A0A077YWN2_TRITR Loading...

WW domain-containing oxidoreductase

AlphaFold DB , UniProt , Accession A0A077YWN2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 399 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.9	Very low	40	Very low	233 Å²	233	135.9 Å²	135.9	100%	1.148	76%	0.756	S	S	*	*				0	95.1	0	-75.8	176.8	-165.3	0	0	105.3	I3	M1-I3 PolarHBondContact O-N 3.5Å; M1-I3 VanDerWaalsContact O-N 3.09Å
2	D	35	Very low	42.3	Very low	170 Å²	170	130 Å²	130	91%	0.909	72%	0.722	S	S	*	*			trans	-71.7	104	174.5	-131.2	-18.4	0	0	0	106.1	G4	D2-G4 PolarHBondContact O-N 3.07Å
3	I	31.5	Very low	45.1	Very low	148 Å²	148	129.3 Å²	129.3	76%	0.759	71%	0.71	S	S	*	*			trans	-76.5	88.1	177.4	-36.5	173.1	0	0	0	103.4	M1 L5	M1-I3 PolarHBondContact O-N 3.5Å; M1-I3 VanDerWaalsContact O-N 3.09Å; I3-L5 PolarHBondContact O-N 2.94Å
4	G	33.6	Very low	47.9	Very low	70 Å²	70	123.1 Å²	123.1	72%	0.722	68%	0.675	S	S	*	*			trans	-60	85.3	179.4	0	0	0	0	0	109.7	D2	D2-G4 PolarHBondContact O-N 3.07Å
5	L	30.6	Very low	50.3	Low	150 Å²	150	117.5 Å²	117.5	79%	0.785	65%	0.646	S	S	*	*			trans	-58	126	161.8	-71.6	166.6	0	0	0	105.3	I3 E7	I3-L5 PolarHBondContact O-N 2.94Å; L5-E7 PolarHBondContact O-N 3.34Å; L5-E7 VanDerWaalsContact O-N 3.16Å
6	P	35.5	Very low	52.5	Low	119 Å²	119	114.4 Å²	114.4	77%	0.773	65%	0.651	S	S	*	*			trans	-54.2	128.1	176.9	21.1	-29.9	0	0	0	107.9	T8	P6-T8 VanDerWaalsContact C-N 3.33Å; P6-T8 PolarHBondContact O-N 3.33Å
7	E	34.1	Very low	54.4	Low	177 Å²	177	109.6 Å²	109.6	83%	0.827	63%	0.632	S	S	*	*			trans	-52.9	97.9	-179.3	-68.3	-177	153.8	0	0	109.3	L5	L5-E7 PolarHBondContact O-N 3.34Å; L5-E7 VanDerWaalsContact O-N 3.16Å
8	T	42.1	Very low	56.3	Low	107 Å²	107	106.1 Å²	106.1	66%	0.656	61%	0.607	S	S	*	*			trans	25.2	126.5	153	49	0	0	0	0	118.2	P6 S10	P6-T8 VanDerWaalsContact C-N 3.33Å; P6-T8 PolarHBondContact O-N 3.33Å; T8-S10 PolarHBondContact O-N 3.35Å; T8-S10 PolarHBondContact O-OG 3.25Å
9	D	50.9	Low	58	Low	146 Å²	146	102.8 Å²	102.8	78%	0.781	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-29.7	-16.6	171.3	-77.1	-23.7	0	0	0	118.5	E11 D12 E13	D9-E11 VanDerWaalsContact C-N 3.3Å; D9-E11 PolarHBondContact O-N 3.41Å; D9-D12 PolarHBondContact O-N 3.28Å; D9-D12 VanDerWaalsContact O-N 3.12Å; D9-E13 PolarHBondContact O-N 2.85Å
10	S	54.8	Low	59.5	Low	58 Å²	58	100.2 Å²	100.2	41%	0.406	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-60.1	-30.3	180	71.9	0	0	0	0	115.1	T8 D12 E13 R44	T8-S10 PolarHBondContact O-N 3.35Å; T8-S10 PolarHBondContact O-OG 3.25Å; S10-D12 PolarHBondContact O-N 2.65Å; S10-E13 PolarHBondContact O-N 2.77Å; S10-R44 PolarHBondContact O-NH1 3.16Å
11	E	58.4	Low	60.8	Low	117 Å²	117	96.8 Å²	96.8	55%	0.547	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-69.5	-26.6	177.3	-76.1	-66	143.7	0	0	111.9	D9 H42 T45	D9-E11 VanDerWaalsContact C-N 3.3Å; D9-E11 PolarHBondContact O-N 3.41Å; E11-H42 PolarHBondContact O-CE1 2.8Å; E11-T45 HydrophobicContact CB-CG2 4.38Å; E11-T45 WeakPolarHBondContact O-CG2 3.35Å
12	D	67.2	Low	63.1	Low	65 Å²	65	85.8 Å²	85.8	35%	0.348	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-90.9	-3	179.3	-84.2	-21.2	0	0	0	113.3	D9 S10 L14 H42 K49	D9-D12 PolarHBondContact O-N 3.28Å; D9-D12 VanDerWaalsContact O-N 3.12Å; S10-D12 PolarHBondContact O-N 2.65Å; D12-L14 PolarHBondContact O-N 2.86Å; D12-H42 PolarHBondContact O-NE2 3.25Å; D12-K49 WeakPolarHBondContact OD1-CE 3.42Å; D12-K49 IonicContact OD1-NZ 2.68Å; D12-K49 PolarHBondContact OD1-NZ 3.48Å; D12-K49 IonicContact OD2-NZ 3.46Å; D12-K49 PolarHBondContact OD2-NZ 3.31Å
13	E	78.4	Confident	65	Low	121 Å²	121	77.8 Å²	77.8	57%	0.565	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-66.3	124.6	173.3	-79.9	-171.5	164.3	0	0	111.5	D9 S10 R44	D9-E13 PolarHBondContact O-N 2.85Å; S10-E13 PolarHBondContact O-N 2.77Å; E13-R44 WeakPolarHBondContact O-CD 3.29Å; E13-R44 PolarHBondContact O-NE 3.27Å; E13-R44 PolarHBondContact O-NH1 3.39Å
14	L	84	Confident	66.9	Low	43 Å²	43	73.4 Å²	73.4	23%	0.225	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-72	137.6	173.7	-73.3	174	0	0	0	111	D12 W18 E20 Y30 H42 P43	D12-L14 PolarHBondContact O-N 2.86Å; L14-W18 HydrophobicContact CB-CB 3.99Å; L14-W18 HydrophobicContact CD1-CB 4.43Å; L14-W18 HydrophobicContact CD2-CB 4.17Å; L14-W18 HydrophobicContact CG-CB 4.45Å; L14-E20 HydrophobicContact CD1-CB 3.82Å; L14-E20 HydrophobicContact CD1-CG 3.81Å; L14-Y30 HydrophobicContact CD1-CD1 4.41Å; L14-Y30 HydrophobicContact CD2-CD1 3.61Å; L14-Y30 HydrophobicContact CD2-CE1 4.02Å; L14-H42 WeakPolarHBondContact CD2-NE2 3.36Å; L14-P43 HydrophobicContact CD2-CG 3.74Å
15	P	84.4	Confident	68.7	Low	38 Å²	38	72.9 Å²	72.9	25%	0.247	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-59.4	155.2	171.1	-17.4	29	0	0	0	111.5	G17 W18 P43 R44	P15-G17 PolarHBondContact O-N 3.29Å; P15-W18 WeakPolarHBondContact O-CB 3.3Å; P15-W18 PolarHBondContact O-N 3.39Å; P15-P43 HydrophobicContact CG-CB 4.25Å; P15-P43 HydrophobicContact CG-CG 4.08Å; P15-R44 HydrophobicContact CG-CG 4.26Å
16	G	85	Confident	70.9	Confident	69 Å²	69	67.6 Å²	67.6	71%	0.711	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	132.5	177.6	0	0	0	0	0	112.7
17	G	85.8	Confident	73	Confident	33 Å²	33	65.4 Å²	65.4	34%	0.34	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-2.6	-177.2	0	0	0	0	0	115.1	P15 H33	P15-G17 PolarHBondContact O-N 3.29Å; G17-H33 WeakPolarHBondContact O-CB 3.41Å; G17-H33 PolarHBondContact O-CD2 3.06Å; G17-H33 VanDerWaalsContact O-CD2 3.31Å; G17-H33 PolarHBondContact O-N 3.48Å
18	W	88.3	Confident	75.2	Confident	46 Å²	46	57.1 Å²	57.1	17%	0.174	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	146	173.1	-68.9	78.4	0	0	0	111.9	L14 P15 V31 N32 Q39 P43	L14-W18 HydrophobicContact CB-CB 3.99Å; L14-W18 HydrophobicContact CD1-CB 4.43Å; L14-W18 HydrophobicContact CD2-CB 4.17Å; L14-W18 HydrophobicContact CG-CB 4.45Å; P15-W18 WeakPolarHBondContact O-CB 3.3Å; P15-W18 PolarHBondContact O-N 3.39Å; W18-V31 CarbonylContact C-O 3.5Å; W18-V31 VanDerWaalsContact CA-O 3.24Å; W18-V31 WeakPolarHBondContact CA-O 3.25Å; W18-N32 HydrophobicContact CD2-CB 3.86Å; W18-N32 HydrophobicContact CE3-CB 3.84Å; W18-N32 HydrophobicContact CH2-CB 3.69Å; W18-N32 HydrophobicContact CZ2-CB 3.7Å; W18-N32 VanDerWaalsContact CZ2-ND2 3.3Å; W18-N32 WeakPolarHBondContact CZ2-ND2 3.46Å; W18-N32 HydrophobicContact CZ3-CB 3.75Å; W18-Q39 VanDerWaalsContact CH2-CD 3.41Å; W18-Q39 HydrophobicContact CH2-CG 4.08Å; W18-Q39 HydrophobicContact CZ3-CG 3.78Å; W18-P43 HydrophobicContact CD2-CB 4.17Å; W18-P43 HydrophobicContact CD2-CG 3.93Å; W18-P43 HydrophobicContact CE3-CB 4.39Å; W18-P43 HydrophobicContact CE3-CG 4.09Å; W18-P43 HydrophobicContact CG-CG 4.28Å; W18-P43 HydrophobicContact CH2-CB 4.23Å; W18-P43 HydrophobicContact CZ2-CB 3.99Å; W18-P43 HydrophobicContact CZ3-CB 4.43Å
19	E	87.9	Confident	77.2	Confident	43 Å²	43	52.4 Å²	52.4	20%	0.201	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.1	174.9	-172.3	-171.8	157.3	0	0	109.4	R21 Y30 V31 H33	E19-R21 VanDerWaalsContact CD-NH2 3.31Å; E19-R21 HydrophobicContact CG-CG 4.34Å; E19-R21 IonicContact OE1-CZ 3.47Å; E19-R21 IonicContact OE1-NE 3.42Å; E19-R21 PolarHBondContact OE1-NE 3.38Å; E19-R21 IonicContact OE1-NH2 2.77Å; E19-R21 PolarHBondContact OE1-NH2 3.33Å; E19-R21 VanDerWaalsContact OE1-NH2 3.09Å; E19-R21 IonicContact OE2-CZ 2.65Å; E19-R21 IonicContact OE2-NE 3.09Å; E19-R21 PolarHBondContact OE2-NE 3.16Å; E19-R21 IonicContact OE2-NH2 3.37Å; E19-R21 PolarHBondContact OE2-NH2 3.41Å; E19-Y30 WeakPolarHBondContact O-CA 3.4Å; E19-V31 PolarHBondContact N-O 3.14Å; E19-V31 PolarHBondContact O-N 3.41Å; E19-H33 WeakPolarHBondContact CB-NE2 3.4Å; E19-H33 IonicContact OE2-CE1 3.76Å; E19-H33 PolarHBondContact OE2-CE1 3.12Å; E19-H33 VanDerWaalsContact OE2-CE1 3.27Å; E19-H33 IonicContact OE2-NE2 2.71Å; E19-H33 PolarHBondContact OE2-NE2 3.31Å
20	E	87.9	Confident	79	Confident	51 Å²	51	45.5 Å²	45.5	24%	0.238	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	137.8	170.9	49.5	170.8	-149.1	0	0	111.4	L14 Y30 L86	L14-E20 HydrophobicContact CD1-CB 3.82Å; L14-E20 HydrophobicContact CD1-CG 3.81Å; E20-Y30 HydrophobicContact CB-CD1 3.97Å; E20-Y30 HydrophobicContact CB-CE1 3.98Å; E20-L86 HydrophobicContact CB-CD1 4.39Å; E20-L86 HydrophobicContact CG-CD1 3.96Å; E20-L86 WeakPolarHBondContact OE1-CB 3.24Å; E20-L86 WeakPolarHBondContact OE1-CD1 3.4Å
21	R	87.1	Confident	80.4	Confident	29 Å²	29	43.5 Å²	43.5	11%	0.109	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	162.1	179.1	-67.5	-174.3	-179.8	177.2	2.7	110.1	E19 V28 Y29 F81	E19-R21 VanDerWaalsContact CD-NH2 3.31Å; E19-R21 HydrophobicContact CG-CG 4.34Å; E19-R21 IonicContact OE1-CZ 3.47Å; E19-R21 IonicContact OE1-NE 3.42Å; E19-R21 PolarHBondContact OE1-NE 3.38Å; E19-R21 IonicContact OE1-NH2 2.77Å; E19-R21 PolarHBondContact OE1-NH2 3.33Å; E19-R21 VanDerWaalsContact OE1-NH2 3.09Å; E19-R21 IonicContact OE2-CZ 2.65Å; E19-R21 IonicContact OE2-NE 3.09Å; E19-R21 PolarHBondContact OE2-NE 3.16Å; E19-R21 IonicContact OE2-NH2 3.37Å; E19-R21 PolarHBondContact OE2-NH2 3.41Å; R21-V28 WeakPolarHBondContact O-CA 3.45Å; R21-Y29 HydrophobicContact CB-CD1 4.16Å; R21-Y29 HydrophobicContact CB-CD2 4.47Å; R21-Y29 HydrophobicContact CB-CE1 3.43Å; R21-Y29 VanDerWaalsContact CB-CE1 3.43Å; R21-Y29 HydrophobicContact CB-CE2 3.9Å; R21-Y29 WeakPolarHBondContact CB-OH 3.25Å; R21-Y29 WeakPolarHBondContact CD-OH 3.37Å; R21-Y29 PolarHBondContact N-O 2.64Å; R21-Y29 VanDerWaalsContact O-CD1 3.29Å; R21-Y29 WeakPolarHBondContact O-CD1 3.24Å; R21-Y29 PolarHBondContact O-N 2.71Å; R21-F81 HydrophobicContact CG-CB 4.27Å
22	T	81.8	Confident	81.7	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152.4	174.3	61.4	0	0	0	0	112.2	R27 V28 V51 F71 D83 L86	T22-R27 CarbonylContact C-O 3.56Å; T22-R27 VanDerWaalsContact CA-O 3.3Å; T22-R27 WeakPolarHBondContact CA-O 3.42Å; T22-V28 HydrophobicContact CG2-CG2 4.23Å; T22-V51 HydrophobicContact CG2-CB 4.49Å; T22-V51 HydrophobicContact CG2-CG2 3.65Å; T22-F71 WeakPolarHBondContact OG1-CE2 3.37Å; T22-F71 WeakPolarHBondContact OG1-CZ 3.41Å; T22-D83 HydrophobicContact CG2-CB 3.56Å; T22-D83 WeakPolarHBondContact CG2-OD2 3.47Å; T22-D83 VanDerWaalsContact OG1-CB 3.24Å; T22-D83 WeakPolarHBondContact OG1-CB 3.36Å; T22-D83 PolarHBondContact OG1-OD2 2.71Å; T22-L86 HydrophobicContact CG2-CD1 4.39Å; T22-L86 HydrophobicContact CG2-CD2 3.69Å; T22-L86 HydrophobicContact CG2-CG 4.05Å
23	T	76	Confident	82.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	22%	0.216	C	C	.	.			trans	-85.9	171.5	172	61.7	0	0	0	0	111.4	D25 D26 R27 Y29 W40 H116	T23-D25 WeakPolarHBondContact CB-OD1 3.18Å; T23-D25 PolarHBondContact O-N 2.86Å; T23-D25 PolarHBondContact OG1-N 3.46Å; T23-D25 PolarHBondContact OG1-OD1 2.84Å; T23-D26 PolarHBondContact O-N 3.29Å; T23-D26 PolarHBondContact OG1-N 2.75Å; T23-R27 HydrophobicContact CG2-CB 4.39Å; T23-R27 PolarHBondContact N-O 3.16Å; T23-R27 WeakPolarHBondContact OG1-CB 3.48Å; T23-R27 PolarHBondContact OG1-N 3.16Å; T23-R27 PolarHBondContact OG1-O 3.09Å; T23-Y29 HydrophobicContact CG2-CD1 3.84Å; T23-Y29 HydrophobicContact CG2-CE1 4.12Å; T23-W40 HydrophobicContact CG2-CH2 3.62Å; T23-W40 HydrophobicContact CG2-CZ3 3.9Å; T23-H116 VanDerWaalsContact CG2-CE1 3.46Å; T23-H116 WeakPolarHBondContact CG2-CE1 3.42Å; T23-H116 WeakPolarHBondContact CG2-ND1 3.24Å
24	L	71.4	Confident	82.6	Confident	56 Å²	56	40.3 Å²	40.3	29%	0.293	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.4	173.3	-61.3	174	0	0	0	113.2	D26 R61 V63 A69	L24-D26 VanDerWaalsContact C-N 3.34Å; L24-R61 HydrophobicContact CD2-CG 4.38Å; L24-R61 PolarHBondContact O-NH1 3.29Å; L24-R61 PolarHBondContact O-NH2 3.44Å; L24-R61 VanDerWaalsContact O-NH2 3.14Å; L24-V63 HydrophobicContact CD1-CG2 4.05Å; L24-V63 HydrophobicContact CD2-CG2 3.74Å; L24-A69 HydrophobicContact CD2-CB 3.97Å
25	D	71.9	Confident	82.3	Confident	59 Å²	59	45 Å²	45	32%	0.316	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	20.3	172.1	64.4	-38.5	0	0	0	113.4	T23 R27 R104	T23-D25 WeakPolarHBondContact CB-OD1 3.18Å; T23-D25 PolarHBondContact O-N 2.86Å; T23-D25 PolarHBondContact OG1-N 3.46Å; T23-D25 PolarHBondContact OG1-OD1 2.84Å; D25-R27 PolarHBondContact O-N 2.94Å; D25-R27 WeakPolarHBondContact OD2-CD 3.37Å; D25-R27 IonicContact OD2-CZ 3.18Å; D25-R27 IonicContact OD2-NE 3.27Å; D25-R27 PolarHBondContact OD2-NE 3.29Å; D25-R104 IonicContact OD2-NE 3.91Å; D25-R104 PolarHBondContact OD2-NE 3.48Å; D25-R104 IonicContact OD2-NH2 2.8Å
26	D	75.8	Confident	82	Confident	40 Å²	40	52.3 Å²	52.3	21%	0.214	27%	0.267	C	S	.	.			trans	62.3	20.7	172.8	-51.7	-46.6	0	0	0	115.1	T23 L24 I50 V51 R61 R85	T23-D26 PolarHBondContact O-N 3.29Å; T23-D26 PolarHBondContact OG1-N 2.75Å; L24-D26 VanDerWaalsContact C-N 3.34Å; D26-I50 WeakPolarHBondContact O-CG1 3.49Å; D26-V51 HydrophobicContact CB-CB 4.21Å; D26-V51 VanDerWaalsContact CB-O 3.23Å; D26-V51 WeakPolarHBondContact CB-O 3.45Å; D26-V51 PolarHBondContact O-N 2.94Å; D26-R61 IonicContact OD1-CZ 3.64Å; D26-R61 IonicContact OD1-NH1 3.11Å; D26-R61 PolarHBondContact OD1-NH1 2.95Å; D26-R85 IonicContact OD1-CZ 3.96Å; D26-R85 IonicContact OD1-NH1 2.69Å; D26-R85 PolarHBondContact OD1-NH1 3.11Å; D26-R85 VanDerWaalsContact OD1-NH1 3.13Å; D26-R85 IonicContact OD1-NH2 3.91Å; D26-R85 PolarHBondContact OD1-NH2 3.27Å; D26-R85 IonicContact OD2-NH1 3.03Å
27	R	79.4	Confident	81.6	Confident	73 Å²	73	49.5 Å²	49.5	28%	0.275	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-87.4	138.4	174.1	-61.9	-177.3	-178.9	-160.2	-4.2	110.4	T22 T23 D25 W40	T22-R27 CarbonylContact C-O 3.56Å; T22-R27 VanDerWaalsContact CA-O 3.3Å; T22-R27 WeakPolarHBondContact CA-O 3.42Å; T23-R27 HydrophobicContact CG2-CB 4.39Å; T23-R27 PolarHBondContact N-O 3.16Å; T23-R27 WeakPolarHBondContact OG1-CB 3.48Å; T23-R27 PolarHBondContact OG1-N 3.16Å; T23-R27 PolarHBondContact OG1-O 3.09Å; D25-R27 PolarHBondContact O-N 2.94Å; D25-R27 WeakPolarHBondContact OD2-CD 3.37Å; D25-R27 IonicContact OD2-CZ 3.18Å; D25-R27 IonicContact OD2-NE 3.27Å; D25-R27 PolarHBondContact OD2-NE 3.29Å; R27-W40 HydrophobicContact CB-CE3 4.43Å; R27-W40 HydrophobicContact CB-CZ3 3.69Å
28	V	81.2	Confident	81.3	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.5	177.2	-173.1	0	0	0	0	110	R21 T22 Y30 K49 V51 L86 A89	R21-V28 WeakPolarHBondContact O-CA 3.45Å; T22-V28 HydrophobicContact CG2-CG2 4.23Å; V28-Y30 HydrophobicContact CG1-CE1 3.95Å; V28-Y30 HydrophobicContact CG1-CE2 4.3Å; V28-K49 HydrophobicContact CB-CB 3.84Å; V28-K49 WeakPolarHBondContact CB-O 3.41Å; V28-K49 HydrophobicContact CG1-CB 4.4Å; V28-K49 HydrophobicContact CG2-CB 3.65Å; V28-K49 PolarHBondContact N-O 2.89Å; V28-K49 VanDerWaalsContact N-O 3.1Å; V28-V51 HydrophobicContact CG2-CG2 3.82Å; V28-L86 HydrophobicContact CB-CD2 4.37Å; V28-L86 HydrophobicContact CG1-CD2 3.83Å; V28-L86 HydrophobicContact CG2-CD2 3.61Å; V28-A89 HydrophobicContact CG2-CB 4.24Å
29	Y	84.2	Confident	81	Confident	9 Å²	9	50.1 Å²	50.1	4%	0.035	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	160.1	170.6	70.4	-80.2	0	0	0	109.8	R21 T23 V31 V38 Q39 H116	R21-Y29 HydrophobicContact CB-CD1 4.16Å; R21-Y29 HydrophobicContact CB-CD2 4.47Å; R21-Y29 HydrophobicContact CB-CE1 3.43Å; R21-Y29 VanDerWaalsContact CB-CE1 3.43Å; R21-Y29 HydrophobicContact CB-CE2 3.9Å; R21-Y29 WeakPolarHBondContact CB-OH 3.25Å; R21-Y29 WeakPolarHBondContact CD-OH 3.37Å; R21-Y29 PolarHBondContact N-O 2.64Å; R21-Y29 VanDerWaalsContact O-CD1 3.29Å; R21-Y29 WeakPolarHBondContact O-CD1 3.24Å; R21-Y29 PolarHBondContact O-N 2.71Å; T23-Y29 HydrophobicContact CG2-CD1 3.84Å; T23-Y29 HydrophobicContact CG2-CE1 4.12Å; Y29-V31 HydrophobicContact CD2-CG2 3.91Å; Y29-V31 HydrophobicContact CE2-CG2 3.48Å; Y29-V31 VanDerWaalsContact CE2-CG2 3.48Å; Y29-V38 HydrophobicContact CD2-CG1 3.32Å; Y29-V38 HydrophobicContact CE2-CG1 3.9Å; Y29-V38 HydrophobicContact CG-CG1 4.3Å; Y29-Q39 WeakPolarHBondContact CA-O 3.5Å; Y29-H116 AromaticContact CD1-CE1 3.95Å; Y29-H116 AromaticContact CE1-CE1 3.14Å; Y29-H116 WeakPolarHBondContact CE1-CE1 3.45Å; Y29-H116 AromaticContact CE1-ND1 3.97Å; Y29-H116 AromaticContact CE1-NE2 3.89Å; Y29-H116 AromaticContact CZ-CE1 3.37Å; Y29-H116 AromaticContact CZ-NE2 3.69Å; Y29-H116 PolarHBondContact OH-CE1 3.14Å; Y29-H116 PolarHBondContact OH-NE2 2.85Å
30	Y	87.2	Confident	80.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	-171.8	-52.6	-80.8	0	0	0	109.3	L14 E19 E20 V28 V38 Q39 M41 H42	L14-Y30 HydrophobicContact CD1-CD1 4.41Å; L14-Y30 HydrophobicContact CD2-CD1 3.61Å; L14-Y30 HydrophobicContact CD2-CE1 4.02Å; E19-Y30 WeakPolarHBondContact O-CA 3.4Å; E20-Y30 HydrophobicContact CB-CD1 3.97Å; E20-Y30 HydrophobicContact CB-CE1 3.98Å; V28-Y30 HydrophobicContact CG1-CE1 3.95Å; V28-Y30 HydrophobicContact CG1-CE2 4.3Å; Y30-V38 WeakPolarHBondContact O-CA 3.43Å; Y30-Q39 PolarHBondContact N-O 3.36Å; Y30-Q39 PolarHBondContact O-N 2.79Å; Y30-M41 VanDerWaalsContact CD2-C 3.47Å; Y30-M41 VanDerWaalsContact CD2-O 3.29Å; Y30-M41 WeakPolarHBondContact CD2-O 3.16Å; Y30-H42 HydrophobicContact CE1-CB 4.43Å; Y30-H42 AromaticContact CE1-CD2 3.49Å; Y30-H42 VanDerWaalsContact CE1-CD2 3.49Å; Y30-H42 WeakPolarHBondContact CE1-CD2 3.29Å; Y30-H42 HydrophobicContact CE2-CB 3.87Å; Y30-H42 AromaticContact CZ-CD2 3.65Å
31	V	84.1	Confident	80.4	Confident	17 Å²	17	52 Å²	52	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126	179.9	-177.7	0	0	0	0	108.2	W18 E19 Y29 V38	W18-V31 CarbonylContact C-O 3.5Å; W18-V31 VanDerWaalsContact CA-O 3.24Å; W18-V31 WeakPolarHBondContact CA-O 3.25Å; E19-V31 PolarHBondContact N-O 3.14Å; E19-V31 PolarHBondContact O-N 3.41Å; Y29-V31 HydrophobicContact CD2-CG2 3.91Å; Y29-V31 HydrophobicContact CE2-CG2 3.48Å; Y29-V31 VanDerWaalsContact CE2-CG2 3.48Å; V31-V38 HydrophobicContact CG2-CG1 4.33Å; V31-V38 HydrophobicContact CG2-CG2 4.31Å
32	N	86.6	Confident	80.2	Confident	5 Å²	5	50.6 Å²	50.6	3%	0.027	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	109.7	170.7	-177	-16.2	0	0	0	108.9	W18 L34 E35 R36 S37	W18-N32 HydrophobicContact CD2-CB 3.86Å; W18-N32 HydrophobicContact CE3-CB 3.84Å; W18-N32 HydrophobicContact CH2-CB 3.69Å; W18-N32 HydrophobicContact CZ2-CB 3.7Å; W18-N32 VanDerWaalsContact CZ2-ND2 3.3Å; W18-N32 WeakPolarHBondContact CZ2-ND2 3.46Å; W18-N32 HydrophobicContact CZ3-CB 3.75Å; N32-L34 VanDerWaalsContact C-N 3.32Å; N32-L34 PolarHBondContact O-N 2.65Å; N32-L34 WeakPolarHBondContact OD1-CB 3.47Å; N32-L34 PolarHBondContact OD1-N 3.11Å; N32-E35 HydrophobicContact CB-CB 4.47Å; N32-E35 VanDerWaalsContact ND2-CD 3.31Å; N32-E35 WeakPolarHBondContact ND2-CG 3.45Å; N32-E35 PolarHBondContact ND2-OE2 3.2Å; N32-E35 PolarHBondContact OD1-N 3.08Å; N32-E35 VanDerWaalsContact OD1-N 3.16Å; N32-R36 WeakPolarHBondContact O-CA 3.32Å; N32-R36 PolarHBondContact O-N 3.12Å; N32-S37 WeakPolarHBondContact CB-OG 3.34Å; N32-S37 PolarHBondContact N-O 2.95Å; N32-S37 PolarHBondContact O-N 3.42Å; N32-S37 VanDerWaalsContact O-N 3.16Å
33	H	84	Confident	80.2	Confident	94 Å²	94	51.3 Å²	51.3	44%	0.435	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-23.5	-179.5	-67.1	-71.4	0	0	0	113.4	G17 E19	G17-H33 WeakPolarHBondContact O-CB 3.41Å; G17-H33 PolarHBondContact O-CD2 3.06Å; G17-H33 VanDerWaalsContact O-CD2 3.31Å; G17-H33 PolarHBondContact O-N 3.48Å; E19-H33 WeakPolarHBondContact CB-NE2 3.4Å; E19-H33 IonicContact OE2-CE1 3.76Å; E19-H33 PolarHBondContact OE2-CE1 3.12Å; E19-H33 VanDerWaalsContact OE2-CE1 3.27Å; E19-H33 IonicContact OE2-NE2 2.71Å; E19-H33 PolarHBondContact OE2-NE2 3.31Å
34	L	80.9	Confident	80.4	Confident	136 Å²	136	57 Å²	57	71%	0.712	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-46.7	179	-59.9	172.9	0	0	0	111	N32	N32-L34 VanDerWaalsContact C-N 3.32Å; N32-L34 PolarHBondContact O-N 2.65Å; N32-L34 WeakPolarHBondContact OD1-CB 3.47Å; N32-L34 PolarHBondContact OD1-N 3.11Å
35	E	78.2	Confident	80.8	Confident	143 Å²	143	55.9 Å²	55.9	67%	0.668	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-10.2	179.5	-67	179.4	177	0	0	113.4	N32 S37	N32-E35 HydrophobicContact CB-CB 4.47Å; N32-E35 VanDerWaalsContact ND2-CD 3.31Å; N32-E35 WeakPolarHBondContact ND2-CG 3.45Å; N32-E35 PolarHBondContact ND2-OE2 3.2Å; N32-E35 PolarHBondContact OD1-N 3.08Å; N32-E35 VanDerWaalsContact OD1-N 3.16Å; E35-S37 PolarHBondContact O-N 3.46Å; E35-S37 PolarHBondContact OE2-OG 3Å
