakPolarHBondContact O-CB 3.45Å; D413-S417 PolarHBondContact O-N 3.25Å; L414-S417 PolarHBondContact O-OG 3.05Å; V415-S417 VanDerWaalsContact C-N 3.33Å; V415-S417 PolarHBondContact O-N 2.8Å; S417-Q419 PolarHBondContact O-N 3.01Å; S417-Q419 VanDerWaalsContact O-N 3.09Å; S417-Q419 PolarHBondContact OG-N 3.19Å
418	C	89.8	Confident	92.1	Very high	103 Å²	103	35.4 Å²	35.4	70%	0.696	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	16.5	-170.7	-57.7	0	0	0	0	114	V415 N416	V415-C418 PolarHBondContact O-N 2.89Å; N416-C418 PolarHBondContact O-N 3.19Å
419	Q	90.7	Very high	92	Very high	81 Å²	81	32.7 Å²	32.7	38%	0.379	18%	0.183	S	C	.	.			trans	-121.8	11.7	178.5	-61.3	-60.1	-31.2	0	0	112	M400 S417 D421 T422 V423	M400-Q419 HydrophobicContact CB-CB 4.38Å; S417-Q419 PolarHBondContact O-N 3.01Å; S417-Q419 VanDerWaalsContact O-N 3.09Å; S417-Q419 PolarHBondContact OG-N 3.19Å; Q419-D421 VanDerWaalsContact C-N 3.27Å; Q419-D421 PolarHBondContact O-N 2.93Å; Q419-T422 PolarHBondContact O-N 3.19Å; Q419-V423 WeakPolarHBondContact O-CG2 3.42Å; Q419-V423 PolarHBondContact O-N 3Å; Q419-V423 VanDerWaalsContact O-N 3.07Å
420	G	90.3	Very high	91.6	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-36.2	-177.6	0	0	0	0	0	113.2	V424	G420-V424 VanDerWaalsContact O-CB 3.27Å; G420-V424 WeakPolarHBondContact O-CB 3.33Å; G420-V424 VanDerWaalsContact O-CG2 3.22Å; G420-V424 WeakPolarHBondContact O-CG2 3.08Å; G420-V424 PolarHBondContact O-N 2.99Å
421	D	92.5	Very high	91.2	Very high	31 Å²	31	34.7 Å²	34.7	17%	0.166	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-41.9	177.8	63.5	-33.8	0	0	0	112.2	R343 K344 Q419 S425	R343-D421 HydrophobicContact CB-CB 3.9Å; K344-D421 WeakPolarHBondContact CE-OD2 3.3Å; K344-D421 HydrophobicContact CG-CB 3.84Å; K344-D421 VanDerWaalsContact CG-OD2 3.31Å; K344-D421 WeakPolarHBondContact CG-OD2 3.4Å; Q419-D421 VanDerWaalsContact C-N 3.27Å; Q419-D421 PolarHBondContact O-N 2.93Å; D421-S425 VanDerWaalsContact O-CB 3.27Å; D421-S425 WeakPolarHBondContact O-CB 3.19Å; D421-S425 PolarHBondContact O-N 3.39Å; D421-S425 PolarHBondContact O-OG 2.98Å
422	T	91.6	Very high	90.8	Very high	35 Å²	35	33.3 Å²	33.3	22%	0.215	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-49.8	178	-62	0	0	0	0	110.7	M400 Q419 V424 S425 I426 Y436	M400-T422 HydrophobicContact SD-CG2 4.36Å; Q419-T422 PolarHBondContact O-N 3.19Å; T422-V424 VanDerWaalsContact C-N 3.33Å; T422-V424 PolarHBondContact O-N 3.4Å; T422-S425 PolarHBondContact O-N 3.43Å; T422-I426 HydrophobicContact CG2-CD1 4Å; T422-I426 VanDerWaalsContact O-CG1 3.32Å; T422-I426 WeakPolarHBondContact O-CG1 3.46Å; T422-I426 PolarHBondContact O-N 2.67Å; T422-Y436 HydrophobicContact CG2-CD2 3.43Å; T422-Y436 VanDerWaalsContact CG2-CD2 3.43Å; T422-Y436 HydrophobicContact CG2-CE2 3.66Å; T422-Y436 HydrophobicContact CG2-CG 4.49Å
423	V	92.5	Very high	90.5	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-45.5	178.2	173	0	0	0	0	111.2	I397 M400 V401 L414 Q419 I426 L427	I397-V423 HydrophobicContact CG1-CG1 4.47Å; I397-V423 HydrophobicContact CG2-CG1 3.81Å; I397-V423 HydrophobicContact CG2-CG2 4.3Å; M400-V423 HydrophobicContact CE-CG2 4.09Å; V401-V423 HydrophobicContact CG2-CG2 3.77Å; L414-V423 HydrophobicContact CD2-CB 4.11Å; L414-V423 HydrophobicContact CD2-CG1 3.92Å; L414-V423 HydrophobicContact CD2-CG2 4.44Å; Q419-V423 WeakPolarHBondContact O-CG2 3.42Å; Q419-V423 PolarHBondContact O-N 3Å; Q419-V423 VanDerWaalsContact O-N 3.07Å; V423-I426 PolarHBondContact O-N 3.11Å; V423-L427 HydrophobicContact CG1-CD1 4.13Å; V423-L427 VanDerWaalsContact O-CG 3.31Å; V423-L427 WeakPolarHBondContact O-CG 3.49Å; V423-L427 PolarHBondContact O-N 2.81Å
424	V	93.1	Very high	90	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-44.5	177.7	166	0	0	0	0	110.8	L349 I352 L356 G420 T422 I426 L427 I428	L349-V424 HydrophobicContact CD2-CG2 3.97Å; I352-V424 HydrophobicContact CB-CG1 3.97Å; I352-V424 HydrophobicContact CD1-CG1 3.68Å; I352-V424 HydrophobicContact CG1-CG1 4.37Å; I352-V424 HydrophobicContact CG2-CB 4.44Å; I352-V424 HydrophobicContact CG2-CG1 3.27Å; I352-V424 HydrophobicContact CG2-CG2 4.3Å; L356-V424 HydrophobicContact CD1-CG2 4.17Å; G420-V424 VanDerWaalsContact O-CB 3.27Å; G420-V424 WeakPolarHBondContact O-CB 3.33Å; G420-V424 VanDerWaalsContact O-CG2 3.22Å; G420-V424 WeakPolarHBondContact O-CG2 3.08Å; G420-V424 PolarHBondContact O-N 2.99Å; T422-V424 VanDerWaalsContact C-N 3.33Å; T422-V424 PolarHBondContact O-N 3.4Å; V424-I426 VanDerWaalsContact C-N 3.32Å; V424-I426 PolarHBondContact O-N 3.31Å; V424-L427 PolarHBondContact O-N 3.25Å; V424-I428 HydrophobicContact CG1-CD1 3.74Å; V424-I428 HydrophobicContact CG1-CG1 4.42Å; V424-I428 HydrophobicContact CG1-CG2 4.35Å; V424-I428 WeakPolarHBondContact O-CG1 3.33Å; V424-I428 WeakPolarHBondContact O-CG2 3.39Å; V424-I428 PolarHBondContact O-N 2.85Å; V424-I428 VanDerWaalsContact O-N 3.08Å
425	S	91.9	Very high	89.7	Confident	18 Å²	18	35.4 Å²	35.4	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-39.7	178.7	-60.4	0	0	0	0	112.4	R343 D421 T422 L427 D429	R343-S425 PolarHBondContact NH1-OG 2.81Å; D421-S425 VanDerWaalsContact O-CB 3.27Å; D421-S425 WeakPolarHBondContact O-CB 3.19Å; D421-S425 PolarHBondContact O-N 3.39Å; D421-S425 PolarHBondContact O-OG 2.98Å; T422-S425 PolarHBondContact O-N 3.43Å; S425-L427 PolarHBondContact O-N 2.82Å; S425-D429 PolarHBondContact O-N 2.85Å
426	I	90.6	Very high	89.3	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-31	173.5	-73.8	164.8	0	0	0	112	I376 V393 I397 M400 T422 V423 V424 F433 Y436	I376-I426 WeakPolarHBondContact CD1-O 3.41Å; V393-I426 HydrophobicContact CG1-CG2 4.05Å; I397-I426 HydrophobicContact CD1-CG2 4.14Å; M400-I426 HydrophobicContact CE-CD1 3.98Å; T422-I426 HydrophobicContact CG2-CD1 4Å; T422-I426 VanDerWaalsContact O-CG1 3.32Å; T422-I426 WeakPolarHBondContact