36	R	76.3	Confident	81.1	Confident	191 Å²	191	59.2 Å²	59.2	72%	0.721	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	43	-171.8	-55.4	-179.9	177.6	-177.7	-0.9	111.9	N32	N32-R36 WeakPolarHBondContact O-CA 3.32Å; N32-R36 PolarHBondContact O-N 3.12Å
37	S	76.9	Confident	81.2	Confident	10 Å²	10	63.9 Å²	63.9	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	158.8	-178.3	62.1	0	0	0	0	111.1	N32 E35 N119	N32-S37 WeakPolarHBondContact CB-OG 3.34Å; N32-S37 PolarHBondContact N-O 2.95Å; N32-S37 PolarHBondContact O-N 3.42Å; N32-S37 VanDerWaalsContact O-N 3.16Å; E35-S37 PolarHBondContact O-N 3.46Å; E35-S37 PolarHBondContact OE2-OG 3Å; S37-N119 WeakPolarHBondContact CB-ND2 3.03Å
38	V	81.1	Confident	81.3	Confident	36 Å²	36	64.1 Å²	64.1	22%	0.218	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.3	177.8	-169.2	0	0	0	0	109.6	Y29 Y30 V31 N119	Y29-V38 HydrophobicContact CD2-CG1 3.32Å; Y29-V38 HydrophobicContact CE2-CG1 3.9Å; Y29-V38 HydrophobicContact CG-CG1 4.3Å; Y30-V38 WeakPolarHBondContact O-CA 3.43Å; V31-V38 HydrophobicContact CG2-CG1 4.33Å; V31-V38 HydrophobicContact CG2-CG2 4.31Å; V38-N119 WeakPolarHBondContact O-CB 3.5Å
39	Q	81.1	Confident	81.2	Confident	55 Å²	55	64.8 Å²	64.8	26%	0.257	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.9	178	68.6	-174.1	34.2	0	0	112.6	W18 Y29 Y30 M41	W18-Q39 VanDerWaalsContact CH2-CD 3.41Å; W18-Q39 HydrophobicContact CH2-CG 4.08Å; W18-Q39 HydrophobicContact CZ3-CG 3.78Å; Y29-Q39 WeakPolarHBondContact CA-O 3.5Å; Y30-Q39 PolarHBondContact N-O 3.36Å; Y30-Q39 PolarHBondContact O-N 2.79Å; Q39-M41 WeakPolarHBondContact CG-O 3.37Å; Q39-M41 PolarHBondContact NE2-O 3.15Å
40	W	80.7	Confident	80.9	Confident	37 Å²	37	66.5 Å²	66.5	14%	0.14	30%	0.298	C	S	.	.	S	Bend	trans	-94.2	-15.9	-178.7	-64.8	93.7	0	0	0	114.2	T23 R27 H116 G117	T23-W40 HydrophobicContact CG2-CH2 3.62Å; T23-W40 HydrophobicContact CG2-CZ3 3.9Å; R27-W40 HydrophobicContact CB-CE3 4.43Å; R27-W40 HydrophobicContact CB-CZ3 3.69Å; W40-H116 WeakPolarHBondContact CZ2-O 3.38Å; W40-G117 PolarHBondContact NE1-O 3.38Å
41	M	82.2	Confident	80.5	Confident	97 Å²	97	66.7 Å²	66.7	48%	0.478	30%	0.299	S	S	.	.	S	Bend	trans	-97.9	137.3	-179.4	-68	-179	-68.3	0	0	109	Y30 Q39 R48	Y30-M41 VanDerWaalsContact CD2-C 3.47Å; Y30-M41 VanDerWaalsContact CD2-O 3.29Å; Y30-M41 WeakPolarHBondContact CD2-O 3.16Å; Q39-M41 WeakPolarHBondContact CG-O 3.37Å; Q39-M41 PolarHBondContact NE2-O 3.15Å; M41-R48 HydrophobicContact CG-CG 4.12Å
42	H	82.4	Confident	79.9	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.315	C	S	.	.			trans	-58.8	132.8	174.5	-173.5	-102.6	0	0	0	109.3	E11 D12 L14 Y30 R44 T45 K46 R47	E11-H42 PolarHBondContact O-CE1 2.8Å; D12-H42 PolarHBondContact O-NE2 3.25Å; L14-H42 WeakPolarHBondContact CD2-NE2 3.36Å; Y30-H42 HydrophobicContact CE1-CB 4.43Å; Y30-H42 AromaticContact CE1-CD2 3.49Å; Y30-H42 VanDerWaalsContact CE1-CD2 3.49Å; Y30-H42 WeakPolarHBondContact CE1-CD2 3.29Å; Y30-H42 HydrophobicContact CE2-CB 3.87Å; Y30-H42 AromaticContact CZ-CD2 3.65Å; H42-R44 PolarHBondContact ND1-N 2.77Å; H42-R44 PolarHBondContact O-N 2.75Å; H42-T45 VanDerWaalsContact CB-OG1 3.28Å; H42-T45 WeakPolarHBondContact CB-OG1 3.48Å; H42-T45 PolarHBondContact ND1-N 3.09Å; H42-T45 PolarHBondContact ND1-OG1 3.42Å; H42-K46 VanDerWaalsContact O-CA 3.25Å; H42-K46 WeakPolarHBondContact O-CA 3.43Å; H42-K46 PolarHBondContact O-N 2.95Å; H42-R47 PolarHBondContact N-O 3.36Å
43	P	82.2	Confident	79.4	Confident	16 Å²	16	71.3 Å²	71.3	10%	0.104	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.9	-172	20.7	-32.9	0	0	0	113.6	L14 P15 W18 K46	L14-P43 HydrophobicContact CD2-CG 3.74Å; P15-P43 HydrophobicContact CG-CB 4.25Å; P15-P43 HydrophobicContact CG-CG 4.08Å; W18-P43 HydrophobicContact CD2-CB 4.17Å; W18-P43 HydrophobicContact CD2-CG 3.93Å; W18-P43 HydrophobicContact CE3-CB 4.39Å; W18-P43 HydrophobicContact CE3-CG 4.09Å; W18-P43 HydrophobicContact CG-CG 4.28Å; W18-P43 HydrophobicContact CH2-CB 4.23Å; W18-P43 HydrophobicContact CZ2-CB 3.99Å; W18-P43 HydrophobicContact CZ3-CB 4.43Å; P43-K46 WeakPolarHBondContact O-CE 3.28Å; P43-K46 PolarHBondContact O-NZ 3.1Å
44	R	81	Confident	79.1	Confident	121 Å²	121	72 Å²	72	46%	0.457	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-71	176.4	-67.9	-175.2	174.3	170.5	0.9	112.4	S10 E13 P15 H42 K46	S10-R44 PolarHBondContact O-NH1 3.16Å; E13-R44 WeakPolarHBondContact O-CD 3.29Å; E13-R44 PolarHBondContact O-NE 3.27Å; E13-R44 PolarHBondContact O-NH1 3.39Å; P15-R44 HydrophobicContact CG-CG 4.26Å; H42-R44 PolarHBondContact ND1-N 2.77Å; H42-R44 PolarHBondContact O-N 2.75Å; R44-K46 PolarHBondContact O-N 3.15Å; R44-K46 VanDerWaalsContact O-N 3.14Å
45	T	80	Confident	79.3	Confident	32 Å²	32	67.3 Å²	67.3	20%	0.196	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-16.5	-173.7	66.5	0	0	0	0	114.9	E11 H42 R47	E11-T45 HydrophobicContact CB-CG2 4.38Å; E11-T45 WeakPolarHBondContact O-CG2 3.35Å; H42-T45 VanDerWaalsContact CB-OG1 3.28Å; H42-T45 WeakPolarHBondContact CB-OG1 3.48Å; H42-T45 PolarHBondContact ND1-N 3.09Å; H42-T45 PolarHBondContact ND1-OG1 3.42Å; T45-R47 PolarHBondContact O-N 3.1Å; T45-R47 PolarHBondContact OG1-N 3.24Å
46	K	78.8	Confident	79.6	Confident	129 Å²	129	63.3 Å²	63.3	56%	0.561	32%	0.318	S	S	*	.			trans	58.2	12.6	-173.7	-53.8	-57.9	-176.7	-163.6	0	114.6	H42 P43 R44	H42-K46 VanDerWaalsContact O-CA 3.25Å; H42-K46 WeakPolarHBondContact O-CA 3.43Å; H42-K46 PolarHBondContact O-N 2.95Å; P43-K46 WeakPolarHBondContact O-CE 3.28Å; P43-K46 PolarHBondContact O-NZ 3.1Å; R44-K46 PolarHBondContact O-N 3.15Å; R44-K46 VanDerWaalsContact O-N 3.14Å
47	R	77.2	Confident	80	Confident	138 Å²	138	59.8 Å²	59.8	52%	0.521	32%	0.323	S	S	.	.			trans	-91.1	157.3	178.8	-64.4	-179.7	-175.5	174.3	5.8	111.4	H42 T45 E91	H42-R47 PolarHBondContact N-O 3.36Å; T45-R47 PolarHBondContact O-N 3.1Å; T45-R47 PolarHBondContact OG1-N 3.24Å; R47-E91 WeakPolarHBondContact CD-OE1 3.23Å; R47-E91 VanDerWaalsContact CD-OE2 3.27Å; R47-E91 WeakPolarHBondContact CD-OE2 3.24Å; R47-E91 IonicContact CZ-OE1 3.64Å; R47-E91 IonicContact CZ-OE2 3.75Å; R47-E91 IonicContact NE-OE1 2.94Å; R47-E91 IonicContact NE-OE2 2.8Å; R47-E91 VanDerWaalsContact NH1-CD 3.31Å; R47-E91 IonicContact NH1-OE1 3.45Å; R47-E91 PolarHBondContact NH1-OE1 2.69Å; R47-E91 IonicContact NH1-OE2 3.39Å; R47-E91 PolarHBondContact NH1-OE2 2.68Å
48	R	81.3	Confident	80.6	Confident	79 Å²	79	61.5 Å²	61.5	30%	0.298	33%	0.333	S	S	.	.			trans	-102.6	143.2	176.5	-58.7	-179	81.2	176.9	8.7	108.9	M41 E91 Q92	M41-R48 HydrophobicContact CG-CG 4.12Å; R48-E91 CarbonylContact O-C 3.52Å; R48-E91 WeakPolarHBondContact O-CA 3.42Å; R48-Q92 HydrophobicContact CB-CB 4.35Å; R48-Q92 PolarHBondContact O-N 2.71Å
49	K	79.4	Confident	81	Confident	15 Å²	15	62.3 Å²	62.3	7%	0.065	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.8	178	-64.1	-175.1	-175.7	-176.8	0	111.3	D12 V28 A89 L90	D12-K49 WeakPolarHBondContact OD1-CE 3.42Å; D12-K49 IonicContact OD1-NZ 2.68Å; D12-K49 PolarHBondContact OD1-NZ 3.48Å; D12-K49 IonicContact OD2-NZ 3.46Å; D12-K49 PolarHBondContact OD2-NZ 3.31Å; V28-K49 HydrophobicContact CB-CB 3.84Å; V28-K49 WeakPolarHBondContact CB-O 3.41Å; V28-K49 HydrophobicContact CG1-CB 4.4Å; V28-K49 HydrophobicContact CG2-CB 3.65Å; V28-K49 PolarHBondContact N-O 2.89Å; V28-K49 VanDerWaalsContact N-O 3.1Å; K49-A89 HydrophobicContact CB-CB 4.12Å; K49-A89 HydrophobicContact CD-CB 4.21Å; K49-L90 CarbonylContact C-O 3.57Å; K49-L90 VanDerWaalsContact CA-O 3.28Å; K49-L90 WeakPolarHBondContact CA-O 3.36Å
50	I	78.4	Confident	81.4	Confident	45 Å²	45	66.5 Å²	66.5	23%	0.231	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.5	170.5	-167.9	170.2	0	0	0	108.6	D26 A89 L90	D26-I50 WeakPolarHBondContact O-CG1 3.49Å; I50-A89 CarbonylContact O-C 3.58Å; I50-A89 WeakPolarHBondContact O-CA 3.3Å; I50-L90 HydrophobicContact CG2-CB 4.39Å; I50-L90 PolarHBondContact N-O 2.8Å; I50-L90 PolarHBondContact O-N 2.79Å
51	V	77.8	Confident	81.8	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.024	35%	0.354	C	S	.	.			trans	-86.5	126.9	173.9	173.9	0	0	0	0	108.3	T22 D26 V28 R85 L86 A89	T22-V51 HydrophobicContact CG2-CB 4.49Å; T22-V51 HydrophobicContact CG2-CG2 3.65Å; D26-V51 HydrophobicContact CB-CB 4.21Å; D26-V51 VanDerWaalsContact CB-O 3.23Å; D26-V51 WeakPolarHBondContact CB-O 3.45Å; D26-V51 PolarHBondContact O-N 2.94Å; V28-V51 HydrophobicContact CG2-CG2 3.82Å; V51-R85 HydrophobicContact CG1-CB 3.29Å; V51-R85 HydrophobicContact CG1-CG 4.13Å; V51-L86 HydrophobicContact CG2-CD2 4.02Å; V51-L86 HydrophobicContact CG2-CG 4.49Å; V51-A89 HydrophobicContact CG2-CB 3.93Å
52	C	72	Confident	82.1	Confident	64 Å²	64	67.2 Å²	67.2	43%	0.432	35%	0.348	S	S	.	.			trans	-110.3	152.5	178.1	-73.2	0	0	0	0	110.8	L90	C52-L90 HydrophobicContact CB-CD1 4.2Å
53	G	74.8	Confident	82	Confident	56 Å²	56	71 Å²	71	58%	0.577	37%	0.37	S	S	*	.	S	Bend	trans	89.3	167.3	176.9	0	0	0	0	0	114.7	R85	G53-R85 PolarHBondContact O-NH1 3.22Å
54	S	78.5	Confident	82	Confident	109 Å²	109	72 Å²	72	76%	0.762	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-74.1	151.8	177.8	48.8	0	0	0	0	111.4
55	L	84.5	Confident	81.6	Confident	37 Å²	37	74.8 Å²	74.8	19%	0.194	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-57.4	142.9	167.6	-78.8	159.7	0	0	0	110.3	W59 R61 F71 P84 R85	L55-W59 HydrophobicContact CB-CB 4.48Å; L55-W59 HydrophobicContact CD2-CB 4.33Å; L55-R61 HydrophobicContact CD1-CB 3.57Å; L55-F71 HydrophobicContact CD1-CD1 4.18Å; L55-F71 HydrophobicContact CD1-CE1 4.08Å; L55-F71 HydrophobicContact CD2-CD1 3.8Å; L55-F71 HydrophobicContact CD2-CE1 3.9Å; L55-P84 HydrophobicContact CD2-CG 3.7Å; L55-R85 HydrophobicContact CD2-CG 4.18Å
56	P	84.5	Confident	81.1	Confident	58 Å²	58	77.3 Å²	77.3	38%	0.377	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-54.8	146.6	170.4	-20	30.1	0	0	0	110.1	T58 W59	P56-T58 PolarHBondContact O-N 2.83Å; P56-W59 PolarHBondContact O-N 2.77Å
57	S	86.4	Confident	80.6	Confident	118 Å²	118	71.7 Å²	71.7	83%	0.825	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.9	-174.8	54.5	0	0	0	0	114.2	W59	S57-W59 PolarHBondContact O-N 3.32Å
58	T	87.7	Confident	80.6	Confident	46 Å²	46	68.2 Å²	68.2	28%	0.282	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.3	175.7	60.9	0	0	0	0	113	P56 L74 R75	P56-T58 PolarHBondContact O-N 2.83Å; T58-L74 WeakPolarHBondContact O-CB 3.29Å; T58-L74 PolarHBondContact O-N 3.11Å; T58-R75 HydrophobicContact CG2-CG 4.12Å
59	W	90.3	Very high	80.6	Confident	52 Å²	52	64.7 Å²	64.7	20%	0.197	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.6	-178.4	-75	85.1	0	0	0	111	L55 P56 S57 F71 Q72 D73 T80 P84	L55-W59 HydrophobicContact CB-CB 4.48Å; L55-W59 HydrophobicContact CD2-CB 4.33Å; P56-W59 PolarHBondContact O-N 2.77Å; S57-W59 PolarHBondContact O-N 3.32Å; W59-F71 HydrophobicContact CE3-CB 3.77Å; W59-F71 HydrophobicContact CZ3-CB 3.72Å; W59-Q72 WeakPolarHBondContact CA-O 3.21Å; W59-D73 HydrophobicContact CD2-CB 4.24Å; W59-D73 HydrophobicContact CE3-CB 4.3Å; W59-D73 HydrophobicContact CH2-CB 4.03Å; W59-D73 HydrophobicContact CZ2-CB 3.93Å; W59-D73 HydrophobicContact CZ3-CB 4.21Å; W59-T80 HydrophobicContact CH2-CG2 3.9Å; W59-T80 HydrophobicContact CZ3-CG2 3.75Å; W59-P84 HydrophobicContact CB-CG 4.29Å; W59-P84 HydrophobicContact CD2-CB 3.93Å; W59-P84 HydrophobicContact CD2-CG 3.58Å; W59-P84 HydrophobicContact CE3-CB 4.38Å; W59-P84 HydrophobicContact CE3-CG 3.83Å; W59-P84 HydrophobicContact CG-CB 4.32Å; W59-P84 HydrophobicContact CG-CG 3.79Å; W59-P84 HydrophobicContact CH2-CB 4.35Å; W59-P84 HydrophobicContact CZ2-CB 3.93Å; W59-P84 HydrophobicContact CZ2-CG 4.42Å; W59-P84 HydrophobicContact CZ3-CG 4.33Å
60	R	90.3	Very high	81	Confident	143 Å²	143	64.7 Å²	64.7	54%	0.54	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.5	172.3	177.3	179.8	-78.2	-177.8	-4.3	109.5	L62 Q72 L74	R60-L62 HydrophobicContact CG-CD2 4.09Å; R60-Q72 PolarHBondContact N-O 3.02Å; R60-Q72 PolarHBondContact O-N 2.84Å; R60-L74 HydrophobicContact CB-CD1 4.38Å; R60-L74 HydrophobicContact CB-CD2 3.99Å; R60-L74 HydrophobicContact CB-CG 4.28Å
61	R	89.4	Confident	81.6	Confident	85 Å²	85	62.5 Å²	62.5	32%	0.321	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.1	168.5	-174.9	167.1	65.9	-164.6	2.7	110.6	L24 D26 L55 A69 V70 F71	L24-R61 HydrophobicContact CD2-CG 4.38Å; L24-R61 PolarHBondContact O-NH1 3.29Å; L24-R61 PolarHBondContact O-NH2 3.44Å; L24-R61 VanDerWaalsContact O-NH2 3.14Å; D26-R61 IonicContact OD1-CZ 3.64Å; D26-R61 IonicContact OD1-NH1 3.11Å; D26-R61 PolarHBondContact OD1-NH1 2.95Å; L55-R61 HydrophobicContact CD1-CB 3.57Å; R61-A69 HydrophobicContact CG-CB 4.4Å; R61-V70 CarbonylContact C-O 3.57Å; R61-V70 WeakPolarHBondContact CA-O 3.31Å; R61-F71 HydrophobicContact CB-CD1 4.17Å; R61-F71 HydrophobicContact CB-CE1 4.03Å; R61-F71 HydrophobicContact CG-CD1 4.31Å; R61-F71 HydrophobicContact CG-CE1 3.88Å; R61-F71 HydrophobicContact CG-CZ 4.29Å
62	L	88.5	Confident	82.2	Confident	65 Å²	65	64.7 Å²	64.7	34%	0.34	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	165.8	175.6	-58.4	175.4	0	0	0	108.5	R60 V70 Q72	R60-L62 HydrophobicContact CG-CD2 4.09Å; L62-V70 HydrophobicContact CB-CB 4.36Å; L62-V70 PolarHBondContact N-O 2.77Å; L62-V70 PolarHBondContact O-N 2.89Å; L62-Q72 HydrophobicContact CD1-CB 4.1Å
63	V	80.2	Confident	83.1	Confident	78 Å²	78	62.2 Å²	62.2	47%	0.473	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.3	173.3	-171.2	0	0	0	0	107.2	L24 R68	L24-V63 HydrophobicContact CD1-CG2 4.05Å; L24-V63 HydrophobicContact CD2-CG2 3.74Å; V63-R68 WeakPolarHBondContact CA-O 3.27Å
64	D	80.8	Confident	83.9	Confident	37 Å²	37	63.6 Å²	63.6	20%	0.198	34%	0.338	C	S	.	.			trans	-80	179.7	177.1	76	2.5	0	0	0	112.6	E66 G67 R68 V70	D64-E66 PolarHBondContact O-N 2.82Å; D64-E66 VanDerWaalsContact O-N 3.13Å; D64-E66 WeakPolarHBondContact OD1-CA 3.32Å; D64-E66 WeakPolarHBondContact OD1-CB 3.39Å; D64-E66 PolarHBondContact OD1-N 2.9Å; D64-G67 PolarHBondContact O-N 2.88Å; D64-G67 PolarHBondContact OD1-N 2.92Å; D64-R68 PolarHBondContact N-O 2.92Å; D64-R68 VanDerWaalsContact N-O 3.08Å; D64-R68 WeakPolarHBondContact OD1-CB 3.04Å; D64-R68 PolarHBondContact OD1-N 3Å; D64-R68 IonicContact OD1-NE 3.32Å; D64-R68 IonicContact OD2-CZ 2.72Å; D64-R68 IonicContact OD2-NE 2.92Å; D64-R68 PolarHBondContact OD2-NE 3.46Å; D64-R68 IonicContact OD2-NH2 2.71Å; D64-R68 PolarHBondContact OD2-NH2 2.92Å; D64-V70 HydrophobicContact CB-CG2 3.95Å
65	N	72.3	Confident	84.3	Confident	180 Å²	180	66.9 Å²	66.9	96%	0.963	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14.8	-179.5	-62.2	-26.1	0	0	0	113.8
66	E	69.6	Low	84.6	Confident	86 Å²	86	69.1 Å²	69.1	40%	0.402	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-1.6	176.5	-67.4	-176.9	-158.2	0	0	112.6	D64 R68 M112	D64-E66 PolarHBondContact O-N 2.82Å; D64-E66 VanDerWaalsContact O-N 3.13Å; D64-E66 WeakPolarHBondContact OD1-CA 3.32Å; D64-E66 WeakPolarHBondContact OD1-CB 3.39Å; D64-E66 PolarHBondContact OD1-N 2.9Å; E66-R68 HydrophobicContact CB-CG 4.16Å; E66-R68 VanDerWaalsContact CD-CZ 3.46Å; E66-R68 IonicContact OE1-CZ 3.9Å; E66-R68 IonicContact OE1-NH1 3.82Å; E66-R68 IonicContact OE1-NH2 2.75Å; E66-R68 IonicContact OE2-CZ 3.59Å; E66-R68 IonicContact OE2-NE 2.71Å; E66-R68 PolarHBondContact OE2-NE 3.31Å; E66-R68 IonicContact OE2-NH1 3.07Å; E66-R68 PolarHBondContact OE2-NH1 2.83Å; E66-R68 IonicContact OE2-NH2 3.24Å; E66-M112 WeakPolarHBondContact O-CB 3.24Å
67	G	69.7	Low	84.7	Confident	11 Å²	11	68.3 Å²	68.3	11%	0.113	35%	0.351	C	S	.	.	S	Bend	trans	83.9	12.3	-178.8	0	0	0	0	0	114.1	D64	D64-G67 PolarHBondContact O-N 2.88Å; D64-G67 PolarHBondContact OD1-N 2.92Å
68	R	76.7	Confident	84.8	Confident	65 Å²	65	69.5 Å²	69.5	25%	0.245	34%	0.343	C	S	.	.			trans	-85.3	144.9	-179.5	-55.6	175.7	-61.8	-159.2	4.7	110.1	V63 D64 E66 V70 F81	V63-R68 WeakPolarHBondContact CA-O 3.27Å; D64-R68 PolarHBondContact N-O 2.92Å; D64-R68 VanDerWaalsContact N-O 3.08Å; D64-R68 WeakPolarHBondContact OD1-CB 3.04Å; D64-R68 PolarHBondContact OD1-N 3Å; D64-R68 IonicContact OD1-NE 3.32Å; D64-R68 IonicContact OD2-CZ 2.72Å; D64-R68 IonicContact OD2-NE 2.92Å; D64-R68 PolarHBondContact OD2-NE 3.46Å; D64-R68 IonicContact OD2-NH2 2.71Å; D64-R68 PolarHBondContact OD2-NH2 2.92Å; E66-R68 HydrophobicContact CB-CG 4.16Å; E66-R68 VanDerWaalsContact CD-CZ 3.46Å; E66-R68 IonicContact OE1-CZ 3.9Å; E66-R68 IonicContact OE1-NH1 3.82Å; E66-R68 IonicContact OE1-NH2 2.75Å; E66-R68 IonicContact OE2-CZ 3.59Å; E66-R68 IonicContact OE2-NE 2.71Å; E66-R68 PolarHBondContact OE2-NE 3.31Å; E66-R68 IonicContact OE2-NH1 3.07Å; E66-R68 PolarHBondContact OE2-NH1 2.83Å; E66-R68 IonicContact OE2-NH2 3.24Å; R68-V70 PolarHBondContact O-N 3.05Å; R68-F81 HydrophobicContact CB-CE1 4.19Å
69	A	81.1	Confident	84.9	Confident	4 Å²	4	71.5 Å²	71.5	3%	0.033	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.3	173.3	0	0	0	0	0	109.9	L24 R61 F71	L24-A69 HydrophobicContact CD2-CB 3.97Å; R61-A69 HydrophobicContact CG-CB 4.4Å; A69-F71 HydrophobicContact CB-CE2 3.98Å; A69-F71 HydrophobicContact CB-CZ 4.03Å
70	V	87.3	Confident	84.8	Confident	15 Å²	15	71.4 Å²	71.4	9%	0.091	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.5	173.6	179.4	0	0	0	0	107.8	R61 L62 D64 R68 T79 F81	R61-V70 CarbonylContact C-O 3.57Å; R61-V70 WeakPolarHBondContact CA-O 3.31Å; L62-V70 HydrophobicContact CB-CB 4.36Å; L62-V70 PolarHBondContact N-O 2.77Å; L62-V70 PolarHBondContact O-N 2.89Å; D64-V70 HydrophobicContact CB-CG2 3.95Å; R68-V70 PolarHBondContact O-N 3.05Å; V70-T79 HydrophobicContact CG1-CG2 4.28Å; V70-F81 HydrophobicContact CG2-CD1 3.98Å; V70-F81 HydrophobicContact CG2-CE1 3.53Å; V70-F81 HydrophobicContact CG2-CZ 4.14Å
71	F	90.5	Very high	84.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.1	-178	-60.3	-86.5	0	0	0	109.1	T22 L55 W59 R61 A69 T79 T80 D83	T22-F71 WeakPolarHBondContact OG1-CE2 3.37Å; T22-F71 WeakPolarHBondContact OG1-CZ 3.41Å; L55-F71 HydrophobicContact CD1-CD1 4.18Å; L55-F71 HydrophobicContact CD1-CE1 4.08Å; L55-F71 HydrophobicContact CD2-CD1 3.8Å; L55-F71 HydrophobicContact CD2-CE1 3.9Å; W59-F71 HydrophobicContact CE3-CB 3.77Å; W59-F71 HydrophobicContact CZ3-CB 3.72Å; R61-F71 HydrophobicContact CB-CD1 4.17Å; R61-F71 HydrophobicContact CB-CE1 4.03Å; R61-F71 HydrophobicContact CG-CD1 4.31Å; R61-F71 HydrophobicContact CG-CE1 3.88Å; R61-F71 HydrophobicContact CG-CZ 4.29Å; A69-F71 HydrophobicContact CB-CE2 3.98Å; A69-F71 HydrophobicContact CB-CZ 4.03Å; F71-T79 CarbonylContact O-C 3.58Å; F71-T79 VanDerWaalsContact O-CA 3.3Å; F71-T79 WeakPolarHBondContact O-CA 3.35Å; F71-T80 HydrophobicContact CB-CG2 4.3Å; F71-T80 PolarHBondContact N-O 3.11Å; F71-T80 PolarHBondContact O-N 2.8Å; F71-D83 HydrophobicContact CD2-CB 4.09Å; F71-D83 HydrophobicContact CE1-CB 4.1Å; F71-D83 WeakPolarHBondContact CE1-OD2 3.38Å; F71-D83 HydrophobicContact CE2-CB 3.59Å; F71-D83 HydrophobicContact CZ-CB 3.61Å; F71-D83 VanDerWaalsContact CZ-CG 3.45Å; F71-D83 WeakPolarHBondContact CZ-OD2 3.49Å
72	Q	92.4	Very high	84.4	Confident	49 Å²	49	65.6 Å²	65.6	23%	0.229	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126	177	-172.8	176.9	34.4	0	0	109.8	W59 R60 L62 L74 G77 E78 T79	W59-Q72 WeakPolarHBondContact CA-O 3.21Å; R60-Q72 PolarHBondContact N-O 3.02Å; R60-Q72 PolarHBondContact O-N 2.84Å; L62-Q72 HydrophobicContact CD1-CB 4.1Å; Q72-L74 PolarHBondContact O-N 2.72Å; Q72-G77 PolarHBondContact NE2-O 2.92Å; Q72-E78 CarbonylContact C-O 3.49Å; Q72-E78 VanDerWaalsContact CA-O 3.3Å; Q72-E78 WeakPolarHBondContact CA-O 3.3Å; Q72-T79 HydrophobicContact CB-CG2 3.98Å; Q72-T79 HydrophobicContact CG-CG2 3.93Å
73	D	90.8	Very high	84.2	Confident	12 Å²	12	62.7 Å²	62.7	6%	0.064	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	115.3	166.4	-170	-32.5	0	0	0	108.1	W59 R75 T76 G77 E78	W59-D73 HydrophobicContact CD2-CB 4.24Å; W59-D73 HydrophobicContact CE3-CB 4.3Å; W59-D73 HydrophobicContact CH2-CB 4.03Å; W59-D73 HydrophobicContact CZ2-CB 3.93Å; W59-D73 HydrophobicContact CZ3-CB 4.21Å; D73-R75 PolarHBondContact O-N 2.86Å; D73-R75 VanDerWaalsContact OD1-CB 3.25Å; D73-R75 WeakPolarHBondContact OD1-CB 3.4Å; D73-R75 WeakPolarHBondContact OD1-CG 3.37Å; D73-R75 IonicContact OD1-CZ 3.8Å; D73-R75 PolarHBondContact OD1-N 3.26Å; D73-R75 IonicContact OD1-NE 3.87Å; D73-R75 PolarHBondContact OD1-NE 3.35Å; D73-R75 VanDerWaalsContact OD1-NE 3.1Å; D73-R75 IonicContact OD1-NH2 3.72Å; D73-R75 IonicContact OD2-CZ 3.62Å; D73-R75 IonicContact OD2-NE 3.05Å; D73-R75 PolarHBondContact OD2-NE 3.07Å; D73-R75 IonicContact OD2-NH2 2.77Å; D73-R75 PolarHBondContact OD2-NH2 3.01Å; D73-T76 PolarHBondContact O-N 2.71Å; D73-G77 VanDerWaalsContact O-CA 3.26Å; D73-G77 WeakPolarHBondContact O-CA 3.3Å; D73-G77 PolarHBondContact O-N 3.07Å; D73-E78 PolarHBondContact N-O 3.23Å