O-CG1 3.46Å; T422-I426 PolarHBondContact O-N 2.67Å; V423-I426 PolarHBondContact O-N 3.11Å; V424-I426 VanDerWaalsContact C-N 3.32Å; V424-I426 PolarHBondContact O-N 3.31Å; I426-F433 HydrophobicContact CG1-CD2 4.47Å; I426-F433 HydrophobicContact CG2-CD2 3.98Å; I426-Y436 HydrophobicContact CD1-CD1 3.74Å; I426-Y436 HydrophobicContact CD1-CD2 3.69Å; I426-Y436 HydrophobicContact CD1-CE1 3.85Å; I426-Y436 HydrophobicContact CD1-CE2 3.73Å; I426-Y436 HydrophobicContact CD1-CG 3.66Å; I426-Y436 HydrophobicContact CG1-CD1 4.13Å; I426-Y436 HydrophobicContact CG1-CD2 4.3Å; I426-Y436 HydrophobicContact CG1-CG 3.92Å
427	L	90.9	Very high	88.9	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-93.3	-24.4	-173.9	-66.6	170.1	0	0	0	113.6	L356 L369 F372 I397 V423 V424 S425	L356-L427 HydrophobicContact CD1-CD1 4.15Å; L356-L427 HydrophobicContact CD2-CB 4.41Å; L369-L427 HydrophobicContact CD2-CD1 3.52Å; L369-L427 HydrophobicContact CD2-CD2 3.95Å; L369-L427 HydrophobicContact CD2-CG 4.37Å; F372-L427 HydrophobicContact CB-CB 4.36Å; F372-L427 HydrophobicContact CB-CD2 4.39Å; I397-L427 HydrophobicContact CD1-CD2 4.21Å; V423-L427 HydrophobicContact CG1-CD1 4.13Å; V423-L427 VanDerWaalsContact O-CG 3.31Å; V423-L427 WeakPolarHBondContact O-CG 3.49Å; V423-L427 PolarHBondContact O-N 2.81Å; V424-L427 PolarHBondContact O-N 3.25Å; S425-L427 PolarHBondContact O-N 2.82Å
428	I	91.7	Very high	88.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-108.1	-24.2	-171	72.4	-179.4	0	0	0	114.1	L309 T310 F313 L340 I352 L356 V424	L309-I428 HydrophobicContact CD2-CG1 4.44Å; T310-I428 PolarHBondContact N-O 3.3Å; T310-I428 PolarHBondContact OG1-O 3.03Å; F313-I428 HydrophobicContact CB-CB 4.26Å; F313-I428 HydrophobicContact CB-CG2 4.46Å; F313-I428 HydrophobicContact CD1-CB 4.05Å; F313-I428 HydrophobicContact CD2-CB 3.86Å; F313-I428 HydrophobicContact CD2-CG2 3.43Å; F313-I428 VanDerWaalsContact CD2-CG2 3.43Å; F313-I428 HydrophobicContact CE1-CB 4.35Å; F313-I428 HydrophobicContact CE1-CD1 4.33Å; F313-I428 HydrophobicContact CE2-CB 4.19Å; F313-I428 HydrophobicContact CE2-CD1 4.49Å; F313-I428 HydrophobicContact CE2-CG2 3.67Å; F313-I428 HydrophobicContact CG-CB 3.79Å; F313-I428 HydrophobicContact CG-CG2 3.89Å; F313-I428 HydrophobicContact CZ-CB 4.42Å; F313-I428 HydrophobicContact CZ-CD1 4.15Å; F313-I428 HydrophobicContact CZ-CG2 4.31Å; L340-I428 HydrophobicContact CD2-CD1 3.72Å; I352-I428 HydrophobicContact CG2-CD1 4.43Å; I352-I428 HydrophobicContact CG2-CG2 4.27Å; L356-I428 HydrophobicContact CD2-CG2 3.93Å; V424-I428 HydrophobicContact CG1-CD1 3.74Å; V424-I428 HydrophobicContact CG1-CG1 4.42Å; V424-I428 HydrophobicContact CG1-CG2 4.35Å; V424-I428 WeakPolarHBondContact O-CG1 3.33Å; V424-I428 WeakPolarHBondContact O-CG2 3.39Å; V424-I428 PolarHBondContact O-N 2.85Å; V424-I428 VanDerWaalsContact O-N 3.08Å