74	L	90.1	Very high	84.3	Confident	86 Å²	86	61.1 Å²	61.1	45%	0.45	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.6	-177.5	-63	174.7	0	0	0	112.9	T58 R60 Q72	T58-L74 WeakPolarHBondContact O-CB 3.29Å; T58-L74 PolarHBondContact O-N 3.11Å; R60-L74 HydrophobicContact CB-CD1 4.38Å; R60-L74 HydrophobicContact CB-CD2 3.99Å; R60-L74 HydrophobicContact CB-CG 4.28Å; Q72-L74 PolarHBondContact O-N 2.72Å
75	R	88.2	Confident	84.4	Confident	177 Å²	177	60 Å²	60	67%	0.668	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-41.6	177.9	-58.3	172.4	-66.1	167	4.2	111.8	T58 D73	T58-R75 HydrophobicContact CG2-CG 4.12Å; D73-R75 PolarHBondContact O-N 2.86Å; D73-R75 VanDerWaalsContact OD1-CB 3.25Å; D73-R75 WeakPolarHBondContact OD1-CB 3.4Å; D73-R75 WeakPolarHBondContact OD1-CG 3.37Å; D73-R75 IonicContact OD1-CZ 3.8Å; D73-R75 PolarHBondContact OD1-N 3.26Å; D73-R75 IonicContact OD1-NE 3.87Å; D73-R75 PolarHBondContact OD1-NE 3.35Å; D73-R75 VanDerWaalsContact OD1-NE 3.1Å; D73-R75 IonicContact OD1-NH2 3.72Å; D73-R75 IonicContact OD2-CZ 3.62Å; D73-R75 IonicContact OD2-NE 3.05Å; D73-R75 PolarHBondContact OD2-NE 3.07Å; D73-R75 IonicContact OD2-NH2 2.77Å; D73-R75 PolarHBondContact OD2-NH2 3.01Å
76	T	89.6	Confident	84.8	Confident	85 Å²	85	52 Å²	52	52%	0.521	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-21.7	-177.3	63.6	0	0	0	0	112.4	D73 E78	D73-T76 PolarHBondContact O-N 2.71Å; T76-E78 PolarHBondContact O-N 2.95Å; T76-E78 WeakPolarHBondContact OG1-CB 3.42Å; T76-E78 PolarHBondContact OG1-N 2.91Å
77	G	86.6	Confident	85	Confident	40 Å²	40	53 Å²	53	41%	0.412	30%	0.297	S	S	.	.			trans	79.6	-5.1	-171.7	0	0	0	0	0	113.8	Q72 D73	Q72-G77 PolarHBondContact NE2-O 2.92Å; D73-G77 VanDerWaalsContact O-CA 3.26Å; D73-G77 WeakPolarHBondContact O-CA 3.3Å; D73-G77 PolarHBondContact O-N 3.07Å
78	E	89.1	Confident	85.2	Confident	143 Å²	143	59.5 Å²	59.5	67%	0.668	33%	0.325	S	S	*	.			trans	-68.2	146.9	-178.3	-67	-178.4	150.3	0	0	111.7	Q72 D73 T76	Q72-E78 CarbonylContact C-O 3.49Å; Q72-E78 VanDerWaalsContact CA-O 3.3Å; Q72-E78 WeakPolarHBondContact CA-O 3.3Å; D73-E78 PolarHBondContact N-O 3.23Å; T76-E78 PolarHBondContact O-N 2.95Å; T76-E78 WeakPolarHBondContact OG1-CB 3.42Å; T76-E78 PolarHBondContact OG1-N 2.91Å
79	T	89.7	Confident	85	Confident	88 Å²	88	57.4 Å²	57.4	54%	0.54	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.9	178	56.3	0	0	0	0	111	V70 F71 Q72	V70-T79 HydrophobicContact CG1-CG2 4.28Å; F71-T79 CarbonylContact O-C 3.58Å; F71-T79 VanDerWaalsContact O-CA 3.3Å; F71-T79 WeakPolarHBondContact O-CA 3.35Å; Q72-T79 HydrophobicContact CB-CG2 3.98Å; Q72-T79 HydrophobicContact CG-CG2 3.93Å
80	T	89.1	Confident	84.6	Confident	50 Å²	50	62.1 Å²	62.1	31%	0.307	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	158.8	177.8	-179.5	0	0	0	0	110.9	W59 F71 S82	W59-T80 HydrophobicContact CH2-CG2 3.9Å; W59-T80 HydrophobicContact CZ3-CG2 3.75Å; F71-T80 HydrophobicContact CB-CG2 4.3Å; F71-T80 PolarHBondContact N-O 3.11Å; F71-T80 PolarHBondContact O-N 2.8Å; T80-S82 WeakPolarHBondContact CG2-O 3.47Å; T80-S82 PolarHBondContact OG1-N 2.92Å; T80-S82 VanDerWaalsContact OG1-N 3.15Å
81	F	86.1	Confident	83.8	Confident	58 Å²	58	65.7 Å²	65.7	25%	0.254	36%	0.361	S	S	.	.	S	Bend	trans	-89	-15	170.6	-69.3	-78.5	0	0	0	112.8	R21 R68 V70 D83	R21-F81 HydrophobicContact CG-CB 4.27Å; R68-F81 HydrophobicContact CB-CE1 4.19Å; V70-F81 HydrophobicContact CG2-CD1 3.98Å; V70-F81 HydrophobicContact CG2-CE1 3.53Å; V70-F81 HydrophobicContact CG2-CZ 4.14Å; F81-D83 PolarHBondContact O-N 3.42Å
82	S	84.1	Confident	82.6	Confident	49 Å²	49	68.7 Å²	68.7	34%	0.343	38%	0.375	S	S	.	.	S	Bend	trans	-78.7	120.5	176.7	-56.4	0	0	0	0	109.9	T80	T80-S82 WeakPolarHBondContact CG2-O 3.47Å; T80-S82 PolarHBondContact OG1-N 2.92Å; T80-S82 VanDerWaalsContact OG1-N 3.15Å
83	D	83.8	Confident	80.8	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	39%	0.388	C	S	.	.			trans	-72.9	125.4	178.8	-173.1	-33.7	0	0	0	109.8	T22 F71 F81 R85 L86	T22-D83 HydrophobicContact CG2-CB 3.56Å; T22-D83 WeakPolarHBondContact CG2-OD2 3.47Å; T22-D83 VanDerWaalsContact OG1-CB 3.24Å; T22-D83 WeakPolarHBondContact OG1-CB 3.36Å; T22-D83 PolarHBondContact OG1-OD2 2.71Å; F71-D83 HydrophobicContact CD2-CB 4.09Å; F71-D83 HydrophobicContact CE1-CB 4.1Å; F71-D83 WeakPolarHBondContact CE1-OD2 3.38Å; F71-D83 HydrophobicContact CE2-CB 3.59Å; F71-D83 HydrophobicContact CZ-CB 3.61Å; F71-D83 VanDerWaalsContact CZ-CG 3.45Å; F71-D83 WeakPolarHBondContact CZ-OD2 3.49Å; F81-D83 PolarHBondContact O-N 3.42Å; D83-R85 PolarHBondContact O-N 2.74Å; D83-R85 VanDerWaalsContact OD1-CB 3.3Å; D83-R85 WeakPolarHBondContact OD1-CB 3.24Å; D83-R85 WeakPolarHBondContact OD1-CG 3.5Å; D83-R85 IonicContact OD1-CZ 3.38Å; D83-R85 PolarHBondContact OD1-N 3.02Å; D83-R85 IonicContact OD1-NE 3.74Å; D83-R85 PolarHBondContact OD1-NE 3.08Å; D83-R85 IonicContact OD1-NH2 2.74Å; D83-R85 IonicContact OD2-CZ 3.1Å; D83-R85 IonicContact OD2-NE 3.87Å; D83-R85 PolarHBondContact OD2-NE 3.28Å; D83-R85 IonicContact OD2-NH2 3.48Å; D83-R85 PolarHBondContact OD2-NH2 3.43Å; D83-L86 HydrophobicContact CB-CD1 3.93Å; D83-L86 HydrophobicContact CB-CG 3.96Å; D83-L86 WeakPolarHBondContact O-CB 3.43Å; D83-L86 WeakPolarHBondContact O-CD1 3.14Å; D83-L86 WeakPolarHBondContact O-CG 3.39Å; D83-L86 PolarHBondContact O-N 2.79Å
84	P	83.7	Confident	79.2	Confident	45 Å²	45	76 Å²	76	29%	0.292	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.6	-177.3	28.2	-39.2	0	0	0	113.5	L55 W59	L55-P84 HydrophobicContact CD2-CG 3.7Å; W59-P84 HydrophobicContact CB-CG 4.29Å; W59-P84 HydrophobicContact CD2-CB 3.93Å; W59-P84 HydrophobicContact CD2-CG 3.58Å; W59-P84 HydrophobicContact CE3-CB 4.38Å; W59-P84 HydrophobicContact CE3-CG 3.83Å; W59-P84 HydrophobicContact CG-CB 4.32Å; W59-P84 HydrophobicContact CG-CG 3.79Å; W59-P84 HydrophobicContact CH2-CB 4.35Å; W59-P84 HydrophobicContact CZ2-CB 3.93Å; W59-P84 HydrophobicContact CZ2-CG 4.42Å; W59-P84 HydrophobicContact CZ3-CG 4.33Å
85	R	81.9	Confident	76.9	Confident	13 Å²	13	80 Å²	80	5%	0.049	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.4	177.9	-57.5	170.9	-70.1	168.5	5.4	113.3	D26 V51 G53 L55 D83 A87 Q88 A89	D26-R85 IonicContact OD1-CZ 3.96Å; D26-R85 IonicContact OD1-NH1 2.69Å; D26-R85 PolarHBondContact OD1-NH1 3.11Å; D26-R85 VanDerWaalsContact OD1-NH1 3.13Å; D26-R85 IonicContact OD1-NH2 3.91Å; D26-R85 PolarHBondContact OD1-NH2 3.27Å; D26-R85 IonicContact OD2-NH1 3.03Å; V51-R85 HydrophobicContact CG1-CB 3.29Å; V51-R85 HydrophobicContact CG1-CG 4.13Å; G53-R85 PolarHBondContact O-NH1 3.22Å; L55-R85 HydrophobicContact CD2-CG 4.18Å; D83-R85 PolarHBondContact O-N 2.74Å; D83-R85 VanDerWaalsContact OD1-CB 3.3Å; D83-R85 WeakPolarHBondContact OD1-CB 3.24Å; D83-R85 WeakPolarHBondContact OD1-CG 3.5Å; D83-R85 IonicContact OD1-CZ 3.38Å; D83-R85 PolarHBondContact OD1-N 3.02Å; D83-R85 IonicContact OD1-NE 3.74Å; D83-R85 PolarHBondContact OD1-NE 3.08Å; D83-R85 IonicContact OD1-NH2 2.74Å; D83-R85 IonicContact OD2-CZ 3.1Å; D83-R85 IonicContact OD2-NE 3.87Å; D83-R85 PolarHBondContact OD2-NE 3.28Å; D83-R85 IonicContact OD2-NH2 3.48Å; D83-R85 PolarHBondContact OD2-NH2 3.43Å; R85-A87 PolarHBondContact O-N 3.47Å; R85-Q88 CarbonylContact O-C 3.55Å; R85-Q88 WeakPolarHBondContact O-CA 3.26Å; R85-Q88 PolarHBondContact O-N 3.1Å; R85-A89 PolarHBondContact O-N 2.89Å
86	L	81.2	Confident	74.6	Confident	12 Å²	12	78.5 Å²	78.5	6%	0.063	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-58.1	-34	-176.6	-81.2	160.8	0	0	0	113.1	E20 T22 V28 V51 D83 Q88 A89	E20-L86 HydrophobicContact CB-CD1 4.39Å; E20-L86 HydrophobicContact CG-CD1 3.96Å; E20-L86 WeakPolarHBondContact OE1-CB 3.24Å; E20-L86 WeakPolarHBondContact OE1-CD1 3.4Å; T22-L86 HydrophobicContact CG2-CD1 4.39Å; T22-L86 HydrophobicContact CG2-CD2 3.69Å; T22-L86 HydrophobicContact CG2-CG 4.05Å; V28-L86 HydrophobicContact CB-CD2 4.37Å; V28-L86 HydrophobicContact CG1-CD2 3.83Å; V28-L86 HydrophobicContact CG2-CD2 3.61Å; V51-L86 HydrophobicContact CG2-CD2 4.02Å; V51-L86 HydrophobicContact CG2-CG 4.49Å; D83-L86 HydrophobicContact CB-CD1 3.93Å; D83-L86 HydrophobicContact CB-CG 3.96Å; D83-L86 WeakPolarHBondContact O-CB 3.43Å; D83-L86 WeakPolarHBondContact O-CD1 3.14Å; D83-L86 WeakPolarHBondContact O-CG 3.39Å; D83-L86 PolarHBondContact O-N 2.79Å; L86-Q88 PolarHBondContact O-N 3.38Å; L86-A89 VanDerWaalsContact O-CB 3.23Å; L86-A89 WeakPolarHBondContact O-CB 3.29Å; L86-A89 PolarHBondContact O-N 2.74Å
87	A	74	Confident	72.5	Confident	106 Å²	106	78.8 Å²	78.8	88%	0.876	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-59.7	-17.1	173.8	0	0	0	0	0	114	R85	R85-A87 PolarHBondContact O-N 3.47Å
88	Q	72.7	Confident	70.2	Confident	149 Å²	149	83.9 Å²	83.9	70%	0.696	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-115.7	16	177.7	-61.7	180	-10.9	0	0	112.1	R85 L86 L90	R85-Q88 CarbonylContact O-C 3.55Å; R85-Q88 WeakPolarHBondContact O-CA 3.26Å; R85-Q88 PolarHBondContact O-N 3.1Å; L86-Q88 PolarHBondContact O-N 3.38Å; Q88-L90 PolarHBondContact O-N 2.95Å
89	A	74.1	Confident	68	Low	21 Å²	21	82.4 Å²	82.4	17%	0.174	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-65.2	134.2	179	0	0	0	0	0	110.6	V28 K49 I50 V51 R85 L86	V28-A89 HydrophobicContact CG2-CB 4.24Å; K49-A89 HydrophobicContact CB-CB 4.12Å; K49-A89 HydrophobicContact CD-CB 4.21Å; I50-A89 CarbonylContact O-C 3.58Å; I50-A89 WeakPolarHBondContact O-CA 3.3Å; V51-A89 HydrophobicContact CG2-CB 3.93Å; R85-A89 PolarHBondContact O-N 2.89Å; L86-A89 VanDerWaalsContact O-CB 3.23Å; L86-A89 WeakPolarHBondContact O-CB 3.29Å; L86-A89 PolarHBondContact O-N 2.74Å
90	L	71.5	Confident	65.5	Low	103 Å²	103	86.3 Å²	86.3	54%	0.539	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	142.2	178	-65.1	175	0	0	0	110.2	K49 I50 C52 Q88 Q92	K49-L90 CarbonylContact C-O 3.57Å; K49-L90 VanDerWaalsContact CA-O 3.28Å; K49-L90 WeakPolarHBondContact CA-O 3.36Å; I50-L90 HydrophobicContact CG2-CB 4.39Å; I50-L90 PolarHBondContact N-O 2.8Å; I50-L90 PolarHBondContact O-N 2.79Å; C52-L90 HydrophobicContact CB-CD1 4.2Å; Q88-L90 PolarHBondContact O-N 2.95Å; L90-Q92 PolarHBondContact O-N 2.84Å
91	E	70.4	Confident	63.3	Low	89 Å²	89	89.5 Å²	89.5	42%	0.416	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	126	169	-65.1	-171	155.1	0	0	110.2	R47 R48 S93	R47-E91 WeakPolarHBondContact CD-OE1 3.23Å; R47-E91 VanDerWaalsContact CD-OE2 3.27Å; R47-E91 WeakPolarHBondContact CD-OE2 3.24Å; R47-E91 IonicContact CZ-OE1 3.64Å; R47-E91 IonicContact CZ-OE2 3.75Å; R47-E91 IonicContact NE-OE1 2.94Å; R47-E91 IonicContact NE-OE2 2.8Å; R47-E91 VanDerWaalsContact NH1-CD 3.31Å; R47-E91 IonicContact NH1-OE1 3.45Å; R47-E91 PolarHBondContact NH1-OE1 2.69Å; R47-E91 IonicContact NH1-OE2 3.39Å; R47-E91 PolarHBondContact NH1-OE2 2.68Å; R48-E91 CarbonylContact O-C 3.52Å; R48-E91 WeakPolarHBondContact O-CA 3.42Å; E91-S93 PolarHBondContact O-N 3.46Å
92	Q	65.9	Low	61.3	Low	63 Å²	63	97.2 Å²	97.2	29%	0.294	52%	0.524	S	S	.	.			trans	-82.8	107.4	175.9	-174.5	168.3	43.3	0	0	108.5	R48 L90	R48-Q92 HydrophobicContact CB-CB 4.35Å; R48-Q92 PolarHBondContact O-N 2.71Å; L90-Q92 PolarHBondContact O-N 2.84Å
93	S	54.5	Low	59.7	Low	70 Å²	70	101.2 Å²	101.2	49%	0.49	54%	0.537	S	S	.	.			trans	-68.9	134.8	169.4	66.3	0	0	0	0	109.7	E91 Q95	E91-S93 PolarHBondContact O-N 3.46Å; S93-Q95 PolarHBondContact O-N 3.49Å
94	D	55.9	Low	58.4	Low	146 Å²	146	105.2 Å²	105.2	78%	0.781	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-11.4	-179	-78.7	-37.7	0	0	0	113.4
95	Q	42.7	Very low	57.5	Low	169 Å²	169	104 Å²	104	79%	0.79	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.7	-172.5	-63.9	-169.8	1	0	0	114.8	S93	S93-Q95 PolarHBondContact O-N 3.49Å
96	H	40.6	Very low	56.6	Low	146 Å²	146	107.2 Å²	107.2	68%	0.676	56%	0.56	S	S	*	*			trans	-121.6	64.7	-177.3	-67.6	-5.9	0	0	0	111.8	H98	H96-H98 PolarHBondContact O-N 2.98Å; H96-H98 VanDerWaalsContact O-N 3.08Å
97	A	44	Very low	55.7	Low	91 Å²	91	108.8 Å²	108.8	75%	0.752	58%	0.575	S	S	*	*			trans	-62.3	108.3	155.4	0	0	0	0	0	107.4
98	H	38.9	Very low	55.1	Low	147 Å²	147	113.3 Å²	113.3	68%	0.681	57%	0.569	S	S	*	*			trans	-43.7	133	173.2	-99	-75	0	0	0	110.3	H96 F100	H96-H98 PolarHBondContact O-N 2.98Å; H96-H98 VanDerWaalsContact O-N 3.08Å; H98-F100 CarbonylContact O-C 3.55Å; H98-F100 PolarHBondContact O-N 2.98Å; H98-F100 VanDerWaalsContact O-N 3.08Å
99	P	43.3	Very low	54.8	Low	112 Å²	112	106.8 Å²	106.8	73%	0.727	54%	0.54	S	S	*	.	S	Bend	trans	-62.1	-23.7	-171.7	21.6	-32.4	0	0	0	113.1
100	F	36.2	Very low	54.6	Low	170 Å²	170	107.3 Å²	107.3	75%	0.746	54%	0.541	S	S	*	.	S	Bend	trans	-106	114.1	165.4	-58.3	-73.5	0	0	0	107.3	H98 R102	H98-F100 CarbonylContact O-C 3.55Å; H98-F100 PolarHBondContact O-N 2.98Å; H98-F100 VanDerWaalsContact O-N 3.08Å; F100-R102 VanDerWaalsContact C-N 3.3Å; F100-R102 PolarHBondContact O-N 2.99Å
101	P	43.5	Very low	54.6	Low	117 Å²	117	102.5 Å²	102.5	76%	0.76	52%	0.516	S	S	*	.			trans	-58.1	104.7	165.5	23.4	-28.8	0	0	0	105.8	Q103	P101-Q103 PolarHBondContact O-N 2.9Å
102	R	43.6	Very low	54.7	Low	220 Å²	220	100 Å²	100	83%	0.83	50%	0.504	S	S	*	.			trans	-45.3	125.1	168.9	-88.2	-173.5	173.1	176.9	-0.7	105.5	F100 R104	F100-R102 VanDerWaalsContact C-N 3.3Å; F100-R102 PolarHBondContact O-N 2.99Å; R102-R104 PolarHBondContact O-N 3.05Å
103	Q	52.3	Low	55	Low	132 Å²	132	99.5 Å²	99.5	62%	0.617	50%	0.502	S	S	*	.			trans	-59.5	95.9	-179.9	-153.4	177.4	3.3	0	0	106.1	P101 F105	P101-Q103 PolarHBondContact O-N 2.9Å; Q103-F105 PolarHBondContact O-N 3.23Å; Q103-F105 VanDerWaalsContact O-N 3.12Å
104	R	56.2	Low	55.6	Low	88 Å²	88	96.3 Å²	96.3	33%	0.332	48%	0.48	S	S	.	.			trans	-63.8	-24.8	-166.3	-172.8	177.3	-174.3	-150.2	-4.6	111.1	D25 R102	D25-R104 IonicContact OD2-NE 3.91Å; D25-R104 PolarHBondContact OD2-NE 3.48Å; D25-R104 IonicContact OD2-NH2 2.8Å; R102-R104 PolarHBondContact O-N 3.05Å
105	F	63.6	Low	56.3	Low	21 Å²	21	89.3 Å²	89.3	9%	0.092	44%	0.442	C	S	.	.			trans	-138.8	146.6	-177.6	-52.4	-67.4	0	0	0	109.9	Q103 S109 V114 F373 Y377	Q103-F105 PolarHBondContact O-N 3.23Å; Q103-F105 VanDerWaalsContact O-N 3.12Å; F105-S109 WeakPolarHBondContact CA-OG 3.28Å; F105-V114 HydrophobicContact CD1-CG2 4.01Å; F105-V114 HydrophobicContact CD2-CG2 4.28Å; F105-V114 HydrophobicContact CE1-CB 4.44Å; F105-V114 HydrophobicContact CE1-CG2 4Å; F105-V114 HydrophobicContact CE2-CG1 4.31Å; F105-V114 HydrophobicContact CE2-CG2 4.28Å; F105-V114 HydrophobicContact CG-CG2 4.16Å; F105-V114 HydrophobicContact CZ-CB 4.29Å; F105-V114 HydrophobicContact CZ-CG1 4.36Å; F105-V114 HydrophobicContact CZ-CG2 4.14Å; F105-F373 HydrophobicContact CB-CD2 4.46Å; F105-F373 HydrophobicContact CB-CE2 3.27Å; F105-F373 HydrophobicContact CB-CZ 3.53Å; F105-F373 HydrophobicContact CD1-CE2 4.32Å; F105-F373 HydrophobicContact CD2-CE2 4.06Å; F105-F373 HydrophobicContact CD2-CZ 4.38Å; F105-F373 AromaticContact CG-CE2 3.65Å; F105-F373 HydrophobicContact CG-CE2 3.65Å; F105-F373 HydrophobicContact CG-CZ 4.19Å; F105-Y377 AromaticContact CD2-CD2 3.79Å; F105-Y377 HydrophobicContact CD2-CD2 3.79Å; F105-Y377 AromaticContact CD2-CE2 3.7Å; F105-Y377 HydrophobicContact CD2-CE2 3.7Å; F105-Y377 AromaticContact CE2-CD2 3.88Å; F105-Y377 HydrophobicContact CE2-CD2 3.88Å; F105-Y377 AromaticContact CE2-CE2 3.85Å; F105-Y377 HydrophobicContact CE2-CE2 3.85Å
106	D	64.6	Low	57.7	Low	79 Å²	79	82.2 Å²	82.2	42%	0.422	41%	0.409	S	S	.	.			trans	-116.4	-176.9	177.4	66.9	8.3	0	0	0	110.7	R108 S109	D106-R108 PolarHBondContact O-N 3.43Å; D106-R108 WeakPolarHBondContact OD1-CA 3.45Å; D106-R108 WeakPolarHBondContact OD1-CB 3.31Å; D106-R108 PolarHBondContact OD1-N 3.33Å; D106-S109 PolarHBondContact N-OG 3.35Å; D106-S109 WeakPolarHBondContact O-CB 3.26Å; D106-S109 PolarHBondContact O-N 3.38Å; D106-S109 VanDerWaalsContact O-N 3.16Å; D106-S109 PolarHBondContact O-OG 2.87Å; D106-S109 PolarHBondContact OD1-N 3.44Å; D106-S109 PolarHBondContact OD1-OG 3.38Å
107	A	60.9	Low	59	Low	46 Å²	46	75.6 Å²	75.6	38%	0.38	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-9.9	178.5	0	0	0	0	0	114.7	K366	A107-K366 VanDerWaalsContact O-CE 3.27Å; A107-K366 WeakPolarHBondContact O-CE 3.35Å
108	R	62.5	Low	60.3	Low	201 Å²	201	73.1 Å²	73.1	76%	0.758	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-7.7	-179.6	-65.4	-179.6	175.2	166.8	-0.4	113.1	D106 M370	D106-R108 PolarHBondContact O-N 3.43Å; D106-R108 WeakPolarHBondContact OD1-CA 3.45Å; D106-R108 WeakPolarHBondContact OD1-CB 3.31Å; D106-R108 PolarHBondContact OD1-N 3.33Å; R108-M370 HydrophobicContact CB-SD 4.45Å; R108-M370 WeakPolarHBondContact O-CG 3.46Å
109	S	65.9	Low	62.2	Low	11 Å²	11	69 Å²	69	8%	0.077	34%	0.337	C	S	.	.			trans	-65.7	137.8	-179.1	-61.8	0	0	0	0	111.4	F105 D106 M370	F105-S109 WeakPolarHBondContact CA-OG 3.28Å; D106-S109 PolarHBondContact N-OG 3.35Å; D106-S109 WeakPolarHBondContact O-CB 3.26Å; D106-S109 PolarHBondContact O-N 3.38Å; D106-S109 VanDerWaalsContact O-N 3.16Å; D106-S109 PolarHBondContact O-OG 2.87Å; D106-S109 PolarHBondContact OD1-N 3.44Å; D106-S109 PolarHBondContact OD1-OG 3.38Å; S109-M370 WeakPolarHBondContact O-CA 2.83Å
110	T	70.8	Confident	64	Low	33 Å²	33	64.2 Å²	64.2	20%	0.202	31%	0.305	C	S	.	.			trans	-89.8	158.5	-179.2	62.5	0	0	0	0	111.7	M112 Q113 V114 V369	T110-M112 PolarHBondContact O-N 3.36Å; T110-Q113 PolarHBondContact O-N 2.98Å; T110-Q113 WeakPolarHBondContact OG1-CB 3.16Å; T110-Q113 VanDerWaalsContact OG1-CD 3.27Å; T110-Q113 VanDerWaalsContact OG1-CG 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.43Å; T110-Q113 PolarHBondContact OG1-N 3.47Å; T110-Q113 PolarHBondContact OG1-OE1 3.46Å; T110-V114 PolarHBondContact O-N 2.94Å; T110-V114 VanDerWaalsContact O-N 3.15Å; T110-V369 HydrophobicContact CG2-CG1 4.08Å
111	V	71	Confident	66.3	Low	1 Å²	1	58.4 Å²	58.4	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-55.5	-39.2	173.5	73.2	0	0	0	0	112.8	V114 L115 A141 V369 A372 S376	V111-V114 PolarHBondContact O-N 3.18Å; V111-L115 HydrophobicContact CG2-CD1 4.26Å; V111-L115 WeakPolarHBondContact O-CG 3.39Å; V111-L115 PolarHBondContact O-N 3.19Å; V111-A141 HydrophobicContact CB-CB 4.17Å; V111-A141 HydrophobicContact CG1-CB 3.42Å; V111-A141 VanDerWaalsContact CG1-CB 3.42Å; V111-A141 HydrophobicContact CG2-CB 3.66Å; V111-V369 WeakPolarHBondContact CB-O 3.39Å; V111-V369 HydrophobicContact CG1-CG1 3.79Å; V111-V369 PolarHBondContact N-O 3.32Å; V111-A372 HydrophobicContact CB-CB 3.62Å; V111-A372 HydrophobicContact CG1-CB 4.11Å; V111-A372 HydrophobicContact CG2-CB 3.6Å; V111-A372 WeakPolarHBondContact CG2-O 3.37Å; V111-S376 WeakPolarHBondContact CG2-OG 3.43Å
112	M	72.3	Confident	68.3	Low	36 Å²	36	60.5 Å²	60.5	18%	0.177	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-40.2	179.2	-67.8	-60.8	-70.8	0	0	111.4	E66 T110 V114 L115 H116 A141 V144	E66-M112 WeakPolarHBondContact O-CB 3.24Å; T110-M112 PolarHBondContact O-N 3.36Å; M112-V114 VanDerWaalsContact C-N 3.28Å; M112-V114 PolarHBondContact O-N 2.91Å; M112-L115 CarbonylContact O-C 3.43Å; M112-L115 PolarHBondContact O-N 3.23Å; M112-H116 WeakPolarHBondContact O-CA 3.44Å; M112-H116 WeakPolarHBondContact O-CB 3.38Å; M112-H116 PolarHBondContact O-N 3.1Å; M112-A141 HydrophobicContact SD-CB 3.86Å; M112-V144 HydrophobicContact CE-CG1 3.99Å
113	Q	70.9	Confident	70.4	Confident	54 Å²	54	53.5 Å²	53.5	25%	0.252	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-33.9	175.3	-75.3	165.4	-32.6	0	0	112.7	T110 H116	T110-Q113 PolarHBondContact O-N 2.98Å; T110-Q113 WeakPolarHBondContact OG1-CB 3.16Å; T110-Q113 VanDerWaalsContact OG1-CD 3.27Å; T110-Q113 VanDerWaalsContact OG1-CG 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.43Å; T110-Q113 PolarHBondContact OG1-N 3.47Å; T110-Q113 PolarHBondContact OG1-OE1 3.46Å; Q113-H116 WeakPolarHBondContact O-CB 3.43Å