429	D	89.8	Confident	87.8	Confident	14 Å²	14	33.2 Å²	33.2	8%	0.075	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-134.8	125.5	-166.8	-179.6	2.5	0	0	0	111.6	T308 L309 S425 N431 G432 F433	T308-D429 VanDerWaalsContact CB-OD1 3.24Å; T308-D429 WeakPolarHBondContact CB-OD1 3.36Å; T308-D429 PolarHBondContact OG1-OD1 2.9Å; L309-D429 HydrophobicContact CD2-CB 4.08Å; S425-D429 PolarHBondContact O-N 2.85Å; D429-N431 VanDerWaalsContact C-N 3.35Å; D429-N431 PolarHBondContact O-N 3.45Å; D429-N431 PolarHBondContact OD1-N 2.61Å; D429-G432 PolarHBondContact O-N 2.89Å; D429-G432 PolarHBondContact OD2-N 2.91Å; D429-F433 PolarHBondContact O-N 3.2Å
430	L	86.7	Confident	86.9	Confident	17 Å²	17	36.5 Å²	36.5	9%	0.089	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-40.4	175.5	178.6	69.3	0	0	0	112.3	T308 I376 Q379 M380 G432 F433 W434	T308-L430 PolarHBondContact O-N 3.46Å; I376-L430 HydrophobicContact CG2-CD1 3.86Å; Q379-L430 HydrophobicContact CB-CD1 4.3Å; Q379-L430 HydrophobicContact CB-CD2 3.98Å; M380-L430 HydrophobicContact CG-CD1 3.58Å; L430-G432 VanDerWaalsContact C-N 3.33Å; L430-F433 PolarHBondContact O-N 3.49Å; L430-W434 WeakPolarHBondContact O-CB 3.45Å; L430-W434 PolarHBondContact O-N 3.32Å
431	N	85.9	Confident	85.9	Confident	72 Å²	72	40.5 Å²	40.5	39%	0.385	21%	0.205	S	C	.	.	H	α-helix	trans	-71.1	-35.7	179.8	-171.2	44	0	0	0	111.2	T308 D429 W434 T435	T308-N431 HydrophobicContact CG2-CB 4.15Å; D429-N431 VanDerWaalsContact C-N 3.35Å; D429-N431 PolarHBondContact O-N 3.45Å; D429-N431 PolarHBondContact OD1-N 2.61Å; N431-W434 PolarHBondContact O-N 2.9Å; N431-T435 WeakPolarHBondContact O-CB 3.4Å; N431-T435 PolarHBondContact O-N 3.2Å; N431-T435 PolarHBondContact O-OG1 3.4Å
432	G	83.2	Confident	84.5	Confident	14 Å²	14	43 Å²	43	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-57.2	-47.8	170	0	0	0	0	0	111.8	D429 L430 Y436	D429-G432 PolarHBondContact O-N 2.89Å; D429-G432 PolarHBondContact OD2-N 2.91Å; L430-G432 VanDerWaalsContact C-N 3.33Å; G432-Y436 PolarHBondContact O-N 3.47Å
433	F	86.6	Confident	83.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-46.8	173.3	-179.5	-107.2	0	0	0	112.4	F373 I376 M380 V388 V393 I426 D429 L430 T435 Y436 E437	F373-F433 HydrophobicContact CE2-CD2 4.2Å; F373-F433 AromaticContact CE2-CE2 3.7Å; F373-F433 HydrophobicContact CE2-CE2 3.7Å; F373-F433 AromaticContact CE2-CZ 3.92Å; F373-F433 HydrophobicContact CE2-CZ 3.92Å; F373-F433 HydrophobicContact CZ-CE2 4.32Å; F373-F433 HydrophobicContact CZ-CZ 4.15Å; I376-F433 HydrophobicContact CG2-CB 4.14Å; I376-F433 HydrophobicContact CG2-CD1 3.87Å; I376-F433 HydrophobicContact CG2-CG 4.01Å; M380-F433 HydrophobicContact CE-CE1 3.89Å; M380-F433 HydrophobicContact SD-CD1 3.91Å; M380-F433 HydrophobicContact SD-CE1 3.47Å; M380-F433 WeakPolarHBondContact SD-CE1 3.29Å; M380-F433 HydrophobicContact SD-CZ 4.5Å; V388-F433 HydrophobicContact CB-CZ 4.05Å; V388-F433 HydrophobicContact CG1-CZ 4.32Å; V388-F433 HydrophobicContact CG2-CE1 4.16Å; V388-F433 HydrophobicContact CG2-CZ 3.92Å; V393-F433 HydrophobicContact CG2-CE2 4.04Å; V393-F433 HydrophobicContact CG2-CZ 4.36Å; I426-F433 HydrophobicContact CG1-CD2 4.47Å; I426-F433 HydrophobicContact CG2-CD2 3.98Å; D429-F433 PolarHBondContact O-N 3.2Å; L430-F433 PolarHBondContact O-N 3.49Å; F433-T435 VanDerWaalsContact C-N 3.32Å; F433-T435 PolarHBondContact O-N 3.47Å; F433-Y436 WeakPolarHBondContact O-CB 3.48Å; F433-Y436 PolarHBondContact O-N 3.01Å; F433-Y436 VanDerWaalsContact O-N 3.12Å; F433-E437 HydrophobicContact CD1-CG 4.09Å; F433-E437 HydrophobicContact CD2-CG 4.28Å; F433-E437 HydrophobicContact CE1-CG 3.53Å; F433-E437 HydrophobicContact CE2-CG 3.76Å; F433-E437 WeakPolarHBondContact CE2-OE1 3.49Å; F433-E437 HydrophobicContact CG-CG 4.44Å; F433-E437 VanDerWaalsContact CZ-CD 3.46Å; F433-E437 HydrophobicContact CZ-CG 3.36Å; F433-E437 WeakPolarHBondContact CZ-OE1 3.45Å; F433-E437 PolarHBondContact O-N 3.24Å
434	W	84	Confident	81.4	Confident	107 Å²	107	48.6 Å²	48.6	41%	0.405	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-39.6	-179.2	-175.9	-98.2	0	0	0	113.1	Q385 L430 N431 Y436 N438	Q385-W434 HydrophobicContact CG-CZ3 4.23Å; L430-W434 WeakPolarHBondContact O-CB 3.45Å; L430-W434 PolarHBondContact O-N 3.32Å; N431-W434 PolarHBondContact O-N 2.9Å; W434-Y436 VanDerWaalsContact C-N 3.31Å; W434-N438 VanDerWaalsContact CD2-ND2 3.3Å; W434-N438 WeakPolarHBondContact CZ2-ND2 3.44Å; W434-N438 PolarHBondContact NE1-ND2 3.37Å; W434-N438 WeakPolarHBondContact O-CB 3.06Å; W434-N438 PolarHBondContact O-N 2.92Å; W434-N438 VanDerWaalsContact O-N 3.1Å; W434-N438 PolarHBondContact O-ND2 3.08Å
435	T	85.3	Confident	79.4	Confident	69 Å²	69	53.7 Å²	53.7	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-66.8	-37.3	177.1	-59.4	0	0	0	0	110.9	N431 F433 R439 L442	N431-T435 WeakPolarHBondContact O-CB 3.4Å; N431-T435 PolarHBondContact O-N 3.2Å; N431-T435 PolarHBondContact O-OG1 3.4Å; F433-T435 VanDerWaalsContact C-N 3.32Å; F433-T435 PolarHBondContact O-N 3.47Å; T435-R439 PolarHBondContact O-N 2.98Å; T435-R439 VanDerWaalsContact O-N 3.15Å; T435-L442 HydrophobicContact CG2-CD1 4.11Å
436	Y	85.3	Confident	77.5	Confident	18 Å²	18	58.9 Å²	58.9	7%	0.071	31%	0.311	C	S	.	.	H	α-helix	trans	-66.7	-48.3	175.6	177.2	-93.4	0	0	0	112.3	E396 M400 T422 I426 G432 F433 W434 N438 R439	E396-Y436 WeakPolarHBondContact OE2-CE1 3.23Å; E396-Y436 VanDerWaalsContact OE2-CZ 3.26Å; E396-Y436 PolarHBondContact OE2-OH 2.87Å; M400-Y436 HydrophobicContact CE-CE2 4.01Å; M400-Y436 WeakPolarHBondContact CE-OH 3.46Å; M400-Y436 HydrophobicContact SD-CE2 3.82Å; T422-Y436 HydrophobicContact CG2-CD2 3.43Å; T422-Y436 VanDerWaalsContact CG2-CD2 3.43Å; T422-Y436 HydrophobicContact CG2-CE2 3.66Å; T422-Y436 HydrophobicContact CG2-CG 4.49Å; I426-Y436 HydrophobicContact CD1-CD1 3.74Å; I426-Y436 HydrophobicContact CD1-CD2 3.69Å; I426-Y436 HydrophobicContact CD1-CE1 3.85Å; I426-Y436 