114	V	68.5	Low	72.4	Confident	2 Å²	2	48 Å²	48	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-71.6	-43.2	175.8	177.4	0	0	0	0	111.7	F105 T110 V111 M112 H116 F373 Y377	F105-V114 HydrophobicContact CD1-CG2 4.01Å; F105-V114 HydrophobicContact CD2-CG2 4.28Å; F105-V114 HydrophobicContact CE1-CB 4.44Å; F105-V114 HydrophobicContact CE1-CG2 4Å; F105-V114 HydrophobicContact CE2-CG1 4.31Å; F105-V114 HydrophobicContact CE2-CG2 4.28Å; F105-V114 HydrophobicContact CG-CG2 4.16Å; F105-V114 HydrophobicContact CZ-CB 4.29Å; F105-V114 HydrophobicContact CZ-CG1 4.36Å; F105-V114 HydrophobicContact CZ-CG2 4.14Å; T110-V114 PolarHBondContact O-N 2.94Å; T110-V114 VanDerWaalsContact O-N 3.15Å; V111-V114 PolarHBondContact O-N 3.18Å; M112-V114 VanDerWaalsContact C-N 3.28Å; M112-V114 PolarHBondContact O-N 2.91Å; V114-H116 PolarHBondContact O-N 3.42Å; V114-F373 HydrophobicContact CG2-CD2 3.16Å; V114-F373 HydrophobicContact CG2-CE2 3.26Å; V114-F373 HydrophobicContact CG2-CG 4.25Å; V114-F373 HydrophobicContact CG2-CZ 4.47Å; V114-Y377 HydrophobicContact CG1-CD2 4.31Å
115	L	70.8	Confident	74.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-77.4	-12	-179.9	-64.9	-176.9	0	0	0	113	V111 M112 G117 L118 L120 A141 V142 H145 S376	V111-L115 HydrophobicContact CG2-CD1 4.26Å; V111-L115 WeakPolarHBondContact O-CG 3.39Å; V111-L115 PolarHBondContact O-N 3.19Å; M112-L115 CarbonylContact O-C 3.43Å; M112-L115 PolarHBondContact O-N 3.23Å; L115-G117 PolarHBondContact O-N 3.14Å; L115-L118 HydrophobicContact CD2-CD1 4.14Å; L115-L118 VanDerWaalsContact O-CB 3.24Å; L115-L118 WeakPolarHBondContact O-CB 3.28Å; L115-L118 PolarHBondContact O-N 3.39Å; L115-L120 HydrophobicContact CD1-CD1 4.45Å; L115-L120 HydrophobicContact CD2-CD1 4.23Å; L115-A141 HydrophobicContact CD1-CB 3.84Å; L115-V142 HydrophobicContact CD1-CG1 3.96Å; L115-H145 WeakPolarHBondContact CB-CE1 3.44Å; L115-H145 WeakPolarHBondContact CB-NE2 3.34Å; L115-H145 PolarHBondContact O-CD2 3.47Å; L115-H145 PolarHBondContact O-NE2 3.36Å; L115-S376 WeakPolarHBondContact CD1-OG 3.48Å; L115-S376 WeakPolarHBondContact CG-OG 3.35Å
116	H	71.8	Confident	75.8	Confident	20 Å²	20	42.9 Å²	42.9	9%	0.093	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	122.3	-179.5	-170.9	-90.3	0	0	0	111.9	T23 Y29 W40 M112 Q113 V114 L118	T23-H116 VanDerWaalsContact CG2-CE1 3.46Å; T23-H116 WeakPolarHBondContact CG2-CE1 3.42Å; T23-H116 WeakPolarHBondContact CG2-ND1 3.24Å; Y29-H116 AromaticContact CD1-CE1 3.95Å; Y29-H116 AromaticContact CE1-CE1 3.14Å; Y29-H116 WeakPolarHBondContact CE1-CE1 3.45Å; Y29-H116 AromaticContact CE1-ND1 3.97Å; Y29-H116 AromaticContact CE1-NE2 3.89Å; Y29-H116 AromaticContact CZ-CE1 3.37Å; Y29-H116 AromaticContact CZ-NE2 3.69Å; Y29-H116 PolarHBondContact OH-CE1 3.14Å; Y29-H116 PolarHBondContact OH-NE2 2.85Å; W40-H116 WeakPolarHBondContact CZ2-O 3.38Å; M112-H116 WeakPolarHBondContact O-CA 3.44Å; M112-H116 WeakPolarHBondContact O-CB 3.38Å; M112-H116 PolarHBondContact O-N 3.1Å; Q113-H116 WeakPolarHBondContact O-CB 3.43Å; V114-H116 PolarHBondContact O-N 3.42Å; H116-L118 VanDerWaalsContact C-N 3.35Å
117	G	66.5	Low	77.3	Confident	6 Å²	6	39.1 Å²	39.1	6%	0.062	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	2.5	-177.3	0	0	0	0	0	115	W40 L115	W40-G117 PolarHBondContact NE1-O 3.38Å; L115-G117 PolarHBondContact O-N 3.14Å
118	L	71.2	Confident	79	Confident	40 Å²	40	37 Å²	37	21%	0.209	18%	0.179	C	C	.	.			trans	-99.4	131.5	177	-60.2	-180	0	0	0	111.2	L115 H116 H145	L115-L118 HydrophobicContact CD2-CD1 4.14Å; L115-L118 VanDerWaalsContact O-CB 3.24Å; L115-L118 WeakPolarHBondContact O-CB 3.28Å; L115-L118 PolarHBondContact O-N 3.39Å; H116-L118 VanDerWaalsContact C-N 3.35Å; L118-H145 PolarHBondContact O-CD2 3.1Å; L118-H145 VanDerWaalsContact O-CD2 3.25Å
119	N	78.9	Confident	80.2	Confident	59 Å²	59	28.3 Å²	28.3	32%	0.316	15%	0.152	S	C	.	.			trans	-97.5	122.2	169.7	-179.5	4.4	0	0	0	109.9	S37 V38 S121	S37-N119 WeakPolarHBondContact CB-ND2 3.03Å; V38-N119 WeakPolarHBondContact O-CB 3.5Å; N119-S121 VanDerWaalsContact CG-OG 3.23Å; N119-S121 PolarHBondContact ND2-OG 2.79Å; N119-S121 VanDerWaalsContact ND2-OG 3.14Å; N119-S121 VanDerWaalsContact OD1-CB 3.25Å; N119-S121 WeakPolarHBondContact OD1-CB 3.44Å; N119-S121 PolarHBondContact OD1-N 3.18Å; N119-S121 PolarHBondContact OD1-OG 2.85Å
120	L	83	Confident	81.2	Confident	13 Å²	13	27.8 Å²	27.8	7%	0.068	15%	0.148	C	C	.	.			trans	-110	11.4	178.9	-56.4	-179.1	0	0	0	113.1	L115 E122 K123 V142 H145 A147	L115-L120 HydrophobicContact CD1-CD1 4.45Å; L115-L120 HydrophobicContact CD2-CD1 4.23Å; L120-E122 PolarHBondContact O-N 3.36Å; L120-E122 VanDerWaalsContact O-N 3.11Å; L120-K123 HydrophobicContact CB-CB 4.3Å; L120-K123 HydrophobicContact CB-CG 4.45Å; L120-K123 HydrophobicContact CD2-CG 4.19Å; L120-K123 WeakPolarHBondContact O-CB 3.35Å; L120-K123 PolarHBondContact O-N 3.12Å; L120-V142 HydrophobicContact CD1-CB 3.98Å; L120-V142 HydrophobicContact CD1-CG1 4.06Å; L120-H145 WeakPolarHBondContact CA-O 3.37Å; L120-H145 HydrophobicContact CB-CB 4.3Å; L120-H145 WeakPolarHBondContact CB-O 3.19Å; L120-H145 HydrophobicContact CD1-CB 4.02Å; L120-H145 HydrophobicContact CG-CB 4.02Å; L120-H145 PolarHBondContact N-O 2.91Å; L120-A147 HydrophobicContact CB-CB 3.78Å; L120-A147 HydrophobicContact CD1-CB 4.3Å; L120-A147 VanDerWaalsContact O-CA 3.24Å; L120-A147 WeakPolarHBondContact O-CA 3.26Å; L120-A147 PolarHBondContact O-N 2.97Å
121	S	83.5	Confident	81.9	Confident	48 Å²	48	27.5 Å²	27.5	34%	0.336	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-38.2	-179.5	45.5	0	0	0	0	115	N119 K123 G146	N119-S121 VanDerWaalsContact CG-OG 3.23Å; N119-S121 PolarHBondContact ND2-OG 2.79Å; N119-S121 VanDerWaalsContact ND2-OG 3.14Å; N119-S121 VanDerWaalsContact OD1-CB 3.25Å; N119-S121 WeakPolarHBondContact OD1-CB 3.44Å; N119-S121 PolarHBondContact OD1-N 3.18Å; N119-S121 PolarHBondContact OD1-OG 2.85Å; S121-K123 VanDerWaalsContact C-N 3.34Å; S121-G146 WeakPolarHBondContact CA-O 3.26Å
122	E	85.5	Confident	82.5	Confident	161 Å²	161	30.7 Å²	30.7	75%	0.752	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	8.2	179.9	-62.5	-57.9	121.3	0	0	113.6	L120	L120-E122 PolarHBondContact O-N 3.36Å; L120-E122 VanDerWaalsContact O-N 3.11Å
123	K	87.3	Confident	83	Confident	72 Å²	72	30 Å²	30	31%	0.313	17%	0.172	S	C	.	.			trans	-104.8	130	-177.4	-61	-54	-173.8	-168.7	0	111.6	L120 S121 S148 D203	L120-K123 HydrophobicContact CB-CB 4.3Å; L120-K123 HydrophobicContact CB-CG 4.45Å; L120-K123 HydrophobicContact CD2-CG 4.19Å; L120-K123 WeakPolarHBondContact O-CB 3.35Å; L120-K123 PolarHBondContact O-N 3.12Å; S121-K123 VanDerWaalsContact C-N 3.34Å; K123-S148 PolarHBondContact O-N 3.43Å; K123-D203 HydrophobicContact CD-CB 4.02Å; K123-D203 WeakPolarHBondContact CD-OD1 3.42Å; K123-D203 IonicContact NZ-OD1 3.37Å; K123-D203 PolarHBondContact NZ-OD1 3.04Å
124	T	94.7	Very high	83.5	Confident	18 Å²	18	28.1 Å²	28.1	11%	0.11	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.1	169.9	-60.5	0	0	0	0	110.3	S148 I150 R201 I202 D203 I204	T124-S148 CarbonylContact C-O 3.58Å; T124-S148 VanDerWaalsContact CA-O 3.31Å; T124-S148 WeakPolarHBondContact CA-O 3.25Å; T124-I150 HydrophobicContact CG2-CD1 4.16Å; T124-I150 HydrophobicContact CG2-CG1 4.48Å; T124-R201 WeakPolarHBondContact CB-O 3.23Å; T124-R201 WeakPolarHBondContact CG2-O 3.22Å; T124-I202 HydrophobicContact CG2-CG1 4.21Å; T124-D203 PolarHBondContact N-OD2 3.36Å; T124-D203 PolarHBondContact O-N 2.9Å; T124-I204 PolarHBondContact O-N 2.99Å
125	I	95.1	Very high	84.3	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.1	-176.4	-53	-176.9	0	0	0	109.5	F138 V142 A147 S148 V149 I150 I204 V206	I125-F138 HydrophobicContact CD1-CZ 4.29Å; I125-F138 HydrophobicContact CG2-CE1 3.96Å; I125-F138 HydrophobicContact CG2-CZ 4.31Å; I125-V142 HydrophobicContact CD1-CB 3.82Å; I125-V142 HydrophobicContact CD1-CG1 3.82Å; I125-V142 HydrophobicContact CD1-CG2 3.98Å; I125-A147 HydrophobicContact CD1-CB 4.01Å; I125-A147 HydrophobicContact CG1-CB 4.38Å; I125-S148 PolarHBondContact N-O 3.39Å; I125-V149 CarbonylContact O-C 3.55Å; I125-V149 VanDerWaalsContact O-CA 3.28Å; I125-V149 WeakPolarHBondContact O-CA 3.35Å; I125-I150 PolarHBondContact O-N 3.44Å; I125-I204 CarbonylContact C-O 3.46Å; I125-I204 WeakPolarHBondContact CA-O 3.28Å; I125-I204 HydrophobicContact CB-CB 4.44Å; I125-I204 HydrophobicContact CD1-CD1 3.97Å; I125-I204 HydrophobicContact CG1-CB 4.13Å; I125-I204 HydrophobicContact CG1-CD1 3.86Å; I125-I204 HydrophobicContact CG2-CB 4.15Å; I125-I204 HydrophobicContact CG2-CG2 3.91Å; I125-V206 HydrophobicContact CG2-CG2 4.07Å
126	F	97	Very high	85.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.3	167.6	173.6	-102.4	0	0	0	109.9	T128 I150 A152 I195 I202 I204 F205 V206 Y207 L237	F126-T128 HydrophobicContact CE1-CG2 3.86Å; F126-T128 HydrophobicContact CZ-CG2 3.97Å; F126-I150 WeakPolarHBondContact CA-O 3.38Å; F126-I150 HydrophobicContact CD2-CB 4.04Å; F126-I150 HydrophobicContact CD2-CG2 3.86Å; F126-I150 HydrophobicContact CE2-CG2 4.32Å; F126-A152 HydrophobicContact CE2-CB 3.59Å; F126-A152 HydrophobicContact CZ-CB 3.57Å; F126-I195 HydrophobicContact CD2-CD1 3.82Å; F126-I195 HydrophobicContact CD2-CG1 4.46Å; F126-I195 HydrophobicContact CE1-CD1 4.49Å; F126-I195 HydrophobicContact CE2-CD1 3.29Å; F126-I195 HydrophobicContact CE2-CG1 4.2Å; F126-I195 HydrophobicContact CZ-CD1 3.68Å; F126-I202 HydrophobicContact CB-CD1 4.32Å; F126-I202 HydrophobicContact CB-CG2 3.73Å; F126-I204 PolarHBondContact N-O 3.4Å; F126-F205 HydrophobicContact CB-CD1 4.08Å; F126-F205 AromaticContact CD1-CD1 3.85Å; F126-F205 HydrophobicContact CD1-CD1 3.85Å; F126-F205 HydrophobicContact CG-CD1 4.26Å; F126-F205 CarbonylContact O-C 3.58Å; F126-V206 PolarHBondContact O-N 3.06Å; F126-Y207 HydrophobicContact CD1-CE1 4.45Å; F126-Y207 HydrophobicContact CE1-CD1 4.49Å; F126-Y207 HydrophobicContact CE1-CE1 4.06Å; F126-L237 HydrophobicContact CE1-CD2 3.84Å; F126-L237 HydrophobicContact CZ-CD2 3.96Å
127	I	95.4	Very high	85.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	133.5	177.4	-178.5	163.7	0	0	0	112.6	F138 V139 V149 I150 V151 A152 V206 N208	I127-F138 HydrophobicContact CD1-CD1 3.65Å; I127-F138 HydrophobicContact CD1-CE1 4.2Å; I127-V139 HydrophobicContact CD1-CG2 4.38Å; I127-V139 HydrophobicContact CG2-CG2 3.8Å; I127-V149 HydrophobicContact CG2-CG1 3.91Å; I127-I150 PolarHBondContact N-O 2.88Å; I127-V151 HydrophobicContact CG2-CB 4.44Å; I127-V151 HydrophobicContact CG2-CG1 4.49Å; I127-V151 HydrophobicContact CG2-CG2 3.99Å; I127-A152 PolarHBondContact O-N 3.06Å; I127-V206 WeakPolarHBondContact CA-O 3.4Å; I127-V206 HydrophobicContact CB-CB 4.04Å; I127-V206 HydrophobicContact CD1-CB 4.19Å; I127-V206 HydrophobicContact CD1-CG1 3.91Å; I127-V206 HydrophobicContact CG1-CB 3.94Å; I127-V206 HydrophobicContact CG1-CG1 4.03Å; I127-N208 HydrophobicContact CD1-CB 4.29Å; I127-N208 HydrophobicContact CG1-CB 4.35Å
128	T	95.7	Very high	86.8	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130	165.5	66.4	0	0	0	0	110.4	F126 A152 V206 Y207 N208 A209 H234 L237	F126-T128 HydrophobicContact CE1-CG2 3.86Å; F126-T128 HydrophobicContact CZ-CG2 3.97Å; T128-A152 HydrophobicContact CG2-CB 4.22Å; T128-V206 PolarHBondContact N-O 3.48Å; T128-Y207 HydrophobicContact CG2-CD1 4.19Å; T128-Y207 WeakPolarHBondContact OG1-CA 3.45Å; T128-N208 WeakPolarHBondContact O-CB 3.43Å; T128-N208 PolarHBondContact O-ND2 3.4Å; T128-N208 PolarHBondContact OG1-N 2.74Å; T128-N208 VanDerWaalsContact OG1-N 3.14Å; T128-A209 PolarHBondContact O-N 3.14Å; T128-A209 WeakPolarHBondContact OG1-CB 3.45Å; T128-A209 PolarHBondContact OG1-N 3.42Å; T128-A209 VanDerWaalsContact OG1-N 3.13Å; T128-H234 PolarHBondContact OG1-NE2 3.31Å; T128-L237 HydrophobicContact CG2-CD2 4.12Å
129	G	89.1	Confident	87.7	Confident	19 Å²	19	28.6 Å²	28.6	20%	0.196	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	37.2	175.5	0	0	0	0	0	114.9	T131 A152 N208	G129-T131 VanDerWaalsContact C-N 3.31Å; G129-T131 PolarHBondContact O-N 3.44Å; G129-A152 PolarHBondContact N-O 2.94Å; G129-N208 PolarHBondContact O-ND2 3.22Å; G129-N208 VanDerWaalsContact O-ND2 3.15Å
130	G	85.9	Confident	88.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	8.4	178.2	0	0	0	0	0	116.2	F136	G130-F136 WeakPolarHBondContact O-CA 3.36Å
131	T	86.1	Confident	88.2	Confident	27 Å²	27	28.7 Å²	28.7	17%	0.166	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-15.5	-170.7	59.1	0	0	0	0	114.7	G129 V151 C153 A159 S162	G129-T131 VanDerWaalsContact C-N 3.31Å; G129-T131 PolarHBondContact O-N 3.44Å; T131-V151 HydrophobicContact CG2-CG1 4.1Å; T131-C153 HydrophobicContact CG2-CB 3.63Å; T131-A159 HydrophobicContact CG2-CB 3.43Å; T131-A159 VanDerWaalsContact CG2-CB 3.43Å; T131-S162 PolarHBondContact O-OG 3.13Å
132	S	83.3	Confident	88.3	Confident	67 Å²	67	26.4 Å²	26.4	47%	0.469	14%	0.143	S	C	.	.	S	Bend	trans	-153.6	169.9	179.1	67	0	0	0	0	111.8	G135 F136	S132-G135 PolarHBondContact O-N 3.17Å; S132-F136 PolarHBondContact O-N 3.21Å
133	G	83.7	Confident	88.5	Confident	23 Å²	23	19 Å²	19	24%	0.237	11%	0.109	C	C	.	.	H	α-helix	trans	61.5	-140.4	173	0	0	0	0	0	113.1	G135 F136 E137	G133-G135 VanDerWaalsContact C-N 3.31Å; G133-G135 PolarHBondContact O-N 3.25Å; G133-F136 PolarHBondContact O-N 3.19Å; G133-E137 PolarHBondContact O-N 3.04Å
134	I	80.6	Confident	88.4	Confident	14 Å²	14	18.4 Å²	18.4	7%	0.072	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-39.6	-177.8	-51.8	170.9	0	0	0	111	F136 E137 F138 P339 V343 T345 L368 L371 A372 Y375	I134-F136 VanDerWaalsContact C-N 3.32Å; I134-F136 PolarHBondContact O-N 2.84Å; I134-E137 PolarHBondContact O-N 3.49Å; I134-F138 WeakPolarHBondContact O-CB 3.25Å; I134-F138 PolarHBondContact O-N 2.99Å; I134-P339 HydrophobicContact CD1-CB 4.06Å; I134-P339 HydrophobicContact CD1-CG 4.29Å; I134-V343 HydrophobicContact CD1-CG1 4.38Å; I134-T345 HydrophobicContact CD1-CG2 4.15Å; I134-T345 HydrophobicContact CG1-CG2 4.31Å; I134-L368 HydrophobicContact CG1-CD2 3.64Å; I134-L371 HydrophobicContact CD1-CB 3.85Å; I134-L371 HydrophobicContact CD1-CD1 3.56Å; I134-L371 HydrophobicContact CD1-CG 4.33Å; I134-L371 HydrophobicContact CG1-CB 3.96Å; I134-L371 HydrophobicContact CG1-CD1 3.79Å; I134-L371 HydrophobicContact CG2-CB 3.76Å; I134-A372 HydrophobicContact CG2-CB 4.33Å; I134-Y375 HydrophobicContact CG2-CD2 4.38Å; I134-Y375 HydrophobicContact CG2-CE2 3.69Å
135	G	86.2	Confident	87.8	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.4	-40.7	178.8	0	0	0	0	0	112.2	S132 G133 F138 V139	S132-G135 PolarHBondContact O-N 3.17Å; G133-G135 VanDerWaalsContact C-N 3.31Å; G133-G135 PolarHBondContact O-N 3.25Å; G135-F138 PolarHBondContact O-N 3.04Å; G135-V139 VanDerWaalsContact O-CG2 3.27Å; G135-V139 WeakPolarHBondContact O-CG2 3.36Å; G135-V139 PolarHBondContact O-N 2.86Å
136	F	89	Confident	87.3	Confident	35 Å²	35	20.7 Å²	20.7	15%	0.154	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-45.4	177.7	178.8	-98.4	0	0	0	112.9	G130 S132 G133 I134 F138 V139 K140 L166	G130-F136 WeakPolarHBondContact O-CA 3.36Å; S132-F136 PolarHBondContact O-N 3.21Å; G133-F136 PolarHBondContact O-N 3.19Å; I134-F136 VanDerWaalsContact C-N 3.32Å; I134-F136 PolarHBondContact O-N 2.84Å; F136-F138 VanDerWaalsContact C-N 3.28Å; F136-F138 PolarHBondContact O-N 3.1Å; F136-V139 PolarHBondContact O-N 3.39Å; F136-K140 WeakPolarHBondContact O-CB 3.49Å; F136-K140 PolarHBondContact O-N 2.8Å; F136-L166 HydrophobicContact CD2-CD1 4.34Å; F136-L166 HydrophobicContact CE1-CD2 4.38Å; F136-L166 HydrophobicContact CE2-CD1 3.8Å; F136-L166 HydrophobicContact CE2-CD2 3.91Å; F136-L166 HydrophobicContact CE2-CG 3.7Å; F136-L166 HydrophobicContact CZ-CD1 4.38Å; F136-L166 HydrophobicContact CZ-CD2 3.62Å; F136-L166 HydrophobicContact CZ-CG 3.9Å
137	E	85.4	Confident	86.9	Confident	43 Å²	43	20.8 Å²	20.8	20%	0.201	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-35.8	177	-68.8	-55.7	140.5	0	0	111.8	G133 I134 A141 L368 V369 A372	G133-E137 PolarHBondContact O-N 3.04Å; I134-E137 PolarHBondContact O-N 3.49Å; E137-A141 WeakPolarHBondContact O-CB 3.18Å; E137-A141 PolarHBondContact O-N 2.98Å; E137-L368 HydrophobicContact CG-CB 3.97Å; E137-V369 HydrophobicContact CG-CG2 4.12Å; E137-A372 HydrophobicContact CB-CB 4.42Å
138	F	86.1	Confident	86.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-50.3	172.3	175.9	-105.1	0	0	0	111.9	I125 I127 I134 G135 F136 K140 A141 V142 V206 A372 Y375 T379	I125-F138 HydrophobicContact CD1-CZ 4.29Å; I125-F138 HydrophobicContact CG2-CE1 3.96Å; I125-F138 HydrophobicContact CG2-CZ 4.31Å; I127-F138 HydrophobicContact CD1-CD1 3.65Å; I127-F138 HydrophobicContact CD1-CE1 4.2Å; I134-F138 WeakPolarHBondContact O-CB 3.25Å; I134-F138 PolarHBondContact O-N 2.99Å; G135-F138 PolarHBondContact O-N 3.04Å; F136-F138 VanDerWaalsContact C-N 3.28Å; F136-F138 PolarHBondContact O-N 3.1Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 2.99Å; F138-A141 PolarHBondContact O-N 2.82Å; F138-A141 VanDerWaalsContact O-N 3.16Å; F138-V142 HydrophobicContact CD2-CG1 4.03Å; F138-V142 HydrophobicContact CE1-CG1 4.2Å; F138-V142 HydrophobicContact CE2-CG1 3.52Å; F138-V142 HydrophobicContact CZ-CG1 3.64Å; F138-V142 WeakPolarHBondContact O-CG2 3.29Å; F138-V142 PolarHBondContact O-N 2.81Å; F138-V206 HydrophobicContact CE1-CG2 3.9Å; F138-V206 HydrophobicContact CZ-CG2 4.16Å; F138-A372 HydrophobicContact CB-CB 3.88Å; F138-Y375 VanDerWaalsContact CD2-CB 3.46Å; F138-Y375 HydrophobicContact CD2-CD2 4.31Å; F138-Y375 HydrophobicContact CD2-CG 4.19Å; F138-Y375 HydrophobicContact CE2-CG 4.37Å; F138-Y375 HydrophobicContact CG-CD2 4.39Å; F138-Y375 HydrophobicContact CG-CG 4.46Å; F138-T379 HydrophobicContact CZ-CG2 4.45Å
139	V	90.6	Very high	86.9	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.9	-45.9	177.7	172.5	0	0	0	0	110.8	I127 G135 F136 A141 V142 V143 V149 V151 M163 L166 I175	I127-V139 HydrophobicContact CD1-CG2 4.38Å; I127-V139 HydrophobicContact CG2-CG2 3.8Å; G135-V139 VanDerWaalsContact O-CG2 3.27Å; G135-V139 WeakPolarHBondContact O-CG2 3.36Å; G135-V139 PolarHBondContact O-N 2.86Å; F136-V139 PolarHBondContact O-N 3.39Å; V139-A141 VanDerWaalsContact C-N 3.33Å; V139-A141 PolarHBondContact O-N 3.35Å; V139-V142 WeakPolarHBondContact O-CG2 3.41Å; V139-V142 PolarHBondContact O-N 2.82Å; V139-V143 HydrophobicContact CG1-CG2 4.14Å; V139-V143 VanDerWaalsContact O-CB 3.28Å; V139-V143 WeakPolarHBondContact O-CB 3.06Å; V139-V143 WeakPolarHBondContact O-CG2 3.49Å; V139-V143 PolarHBondContact O-N 3.4Å; V139-V149 HydrophobicContact CG1-CG1 4.23Å; V139-V149 HydrophobicContact CG2-CG1 4.11Å; V139-V151 HydrophobicContact CG1-CG2 4.43Å; V139-V151 HydrophobicContact CG2-CG2 4.18Å; V139-M163 HydrophobicContact CG1-SD 4.46Å; V139-L166 HydrophobicContact CG1-CD1 3.8Å; V139-I175 HydrophobicContact CG1-CD1 4.45Å
140	K	87.5	Confident	87.3	Confident	73 Å²	73	20.2 Å²	20.2	32%	0.317	12%	0.124	S	C	.	.	H	α-helix	trans	-53.9	-50.8	175.5	-178.5	-179.6	174	-169.1	0	111.1	F136 F138 V144 L166	F136-K140 WeakPolarHBondContact O-CB 3.49Å; F136-K140 PolarHBondContact O-N 2.8Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 2.99Å; K140-V144 VanDerWaalsContact O-CG2 3.26Å; K140-V144 WeakPolarHBondContact O-CG2 3.33Å; K140-V144 PolarHBondContact O-N 2.98Å; K140-V144 VanDerWaalsContact O-N 3.12Å; K140-L166 HydrophobicContact CB-CD2 3.62Å; K140-L166 HydrophobicContact CD-CD2 4.21Å; K140-L166 HydrophobicContact CG-CD2 3.64Å
141	A	84.6	Confident	87.8	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-47.3	-175.9	0	0	0	0	0	112.4	V111 M112 L115 E137 F138 V139 V143 V144 H145	V111-A141 HydrophobicContact CB-CB 4.17Å; V111-A141 HydrophobicContact CG1-CB 3.42Å; V111-A141 VanDerWaalsContact CG1-CB 3.42Å; V111-A141 HydrophobicContact CG2-CB 3.66Å; M112-A141 HydrophobicContact SD-CB 3.86Å; L115-A141 HydrophobicContact CD1-CB 3.84Å; E137-A141 WeakPolarHBondContact O-CB 3.18Å; E137-A141 PolarHBondContact O-N 2.98Å; F138-A141 PolarHBondContact O-N 2.82Å; F138-A141 VanDerWaalsContact O-N 3.16Å; V139-A141 VanDerWaalsContact C-N 3.33Å; V139-A141 PolarHBondContact O-N 3.35Å; A141-V143 VanDerWaalsContact C-N 3.34Å; A141-V143 PolarHBondContact O-N 2.9Å; A141-V144 PolarHBondContact O-N 3.27Å; A141-H145 PolarHBondContact O-N 2.82Å; A141-H145 PolarHBondContact O-ND1 3.05Å