HydrophobicContact CD1-CE2 3.73Å; I426-Y436 HydrophobicContact CD1-CG 3.66Å; I426-Y436 HydrophobicContact CG1-CD1 4.13Å; I426-Y436 HydrophobicContact CG1-CD2 4.3Å; I426-Y436 HydrophobicContact CG1-CG 3.92Å; G432-Y436 PolarHBondContact O-N 3.47Å; F433-Y436 WeakPolarHBondContact O-CB 3.48Å; F433-Y436 PolarHBondContact O-N 3.01Å; F433-Y436 VanDerWaalsContact O-N 3.12Å; W434-Y436 VanDerWaalsContact C-N 3.31Å; Y436-N438 VanDerWaalsContact C-N 3.27Å; Y436-N438 PolarHBondContact O-N 3.12Å; Y436-R439 VanDerWaalsContact CZ-CZ 3.5Å; Y436-R439 WeakPolarHBondContact O-CB 3.49Å; Y436-R439 VanDerWaalsContact O-CD 3.26Å; Y436-R439 WeakPolarHBondContact O-CD 3.38Å; Y436-R439 WeakPolarHBondContact O-CG 3.43Å; Y436-R439 PolarHBondContact O-N 3.44Å; Y436-R439 VanDerWaalsContact O-N 3.15Å; Y436-R439 PolarHBondContact OH-NH1 2.99Å; Y436-R439 PolarHBondContact OH-NH2 3.32Å
437	E	83.8	Confident	75.5	Confident	71 Å²	71	63.9 Å²	63.9	33%	0.332	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-38.4	178.4	-71	-68	121.6	0	0	111.9	F433 R439	F433-E437 HydrophobicContact CD1-CG 4.09Å; F433-E437 HydrophobicContact CD2-CG 4.28Å; F433-E437 HydrophobicContact CE1-CG 3.53Å; F433-E437 HydrophobicContact CE2-CG 3.76Å; F433-E437 WeakPolarHBondContact CE2-OE1 3.49Å; F433-E437 HydrophobicContact CG-CG 4.44Å; F433-E437 VanDerWaalsContact CZ-CD 3.46Å; F433-E437 HydrophobicContact CZ-CG 3.36Å; F433-E437 WeakPolarHBondContact CZ-OE1 3.45Å; F433-E437 PolarHBondContact O-N 3.24Å; E437-R439 VanDerWaalsContact C-N 3.33Å; E437-R439 PolarHBondContact O-N 3.09Å
438	N	80	Confident	73.5	Confident	47 Å²	47	69.2 Å²	69.2	25%	0.251	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	11.4	-179.7	-65	-70.9	0	0	0	113.9	W434 Y436 E440 V441 L442	W434-N438 VanDerWaalsContact CD2-ND2 3.3Å; W434-N438 WeakPolarHBondContact CZ2-ND2 3.44Å; W434-N438 PolarHBondContact NE1-ND2 3.37Å; W434-N438 WeakPolarHBondContact O-CB 3.06Å; W434-N438 PolarHBondContact O-N 2.92Å; W434-N438 VanDerWaalsContact O-N 3.1Å; W434-N438 PolarHBondContact O-ND2 3.08Å; Y436-N438 VanDerWaalsContact C-N 3.27Å; Y436-N438 PolarHBondContact O-N 3.12Å; N438-E440 PolarHBondContact O-N 3.06Å; N438-E440 VanDerWaalsContact O-N 3.17Å; N438-V441 PolarHBondContact O-N 3.33Å; N438-V441 VanDerWaalsContact O-N 3.09Å; N438-L442 HydrophobicContact CB-CD1 4.46Å; N438-L442 WeakPolarHBondContact O-CG 3.28Å; N438-L442 PolarHBondContact O-N 2.77Å
439	R	78.4	Confident	71.2	Confident	96 Å²	96	71.9 Å²	71.9	36%	0.362	39%	0.393	S	S	.	.	