142	V	86	Confident	88.3	Confident	0 Å²	0	19 Å²	19	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.9	-33.8	-177.7	-60.4	0	0	0	0	112.7	L115 L120 I125 F138 V139 H145 G146 A147 V149	L115-V142 HydrophobicContact CD1-CG1 3.96Å; L120-V142 HydrophobicContact CD1-CB 3.98Å; L120-V142 HydrophobicContact CD1-CG1 4.06Å; I125-V142 HydrophobicContact CD1-CB 3.82Å; I125-V142 HydrophobicContact CD1-CG1 3.82Å; I125-V142 HydrophobicContact CD1-CG2 3.98Å; F138-V142 HydrophobicContact CD2-CG1 4.03Å; F138-V142 HydrophobicContact CE1-CG1 4.2Å; F138-V142 HydrophobicContact CE2-CG1 3.52Å; F138-V142 HydrophobicContact CZ-CG1 3.64Å; F138-V142 WeakPolarHBondContact O-CG2 3.29Å; F138-V142 PolarHBondContact O-N 2.81Å; V139-V142 WeakPolarHBondContact O-CG2 3.41Å; V139-V142 PolarHBondContact O-N 2.82Å; V142-H145 CarbonylContact O-C 3.57Å; V142-H145 PolarHBondContact O-N 3.32Å; V142-G146 PolarHBondContact O-N 3.41Å; V142-A147 HydrophobicContact CB-CB 3.94Å; V142-A147 HydrophobicContact CG2-CB 4.25Å; V142-A147 VanDerWaalsContact O-CB 3.24Å; V142-A147 WeakPolarHBondContact O-CB 3.47Å; V142-A147 PolarHBondContact O-N 2.99Å; V142-V149 HydrophobicContact CG2-CG2 3.66Å
143	V	89.1	Confident	88.8	Confident	4 Å²	4	16.1 Å²	16.1	2%	0.024	10%	0.096	C	C	.	.	H	α-helix	trans	-68.2	-39.3	176.7	167.2	0	0	0	0	111.5	V139 A141 H145 G146 V149 T170 A173 I175	V139-V143 HydrophobicContact CG1-CG2 4.14Å; V139-V143 VanDerWaalsContact O-CB 3.28Å; V139-V143 WeakPolarHBondContact O-CB 3.06Å; V139-V143 WeakPolarHBondContact O-CG2 3.49Å; V139-V143 PolarHBondContact O-N 3.4Å; A141-V143 VanDerWaalsContact C-N 3.34Å; A141-V143 PolarHBondContact O-N 2.9Å; V143-H145 PolarHBondContact O-N 2.79Å; V143-G146 PolarHBondContact O-N 3.37Å; V143-V149 HydrophobicContact CG2-CB 4.32Å; V143-V149 HydrophobicContact CG2-CG2 3.56Å; V143-T170 HydrophobicContact CG1-CG2 4.06Å; V143-A173 HydrophobicContact CG1-CB 3.21Å; V143-I175 HydrophobicContact CG1-CD1 4.43Å; V143-I175 HydrophobicContact CG2-CD1 3.99Å; V143-I175 HydrophobicContact CG2-CG1 3.95Å
144	V	85.1	Confident	89.2	Confident	61 Å²	61	21.6 Å²	21.6	37%	0.37	11%	0.11	S	C	.	.	H	α-helix	trans	-59.8	-32.4	173.4	168.8	0	0	0	0	111.2	M112 K140 A141 G146	M112-V144 HydrophobicContact CE-CG1 3.99Å; K140-V144 VanDerWaalsContact O-CG2 3.26Å; K140-V144 WeakPolarHBondContact O-CG2 3.33Å; K140-V144 PolarHBondContact O-N 2.98Å; K140-V144 VanDerWaalsContact O-N 3.12Å; A141-V144 PolarHBondContact O-N 3.27Å; V144-G146 VanDerWaalsContact C-N 3.27Å; V144-G146 PolarHBondContact O-N 2.94Å
145	H	82.1	Confident	89.7	Confident	31 Å²	31	25.3 Å²	25.3	14%	0.144	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	10.7	175.5	-63.5	78.7	0	0	0	113.4	L115 L118 L120 A141 V142 V143	L115-H145 WeakPolarHBondContact CB-CE1 3.44Å; L115-H145 WeakPolarHBondContact CB-NE2 3.34Å; L115-H145 PolarHBondContact O-CD2 3.47Å; L115-H145 PolarHBondContact O-NE2 3.36Å; L118-H145 PolarHBondContact O-CD2 3.1Å; L118-H145 VanDerWaalsContact O-CD2 3.25Å; L120-H145 WeakPolarHBondContact CA-O 3.37Å; L120-H145 HydrophobicContact CB-CB 4.3Å; L120-H145 WeakPolarHBondContact CB-O 3.19Å; L120-H145 HydrophobicContact CD1-CB 4.02Å; L120-H145 HydrophobicContact CG-CB 4.02Å; L120-H145 PolarHBondContact N-O 2.91Å; A141-H145 PolarHBondContact O-N 2.82Å; A141-H145 PolarHBondContact O-ND1 3.05Å; V142-H145 CarbonylContact O-C 3.57Å; V142-H145 PolarHBondContact O-N 3.32Å; V143-H145 PolarHBondContact O-N 2.79Å
146	G	85.8	Confident	90.1	Very high	35 Å²	35	27.2 Å²	27.2	36%	0.361	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	95	-3.4	171.4	0	0	0	0	0	116.1	S121 V142 V143 V144	S121-G146 WeakPolarHBondContact CA-O 3.26Å; V142-G146 PolarHBondContact O-N 3.41Å; V143-G146 PolarHBondContact O-N 3.37Å; V144-G146 VanDerWaalsContact C-N 3.27Å; V144-G146 PolarHBondContact O-N 2.94Å
147	A	88.4	Confident	90.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.008	16%	0.157	C	C	.	.			trans	-61.7	142.5	-177.6	0	0	0	0	0	112.6	L120 I125 V142 V149	L120-A147 HydrophobicContact CB-CB 3.78Å; L120-A147 HydrophobicContact CD1-CB 4.3Å; L120-A147 VanDerWaalsContact O-CA 3.24Å; L120-A147 WeakPolarHBondContact O-CA 3.26Å; L120-A147 PolarHBondContact O-N 2.97Å; I125-A147 HydrophobicContact CD1-CB 4.01Å; I125-A147 HydrophobicContact CG1-CB 4.38Å; V142-A147 HydrophobicContact CB-CB 3.94Å; V142-A147 HydrophobicContact CG2-CB 4.25Å; V142-A147 VanDerWaalsContact O-CB 3.24Å; V142-A147 WeakPolarHBondContact O-CB 3.47Å; V142-A147 PolarHBondContact O-N 2.99Å; A147-V149 HydrophobicContact CB-CG2 4.42Å
148	S	94.2	Very high	90.4	Very high	9 Å²	9	30.9 Å²	30.9	6%	0.063	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132	164.7	-62.9	0	0	0	0	109.4	K123 T124 I125 K174	K123-S148 PolarHBondContact O-N 3.43Å; T124-S148 CarbonylContact C-O 3.58Å; T124-S148 VanDerWaalsContact CA-O 3.31Å; T124-S148 WeakPolarHBondContact CA-O 3.25Å; I125-S148 PolarHBondContact N-O 3.39Å; S148-K174 WeakPolarHBondContact CA-O 3.34Å; S148-K174 WeakPolarHBondContact OG-CD 3.46Å
149	V	95.7	Very high	90.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.6	-173.9	-173.1	0	0	0	0	111.8	I125 I127 V139 V142 V143 A147 V151 K174 I175 D176	I125-V149 CarbonylContact O-C 3.55Å; I125-V149 VanDerWaalsContact O-CA 3.28Å; I125-V149 WeakPolarHBondContact O-CA 3.35Å; I127-V149 HydrophobicContact CG2-CG1 3.91Å; V139-V149 HydrophobicContact CG1-CG1 4.23Å; V139-V149 HydrophobicContact CG2-CG1 4.11Å; V142-V149 HydrophobicContact CG2-CG2 3.66Å; V143-V149 HydrophobicContact CG2-CB 4.32Å; V143-V149 HydrophobicContact CG2-CG2 3.56Å; A147-V149 HydrophobicContact CB-CG2 4.42Å; V149-V151 HydrophobicContact CG1-CG2 3.76Å; V149-K174 PolarHBondContact N-O 3.22Å; V149-I175 CarbonylContact O-C 3.42Å; V149-I175 VanDerWaalsContact O-CA 3.29Å; V149-I175 WeakPolarHBondContact O-CA 3.23Å; V149-D176 PolarHBondContact O-N 3.01Å
150	I	97.1	Very high	90.8	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.8	170.4	-55.1	169.4	0	0	0	107.4	T124 I125 F126 I127 D176 V178 M198 I202	T124-I150 HydrophobicContact CG2-CD1 4.16Å; T124-I150 HydrophobicContact CG2-CG1 4.48Å; I125-I150 PolarHBondContact O-N 3.44Å; F126-I150 WeakPolarHBondContact CA-O 3.38Å; F126-I150 HydrophobicContact CD2-CB 4.04Å; F126-I150 HydrophobicContact CD2-CG2 3.86Å; F126-I150 HydrophobicContact CE2-CG2 4.32Å; I127-I150 PolarHBondContact N-O 2.88Å; I150-D176 CarbonylContact C-O 3.53Å; I150-D176 WeakPolarHBondContact CA-O 3.43Å; I150-D176 HydrophobicContact CG1-CB 4.35Å; I150-V178 HydrophobicContact CG2-CG2 3.62Å; I150-M198 HydrophobicContact CD1-SD 3.96Å; I150-M198 HydrophobicContact CG1-SD 4.5Å; I150-I202 HydrophobicContact CD1-CD1 4.17Å; I150-I202 HydrophobicContact CD1-CG1 4.31Å
151	V	96.8	Very high	91	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	109.9	-178.5	-176	0	0	0	0	109.9	I127 T131 V139 V149 I175 D176 L177 V178	I127-V151 HydrophobicContact CG2-CB 4.44Å; I127-V151 HydrophobicContact CG2-CG1 4.49Å; I127-V151 HydrophobicContact CG2-CG2 3.99Å; T131-V151 HydrophobicContact CG2-CG1 4.1Å; V139-V151 HydrophobicContact CG1-CG2 4.43Å; V139-V151 HydrophobicContact CG2-CG2 4.18Å; V149-V151 HydrophobicContact CG1-CG2 3.76Å; V151-I175 HydrophobicContact CG2-CG2 4.01Å; V151-D176 PolarHBondContact N-O 3.41Å; V151-L177 HydrophobicContact CB-CD2 3.88Å; V151-L177 HydrophobicContact CG1-CD2 4.46Å; V151-V178 PolarHBondContact O-N 3.27Å
152	A	97.3	Very high	91.3	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.017	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.3	169.3	0	0	0	0	0	110.5	F126 I127 T128 G129 V178 C180	F126-A152 HydrophobicContact CE2-CB 3.59Å; F126-A152 HydrophobicContact CZ-CB 3.57Å; I127-A152 PolarHBondContact O-N 3.06Å; T128-A152 HydrophobicContact CG2-CB 4.22Å; G129-A152 PolarHBondContact N-O 2.94Å; A152-V178 WeakPolarHBondContact CA-O 3.38Å; A152-C180 HydrophobicContact CB-CB 3.8Å
153	C	94.3	Very high	91.5	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.041	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	155.3	-175.4	63.2	0	0	0	0	113.3	T131 A159 V178 L179 C180	T131-C153 HydrophobicContact CG2-CB 3.63Å; C153-A159 HydrophobicContact CB-CB 4.37Å; C153-A159 WeakPolarHBondContact SG-CB 3.46Å; C153-V178 PolarHBondContact N-O 2.86Å; C153-L179 WeakPolarHBondContact O-CA 3.37Å; C153-C180 CarbonylContact C-O 3.56Å; C153-C180 VanDerWaalsContact C-O 3.31Å; C153-C180 PolarHBondContact O-N 3.16Å
154	R	91.4	Very high	91.6	Very high	137 Å²	137	48 Å²	48	52%	0.517	24%	0.241	S	C	.	.	S	Bend	trans	-75.7	-32.3	-177	-55.1	-171.5	-77.1	-174.1	-5.4	113.8	L179 C180 D181	R154-L179 WeakPolarHBondContact O-CD1 3.38Å; R154-C180 WeakPolarHBondContact CG-O 3.42Å; R154-C180 PolarHBondContact N-O 3.41Å; R154-D181 HydrophobicContact CG-CB 4.48Å
155	N	91.3	Very high	91.8	Very high	92 Å²	92	51.6 Å²	51.6	49%	0.492	25%	0.252	S	S	.	.			trans	-126.9	104.5	-176.9	-177.5	-40.7	0	0	0	108.6	D157 S158 A159	N155-D157 VanDerWaalsContact C-N 3.33Å; N155-D157 PolarHBondContact O-N 3.21Å; N155-D157 PolarHBondContact OD1-N 3.25Å; N155-S158 PolarHBondContact OD1-N 3.12Å; N155-A159 WeakPolarHBondContact O-CB 3.48Å; N155-A159 PolarHBondContact O-N 3.26Å; N155-A159 VanDerWaalsContact O-N 3.11Å
156	I	93.4	Very high	92	Very high	41 Å²	41	50.3 Å²	50.3	21%	0.21	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-35.4	-178.4	-76.2	178.9	0	0	0	111.5	A159 R160 L179	I156-A159 CarbonylContact O-C 3.31Å; I156-A159 WeakPolarHBondContact O-CB 3.36Å; I156-A159 PolarHBondContact O-N 3.18Å; I156-R160 HydrophobicContact CG2-CG 4.16Å; I156-R160 VanDerWaalsContact CG2-CZ 3.48Å; I156-R160 VanDerWaalsContact O-CG 3.31Å; I156-R160 WeakPolarHBondContact O-CG 3.17Å; I156-R160 PolarHBondContact O-N 3.24Å; I156-L179 HydrophobicContact CD1-CB 3.71Å; I156-L179 HydrophobicContact CD1-CD1 4.22Å; I156-L179 HydrophobicContact CD1-CG 4.49Å; I156-L179 HydrophobicContact CG1-CB 4.31Å; I156-L179 HydrophobicContact CG1-CD1 4.11Å
157	D	92.4	Very high	92.1	Very high	99 Å²	99	53.7 Å²	53.7	53%	0.529	25%	0.251	S	S	.	.	H	α-helix	trans	-69.4	-45.4	-176.1	-61	-44.7	0	0	0	111.5	N155 A159 R160 E161	N155-D157 VanDerWaalsContact C-N 3.33Å; N155-D157 PolarHBondContact O-N 3.21Å; N155-D157 PolarHBondContact OD1-N 3.25Å; D157-A159 VanDerWaalsContact C-N 3.26Å; D157-A159 PolarHBondContact O-N 3.18Å; D157-R160 WeakPolarHBondContact O-CB 3.4Å; D157-R160 PolarHBondContact O-N 2.87Å; D157-R160 IonicContact OD1-NH1 3.13Å; D157-R160 PolarHBondContact OD1-NH1 3.49Å; D157-E161 PolarHBondContact O-N 2.77Å; D157-E161 VanDerWaalsContact O-N 3.1Å
158	S	88.5	Confident	92.1	Very high	56 Å²	56	60.1 Å²	60.1	39%	0.392	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-37.2	170.8	-179	0	0	0	0	111.7	N155 E161 S162	N155-S158 PolarHBondContact OD1-N 3.12Å; S158-E161 PolarHBondContact O-N 2.92Å; S158-S162 PolarHBondContact O-N 2.73Å; S158-S162 VanDerWaalsContact O-N 3.14Å
159	A	91.2	Very high	91.4	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-43.4	175	0	0	0	0	0	112	T131 C153 N155 I156 D157 E161 S162 M163 L177	T131-A159 HydrophobicContact CG2-CB 3.43Å; T131-A159 VanDerWaalsContact CG2-CB 3.43Å; C153-A159 HydrophobicContact CB-CB 4.37Å; C153-A159 WeakPolarHBondContact SG-CB 3.46Å; N155-A159 WeakPolarHBondContact O-CB 3.48Å; N155-A159 PolarHBondContact O-N 3.26Å; N155-A159 VanDerWaalsContact O-N 3.11Å; I156-A159 CarbonylContact O-C 3.31Å; I156-A159 WeakPolarHBondContact O-CB 3.36Å; I156-A159 PolarHBondContact O-N 3.18Å; D157-A159 VanDerWaalsContact C-N 3.26Å; D157-A159 PolarHBondContact O-N 3.18Å; A159-E161 VanDerWaalsContact C-N 3.3Å; A159-E161 PolarHBondContact O-N 3.46Å; A159-S162 PolarHBondContact O-N 2.83Å; A159-M163 VanDerWaalsContact O-CG 3.26Å; A159-M163 WeakPolarHBondContact O-CG 3.48Å; A159-M163 PolarHBondContact O-N 2.95Å; A159-L177 HydrophobicContact CB-CD1 3.92Å; A159-L177 HydrophobicContact CB-CD2 4.01Å
160	R	94.1	Very high	90.9	Very high	136 Å²	136	66 Å²	66	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-59	-41.3	176.8	-75.8	170.2	178.3	156.6	-4.9	111.4	I156 D157 M163 K164 L177	I156-R160 HydrophobicContact CG2-CG 4.16Å; I156-R160 VanDerWaalsContact CG2-CZ 3.48Å; I156-R160 VanDerWaalsContact O-CG 3.31Å; I156-R160 WeakPolarHBondContact O-CG 3.17Å; I156-R160 PolarHBondContact O-N 3.24Å; D157-R160 WeakPolarHBondContact O-CB 3.4Å; D157-R160 PolarHBondContact O-N 2.87Å; D157-R160 IonicContact OD1-NH1 3.13Å; D157-R160 PolarHBondContact OD1-NH1 3.49Å; R160-M163 PolarHBondContact O-N 3.47Å; R160-K164 WeakPolarHBondContact O-CG 3.13Å; R160-K164 PolarHBondContact O-N 2.86Å; R160-L177 HydrophobicContact CB-CD1 4.39Å; R160-L177 HydrophobicContact CG-CD1 3.62Å
161	E	92	Very high	90.4	Very high	126 Å²	126	71.1 Å²	71.1	59%	0.589	35%	0.348	S	S	*	.	H	α-helix	trans	-63.1	-46.3	175.4	-69.6	-178	172.1	0	0	112.6	D157 S158 A159 M163 K164 K165	D157-E161 PolarHBondContact O-N 2.77Å; D157-E161 VanDerWaalsContact O-N 3.1Å; S158-E161 PolarHBondContact O-N 2.92Å; A159-E161 VanDerWaalsContact C-N 3.3Å; A159-E161 PolarHBondContact O-N 3.46Å; E161-M163 VanDerWaalsContact C-N 3.33Å; E161-M163 PolarHBondContact O-N 2.84Å; E161-K164 PolarHBondContact O-N 3Å; E161-K165 PolarHBondContact O-N 2.91Å
162	S	90.2	Very high	89.7	Confident	20 Å²	20	74.6 Å²	74.6	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-61.8	-41	175	-72.1	0	0	0	0	111.7	T131 S158 A159 K165 L166	T131-S162 PolarHBondContact O-OG 3.13Å; S158-S162 PolarHBondContact O-N 2.73Å; S158-S162 VanDerWaalsContact O-N 3.14Å; A159-S162 PolarHBondContact O-N 2.83Å; S162-K165 WeakPolarHBondContact O-CB 3.44Å; S162-K165 PolarHBondContact O-N 2.68Å; S162-L166 PolarHBondContact O-N 2.9Å
163	M	92	Very high	89.1	Confident	8 Å²	8	74.9 Å²	74.9	4%	0.039	38%	0.375	C	S	.	.	H	α-helix	trans	-71.5	-30.6	178.9	-63.9	-43.8	120	0	0	113	V139 A159 R160 E161 K165 L166 K167 I175 L177	V139-M163 HydrophobicContact CG1-SD 4.46Å; A159-M163 VanDerWaalsContact O-CG 3.26Å; A159-M163 WeakPolarHBondContact O-CG 3.48Å; A159-M163 PolarHBondContact O-N 2.95Å; R160-M163 PolarHBondContact O-N 3.47Å; E161-M163 VanDerWaalsContact C-N 3.33Å; E161-M163 PolarHBondContact O-N 2.84Å; M163-K165 VanDerWaalsContact C-N 3.3Å; M163-K165 PolarHBondContact O-N 2.72Å; M163-L166 HydrophobicContact CE-CD1 4.39Å; M163-L166 PolarHBondContact O-N 3.42Å; M163-L166 HydrophobicContact SD-CD1 3.82Å; M163-K167 WeakPolarHBondContact O-CG 3.41Å; M163-K167 PolarHBondContact O-N 2.75Å; M163-I175 HydrophobicContact CG-CG2 3.96Å; M163-I175 HydrophobicContact SD-CD1 3.75Å; M163-I175 HydrophobicContact SD-CG2 3.71Å; M163-L177 HydrophobicContact CG-CD1 4.35Å; M163-L177 HydrophobicContact CG-CD2 3.76Å; M163-L177 HydrophobicContact CG-CG 4.41Å
164	K	90.6	Very high	89	Confident	146 Å²	146	81.2 Å²	81.2	64%	0.635	40%	0.402	S	S	*	.	H	α-helix	trans	-58.4	-42.8	171.4	-80.3	175.8	-178.8	-179.4	0	111.2	R160 E161 L166 K167 I168	R160-K164 WeakPolarHBondContact O-CG 3.13Å; R160-K164 PolarHBondContact O-N 2.86Å; E161-K164 PolarHBondContact O-N 3Å; K164-L166 VanDerWaalsContact C-N 3.29Å; K164-L166 PolarHBondContact O-N 3.03Å; K164-K167 PolarHBondContact O-N 3.08Å; K164-I168 WeakPolarHBondContact O-CG1 3.48Å; K164-I168 PolarHBondContact O-N 3.47Å; K164-I168 VanDerWaalsContact O-N 3.1Å
165	K	88	Confident	89.1	Confident	137 Å²	137	75.6 Å²	75.6	60%	0.596	38%	0.382	S	S	*	.	H	α-helix	trans	-60.7	-38.6	176.2	-63.4	174.3	-177	175.1	0	112	E161 S162 M163	E161-K165 PolarHBondContact O-N 2.91Å; S162-K165 WeakPolarHBondContact O-CB 3.44Å; S162-K165 PolarHBondContact O-N 2.68Å; M163-K165 VanDerWaalsContact C-N 3.3Å; M163-K165 PolarHBondContact O-N 2.72Å
166	L	87.3	Confident	89.4	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-70.9	-39	175.8	-65.9	-178.6	0	0	0	112.7	F136 V139 K140 S162 M163 K164 I168 L169 T170 I175	F136-L166 HydrophobicContact CD2-CD1 4.34Å; F136-L166 HydrophobicContact CE1-CD2 4.38Å; F136-L166 HydrophobicContact CE2-CD1 3.8Å; F136-L166 HydrophobicContact CE2-CD2 3.91Å; F136-L166 HydrophobicContact CE2-CG 3.7Å; F136-L166 HydrophobicContact CZ-CD1 4.38Å; F136-L166 HydrophobicContact CZ-CD2 3.62Å; F136-L166 HydrophobicContact CZ-CG 3.9Å; V139-L166 HydrophobicContact CG1-CD1 3.8Å; K140-L166 HydrophobicContact CB-CD2 3.62Å; K140-L166 HydrophobicContact CD-CD2 4.21Å; K140-L166 HydrophobicContact CG-CD2 3.64Å; S162-L166 PolarHBondContact O-N 2.9Å; M163-L166 HydrophobicContact CE-CD1 4.39Å; M163-L166 PolarHBondContact O-N 3.42Å; M163-L166 HydrophobicContact SD-CD1 3.82Å; K164-L166 VanDerWaalsContact C-N 3.29Å; K164-L166 PolarHBondContact O-N 3.03Å; L166-I168 VanDerWaalsContact C-N 3.26Å; L166-I168 PolarHBondContact O-N 3.02Å; L166-L169 PolarHBondContact O-N 3.47Å; L166-L169 VanDerWaalsContact O-N 3.1Å; L166-T170 PolarHBondContact O-N 2.93Å; L166-I175 HydrophobicContact CB-CD1 4.3Å; L166-I175 HydrophobicContact CD1-CD1 4.09Å
167	K	88.4	Confident	89.5	Confident	106 Å²	106	74.1 Å²	74.1	46%	0.461	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-27.4	176.8	-74.3	-172.4	176.1	-171.3	0	113.2	M163 K164 T170 P171 A173	M163-K167 WeakPolarHBondContact O-CG 3.41Å; M163-K167 PolarHBondContact O-N 2.75Å; K164-K167 PolarHBondContact O-N 3.08Å; K167-T170 CarbonylContact O-C 3.36Å; K167-P171 VanDerWaalsContact O-CA 3.24Å; K167-P171 WeakPolarHBondContact O-CA 3.3Å; K167-A173 HydrophobicContact CG-CB 4.44Å
168	I	87.5	Confident	89.8	Confident	137 Å²	137	69.8 Å²	69.8	70%	0.703	35%	0.351	S	S	*	.	H	α-helix	trans	-65.5	-42.2	171.2	-66.9	165.6	0	0	0	110.5	K164 L166	K164-I168 WeakPolarHBondContact O-CG1 3.48Å; K164-I168 PolarHBondContact O-N 3.47Å; K164-I168 VanDerWaalsContact O-N 3.1Å; L166-I168 VanDerWaalsContact C-N 3.26Å; L166-I168 PolarHBondContact O-N 3.02Å
169	L	80.8	Confident	90.2	Very high	112 Å²	112	71.4 Å²	71.4	59%	0.586	36%	0.355	S	S	*	.	H	α-helix	trans	-76.1	-35.1	179.2	-64.6	173.6	0	0	0	112.7	L166	L166-L169 PolarHBondContact O-N 3.47Å; L166-L169 VanDerWaalsContact O-N 3.1Å
170	T	85.3	Confident	90.5	Very high	19 Å²	19	71.6 Å²	71.6	12%	0.117	36%	0.356	C	S	.	.			trans	-137	85.7	-177.4	-49.6	0	0	0	0	109.1	V143 L166 K167 S172 A173	V143-T170 HydrophobicContact CG1-CG2 4.06Å; L166-T170 PolarHBondContact O-N 2.93Å; K167-T170 CarbonylContact O-C 3.36Å; T170-S172 PolarHBondContact O-N 3.25Å; T170-S172 VanDerWaalsContact O-N 3.15Å; T170-A173 HydrophobicContact CG2-CB 4.29Å; T170-A173 WeakPolarHBondContact O-CB 3.46Å; T170-A173 PolarHBondContact O-N 2.93Å
171	P	84.8	Confident	90.6	Very high	109 Å²	109	67.3 Å²	67.3	71%	0.708	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27	-177.8	-27.8	36.1	0	0	0	114.3	K167 A173	K167-P171 VanDerWaalsContact O-CA 3.24Å; K167-P171 WeakPolarHBondContact O-CA 3.3Å; P171-A173 PolarHBondContact O-N 2.81Å
172	S	83.6	Confident	90.8	Very high	73 Å²	73	61.6 Å²	61.6	51%	0.51	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.1	175.8	53	0	0	0	0	114.2	T170 K174	T170-S172 PolarHBondContact O-N 3.25Å; T170-S172 VanDerWaalsContact O-N 3.15Å; S172-K174 PolarHBondContact O-N 2.91Å; S172-K174 VanDerWaalsContact O-N 3.16Å
173	A	84.6	Confident	91.1	Very high	9 Å²	9	61.5 Å²	61.5	7%	0.074	32%	0.316	C	S	.	.			trans	-61.3	113.4	-178.8	0	0	0	0	0	112.5	V143 K167 T170 P171 I175	V143-A173 HydrophobicContact CG1-CB 3.21Å; K167-A173 HydrophobicContact CG-CB 4.44Å; T170-A173 HydrophobicContact CG2-CB 4.29Å; T170-A173 WeakPolarHBondContact O-CB 3.46Å; T170-A173 PolarHBondContact O-N 2.93Å; P171-A173 PolarHBondContact O-N 2.81Å; A173-I175 HydrophobicContact CB-CD1 4.05Å; A173-I175 HydrophobicContact CB-CG1 4.17Å; A173-I175 PolarHBondContact O-N 3.11Å
174	K	91.1	Very high	91.3	Very high	138 Å²	138	62.8 Å²	62.8	60%	0.6	32%	0.324	S	S	*	.			trans	-87.5	91.9	172.9	-65.5	177.6	-176.1	174	0	109.3	S148 V149 S172	S148-K174 WeakPolarHBondContact CA-O 3.34Å; S148-K174 WeakPolarHBondContact OG-CD 3.46Å; V149-K174 PolarHBondContact N-O 3.22Å; S172-K174 PolarHBondContact O-N 2.91Å; S172-K174 VanDerWaalsContact O-N 3.16Å
175	I	95	Very high	91.6	Very high	19 Å²	19	57.8 Å²	57.8	10%	0.097	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.4	-179.1	-52.6	171.3	0	0	0	110.5	V139 V143 V149 V151 M163 L166 A173 L177	V139-I175 HydrophobicContact CG1-CD1 4.45Å; V143-I175 HydrophobicContact CG1-CD1 4.43Å; V143-I175 HydrophobicContact CG2-CD1 3.99Å; V143-I175 HydrophobicContact CG2-CG1 3.95Å; V149-I175 CarbonylContact O-C 3.42Å; V149-I175 VanDerWaalsContact O-CA 3.29Å; V149-I175 WeakPolarHBondContact O-CA 3.23Å; V151-I175 HydrophobicContact CG2-CG2 4.01Å; M163-I175 HydrophobicContact CG-CG2 3.96Å; M163-I175 HydrophobicContact SD-CD1 3.75Å; M163-I175 HydrophobicContact SD-CG2 3.71Å; L166-I175 HydrophobicContact CB-CD1 4.3Å; L166-I175 HydrophobicContact CD1-CD1 4.09Å; A173-I175 HydrophobicContact CB-CD1 4.05Å; A173-I175 HydrophobicContact CB-CG1 4.17Å; A173-I175 PolarHBondContact O-N 3.11Å; I175-L177 HydrophobicContact CG2-CD2 4.39Å
176	D	95.7	Very high	92	Very high	56 Å²	56	57.6 Å²	57.6	30%	0.299	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.7	173.6	-61	-67.5	0	0	0	110.1	V149 I150 V151 R200	V149-D176 PolarHBondContact O-N 3.01Å; I150-D176 CarbonylContact C-O 3.53Å; I150-D176 WeakPolarHBondContact CA-O 3.43Å; I150-D176 HydrophobicContact CG1-CB 4.35Å; V151-D176 PolarHBondContact N-O 3.41Å; D176-R200 IonicContact OD2-CZ 2.75Å; D176-R200 IonicContact OD2-NH1 3.6Å; D176-R200 PolarHBondContact OD2-NH1 3.23Å; D176-R200 IonicContact OD2-NH2 2.75Å
177	L	97	Very high	92.5	Very high	47 Å²	47	58.4 Å²	58.4	25%	0.246	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130	179.7	-62.3	-179.8	0	0	0	109.5	V151 A159 R160 M163 I175	V151-L177 HydrophobicContact CB-CD2 3.88Å; V151-L177 HydrophobicContact CG1-CD2 4.46Å; A159-L177 HydrophobicContact CB-CD1 3.92Å; A159-L177 HydrophobicContact CB-CD2 4.01Å; R160-L177 HydrophobicContact CB-CD1 4.39Å; R160-L177 HydrophobicContact CG-CD1 3.62Å; M163-L177 HydrophobicContact CG-CD1 4.35Å; M163-L177 HydrophobicContact CG-CD2 3.76Å; M163-L177 HydrophobicContact CG-CG 4.41Å; I175-L177 HydrophobicContact CG2-CD2 4.39Å
178	V	97.2	Very high	93	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.8	176.7	-177	0	0	0	0	109	I150 V151 A152 C153 C180 C191 E194 M198	I150-V178 HydrophobicContact CG2-CG2 3.62Å; V151-V178 PolarHBondContact O-N 3.27Å; A152-V178 WeakPolarHBondContact CA-O 3.38Å; C153-V178 PolarHBondContact N-O 2.86Å; V178-C180 PolarHBondContact O-N 3.04Å; V178-C191 HydrophobicContact CG1-CB 4.2Å; V178-E194 HydrophobicContact CG1-CB 4.18Å; V178-M198 HydrophobicContact CG2-CE 3.52Å
179	L	97.6	Very high	93.5	Very high	91 Å²	91	51.3 Å²	51.3	48%	0.476	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	125.6	175	-173.8	64.7	0	0	0	109.2	C153 R154 I156	C153-L179 WeakPolarHBondContact O-CA 3.37Å; R154-L179 WeakPolarHBondContact O-CD1 3.38Å; I156-L179 HydrophobicContact CD1-CB 3.71Å; I156-L179 HydrophobicContact CD1-CD1 4.22Å; I156-L179 HydrophobicContact CD1-CG 4.49Å; I156-L179 HydrophobicContact CG1-CB 4.31Å; I156-L179 HydrophobicContact CG1-CD1 4.11Å
180	C	97.4	Very high	94.3	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.02	27%	0.267	C	S	.	.			trans	-152.5	104.9	175.8	-171	0	0	0	0	110.2	A152 C153 R154 V178 C191	A152-C180 HydrophobicContact CB-CB 3.8Å; C153-C180 CarbonylContact C-O 3.56Å; C153-C180 VanDerWaalsContact C-O 3.31Å; C153-C180 PolarHBondContact O-N 3.16Å; R154-C180 WeakPolarHBondContact CG-O 3.42Å; R154-C180 PolarHBondContact N-O 3.41Å; V178-C180 PolarHBondContact O-N 3.04Å; C180-C191 HydrophobicContact CB-CB 3.84Å
181	D	96.2	Very high	94.9	Very high	46 Å²	46	47.4 Å²	47.4	25%	0.246	26%	0.261	C	S	.	.			trans	-91.7	101.9	164.5	-163	-19.1	0	0	0	110.7	R154 S183 V184 S187	R154-D181 HydrophobicContact CG-CB 4.48Å; D181-S183 VanDerWaalsContact CG-OG 3.24Å; D181-S183 PolarHBondContact O-N 3.39Å; D181-S183 WeakPolarHBondContact OD1-CB 3.39Å; D181-S183 PolarHBondContact OD1-N 3.28Å; D181-S183 PolarHBondContact OD1-OG 2.98Å; D181-S183 PolarHBondContact OD2-OG 2.82Å; D181-V184 HydrophobicContact CB-CG2 4.45Å; D181-V184 PolarHBondContact O-N 3.3Å; D181-V184 VanDerWaalsContact O-O 3.07Å; D181-S187 PolarHBondContact N-OG 2.95Å
182	L	96.4	Very high	95.6	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.037	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-6.9	177.4	-64	174.2	0	0	0	113.5	V188 A209 C228 V229 S233	L182-V188 HydrophobicContact CD2-CG2 4.19Å; L182-A209 HydrophobicContact CD1-CB 3.44Å; L182-A209 VanDerWaalsContact CD1-CB 3.44Å; L182-C228 PolarHBondContact O-SG 3.47Å; L182-V229 HydrophobicContact CB-CB 4.37Å; L182-V229 HydrophobicContact CB-CG1 4.06Å; L182-V229 HydrophobicContact CB-CG2 4.26Å; L182-V229 HydrophobicContact CD1-CG1 4.35Å; L182-S233 WeakPolarHBondContact O-CB 3.38Å; L182-S233 PolarHBondContact O-OG 3.3Å
183	S	95.5	Very high	96.3	Very high	18 Å²	18	41.9 Å²	41.9	13%	0.126	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.5	172	67.7	0	0	0	0	113.5	D181 T219	D181-S183 VanDerWaalsContact CG-OG 3.24Å; D181-S183 PolarHBondContact O-N 3.39Å; D181-S183 WeakPolarHBondContact OD1-CB 3.39Å; D181-S183 PolarHBondContact OD1-N 3.28Å; D181-S183 PolarHBondContact OD1-OG 2.98Å; D181-S183 PolarHBondContact OD2-OG 2.82Å; S183-T219 VanDerWaalsContact O-CB 3.26Å; S183-T219 WeakPolarHBondContact O-CB 3.5Å; S183-T219 WeakPolarHBondContact O-CG2 3.33Å
184	V	96.5	Very high	96.9	Very high	35 Å²	35	45.5 Å²	45.5	21%	0.212	24%	0.236	C	C	.	.			trans	-133.4	111	-179.2	-177.6	0	0	0	0	109.3	D181 E186 S187 V188	D181-V184 HydrophobicContact CB-CG2 4.45Å; D181-V184 PolarHBondContact O-N 3.3Å; D181-V184 VanDerWaalsContact O-O 3.07Å; V184-E186 VanDerWaalsContact C-N 3.26Å; V184-E186 HydrophobicContact CG1-CB 4.12Å; V184-E186 PolarHBondContact O-N 2.47Å; V184-S187 WeakPolarHBondContact O-CA 3.44Å; V184-S187 WeakPolarHBondContact O-CB 3.38Å; V184-S187 PolarHBondContact O-N 3.36Å; V184-V188 PolarHBondContact O-N 2.76Å; V184-V188 VanDerWaalsContact O-N 3.15Å
185	L	96.7	Very high	97.2	Very high	40 Å²	40	39 Å²	39	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-33.4	-174.4	-65.1	179.4	0	0	0	113.1	S187 V188 K189 D221 L223 Y236	L185-S187 VanDerWaalsContact C-N 3.29Å; L185-S187 PolarHBondContact O-N 2.84Å; L185-V188 WeakPolarHBondContact O-CB 3.22Å; L185-V188 PolarHBondContact O-N 2.97Å; L185-K189 PolarHBondContact O-N 3.18Å; L185-D221 HydrophobicContact CD1-CB 4.21Å; L185-D221 WeakPolarHBondContact CG-OD2 3.23Å; L185-D221 PolarHBondContact N-OD2 3.3Å; L185-L223 HydrophobicContact CD1-CD1 4.17Å; L185-Y236 HydrophobicContact CB-CE1 4.37Å; L185-Y236 HydrophobicContact CD2-CD1 4.04Å
186	E	97.4	Very high	97.2	Very high	134 Å²	134	41 Å²	41	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-59	-39.6	172.4	-173.1	179.4	-179.7	0	0	112	V184 K189 A190 K220	V184-E186 VanDerWaalsContact C-N 3.26Å; V184-E186 HydrophobicContact CG1-CB 4.12Å; V184-E186 PolarHBondContact O-N 2.47Å; E186-K189 PolarHBondContact O-N 3.41Å; E186-A190 PolarHBondContact O-N 2.67Å; E186-K220 IonicContact OE2-NZ 3.89Å; E186-K220 PolarHBondContact OE2-NZ 2.93Å
187	S	97.7	Very high	97.2	Very high	20 Å²	20	45.3 Å²	45.3	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-69.3	-36.7	175.9	-175.3	0	0	0	0	112	D181 V184 L185 K189 A190 C191	D181-S187 PolarHBondContact N-OG 2.95Å; V184-S187 WeakPolarHBondContact O-CA 3.44Å; V184-S187 WeakPolarHBondContact O-CB 3.38Å; V184-S187 PolarHBondContact O-N 3.36Å; L185-S187 VanDerWaalsContact C-N 3.29Å; L185-S187 PolarHBondContact O-N 2.84Å; S187-K189 VanDerWaalsContact C-N 3.34Å; S187-A190 PolarHBondContact O-N 2.99Å; S187-C191 WeakPolarHBondContact O-CB 3.47Å; S187-C191 PolarHBondContact O-N 2.87Å
188	V	98.1	Very high	97.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-42.4	174.2	-178.3	0	0	0	0	110.9	L182 V184 L185 C191 A192 Y236 L237 L240	L182-V188 HydrophobicContact CD2-CG2 4.19Å; V184-V188 PolarHBondContact O-N 2.76Å; V184-V188 VanDerWaalsContact O-N 3.15Å; L185-V188 WeakPolarHBondContact O-CB 3.22Å; L185-V188 PolarHBondContact O-N 2.97Å; V188-C191 WeakPolarHBondContact O-CB 3.04Å; V188-C191 PolarHBondContact O-N 3.19Å; V188-A192 PolarHBondContact O-N 2.63Å; V188-Y236 HydrophobicContact CB-CD1 4.03Å; V188-Y236 HydrophobicContact CB-CE1 4.43Å; V188-Y236 HydrophobicContact CG1-CD1 3.77Å; V188-Y236 HydrophobicContact CG1-CE1 4.45Å; V188-L237 HydrophobicContact CG1-CB 3.83Å; V188-L237 HydrophobicContact CG1-CD1 4.11Å; V188-L240 HydrophobicContact CG1-CD1 4.45Å
189	K	98.3	Very high	97	Very high	95 Å²	95	51.4 Å²	51.4	41%	0.413	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-48.5	174.9	-174.1	173.4	177.3	-86.1	0	112	L185 E186 S187 C191 A192 D193 Y236 L240	L185-K189 PolarHBondContact O-N 3.18Å; E186-K189 PolarHBondContact O-N 3.41Å; S187-K189 VanDerWaalsContact C-N 3.34Å; K189-C191 VanDerWaalsContact C-N 3.3Å; K189-C191 PolarHBondContact O-N 2.86Å; K189-A192 PolarHBondContact O-N 3.44Å; K189-A192 VanDerWaalsContact O-N 3.1Å; K189-D193 IonicContact NZ-OD2 3.84Å; K189-D193 PolarHBondContact O-N 2.81Å; K189-Y236 HydrophobicContact CB-CE1 4.27Å; K189-L240 HydrophobicContact CB-CD1 4.22Å; K189-L240 HydrophobicContact CG-CD1 4.46Å
190	A	98.3	Very high	96.7	Very high	49 Å²	49	50.8 Å²	50.8	41%	0.405	26%	0.259	S	S	.	.	H	α-helix	trans	-58.4	-41.7	176.7	0	0	0	0	0	112.2	E186 S187 A192 D193 E194	E186-A190 PolarHBondContact O-N 2.67Å; S187-A190 PolarHBondContact O-N 2.99Å; A190-A192 PolarHBondContact O-N 3.04Å; A190-D193 PolarHBondContact O-N 2.96Å; A190-E194 WeakPolarHBondContact O-CG 3.46Å; A190-E194 PolarHBondContact O-N 3.41Å
191	C	98.1	Very high	96.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-46	173.8	176.9	0	0	0	0	112	V178 C180 S187 V188 K189 E194 I195	V178-C191 HydrophobicContact CG1-CB 4.2Å; C180-C191 HydrophobicContact CB-CB 3.84Å; S187-C191 WeakPolarHBondContact O-CB 3.47Å; S187-C191 PolarHBondContact O-N 2.87Å; V188-C191 WeakPolarHBondContact O-CB 3.04Å; V188-C191 PolarHBondContact O-N 3.19Å; K189-C191 VanDerWaalsContact C-N 3.3Å; K189-C191 PolarHBondContact O-N 2.86Å; C191-E194 PolarHBondContact O-N 3.42Å; C191-I195 WeakPolarHBondContact O-CD1 3.49Å; C191-I195 VanDerWaalsContact O-CG1 3.25Å; C191-I195 WeakPolarHBondContact O-CG1 3.27Å; C191-I195 PolarHBondContact O-N 3.49Å
192	A	98.3	Very high	96.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-65.4	-39.4	178.2	0	0	0	0	0	112.8	V188 K189 A190 I195 T196 L237 L240 L241	V188-A192 PolarHBondContact O-N 2.63Å; K189-A192 PolarHBondContact O-N 3.44Å; K189-A192 VanDerWaalsContact O-N 3.1Å; A190-A192 PolarHBondContact O-N 3.04Å; A192-I195 PolarHBondContact O-N 3.27Å; A192-T196 WeakPolarHBondContact O-CB 3.37Å; A192-T196 PolarHBondContact O-N 3.49Å; A192-T196 PolarHBondContact O-OG1 3.41Å; A192-L237 HydrophobicContact CB-CD1 3.92Å; A192-L240 HydrophobicContact CB-CB 3.56Å; A192-L240 HydrophobicContact CB-CD1 3.81Å; A192-L240 HydrophobicContact CB-CG 4.3Å; A192-L241 HydrophobicContact CB-CD2 3.94Å; A192-L241 HydrophobicContact CB-CG 4.17Å
193	D	98.2	Very high	96.4	Very high	65 Å²	65	53.1 Å²	53.1	35%	0.348	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-44.6	175.9	-68.6	-20.9	0	0	0	110.3	K189 A190 T196 K197	K189-D193 IonicContact NZ-OD2 3.84Å; K189-D193 PolarHBondContact O-N 2.81Å; A190-D193 PolarHBondContact O-N 2.96Å; D193-T196 PolarHBondContact O-N 2.89Å; D193-K197 VanDerWaalsContact O-CG 3.29Å; D193-K197 WeakPolarHBondContact O-CG 3.43Å; D193-K197 PolarHBondContact O-N 2.91Å
194	E	97.7	Very high	96.3	Very high	85 Å²	85	52.5 Å²	52.5	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-45.2	175.5	-71.3	-54.3	122	0	0	112.5	V178 A190 C191 T196 K197 M198	V178-E194 HydrophobicContact CG1-CB 4.18Å; A190-E194 WeakPolarHBondContact O-CG 3.46Å; A190-E194 PolarHBondContact O-N 3.41Å; C191-E194 PolarHBondContact O-N 3.42Å; E194-T196 VanDerWaalsContact C-N 3.25Å; E194-T196 PolarHBondContact O-N 2.77Å; E194-K197 PolarHBondContact O-N 2.78Å; E194-K197 IonicContact OE1-NZ 2.68Å; E194-K197 PolarHBondContact OE1-NZ 3.28Å; E194-M198 WeakPolarHBondContact O-CG 3.33Å; E194-M198 PolarHBondContact O-N 2.82Å
195	I	97.2	Very high	96.3	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-39.2	175.1	-68.7	163.1	0	0	0	111	F126 C191 A192 M198 I202 L241	F126-I195 HydrophobicContact CD2-CD1 3.82Å; F126-I195 HydrophobicContact CD2-CG1 4.46Å; F126-I195 HydrophobicContact CE1-CD1 4.49Å; F126-I195 HydrophobicContact CE2-CD1 3.29Å; F126-I195 HydrophobicContact CE2-CG1 4.2Å; F126-I195 HydrophobicContact CZ-CD1 3.68Å; C191-I195 WeakPolarHBondContact O-CD1 3.49Å; C191-I195 VanDerWaalsContact O-CG1 3.25Å; C191-I195 WeakPolarHBondContact O-CG1 3.27Å; C191-I195 PolarHBondContact O-N 3.49Å; A192-I195 PolarHBondContact O-N 3.27Å; I195-M198 PolarHBondContact O-N 2.95Å; I195-I202 HydrophobicContact CG2-CD1 3.53Å; I195-L241 HydrophobicContact CB-CD2 3.96Å; I195-L241 HydrophobicContact CD1-CD1 3.89Å; I195-L241 HydrophobicContact CD1-CD2 4.38Å; I195-L241 HydrophobicContact CG2-CD1 4.42Å; I195-L241 HydrophobicContact CG2-CD2 3.71Å
196	T	95.8	Very high	96.1	Very high	62 Å²	62	48.9 Å²	48.9	38%	0.38	24%	0.239	S	C	.	.	H	α-helix	trans	-67.7	-42.5	179.1	-58.5	0	0	0	0	111.2	A192 D193 E194 M198 N199 R244	A192-T196 WeakPolarHBondContact O-CB 3.37Å; A192-T196 PolarHBondContact O-N 3.49Å; A192-T196 PolarHBondContact O-OG1 3.41Å; D193-T196 PolarHBondContact O-N 2.89Å; E194-T196 VanDerWaalsContact C-N 3.25Å; E194-T196 PolarHBondContact O-N 2.77Å; T196-M198 VanDerWaalsContact C-N 3.31Å; T196-M198 PolarHBondContact O-N 3.38Å; T196-N199 PolarHBondContact O-N 2.97Å; T196-N199 VanDerWaalsContact O-N 3.12Å; T196-R244 PolarHBondContact O-NH2 3.37Å; T196-R244 VanDerWaalsContact O-NH2 3.11Å
197	K	96.6	Very high	96	Very high	146 Å²	146	42.8 Å²	42.8	64%	0.635	21%	0.211	S	C	*	.	H	α-helix	trans	-62.2	-33	176.4	-73.3	172.3	-167	170.8	0	113.4	D193 E194 N199	D193-K197 VanDerWaalsContact O-CG 3.29Å; D193-K197 WeakPolarHBondContact O-CG 3.43Å; D193-K197 PolarHBondContact O-N 2.91Å; E194-K197 PolarHBondContact O-N 2.78Å; E194-K197 IonicContact OE1-NZ 2.68Å; E194-K197 PolarHBondContact OE1-NZ 3.28Å; K197-N199 PolarHBondContact O-N 3.19Å; K197-N199 VanDerWaalsContact O-N 3.08Å
198	M	95.4	Very high	95.8	Very high	60 Å²	60	42.8 Å²	42.8	30%	0.296	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.7	175.6	-71	-179.4	-175.5	0	0	112.4	I150 V178 E194 I195 T196 R200	I150-M198 HydrophobicContact CD1-SD 3.96Å; I150-M198 HydrophobicContact CG1-SD 4.5Å; V178-M198 HydrophobicContact CG2-CE 3.52Å; E194-M198 WeakPolarHBondContact O-CG 3.33Å; E194-M198 PolarHBondContact O-N 2.82Å; I195-M198 PolarHBondContact O-N 2.95Å; T196-M198 VanDerWaalsContact C-N 3.31Å; T196-M198 PolarHBondContact O-N 3.38Å; M198-R200 WeakPolarHBondContact O-CG 3.06Å; M198-R200 PolarHBondContact O-N 3.25Å; M198-R200 VanDerWaalsContact O-N 3.11Å
199	N	93	Very high	95.5	Very high	121 Å²	121	43.6 Å²	43.6	65%	0.647	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	38	-179	-161.2	37.6	0	0	0	114.2	T196 K197 R244	T196-N199 PolarHBondContact O-N 2.97Å; T196-N199 VanDerWaalsContact O-N 3.12Å; K197-N199 PolarHBondContact O-N 3.19Å; K197-N199 VanDerWaalsContact O-N 3.08Å; N199-R244 PolarHBondContact OD1-NH1 3.15Å; N199-R244 PolarHBondContact OD1-NH2 2.94Å
200	R	92.5	Very high	95.2	Very high	78 Å²	78	40.4 Å²	40.4	29%	0.294	21%	0.207	S	C	.	.			trans	-108.1	138.8	179.4	-75.1	168.7	67.6	-175.9	-1.6	109.7	D176 M198	D176-R200 IonicContact OD2-CZ 2.75Å; D176-R200 IonicContact OD2-NH1 3.6Å; D176-R200 PolarHBondContact OD2-NH1 3.23Å; D176-R200 IonicContact OD2-NH2 2.75Å; M198-R200 WeakPolarHBondContact O-CG 3.06Å; M198-R200 PolarHBondContact O-N 3.25Å; M198-R200 VanDerWaalsContact O-N 3.11Å
201	R	94.6	Very high	94.9	Very high	97 Å²	97	39 Å²	39	37%	0.366	19%	0.193	S	C	.	.			trans	-63	136.2	169.3	178.1	162.9	-178.9	-81.7	-16.6	109.6	T124 D203 S248 P250	T124-R201 WeakPolarHBondContact CB-O 3.23Å; T124-R201 WeakPolarHBondContact CG2-O 3.22Å; R201-D203 IonicContact CZ-OD1 3.42Å; R201-D203 VanDerWaalsContact CZ-OD1 3.24Å; R201-D203 IonicContact NH1-OD1 2.72Å; R201-D203 PolarHBondContact NH1-OD1 3.18Å; R201-D203 IonicContact NH1-OD2 3.69Å; R201-D203 IonicContact NH2-OD1 2.93Å; R201-D203 PolarHBondContact NH2-OD1 3.48Å; R201-D203 VanDerWaalsContact NH2-OD1 3.07Å; R201-S248 PolarHBondContact NE-O 3.34Å; R201-S248 VanDerWaalsContact NE-O 3.08Å; R201-S248 PolarHBondContact NH2-O 3.47Å; R201-P250 PolarHBondContact NH2-O 2.9Å
202	I	96.5	Very high	94.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	20%	0.196	C	C	.	.			trans	-122.1	108.3	177	-60.4	170.1	0	0	0	108.2	T124 F126 I150 I195 I204 F205 R244 S248	T124-I202 HydrophobicContact CG2-CG1 4.21Å; F126-I202 HydrophobicContact CB-CD1 4.32Å; F126-I202 HydrophobicContact CB-CG2 3.73Å; I150-I202 HydrophobicContact CD1-CD1 4.17Å; I150-I202 HydrophobicContact CD1-CG1 4.31Å; I195-I202 HydrophobicContact CG2-CD1 3.53Å; I202-I204 WeakPolarHBondContact CG2-O 3.48Å; I202-F205 HydrophobicContact CB-CE1 4Å; I202-F205 HydrophobicContact CB-CE2 3.87Å; I202-F205 HydrophobicContact CB-CZ 3.49Å; I202-F205 VanDerWaalsContact CB-CZ 3.49Å; I202-F205 HydrophobicContact CD1-CE1 3.85Å; I202-F205 HydrophobicContact CD1-CZ 4.07Å; I202-F205 HydrophobicContact CG1-CZ 4.36Å; I202-F205 HydrophobicContact CG2-CD1 4.01Å; I202-F205 HydrophobicContact CG2-CD2 3.97Å; I202-F205 HydrophobicContact CG2-CE1 3.69Å; I202-F205 HydrophobicContact CG2-CE2 3.63Å; I202-F205 HydrophobicContact CG2-CG 4.14Å; I202-F205 HydrophobicContact CG2-CZ 3.5Å; I202-F205 VanDerWaalsContact CG2-CZ 3.5Å; I202-F205 WeakPolarHBondContact O-CE2 3.45Å; I202-R244 HydrophobicContact CD1-CG 4.5Å; I202-S248 PolarHBondContact N-OG 3.35Å; I202-S248 WeakPolarHBondContact O-CB 3.46Å
203	D	93	Very high	93.8	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.043	20%	0.204	C	C	.	.	S	Bend	trans	-71.5	-33.2	-179.1	-63.6	-99.5	0	0	0	112.3	K123 T124 R201 A251 R252	K123-D203 HydrophobicContact CD-CB 4.02Å; K123-D203 WeakPolarHBondContact CD-OD1 3.42Å; K123-D203 IonicContact NZ-OD1 3.37Å; K123-D203 PolarHBondContact NZ-OD1 3.04Å; T124-D203 PolarHBondContact N-OD2 3.36Å; T124-D203 PolarHBondContact O-N 2.9Å; R201-D203 IonicContact CZ-OD1 3.42Å; R201-D203 VanDerWaalsContact CZ-OD1 3.24Å; R201-D203 IonicContact NH1-OD1 2.72Å; R201-D203 PolarHBondContact NH1-OD1 3.18Å; R201-D203 IonicContact NH1-OD2 3.69Å; R201-D203 IonicContact NH2-OD1 2.93Å; R201-D203 PolarHBondContact NH2-OD1 3.48Å; R201-D203 VanDerWaalsContact NH2-OD1 3.07Å; D203-A251 CarbonylContact O-C 3.59Å; D203-A251 WeakPolarHBondContact O-CA 3.24Å; D203-A251 WeakPolarHBondContact O-CB 3.34Å; D203-R252 PolarHBondContact O-N 2.78Å
204	I	93.2	Very high	93.3	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128	-170.1	-65	151.7	0	0	0	109.9	T124 I125 F126 I202 V206 R252 T379	T124-I204 PolarHBondContact O-N 2.99Å; I125-I204 CarbonylContact C-O 3.46Å; I125-I204 WeakPolarHBondContact CA-O 3.28Å; I125-I204 HydrophobicContact CB-CB 4.44Å; I125-I204 HydrophobicContact CD1-CD1 3.97Å; I125-I204 HydrophobicContact CG1-CB 4.13Å; I125-I204 HydrophobicContact CG1-CD1 3.86Å; I125-I204 HydrophobicContact CG2-CB 4.15Å; I125-I204 HydrophobicContact CG2-CG2 3.91Å; F126-I204 PolarHBondContact N-O 3.4Å; I202-I204 WeakPolarHBondContact CG2-O 3.48Å; I204-V206 HydrophobicContact CG2-CG2 3.65Å; I204-R252 CarbonylContact C-O 3.54Å; I204-R252 WeakPolarHBondContact CA-O 3.38Å; I204-R252 HydrophobicContact CG1-CB 4.47Å; I204-T379 HydrophobicContact CB-CG2 4.31Å; I204-T379 HydrophobicContact CD1-CG2 3.86Å; I204-T379 HydrophobicContact CG1-CG2 4Å; I204-T379 HydrophobicContact CG2-CG2 3.34Å