H	α-helix	trans	-55.1	-37.5	-175.9	68.7	-170.6	170.8	-167.2	-16.9	113	E396 T435 Y436 E437 L442 V443	E396-R439 IonicContact OE2-NH2 3.82Å; E396-R439 PolarHBondContact OE2-NH2 2.79Å; T435-R439 PolarHBondContact O-N 2.98Å; T435-R439 VanDerWaalsContact O-N 3.15Å; Y436-R439 VanDerWaalsContact CZ-CZ 3.5Å; Y436-R439 WeakPolarHBondContact O-CB 3.49Å; Y436-R439 VanDerWaalsContact O-CD 3.26Å; Y436-R439 WeakPolarHBondContact O-CD 3.38Å; Y436-R439 WeakPolarHBondContact O-CG 3.43Å; Y436-R439 PolarHBondContact O-N 3.44Å; Y436-R439 VanDerWaalsContact O-N 3.15Å; Y436-R439 PolarHBondContact OH-NH1 2.99Å; Y436-R439 PolarHBondContact OH-NH2 3.32Å; E437-R439 VanDerWaalsContact C-N 3.33Å; E437-R439 PolarHBondContact O-N 3.09Å; R439-L442 PolarHBondContact O-N 3.29Å; R439-V443 WeakPolarHBondContact O-CB 3.39Å; R439-V443 WeakPolarHBondContact O-CG2 3.23Å; R439-V443 PolarHBondContact O-N 2.98Å
440	E	71.2	Confident	69	Low	150 Å²	150	74.6 Å²	74.6	70%	0.701	41%	0.413	S	S	*	.	H	α-helix	trans	-69.7	-35.8	-178.4	-62.9	-171.6	171.8	0	0	112.1	N438 A444	N438-E440 PolarHBondContact O-N 3.06Å; N438-E440 VanDerWaalsContact O-N 3.17Å; E440-A444 WeakPolarHBondContact O-CB 3.44Å; E440-A444 PolarHBondContact O-N 3.31Å; E440-A444 VanDerWaalsContact O-N 3.11Å
441	V	69.1	Low	66.7	Low	86 Å²	86	79.2 Å²	79.2	52%	0.521	44%	0.438	S	S	.	.	H	α-helix	trans	-74.3	-39.1	177.6	-178.8	0	0	0	0	111	N438 A444 N445	N438-V441 PolarHBondContact O-N 3.33Å; N438-V441 VanDerWaalsContact O-N 3.09Å; V441-A444 PolarHBondContact O-N 3.36Å; V441-N445 PolarHBondContact O-N 2.86Å; V441-N445 VanDerWaalsContact O-N 3.1Å
442	L	63	Low	64.5	Low	84 Å²	84	84 Å²	84	44%	0.44	46%	0.46	S	S	.	.	H	α-helix	trans	-64.9	-44.1	176.7	-69.2	169.1	0	0	0	111.3	T435 N438 R439 A444 N445 D446	T435-L442 HydrophobicContact CG2-CD1 4.11Å; N438-L442 HydrophobicContact CB-CD1 4.46Å; N438-L442 WeakPolarHBondContact O-CG 3.28Å; N438-L442 PolarHBondContact O-N 2.77Å; R439-L442 PolarHBondContact O-N 3.29Å; L442-A444 VanDerWaalsContact C-N 3.32Å; L442-A444 PolarHBondContact O-N 3.01Å; L442-N445 PolarHBondContact O-N 2.74Å; L442-D446 PolarHBondContact O-N 3.44Å; L442-D446 VanDerWaalsContact O-N 3.14Å
443	V	63	Low	62.5	Low	101 Å²	101	87.4 Å²	87.4	61%	0.612	49%	0.487	S	S	*	.	H	α-helix	trans	-65.1	-35.3	176.1	172.4	0	0	0	0	111.9	R439 N447	R439-V443 WeakPolarHBondContact O-CB 3.39Å; R439-V443 WeakPolarHBondContact O-CG2 3.23Å; R439-V443 PolarHBondContact O-N 2.98Å; V443-N447 PolarHBondContact O-N 2.87Å
444	A	55.8	Low	60.5	Low	53 Å²	53	95 Å²	95	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-40.1	175.4	0	0	0	0	0	112.5	E440 V441 L442 N447 D448	E440-A444 WeakPolarHBondContact O-CB 3.44Å; E440-A444 PolarHBondContact O-N 3.31Å; E440-A444 VanDerWaalsContact O-N 3.11Å; V441-A444 PolarHBondContact O-N 3.36Å; L442-A444 VanDerWaalsContact C-N 3.32Å; L442-A444 PolarHBondContact O-N 3.01Å; A444-N447 PolarHBondContact O-N 3.39Å; A444-D448 PolarHBondContact O-N 2.9Å
445	N	50.2	Low	58.6	Low	106 Å²	106	96 Å²	96	57%	0.567	55%	0.545	S	S	*	.	H	α-helix	trans	-69.9	-36.7	178.6	-79.2	-12.6	0	0	0	113.3	V441 L442 N447 D448 G449	V441-N445 PolarHBondContact O-N 2.86Å; V441-N445 VanDerWaalsContact O-N 3.1Å; L442-N445 PolarHBondContact O-N 2.74Å; N445-N447 VanDerWaalsContact C-N 3.3Å; N445-N447 PolarHBondContact O-N 3.2Å; N445-D448 PolarHBondContact O-N 3.03Å; N445-G449 PolarHBondContact O-N 3.01Å; N445-G449 VanDerWaalsContact O-N 3.11Å