205	F	95.3	Very high	93	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.1	172.3	-60.4	-99.8	0	0	0	109.1	F126 I202 L241 M245 A251 R252 I253 V254	F126-F205 HydrophobicContact CB-CD1 4.08Å; F126-F205 AromaticContact CD1-CD1 3.85Å; F126-F205 HydrophobicContact CD1-CD1 3.85Å; F126-F205 HydrophobicContact CG-CD1 4.26Å; F126-F205 CarbonylContact O-C 3.58Å; I202-F205 HydrophobicContact CB-CE1 4Å; I202-F205 HydrophobicContact CB-CE2 3.87Å; I202-F205 HydrophobicContact CB-CZ 3.49Å; I202-F205 VanDerWaalsContact CB-CZ 3.49Å; I202-F205 HydrophobicContact CD1-CE1 3.85Å; I202-F205 HydrophobicContact CD1-CZ 4.07Å; I202-F205 HydrophobicContact CG1-CZ 4.36Å; I202-F205 HydrophobicContact CG2-CD1 4.01Å; I202-F205 HydrophobicContact CG2-CD2 3.97Å; I202-F205 HydrophobicContact CG2-CE1 3.69Å; I202-F205 HydrophobicContact CG2-CE2 3.63Å; I202-F205 HydrophobicContact CG2-CG 4.14Å; I202-F205 HydrophobicContact CG2-CZ 3.5Å; I202-F205 VanDerWaalsContact CG2-CZ 3.5Å; I202-F205 WeakPolarHBondContact O-CE2 3.45Å; F205-L241 HydrophobicContact CD1-CD1 4.47Å; F205-L241 HydrophobicContact CE1-CD1 4.17Å; F205-M245 HydrophobicContact CB-CE 4.38Å; F205-M245 HydrophobicContact CD1-CE 3.83Å; F205-M245 HydrophobicContact CD2-CE 4.29Å; F205-M245 HydrophobicContact CD2-CG 4.15Å; F205-M245 HydrophobicContact CE1-CE 4.13Å; F205-M245 HydrophobicContact CE1-CG 4.12Å; F205-M245 HydrophobicContact CE2-CB 4.38Å; F205-M245 HydrophobicContact CE2-CG 3.65Å; F205-M245 HydrophobicContact CG-CE 3.91Å; F205-M245 HydrophobicContact CZ-CB 4.5Å; F205-M245 HydrophobicContact CZ-CE 4.48Å; F205-M245 HydrophobicContact CZ-CG 3.62Å; F205-A251 HydrophobicContact CE2-CB 4.38Å; F205-R252 PolarHBondContact N-O 3.22Å; F205-I253 HydrophobicContact CB-CG1 4.35Å; F205-I253 HydrophobicContact CB-CG2 4.46Å; F205-I253 HydrophobicContact CD2-CG1 4.45Å; F205-I253 CarbonylContact O-C 3.6Å; F205-I253 WeakPolarHBondContact O-CA 3.36Å; F205-V254 PolarHBondContact O-N 3.11Å
206	V	93.7	Very high	92.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.9	-179.1	-175.4	0	0	0	0	110	I125 F126 I127 T128 F138 I204 N208 Y375	I125-V206 HydrophobicContact CG2-CG2 4.07Å; F126-V206 PolarHBondContact O-N 3.06Å; I127-V206 WeakPolarHBondContact CA-O 3.4Å; I127-V206 HydrophobicContact CB-CB 4.04Å; I127-V206 HydrophobicContact CD1-CB 4.19Å; I127-V206 HydrophobicContact CD1-CG1 3.91Å; I127-V206 HydrophobicContact CG1-CB 3.94Å; I127-V206 HydrophobicContact CG1-CG1 4.03Å; T128-V206 PolarHBondContact N-O 3.48Å; F138-V206 HydrophobicContact CE1-CG2 3.9Å; F138-V206 HydrophobicContact CZ-CG2 4.16Å; I204-V206 HydrophobicContact CG2-CG2 3.65Å; V206-N208 HydrophobicContact CG1-CB 3.96Å; V206-N208 PolarHBondContact O-N 3.04Å; V206-Y375 HydrophobicContact CG1-CD1 3.38Å; V206-Y375 HydrophobicContact CG1-CE1 3.37Å; V206-Y375 HydrophobicContact CG1-CG 4.29Å
207	Y	95.2	Very high	92.7	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.02	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	83.3	175.3	-63.6	-23.3	0	0	0	110.3	F126 T128 H234 L237 T238 M245 I253 V254 L255 T256	F126-Y207 HydrophobicContact CD1-CE1 4.45Å; F126-Y207 HydrophobicContact CE1-CD1 4.49Å; F126-Y207 HydrophobicContact CE1-CE1 4.06Å; T128-Y207 HydrophobicContact CG2-CD1 4.19Å; T128-Y207 WeakPolarHBondContact OG1-CA 3.45Å; Y207-H234 VanDerWaalsContact CB-CD2 3.44Å; Y207-H234 WeakPolarHBondContact CB-CD2 3.47Å; Y207-H234 AromaticContact CD1-CD2 3.51Å; Y207-H234 HydrophobicContact CD2-CB 3.91Å; Y207-H234 HydrophobicContact CE2-CB 4.35Å; Y207-H234 HydrophobicContact CG-CB 4.12Å; Y207-H234 AromaticContact CG-CD2 3.39Å; Y207-H234 AromaticContact CG-CG 3.91Å; Y207-L237 HydrophobicContact CE1-CD2 3.92Å; Y207-L237 HydrophobicContact CE1-CG 4.45Å; Y207-T238 WeakPolarHBondContact CE2-OG1 3.44Å; Y207-T238 WeakPolarHBondContact OH-CA 3.36Å; Y207-T238 PolarHBondContact OH-N 2.92Å; Y207-T238 PolarHBondContact OH-OG1 2.86Å; Y207-M245 WeakPolarHBondContact OH-CE 3.46Å; Y207-I253 HydrophobicContact CD2-CG2 4.14Å; Y207-I253 HydrophobicContact CE2-CG2 3.88Å; Y207-V254 PolarHBondContact N-O 3.03Å; Y207-L255 HydrophobicContact CD2-CD2 4.21Å; Y207-L255 HydrophobicContact CD2-CG 4Å; Y207-T256 PolarHBondContact O-N 3.02Å; Y207-T256 PolarHBondContact O-OG1 3.02Å; Y207-T256 VanDerWaalsContact O-OG1 3.11Å
208	N	92.2	Very high	92.6	Very high	21 Å²	21	39.7 Å²	39.7	11%	0.112	20%	0.202	C	C	.	.			trans	-104.1	-27.7	-174	159.1	89.6	0	0	0	113.8	I127 T128 G129 V206 A210 T256 Y375	I127-N208 HydrophobicContact CD1-CB 4.29Å; I127-N208 HydrophobicContact CG1-CB 4.35Å; T128-N208 WeakPolarHBondContact O-CB 3.43Å; T128-N208 PolarHBondContact O-ND2 3.4Å; T128-N208 PolarHBondContact OG1-N 2.74Å; T128-N208 VanDerWaalsContact OG1-N 3.14Å; G129-N208 PolarHBondContact O-ND2 3.22Å; G129-N208 VanDerWaalsContact O-ND2 3.15Å; V206-N208 HydrophobicContact CG1-CB 3.96Å; V206-N208 PolarHBondContact O-N 3.04Å; N208-A210 PolarHBondContact O-N 3.13Å; N208-T256 WeakPolarHBondContact CA-OG1 3.4Å; N208-Y375 HydrophobicContact CB-CE1 4.31Å; N208-Y375 WeakPolarHBondContact CB-OH 3.27Å; N208-Y375 PolarHBondContact OD1-OH 3.04Å
209	A	92.4	Very high	92.6	Very high	17 Å²	17	37.6 Å²	37.6	14%	0.14	19%	0.192	C	C	.	.			trans	-58	133.7	-177.3	0	0	0	0	0	111.2	T128 L182 H234	T128-A209 PolarHBondContact O-N 3.14Å; T128-A209 WeakPolarHBondContact OG1-CB 3.45Å; T128-A209 PolarHBondContact OG1-N 3.42Å; T128-A209 VanDerWaalsContact OG1-N 3.13Å; L182-A209 HydrophobicContact CD1-CB 3.44Å; L182-A209 VanDerWaalsContact CD1-CB 3.44Å; A209-H234 PolarHBondContact O-CE1 2.75Å; A209-H234 VanDerWaalsContact O-CE1 3.26Å
210	A	92	Very high	92.5	Very high	28 Å²	28	39.5 Å²	39.5	23%	0.231	20%	0.195	C	C	.	.			trans	-154.5	159	175.1	0	0	0	0	0	110	N208 N230 L347	N208-A210 PolarHBondContact O-N 3.13Å; A210-N230 WeakPolarHBondContact CA-OD1 3.18Å; A210-N230 WeakPolarHBondContact CB-OD1 3.19Å; A210-L347 HydrophobicContact CB-CD1 4.33Å; A210-L347 WeakPolarHBondContact O-CD1 3.3Å
211	I	91.5	Very high	92.5	Very high	20 Å²	20	39.2 Å²	39.2	10%	0.103	20%	0.199	C	C	.	.			trans	-129.2	158.9	170.5	63.1	170.7	0	0	0	110.3	K225 V229 N230 Y309	I211-K225 HydrophobicContact CD1-CB 4.42Å; I211-K225 HydrophobicContact CD1-CD 4.22Å; I211-K225 HydrophobicContact CD1-CG 3.79Å; I211-V229 HydrophobicContact CD1-CB 3.99Å; I211-V229 HydrophobicContact CD1-CG1 4.33Å; I211-V229 HydrophobicContact CD1-CG2 3.92Å; I211-V229 HydrophobicContact CG1-CB 3.95Å; I211-V229 HydrophobicContact CG1-CG1 3.95Å; I211-V229 HydrophobicContact CG1-CG2 4.42Å; I211-V229 HydrophobicContact CG2-CG1 4.07Å; I211-N230 PolarHBondContact N-OD1 2.87Å; I211-N230 PolarHBondContact O-ND2 2.99Å; I211-N230 PolarHBondContact O-OD1 2.87Å; I211-Y309 WeakPolarHBondContact O-CD2 3.39Å
212	F	87.8	Confident	92.4	Very high	15 Å²	15	36.9 Å²	36.9	7%	0.066	21%	0.206	C	C	.	.			trans	-123.9	107	162.9	-178	-81	0	0	0	105.8	P214 S305 Y309 L347 F348	F212-P214 HydrophobicContact CD1-CG 4.39Å; F212-P214 HydrophobicContact CE1-CG 4.43Å; F212-P214 WeakPolarHBondContact O-CD 3.46Å; F212-S305 WeakPolarHBondContact CZ-OG 3.42Å; F212-Y309 HydrophobicContact CB-CD2 4.34Å; F212-Y309 HydrophobicContact CD2-CD1 4.27Å; F212-Y309 AromaticContact CD2-CD2 3.92Å; F212-Y309 HydrophobicContact CD2-CD2 3.92Å; F212-Y309 AromaticContact CD2-CG 3.7Å; F212-Y309 HydrophobicContact CD2-CG 3.7Å; F212-Y309 HydrophobicContact CE2-CG 4.26Å; F212-L347 HydrophobicContact CB-CD2 4.12Å; F212-L347 HydrophobicContact CB-CG 3.87Å; F212-F348 HydrophobicContact CB-CD1 4.49Å; F212-F348 HydrophobicContact CB-CE1 4.48Å; F212-F348 HydrophobicContact CD1-CD1 4.2Å; F212-F348 HydrophobicContact CD1-CE1 4.47Å; F212-F348 AromaticContact CD2-CE1 3.99Å; F212-F348 HydrophobicContact CD2-CE1 3.99Å; F212-F348 HydrophobicContact CE2-CE1 4.35Å; F212-F348 HydrophobicContact CG-CD1 4.14Å; F212-F348 HydrophobicContact CG-CE1 4.06Å
213	E	87	Confident	92.3	Very high	36 Å²	36	37.8 Å²	37.8	17%	0.168	21%	0.21	C	C	.	.			trans	-95.4	116.5	179.8	-169.5	67.5	-98.2	0	0	108.7	N215 K225 Y303 S305	E213-N215 VanDerWaalsContact C-N 3.34Å; E213-N215 WeakPolarHBondContact CG-O 3.43Å; E213-K225 IonicContact OE2-NZ 3.63Å; E213-K225 PolarHBondContact OE2-NZ 3.3Å; E213-Y303 PolarHBondContact O-OH 3.32Å; E213-S305 VanDerWaalsContact O-CB 3.23Å; E213-S305 WeakPolarHBondContact O-CB 3.21Å
214	P	86.8	Confident	92.5	Very high	21 Å²	21	37.4 Å²	37.4	14%	0.136	21%	0.208	C	C	.	.	S	Bend	trans	-69.5	-34.4	179.5	-23.9	36.2	0	0	0	113.4	F212 Y351	F212-P214 HydrophobicContact CD1-CG 4.39Å; F212-P214 HydrophobicContact CE1-CG 4.43Å; F212-P214 WeakPolarHBondContact O-CD 3.46Å; P214-Y351 HydrophobicContact CB-CD2 3.93Å; P214-Y351 HydrophobicContact CG-CD2 4.17Å
215	N	90.8	Very high	92.6	Very high	120 Å²	120	39.9 Å²	39.9	64%	0.642	22%	0.219	S	C	*	.	S	Bend	trans	-104.5	135.6	-174.7	-61.7	-38.1	0	0	0	109.6	E213 S217	E213-N215 VanDerWaalsContact C-N 3.34Å; E213-N215 WeakPolarHBondContact CG-O 3.43Å; N215-S217 PolarHBondContact O-N 3.26Å
216	W	92.8	Very high	92.5	Very high	82 Å²	82	39.9 Å²	39.9	31%	0.311	22%	0.219	S	C	.	.			trans	-55.1	128.8	175.2	178.1	77.7	0	0	0	111	V218 P297 V298 A300 Y303	W216-V218 HydrophobicContact CH2-CG1 3.99Å; W216-V218 HydrophobicContact CZ2-CG1 3.39Å; W216-P297 PolarHBondContact NE1-O 3.5Å; W216-V298 WeakPolarHBondContact CZ2-O 3.06Å; W216-A300 HydrophobicContact CB-CB 3.94Å; W216-A300 HydrophobicContact CD2-CB 4.34Å; W216-A300 HydrophobicContact CE3-CB 4.13Å; W216-A300 HydrophobicContact CG-CB 4.3Å; W216-Y303 HydrophobicContact CB-CD1 3.75Å; W216-Y303 HydrophobicContact CB-CD2 4.44Å; W216-Y303 HydrophobicContact CB-CE1 4.46Å; W216-Y303 HydrophobicContact CB-CG 3.72Å; W216-Y303 AromaticContact CD1-CD2 3.74Å; W216-Y303 AromaticContact CD1-CG 3.72Å; W216-Y303 HydrophobicContact CG-CG 4.12Å
217	S	94.5	Very high	92.6	Very high	31 Å²	31	40.6 Å²	40.6	22%	0.217	22%	0.222	C	C	.	.			trans	-151.2	149.5	173.4	58.9	0	0	0	0	110.3	N215 K225	N215-S217 PolarHBondContact O-N 3.26Å; S217-K225 WeakPolarHBondContact O-CB 3.46Å; S217-K225 PolarHBondContact O-N 2.97Å; S217-K225 VanDerWaalsContact O-N 3.08Å; S217-K225 VanDerWaalsContact OG-CD 3.27Å; S217-K225 WeakPolarHBondContact OG-CD 3.47Å
218	V	94.8	Very high	92.7	Very high	69 Å²	69	40.3 Å²	40.3	42%	0.418	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-111.8	150.1	179.1	-67.1	0	0	0	0	110.9	W216 L223	W216-V218 HydrophobicContact CH2-CG1 3.99Å; W216-V218 HydrophobicContact CZ2-CG1 3.39Å; V218-L223 CarbonylContact C-O 3.35Å; V218-L223 WeakPolarHBondContact CA-O 3.36Å
219	T	94.6	Very high	92.9	Very high	16 Å²	16	39.5 Å²	39.5	10%	0.098	22%	0.217	C	C	.	.			trans	-75.7	170.5	172	58.2	0	0	0	0	111.1	S183 D221 G222 L223 K225 C228	S183-T219 VanDerWaalsContact O-CB 3.26Å; S183-T219 WeakPolarHBondContact O-CB 3.5Å; S183-T219 WeakPolarHBondContact O-CG2 3.33Å; T219-D221 PolarHBondContact O-N 3.37Å; T219-D221 VanDerWaalsContact O-N 3.15Å; T219-G222 PolarHBondContact O-N 3.4Å; T219-L223 WeakPolarHBondContact CG2-O 3.42Å; T219-L223 PolarHBondContact N-O 3.49Å; T219-L223 WeakPolarHBondContact OG1-CB 3.44Å; T219-L223 PolarHBondContact OG1-N 3.27Å; T219-L223 VanDerWaalsContact OG1-N 3.16Å; T219-L223 PolarHBondContact OG1-O 3.34Å; T219-K225 HydrophobicContact CG2-CB 4.45Å; T219-K225 HydrophobicContact CG2-CG 4.35Å; T219-C228 HydrophobicContact CG2-CB 3.85Å
220	K	92.4	Very high	93	Very high	160 Å²	160	38.8 Å²	38.8	70%	0.696	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.1	172.9	179.1	-175.5	171	-169	0	112.1	E186 G222	E186-K220 IonicContact OE2-NZ 3.89Å; E186-K220 PolarHBondContact OE2-NZ 2.93Å; K220-G222 VanDerWaalsContact C-N 3.27Å; K220-G222 PolarHBondContact O-N 3.43Å
221	D	90.9	Very high	93.2	Very high	72 Å²	72	39.5 Å²	39.5	39%	0.385	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	7.5	-178.9	-57.2	-62.5	0	0	0	113.1	L185 T219 L223	L185-D221 HydrophobicContact CD1-CB 4.21Å; L185-D221 WeakPolarHBondContact CG-OD2 3.23Å; L185-D221 PolarHBondContact N-OD2 3.3Å; T219-D221 PolarHBondContact O-N 3.37Å; T219-D221 VanDerWaalsContact O-N 3.15Å; D221-L223 VanDerWaalsContact C-N 3.31Å; D221-L223 HydrophobicContact CB-CD1 4.1Å; D221-L223 PolarHBondContact O-N 2.98Å
222	G	93	Very high	93.5	Very high	49 Å²	49	40.4 Å²	40.4	51%	0.505	21%	0.212	S	C	.	.	S	Bend	trans	77.5	12.2	177.8	0	0	0	0	0	114.9	T219 K220	T219-G222 PolarHBondContact O-N 3.4Å; K220-G222 VanDerWaalsContact C-N 3.27Å; K220-G222 PolarHBondContact O-N 3.43Å
223	L	95.5	Very high	93.9	Very high	20 Å²	20	39.7 Å²	39.7	11%	0.105	21%	0.209	C	C	.	.			trans	-98.4	143.3	-178.6	-61.8	157.2	0	0	0	111.2	L185 V218 T219 D221 K225 C228 L232 F292	L185-L223 HydrophobicContact CD1-CD1 4.17Å; V218-L223 CarbonylContact C-O 3.35Å; V218-L223 WeakPolarHBondContact CA-O 3.36Å; T219-L223 WeakPolarHBondContact CG2-O 3.42Å; T219-L223 PolarHBondContact N-O 3.49Å; T219-L223 WeakPolarHBondContact OG1-CB 3.44Å; T219-L223 PolarHBondContact OG1-N 3.27Å; T219-L223 VanDerWaalsContact OG1-N 3.16Å; T219-L223 PolarHBondContact OG1-O 3.34Å; D221-L223 VanDerWaalsContact C-N 3.31Å; D221-L223 HydrophobicContact CB-CD1 4.1Å; D221-L223 PolarHBondContact O-N 2.98Å; L223-K225 PolarHBondContact O-N 3.44Å; L223-C228 HydrophobicContact CB-CB 4.27Å; L223-L232 HydrophobicContact CD1-CD2 3.42Å; L223-L232 VanDerWaalsContact CD1-CD2 3.42Å; L223-L232 HydrophobicContact CD2-CD2 4.21Å; L223-L232 HydrophobicContact CG-CD2 4.39Å; L223-F292 HydrophobicContact CD2-CE2 3.82Å; L223-F292 HydrophobicContact CD2-CZ 4.03Å
224	E	96.4	Very high	94.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-59.4	134.3	173.2	-169.1	-78.3	139.7	0	0	110.2	T226 F227 C228 S296 Y303	E224-T226 PolarHBondContact O-N 3.15Å; E224-T226 WeakPolarHBondContact OE1-CB 3.46Å; E224-T226 PolarHBondContact OE1-N 3.19Å; E224-T226 PolarHBondContact OE1-OG1 3.27Å; E224-T226 WeakPolarHBondContact OE2-CA 2.96Å; E224-T226 VanDerWaalsContact OE2-CB 3.24Å; E224-T226 WeakPolarHBondContact OE2-CB 3.3Å; E224-T226 PolarHBondContact OE2-N 3.18Å; E224-F227 PolarHBondContact O-N 3.15Å; E224-F227 WeakPolarHBondContact OE2-CB 3.48Å; E224-F227 PolarHBondContact OE2-N 2.71Å; E224-C228 VanDerWaalsContact O-CB 3.27Å; E224-C228 WeakPolarHBondContact O-CB 3.43Å; E224-C228 PolarHBondContact O-N 3.42Å; E224-S296 PolarHBondContact N-OG 3.12Å; E224-Y303 HydrophobicContact CG-CD2 4.04Å; E224-Y303 HydrophobicContact CG-CE2 3.74Å; E224-Y303 VanDerWaalsContact OE1-CE2 3.31Å; E224-Y303 WeakPolarHBondContact OE1-CE2 3.27Å; E224-Y303 PolarHBondContact OE1-OH 3.01Å
225	K	95.1	Very high	95	Very high	56 Å²	56	40.7 Å²	40.7	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-39.2	-165	-163	-179.2	175.9	-170.5	0	113.7	I211 E213 S217 T219 L223 V229	I211-K225 HydrophobicContact CD1-CB 4.42Å; I211-K225 HydrophobicContact CD1-CD 4.22Å; I211-K225 HydrophobicContact CD1-CG 3.79Å; E213-K225 IonicContact OE2-NZ 3.63Å; E213-K225 PolarHBondContact OE2-NZ 3.3Å; S217-K225 WeakPolarHBondContact O-CB 3.46Å; S217-K225 PolarHBondContact O-N 2.97Å; S217-K225 VanDerWaalsContact O-N 3.08Å; S217-K225 VanDerWaalsContact OG-CD 3.27Å; S217-K225 WeakPolarHBondContact OG-CD 3.47Å; T219-K225 HydrophobicContact CG2-CB 4.45Å; T219-K225 HydrophobicContact CG2-CG 4.35Å; L223-K225 PolarHBondContact O-N 3.44Å; K225-V229 WeakPolarHBondContact O-CB 3.34Å; K225-V229 WeakPolarHBondContact O-CG2 3.16Å; K225-V229 PolarHBondContact O-N 3.21Å
226	T	94	Very high	95.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-48.2	179.3	-50.9	0	0	0	0	110.8	E224 N230 Y303 Y309	E224-T226 PolarHBondContact O-N 3.15Å; E224-T226 WeakPolarHBondContact OE1-CB 3.46Å; E224-T226 PolarHBondContact OE1-N 3.19Å; E224-T226 PolarHBondContact OE1-OG1 3.27Å; E224-T226 WeakPolarHBondContact OE2-CA 2.96Å; E224-T226 VanDerWaalsContact OE2-CB 3.24Å; E224-T226 WeakPolarHBondContact OE2-CB 3.3Å; E224-T226 PolarHBondContact OE2-N 3.18Å; T226-N230 WeakPolarHBondContact CG2-ND2 3.41Å; T226-N230 WeakPolarHBondContact O-CB 3.43Å; T226-N230 VanDerWaalsContact O-CG 3.24Å; T226-N230 PolarHBondContact O-N 3.13Å; T226-Y303 PolarHBondContact OG1-OH 2.83Å; T226-Y309 HydrophobicContact CG2-CD2 4.35Å
227	F	95.6	Very high	95.6	Very high	14 Å²	14	34.5 Å²	34.5	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-47.5	174.6	172.5	-110.4	0	0	0	111.8	E224 Y231 L232 L295	E224-F227 PolarHBondContact O-N 3.15Å; E224-F227 WeakPolarHBondContact OE2-CB 3.48Å; E224-F227 PolarHBondContact OE2-N 2.71Å; F227-Y231 HydrophobicContact CD2-CD1 4.12Å; F227-Y231 AromaticContact CE2-CD1 3.43Å; F227-Y231 HydrophobicContact CE2-CD1 3.43Å; F227-Y231 VanDerWaalsContact CE2-CD1 3.43Å; F227-Y231 HydrophobicContact CE2-CE1 4.02Å; F227-Y231 HydrophobicContact CE2-CG 4.43Å; F227-Y231 AromaticContact CZ-CD1 3.95Å; F227-Y231 HydrophobicContact CZ-CD1 3.95Å; F227-Y231 HydrophobicContact CZ-CE1 4.3Å; F227-Y231 PolarHBondContact O-N 3.2Å; F227-Y231 VanDerWaalsContact O-N 3.1Å; F227-L232 HydrophobicContact CE1-CB 4.12Å; F227-L232 HydrophobicContact CE1-CD2 4.14Å; F227-L232 HydrophobicContact CZ-CB 4.36Å; F227-L232 PolarHBondContact O-N 3.25Å; F227-L232 VanDerWaalsContact O-N 3.09Å; F227-L295 WeakPolarHBondContact CB-O 3.49Å; F227-L295 HydrophobicContact CD2-CB 4.12Å; F227-L295 HydrophobicContact CD2-CD2 4.38Å; F227-L295 WeakPolarHBondContact CD2-O 3.45Å; F227-L295 HydrophobicContact CE2-CB 3.82Å; F227-L295 HydrophobicContact CE2-CD1 4.32Å; F227-L295 HydrophobicContact CE2-CD2 3.96Å; F227-L295 HydrophobicContact CE2-CG 4.27Å; F227-L295 WeakPolarHBondContact CG-O 3.49Å; F227-L295 HydrophobicContact CZ-CB 4.04Å; F227-L295 HydrophobicContact CZ-CD1 4.4Å
228	C	96.5	Very high	95.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	I	π-helix	trans	-58.1	-55.7	179	-174.9	0	0	0	0	111.5	L182 T219 L223 E224 L232 S233	L182-C228 PolarHBondContact O-SG 3.47Å; T219-C228 HydrophobicContact CG2-CB 3.85Å; L223-C228 HydrophobicContact CB-CB 4.27Å; E224-C228 VanDerWaalsContact O-CB 3.27Å; E224-C228 WeakPolarHBondContact O-CB 3.43Å; E224-C228 PolarHBondContact O-N 3.42Å; C228-L232 PolarHBondContact O-N 3.25Å; C228-S233 WeakPolarHBondContact O-CB 3.33Å; C228-S233 PolarHBondContact O-N 3.36Å; C228-S233 PolarHBondContact O-OG 2.9Å
229	V	95.9	Very high	95.8	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.024	18%	0.182	C	C	.	.	I	π-helix	trans	-70.9	-43.9	-174.4	171.2	0	0	0	0	112.6	L182 I211 K225	L182-V229 HydrophobicContact CB-CB 4.37Å; L182-V229 HydrophobicContact CB-CG1 4.06Å; L182-V229 HydrophobicContact CB-CG2 4.26Å; L182-V229 HydrophobicContact CD1-CG1 4.35Å; I211-V229 HydrophobicContact CD1-CB 3.99Å; I211-V229 HydrophobicContact CD1-CG1 4.33Å; I211-V229 HydrophobicContact CD1-CG2 3.92Å; I211-V229 HydrophobicContact CG1-CB 3.95Å; I211-V229 HydrophobicContact CG1-CG1 3.95Å; I211-V229 HydrophobicContact CG1-CG2 4.42Å; I211-V229 HydrophobicContact CG2-CG1 4.07Å; K225-V229 WeakPolarHBondContact O-CB 3.34Å; K225-V229 WeakPolarHBondContact O-CG2 3.16Å; K225-V229 PolarHBondContact O-N 3.21Å
230	N	95.1	Very high	95.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.19	C	C	.	.	I	π-helix	trans	-76.2	-35	-172.7	-67.9	-3.5	0	0	0	112	A210 I211 T226 H234 Y309 S312 C316	A210-N230 WeakPolarHBondContact CA-OD1 3.18Å; A210-N230 WeakPolarHBondContact CB-OD1 3.19Å; I211-N230 PolarHBondContact N-OD1 2.87Å; I211-N230 PolarHBondContact O-ND2 2.99Å; I211-N230 PolarHBondContact O-OD1 2.87Å; T226-N230 WeakPolarHBondContact CG2-ND2 3.41Å; T226-N230 WeakPolarHBondContact O-CB 3.43Å; T226-N230 VanDerWaalsContact O-CG 3.24Å; T226-N230 PolarHBondContact O-N 3.13Å; N230-H234 PolarHBondContact O-ND1 3.14Å; N230-H234 VanDerWaalsContact O-ND1 3.14Å; N230-Y309 WeakPolarHBondContact ND2-CD2 3.15Å; N230-S312 WeakPolarHBondContact CB-OG 3.4Å; N230-S312 PolarHBondContact ND2-OG 3.08Å; N230-S312 VanDerWaalsContact ND2-OG 3.07Å; N230-C316 PolarHBondContact O-SG 3.49Å
231	Y	96.1	Very high	96.1	Very high	44 Å²	44	32.6 Å²	32.6	17%	0.173	16%	0.158	C	C	.	.	I	π-helix	trans	-123.9	-64.8	-171.1	172.4	-109.2	0	0	0	113.4	F227 S233 H234 F235 C315 F319	F227-Y231 HydrophobicContact CD2-CD1 4.12Å; F227-Y231 AromaticContact CE2-CD1 3.43Å; F227-Y231 HydrophobicContact CE2-CD1 3.43Å; F227-Y231 VanDerWaalsContact CE2-CD1 3.43Å; F227-Y231 HydrophobicContact CE2-CE1 4.02Å; F227-Y231 HydrophobicContact CE2-CG 4.43Å; F227-Y231 AromaticContact CZ-CD1 3.95Å; F227-Y231 HydrophobicContact CZ-CD1 3.95Å; F227-Y231 HydrophobicContact CZ-CE1 4.3Å; F227-Y231 PolarHBondContact O-N 3.2Å; F227-Y231 VanDerWaalsContact O-N 3.1Å; Y231-S233 VanDerWaalsContact C-N 3.34Å; Y231-S233 PolarHBondContact O-N 2.64Å; Y231-H234 PolarHBondContact O-N 3.13Å; Y231-F235 PolarHBondContact O-N 3.31Å; Y231-C315 HydrophobicContact CD1-CB 3.8Å; Y231-C315 HydrophobicContact CD2-CB 3.44Å; Y231-C315 VanDerWaalsContact CD2-CB 3.44Å; Y231-C315 HydrophobicContact CE1-CB 3.97Å; Y231-C315 HydrophobicContact CE2-CB 3.65Å; Y231-C315 WeakPolarHBondContact CE2-O 3.37Å; Y231-C315 HydrophobicContact CG-CB 3.51Å; Y231-F319 HydrophobicContact CE2-CB 3.68Å; Y231-F319 HydrophobicContact CE2-CD1 4.25Å; Y231-F319 HydrophobicContact CE2-CG 4.08Å