446	D	52.4	Low	56.6	Low	128 Å²	128	100.2 Å²	100.2	68%	0.684	57%	0.565	S	S	*	*	H	α-helix	trans	-65.5	-35.7	175.9	-81.8	-18.2	0	0	0	111.8	L442 G449 S450	L442-D446 PolarHBondContact O-N 3.44Å; L442-D446 VanDerWaalsContact O-N 3.14Å; D446-G449 PolarHBondContact O-N 3.37Å; D446-S450 PolarHBondContact O-N 3.35Å; D446-S450 PolarHBondContact O-OG 2.92Å
447	N	49.1	Very low	54.6	Low	105 Å²	105	107.4 Å²	107.4	56%	0.561	61%	0.605	S	S	*	*	H	α-helix	trans	-75.1	-30.8	-180	-138.9	30.8	0	0	0	112.7	V443 A444 N445 S450 N451	V443-N447 PolarHBondContact O-N 2.87Å; A444-N447 PolarHBondContact O-N 3.39Å; N445-N447 VanDerWaalsContact C-N 3.3Å; N445-N447 PolarHBondContact O-N 3.2Å; N447-S450 PolarHBondContact O-OG 2.8Å; N447-N451 PolarHBondContact O-ND2 2.92Å
448	D	48.8	Very low	52.5	Low	116 Å²	116	114.2 Å²	114.2	62%	0.62	65%	0.652	S	S	*	*	H	α-helix	trans	-75.2	-28.6	173	-96.8	-7.6	0	0	0	112.6	A444 N445	A444-D448 PolarHBondContact O-N 2.9Å; N445-D448 PolarHBondContact O-N 3.03Å
449	G	43.9	Very low	51.1	Low	56 Å²	56	117.6 Å²	117.6	58%	0.577	67%	0.672	S	S	*	*	H	α-helix	trans	-69.7	-33.2	172.5	0	0	0	0	0	113.7	N445 D446	N445-G449 PolarHBondContact O-N 3.01Å; N445-G449 VanDerWaalsContact O-N 3.11Å; D446-G449 PolarHBondContact O-N 3.37Å
450	S	43.4	Very low	49.7	Very low	70 Å²	70	118.7 Å²	118.7	49%	0.49	69%	0.688	S	S	.	*	H	α-helix	trans	-76.3	-17.7	176.4	50.1	0	0	0	0	114.7	D446 N447	D446-S450 PolarHBondContact O-N 3.35Å; D446-S450 PolarHBondContact O-OG 2.92Å; N447-S450 PolarHBondContact O-OG 2.8Å
451	N	38.2	Very low	48.5	Very low	115 Å²	115	117 Å²	117	62%	0.615	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-0.2	-178.8	-78.3	-28.8	0	0	0	114.3	N447	N447-N451 PolarHBondContact O-ND2 2.92Å
452	M	39.6	Very low	47.3	Very low	173 Å²	173	118.8 Å²	118.8	85%	0.852	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-1.9	177	-89.9	-164.1	164.5	0	0	114.8
453	A	41.5	Very low	46.3	Very low	85 Å²	85	121 Å²	121	70%	0.702	71%	0.713	S	S	*	*	S	Bend	trans	-90.1	-5.5	-177	0	0	0	0	0	115.3
454	D	43.5	Very low	45.2	Very low	158 Å²	158	122.3 Å²	122.3	85%	0.845	72%	0.72	S	S	*	*	S	Bend	trans	-119.3	22.5	-170.4	-95.5	-18.9	0	0	0	115.1
455	V	45.8	Very low	44.5	Very low	128 Å²	128	127.3 Å²	127.3	78%	0.776	74%	0.74	S	S	*	*	S	Bend	trans	-136.7	65.3	175.7	-163.3	0	0	0	0	111.8
456	D	43.1	Very low	44	Very low	159 Å²	159	128.9 Å²	128.9	85%	0.85	75%	0.753	S	S	*	*			trans	-163.7	78.8	145.9	-134.6	7.8	0	0	0	111
457	D	43.4	Very low	43.3	Very low	168 Å²	168	129 Å²	129	90%	0.898	76%	0.759	S	S	*	*			trans	-161.7	86.3	151.4	-123	-5.6	0	0	0	110.1
458	T	39.4	Very low	42.8	Very low	215 Å²	215	131.2 Å²	131.2	100%	1.319	78%	0.777	S	S	*	*			trans	-144.3	0	155.7	45.3	0	0	0	0	110.9

Retrieved 458 of 458 residues in 910.8 ms (Link to these results)

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