232	L	97.1	Very high	96.3	Very high	39 Å²	39	32.3 Å²	32.3	20%	0.204	15%	0.151	C	C	.	.	I	π-helix	trans	-61	-41.8	-165.2	-176.1	67.8	0	0	0	112.6	L223 F227 C228 H234 F235 Y236	L223-L232 HydrophobicContact CD1-CD2 3.42Å; L223-L232 VanDerWaalsContact CD1-CD2 3.42Å; L223-L232 HydrophobicContact CD2-CD2 4.21Å; L223-L232 HydrophobicContact CG-CD2 4.39Å; F227-L232 HydrophobicContact CE1-CB 4.12Å; F227-L232 HydrophobicContact CE1-CD2 4.14Å; F227-L232 HydrophobicContact CZ-CB 4.36Å; F227-L232 PolarHBondContact O-N 3.25Å; F227-L232 VanDerWaalsContact O-N 3.09Å; C228-L232 PolarHBondContact O-N 3.25Å; L232-H234 VanDerWaalsContact C-N 3.32Å; L232-H234 PolarHBondContact O-N 3.06Å; L232-F235 HydrophobicContact CD1-CD1 4.42Å; L232-F235 WeakPolarHBondContact O-CB 3.43Å; L232-F235 PolarHBondContact O-N 3.38Å; L232-Y236 WeakPolarHBondContact O-CB 3.4Å; L232-Y236 PolarHBondContact O-N 3.31Å
233	S	98.1	Very high	96.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-32.3	178.8	-71.2	0	0	0	0	112.6	L182 C228 Y231 L237	L182-S233 WeakPolarHBondContact O-CB 3.38Å; L182-S233 PolarHBondContact O-OG 3.3Å; C228-S233 WeakPolarHBondContact O-CB 3.33Å; C228-S233 PolarHBondContact O-N 3.36Å; C228-S233 PolarHBondContact O-OG 2.9Å; Y231-S233 VanDerWaalsContact C-N 3.34Å; Y231-S233 PolarHBondContact O-N 2.64Å; S233-L237 WeakPolarHBondContact O-CB 3.33Å; S233-L237 PolarHBondContact O-N 3.44Å
234	H	97.7	Very high	96.3	Very high	5 Å²	5	34.7 Å²	34.7	2%	0.023	15%	0.151	C	C	.	.	H	α-helix	trans	-72.4	-38.4	172.6	-69.1	116.4	0	0	0	112.2	T128 Y207 A209 N230 Y231 L232 T238	T128-H234 PolarHBondContact OG1-NE2 3.31Å; Y207-H234 VanDerWaalsContact CB-CD2 3.44Å; Y207-H234 WeakPolarHBondContact CB-CD2 3.47Å; Y207-H234 AromaticContact CD1-CD2 3.51Å; Y207-H234 HydrophobicContact CD2-CB 3.91Å; Y207-H234 HydrophobicContact CE2-CB 4.35Å; Y207-H234 HydrophobicContact CG-CB 4.12Å; Y207-H234 AromaticContact CG-CD2 3.39Å; Y207-H234 AromaticContact CG-CG 3.91Å; A209-H234 PolarHBondContact O-CE1 2.75Å; A209-H234 VanDerWaalsContact O-CE1 3.26Å; N230-H234 PolarHBondContact O-ND1 3.14Å; N230-H234 VanDerWaalsContact O-ND1 3.14Å; Y231-H234 PolarHBondContact O-N 3.13Å; L232-H234 VanDerWaalsContact C-N 3.32Å; L232-H234 PolarHBondContact O-N 3.06Å; H234-T238 WeakPolarHBondContact O-CB 3.44Å; H234-T238 PolarHBondContact O-N 3.08Å; H234-T238 PolarHBondContact O-OG1 2.87Å
235	F	97.6	Very high	96.2	Very high	73 Å²	73	34.7 Å²	34.7	32%	0.32	15%	0.151	S	C	.	.	H	α-helix	trans	-59.3	-48.3	171	169	-94.8	0	0	0	110.8	Y231 L232 T238 R239 F319	Y231-F235 PolarHBondContact O-N 3.31Å; L232-F235 HydrophobicContact CD1-CD1 4.42Å; L232-F235 WeakPolarHBondContact O-CB 3.43Å; L232-F235 PolarHBondContact O-N 3.38Å; F235-T238 WeakPolarHBondContact O-CB 3.33Å; F235-T238 PolarHBondContact O-N 3Å; F235-R239 HydrophobicContact CE1-CG 4.06Å; F235-R239 HydrophobicContact CE2-CG 4.37Å; F235-R239 HydrophobicContact CZ-CG 3.97Å; F235-R239 WeakPolarHBondContact O-CG 3.4Å; F235-R239 PolarHBondContact O-N 3.49Å; F235-F319 HydrophobicContact CB-CZ 4.46Å; F235-F319 HydrophobicContact CD2-CD2 4.01Å; F235-F319 AromaticContact CD2-CE2 3.62Å; F235-F319 HydrophobicContact CD2-CE2 3.62Å; F235-F319 HydrophobicContact CD2-CZ 4.01Å; F235-F319 HydrophobicContact CE2-CE2 4.23Å
236	Y	98.1	Very high	96.1	Very high	71 Å²	71	35.5 Å²	35.5	28%	0.278	15%	0.154	S	C	.	.	H	α-helix	trans	-64	-44.5	179.3	-175.8	-133.4	0	0	0	112	L185 V188 K189 L232 T238 R239 L240	L185-Y236 HydrophobicContact CB-CE1 4.37Å; L185-Y236 HydrophobicContact CD2-CD1 4.04Å; V188-Y236 HydrophobicContact CB-CD1 4.03Å; V188-Y236 HydrophobicContact CB-CE1 4.43Å; V188-Y236 HydrophobicContact CG1-CD1 3.77Å; V188-Y236 HydrophobicContact CG1-CE1 4.45Å; K189-Y236 HydrophobicContact CB-CE1 4.27Å; L232-Y236 WeakPolarHBondContact O-CB 3.4Å; L232-Y236 PolarHBondContact O-N 3.31Å; Y236-T238 VanDerWaalsContact C-N 3.27Å; Y236-T238 PolarHBondContact O-N 3.07Å; Y236-R239 WeakPolarHBondContact O-CB 3.43Å; Y236-R239 PolarHBondContact O-N 2.61Å; Y236-R239 VanDerWaalsContact O-N 3.11Å; Y236-L240 HydrophobicContact CD1-CD1 3.91Å; Y236-L240 HydrophobicContact CD2-CD1 4.25Å; Y236-L240 HydrophobicContact CD2-CG 4.24Å; Y236-L240 HydrophobicContact CE1-CD1 3.62Å; Y236-L240 HydrophobicContact CE1-CG 4.47Å; Y236-L240 HydrophobicContact CE2-CD1 3.97Å; Y236-L240 HydrophobicContact CE2-CD2 4.03Å; Y236-L240 HydrophobicContact CE2-CG 3.93Å; Y236-L240 HydrophobicContact CG-CD1 4.21Å; Y236-L240 WeakPolarHBondContact O-CG 3.48Å; Y236-L240 PolarHBondContact O-N 3.06Å
237	L	98	Very high	96	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-39.6	174.6	-173.2	59.2	0	0	0	111.8	F126 T128 V188 A192 Y207 S233 L240 L241	F126-L237 HydrophobicContact CE1-CD2 3.84Å; F126-L237 HydrophobicContact CZ-CD2 3.96Å; T128-L237 HydrophobicContact CG2-CD2 4.12Å; V188-L237 HydrophobicContact CG1-CB 3.83Å; V188-L237 HydrophobicContact CG1-CD1 4.11Å; A192-L237 HydrophobicContact CB-CD1 3.92Å; Y207-L237 HydrophobicContact CE1-CD2 3.92Å; Y207-L237 HydrophobicContact CE1-CG 4.45Å; S233-L237 WeakPolarHBondContact O-CB 3.33Å; S233-L237 PolarHBondContact O-N 3.44Å; L237-L240 PolarHBondContact O-N 3.1Å; L237-L241 HydrophobicContact CD1-CD1 3.72Å; L237-L241 HydrophobicContact CD1-CG 4.09Å; L237-L241 HydrophobicContact CG-CD1 3.87Å; L237-L241 HydrophobicContact CG-CG 4.48Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.21Å
238	T	96.8	Very high	95.9	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-42.5	175.1	-55	0	0	0	0	112.1	Y207 H234 F235 Y236 L240 L241 W242 M245 F319 L323	Y207-T238 WeakPolarHBondContact CE2-OG1 3.44Å; Y207-T238 WeakPolarHBondContact OH-CA 3.36Å; Y207-T238 PolarHBondContact OH-N 2.92Å; Y207-T238 PolarHBondContact OH-OG1 2.86Å; H234-T238 WeakPolarHBondContact O-CB 3.44Å; H234-T238 PolarHBondContact O-N 3.08Å; H234-T238 PolarHBondContact O-OG1 2.87Å; F235-T238 WeakPolarHBondContact O-CB 3.33Å; F235-T238 PolarHBondContact O-N 3Å; Y236-T238 VanDerWaalsContact C-N 3.27Å; Y236-T238 PolarHBondContact O-N 3.07Å; T238-L240 VanDerWaalsContact C-N 3.34Å; T238-L241 PolarHBondContact O-N 2.89Å; T238-W242 WeakPolarHBondContact O-CA 3.15Å; T238-W242 PolarHBondContact O-N 2.88Å; T238-M245 HydrophobicContact CG2-CE 4.07Å; T238-M245 HydrophobicContact CG2-SD 4Å; T238-F319 HydrophobicContact CG2-CZ 3.95Å; T238-L323 HydrophobicContact CG2-CD1 4.29Å; T238-L323 HydrophobicContact CG2-CD2 3.96Å
239	R	96.8	Very high	95.5	Very high	179 Å²	179	42.2 Å²	42.2	68%	0.675	19%	0.192	S	C	*	.	H	α-helix	trans	-62.1	-42.8	176.8	-73.1	-85.8	-71.8	-167.5	-3.4	111.3	F235 Y236 W242	F235-R239 HydrophobicContact CE1-CG 4.06Å; F235-R239 HydrophobicContact CE2-CG 4.37Å; F235-R239 HydrophobicContact CZ-CG 3.97Å; F235-R239 WeakPolarHBondContact O-CG 3.4Å; F235-R239 PolarHBondContact O-N 3.49Å; Y236-R239 WeakPolarHBondContact O-CB 3.43Å; Y236-R239 PolarHBondContact O-N 2.61Å; Y236-R239 VanDerWaalsContact O-N 3.11Å; R239-W242 WeakPolarHBondContact O-CB 3.06Å
240	L	98	Very high	95.2	Very high	54 Å²	54	45 Å²	45	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-69.3	-41	179.6	-66.9	167.7	0	0	0	112.3	V188 K189 A192 Y236 L237 T238 W242	V188-L240 HydrophobicContact CG1-CD1 4.45Å; K189-L240 HydrophobicContact CB-CD1 4.22Å; K189-L240 HydrophobicContact CG-CD1 4.46Å; A192-L240 HydrophobicContact CB-CB 3.56Å; A192-L240 HydrophobicContact CB-CD1 3.81Å; A192-L240 HydrophobicContact CB-CG 4.3Å; Y236-L240 HydrophobicContact CD1-CD1 3.91Å; Y236-L240 HydrophobicContact CD2-CD1 4.25Å; Y236-L240 HydrophobicContact CD2-CG 4.24Å; Y236-L240 HydrophobicContact CE1-CD1 3.62Å; Y236-L240 HydrophobicContact CE1-CG 4.47Å; Y236-L240 HydrophobicContact CE2-CD1 3.97Å; Y236-L240 HydrophobicContact CE2-CD2 4.03Å; Y236-L240 HydrophobicContact CE2-CG 3.93Å; Y236-L240 HydrophobicContact CG-CD1 4.21Å; Y236-L240 WeakPolarHBondContact O-CG 3.48Å; Y236-L240 PolarHBondContact O-N 3.06Å; L237-L240 PolarHBondContact O-N 3.1Å; T238-L240 VanDerWaalsContact C-N 3.34Å; L240-W242 VanDerWaalsContact C-N 3.28Å; L240-W242 PolarHBondContact O-N 2.84Å
241	L	96.7	Very high	94.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6.8	179.9	-64.6	178.5	0	0	0	113.7	A192 I195 F205 L237 T238 N243 R244 M245	A192-L241 HydrophobicContact CB-CD2 3.94Å; A192-L241 HydrophobicContact CB-CG 4.17Å; I195-L241 HydrophobicContact CB-CD2 3.96Å; I195-L241 HydrophobicContact CD1-CD1 3.89Å; I195-L241 HydrophobicContact CD1-CD2 4.38Å; I195-L241 HydrophobicContact CG2-CD1 4.42Å; I195-L241 HydrophobicContact CG2-CD2 3.71Å; F205-L241 HydrophobicContact CD1-CD1 4.47Å; F205-L241 HydrophobicContact CE1-CD1 4.17Å; L237-L241 HydrophobicContact CD1-CD1 3.72Å; L237-L241 HydrophobicContact CD1-CG 4.09Å; L237-L241 HydrophobicContact CG-CD1 3.87Å; L237-L241 HydrophobicContact CG-CG 4.48Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.21Å; T238-L241 PolarHBondContact O-N 2.89Å; L241-N243 VanDerWaalsContact C-N 3.32Å; L241-N243 PolarHBondContact O-N 3.23Å; L241-R244 WeakPolarHBondContact O-CB 3.38Å; L241-R244 PolarHBondContact O-N 2.7Å; L241-M245 HydrophobicContact CB-CE 4.28Å; L241-M245 WeakPolarHBondContact O-CG 3.45Å; L241-M245 PolarHBondContact O-N 3.37Å
242	W	94.4	Very high	94.6	Very high	66 Å²	66	44.4 Å²	44.4	25%	0.25	21%	0.207	C	C	.	.	H	α-helix	trans	-55.3	-44.4	-172.7	-177.4	-111.2	0	0	0	113.3	T238 R239 L240 M245 K246 L323 M327	T238-W242 WeakPolarHBondContact O-CA 3.15Å; T238-W242 PolarHBondContact O-N 2.88Å; R239-W242 WeakPolarHBondContact O-CB 3.06Å; L240-W242 VanDerWaalsContact C-N 3.28Å; L240-W242 PolarHBondContact O-N 2.84Å; W242-M245 PolarHBondContact O-N 3.06Å; W242-K246 PolarHBondContact O-N 3.22Å; W242-L323 HydrophobicContact CH2-CD1 4.4Å; W242-L323 HydrophobicContact CZ3-CD1 3.74Å; W242-M327 HydrophobicContact CE3-CE 3.84Å; W242-M327 HydrophobicContact CH2-CE 3.93Å; W242-M327 HydrophobicContact CH2-CG 3.52Å; W242-M327 HydrophobicContact CZ3-CE 3.17Å; W242-M327 HydrophobicContact CZ3-CG 3.79Å; W242-M327 HydrophobicContact CZ3-SD 4.29Å
243	N	93.9	Very high	94.3	Very high	96 Å²	96	42.6 Å²	42.6	51%	0.513	20%	0.198	S	C	.	.	H	α-helix	trans	-67.4	-42	178	-70.4	-27.3	0	0	0	111.7	L241 M245 K246 E247	L241-N243 VanDerWaalsContact C-N 3.32Å; L241-N243 PolarHBondContact O-N 3.23Å; N243-M245 VanDerWaalsContact C-N 3.31Å; N243-M245 PolarHBondContact O-N 3.46Å; N243-K246 PolarHBondContact O-N 2.86Å; N243-K246 VanDerWaalsContact OD1-CE 3.26Å; N243-K246 WeakPolarHBondContact OD1-CE 3.05Å; N243-K246 PolarHBondContact OD1-NZ 2.98Å; N243-E247 WeakPolarHBondContact O-CG 3.37Å; N243-E247 PolarHBondContact O-N 3.24Å
244	R	94.6	Very high	93.9	Very high	23 Å²	23	42.6 Å²	42.6	9%	0.087	20%	0.198	C	C	.	.	H	α-helix	trans	-62.3	-38	176.5	-177.1	57.5	64.1	-166.9	11.3	112.3	T196 N199 I202 L241 E247 S248	T196-R244 PolarHBondContact O-NH2 3.37Å; T196-R244 VanDerWaalsContact O-NH2 3.11Å; N199-R244 PolarHBondContact OD1-NH1 3.15Å; N199-R244 PolarHBondContact OD1-NH2 2.94Å; I202-R244 HydrophobicContact CD1-CG 4.5Å; L241-R244 WeakPolarHBondContact O-CB 3.38Å; L241-R244 PolarHBondContact O-N 2.7Å; R244-E247 IonicContact CZ-OE2 3.27Å; R244-E247 IonicContact NE-OE2 3.9Å; R244-E247 IonicContact NH1-OE2 2.77Å; R244-E247 PolarHBondContact NH1-OE2 3.03Å; R244-S248 VanDerWaalsContact O-CB 3.29Å; R244-S248 WeakPolarHBondContact O-CB 2.92Å; R244-S248 PolarHBondContact O-N 3.43Å; R244-S248 PolarHBondContact O-OG 3.01Å
245	M	93.8	Very high	93.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-49.4	174.6	-70.6	177.7	177.3	0	0	110.7	F205 Y207 T238 L241 W242 N243 E247 S248 A249 I253 M327 L332	F205-M245 HydrophobicContact CB-CE 4.38Å; F205-M245 HydrophobicContact CD1-CE 3.83Å; F205-M245 HydrophobicContact CD2-CE 4.29Å; F205-M245 HydrophobicContact CD2-CG 4.15Å; F205-M245 HydrophobicContact CE1-CE 4.13Å; F205-M245 HydrophobicContact CE1-CG 4.12Å; F205-M245 HydrophobicContact CE2-CB 4.38Å; F205-M245 HydrophobicContact CE2-CG 3.65Å; F205-M245 HydrophobicContact CG-CE 3.91Å; F205-M245 HydrophobicContact CZ-CB 4.5Å; F205-M245 HydrophobicContact CZ-CE 4.48Å; F205-M245 HydrophobicContact CZ-CG 3.62Å; Y207-M245 WeakPolarHBondContact OH-CE 3.46Å; T238-M245 HydrophobicContact CG2-CE 4.07Å; T238-M245 HydrophobicContact CG2-SD 4Å; L241-M245 HydrophobicContact CB-CE 4.28Å; L241-M245 WeakPolarHBondContact O-CG 3.45Å; L241-M245 PolarHBondContact O-N 3.37Å; W242-M245 PolarHBondContact O-N 3.06Å; N243-M245 VanDerWaalsContact C-N 3.31Å; N243-M245 PolarHBondContact O-N 3.46Å; M245-E247 PolarHBondContact O-N 3.41Å; M245-S248 PolarHBondContact O-N 2.85Å; M245-S248 VanDerWaalsContact O-N 3.11Å; M245-A249 PolarHBondContact O-N 3.36Å; M245-I253 HydrophobicContact CE-CG1 4.13Å; M245-I253 HydrophobicContact SD-CD1 4.38Å; M245-I253 HydrophobicContact SD-CG1 4.06Å; M245-M327 HydrophobicContact SD-CE 3.79Å; M245-L332 HydrophobicContact CB-CD1 4.18Å; M245-L332 WeakPolarHBondContact O-CD2 3.34Å
246	K	92.4	Very high	93.1	Very high	73 Å²	73	39.4 Å²	39.4	32%	0.317	18%	0.184	S	C	.	.	H	α-helix	trans	-60.5	-45.5	177.4	-70.3	-177.9	-66.1	171	0	112.6	W242 N243 S248 A249 L332	W242-K246 PolarHBondContact O-N 3.22Å; N243-K246 PolarHBondContact O-N 2.86Å; N243-K246 VanDerWaalsContact OD1-CE 3.26Å; N243-K246 WeakPolarHBondContact OD1-CE 3.05Å; N243-K246 PolarHBondContact OD1-NZ 2.98Å; K246-S248 PolarHBondContact O-N 3.2Å; K246-A249 WeakPolarHBondContact O-CB 3.46Å; K246-A249 PolarHBondContact O-N 2.87Å; K246-A249 VanDerWaalsContact O-N 3.12Å; K246-L332 HydrophobicContact CG-CD1 4.31Å
247	E	93.3	Very high	92.5	Very high	121 Å²	121	36.3 Å²	36.3	57%	0.565	17%	0.173	S	C	*	.	H	α-helix	trans	-63.8	-26.1	176.7	-71.4	167.3	-167.7	0	0	112.7	N243 R244 M245 A249	N243-E247 WeakPolarHBondContact O-CG 3.37Å; N243-E247 PolarHBondContact O-N 3.24Å; R244-E247 IonicContact CZ-OE2 3.27Å; R244-E247 IonicContact NE-OE2 3.9Å; R244-E247 IonicContact NH1-OE2 2.77Å; R244-E247 PolarHBondContact NH1-OE2 3.03Å; M245-E247 PolarHBondContact O-N 3.41Å; E247-A249 VanDerWaalsContact C-N 3.32Å
248	S	93	Very high	91.6	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.007	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.5	178.1	-56.5	0	0	0	0	113.5	R201 I202 R244 M245 K246 P250	R201-S248 PolarHBondContact NE-O 3.34Å; R201-S248 VanDerWaalsContact NE-O 3.08Å; R201-S248 PolarHBondContact NH2-O 3.47Å; I202-S248 PolarHBondContact N-OG 3.35Å; I202-S248 WeakPolarHBondContact O-CB 3.46Å; R244-S248 VanDerWaalsContact O-CB 3.29Å; R244-S248 WeakPolarHBondContact O-CB 2.92Å; R244-S248 PolarHBondContact O-N 3.43Å; R244-S248 PolarHBondContact O-OG 3.01Å; M245-S248 PolarHBondContact O-N 2.85Å; M245-S248 VanDerWaalsContact O-N 3.11Å; K246-S248 PolarHBondContact O-N 3.2Å; S248-P250 CarbonylContact O-C 3.58Å
249	A	88.7	Confident	90.5	Very high	33 Å²	33	39.8 Å²	39.8	27%	0.273	19%	0.192	S	C	.	.			trans	-54.8	138.6	-178.6	0	0	0	0	0	111.8	M245 K246 E247 H330 N331 L332	M245-A249 PolarHBondContact O-N 3.36Å; K246-A249 WeakPolarHBondContact O-CB 3.46Å; K246-A249 PolarHBondContact O-N 2.87Å; K246-A249 VanDerWaalsContact O-N 3.12Å; E247-A249 VanDerWaalsContact C-N 3.32Å; A249-H330 WeakPolarHBondContact CB-O 3.3Å; A249-N331 HydrophobicContact CB-CB 4.31Å; A249-L332 HydrophobicContact CB-CD2 4.21Å
250	P	88.3	Confident	89.3	Confident	63 Å²	63	32.4 Å²	32.4	41%	0.409	17%	0.168	S	C	.	.	S	Bend	cis	-70.4	129	-2.1	29.2	-33.7	0	0	0	111.7	R201 S248 N331 L385	R201-P250 PolarHBondContact NH2-O 2.9Å; S248-P250 CarbonylContact O-C 3.58Å; P250-N331 WeakPolarHBondContact CA-O 3.45Å; P250-L385 HydrophobicContact CB-CD1 4.12Å; P250-L385 HydrophobicContact CB-CD2 3.55Å
251	A	89.7	Confident	87.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.7	179.6	0	0	0	0	0	111.6	D203 F205 L332 C333	D203-A251 CarbonylContact O-C 3.59Å; D203-A251 WeakPolarHBondContact O-CA 3.24Å; D203-A251 WeakPolarHBondContact O-CB 3.34Å; F205-A251 HydrophobicContact CE2-CB 4.38Å; A251-L332 HydrophobicContact CB-CD2 3.64Å; A251-L332 WeakPolarHBondContact O-CA 3.42Å; A251-C333 PolarHBondContact O-N 3Å
252	R	89.8	Confident	86.2	Confident	31 Å²	31	33.3 Å²	33.3	12%	0.117	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.7	-176.2	-60.7	-170	179.6	105.8	10.4	111.6	D203 I204 F205 C333 M378 T379 L381	D203-R252 PolarHBondContact O-N 2.78Å; I204-R252 CarbonylContact C-O 3.54Å; I204-R252 WeakPolarHBondContact CA-O 3.38Å; I204-R252 HydrophobicContact CG1-CB 4.47Å; F205-R252 PolarHBondContact N-O 3.22Å; R252-C333 CarbonylContact C-O 3.6Å; R252-C333 WeakPolarHBondContact CA-O 3.41Å; R252-C333 HydrophobicContact CG-CB 4.3Å; R252-M378 VanDerWaalsContact CD-O 3.27Å; R252-M378 WeakPolarHBondContact CD-O 3.06Å; R252-T379 PolarHBondContact NH1-O 3.28Å; R252-L381 VanDerWaalsContact CZ-O 3.27Å; R252-L381 PolarHBondContact NH2-O 3.32Å
253	I	91.2	Very high	84.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124	174.1	-54.7	81.2	0	0	0	107.2	F205 Y207 M245 L255 M327 C333 C334 V335	F205-I253 HydrophobicContact CB-CG1 4.35Å; F205-I253 HydrophobicContact CB-CG2 4.46Å; F205-I253 HydrophobicContact CD2-CG1 4.45Å; F205-I253 CarbonylContact O-C 3.6Å; F205-I253 WeakPolarHBondContact O-CA 3.36Å; Y207-I253 HydrophobicContact CD2-CG2 4.14Å; Y207-I253 HydrophobicContact CE2-CG2 3.88Å; M245-I253 HydrophobicContact CE-CG1 4.13Å; M245-I253 HydrophobicContact SD-CD1 4.38Å; M245-I253 HydrophobicContact SD-CG1 4.06Å; I253-L255 HydrophobicContact CG2-CD1 3.79Å; I253-M327 HydrophobicContact CD1-CE 3.61Å; I253-M327 HydrophobicContact CD1-SD 3.53Å; I253-M327 VanDerWaalsContact CD1-SD 3.53Å; I253-M327 HydrophobicContact CG1-CE 4.16Å; I253-M327 HydrophobicContact CG1-SD 4.48Å; I253-C333 PolarHBondContact N-O 3.38Å; I253-C334 HydrophobicContact CB-CB 4.33Å; I253-C334 CarbonylContact O-C 3.59Å; I253-C334 WeakPolarHBondContact O-CA 3.39Å; I253-V335 PolarHBondContact O-N 2.95Å
254	V	89.8	Confident	83.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.9	-179	-174	0	0	0	0	108.6	F205 Y207 V335 V337 Y375 M378 T379	F205-V254 PolarHBondContact O-N 3.11Å; Y207-V254 PolarHBondContact N-O 3.03Å; V254-V335 WeakPolarHBondContact CA-O 3.14Å; V254-V335 HydrophobicContact CB-CG2 4.34Å; V254-V335 HydrophobicContact CG1-CG2 4.25Å; V254-V335 HydrophobicContact CG2-CG2 3.91Å; V254-V337 HydrophobicContact CG1-CB 4.08Å; V254-V337 HydrophobicContact CG1-CG2 3.7Å; V254-Y375 HydrophobicContact CB-CD1 4.4Å; V254-Y375 HydrophobicContact CG1-CD1 3.63Å; V254-Y375 HydrophobicContact CG1-CE1 4.06Å; V254-M378 HydrophobicContact CG2-CB 4.38Å; V254-T379 HydrophobicContact CG2-CG2 4.12Å
255	L	90.4	Very high	81.4	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.6	177.4	-71.4	97.1	0	0	0	111.1	Y207 I253 T257 C316 F319 A320 C334 V335 A336 V337	Y207-L255 HydrophobicContact CD2-CD2 4.21Å; Y207-L255 HydrophobicContact CD2-CG 4Å; I253-L255 HydrophobicContact CG2-CD1 3.79Å; L255-T257 PolarHBondContact O-N 3.36Å; L255-C316 HydrophobicContact CD2-CB 4.41Å; L255-F319 HydrophobicContact CD2-CD1 3.45Å; L255-F319 VanDerWaalsContact CD2-CD1 3.45Å; L255-F319 HydrophobicContact CD2-CE1 3.83Å; L255-A320 HydrophobicContact CD1-CB 4.04Å; L255-C334 WeakPolarHBondContact CD1-SG 3.01Å; L255-V335 PolarHBondContact N-O 3.12Å; L255-A336 CarbonylContact O-C 3.55Å; L255-A336 WeakPolarHBondContact O-CA 3.47Å; L255-V337 PolarHBondContact O-N 2.97Å
256	T	87.4	Confident	79.3	Confident	9 Å²	9	35.9 Å²	35.9	6%	0.055	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	112.9	-180	-48.1	0	0	0	0	111.5	Y207 N208 K313 V337 P339 Y375	Y207-T256 PolarHBondContact O-N 3.02Å; Y207-T256 PolarHBondContact O-OG1 3.02Å; Y207-T256 VanDerWaalsContact O-OG1 3.11Å; N208-T256 WeakPolarHBondContact CA-OG1 3.4Å; T256-K313 PolarHBondContact O-NZ 3.44Å; T256-V337 CarbonylContact C-O 3.52Å; T256-V337 WeakPolarHBondContact CA-O 3.47Å; T256-P339 HydrophobicContact CG2-CG 4.45Å; T256-Y375 WeakPolarHBondContact CB-OH 3.06Å; T256-Y375 WeakPolarHBondContact CG2-OH 3.33Å; T256-Y375 WeakPolarHBondContact OG1-CE1 3.5Å; T256-Y375 PolarHBondContact OG1-OH 3.16Å
257	T	85.8	Confident	77.1	Confident	6 Å²	6	34.7 Å²	34.7	4%	0.037	18%	0.177	C	C	.	.			trans	-106.5	-176.5	179.5	69.8	0	0	0	0	111	L255 C316 V317 A336 V337 H338 P339	L255-T257 PolarHBondContact O-N 3.36Å; T257-C316 HydrophobicContact CG2-CB 3.91Å; T257-V317 HydrophobicContact CG2-CG2 3.62Å; T257-A336 HydrophobicContact CG2-CB 3.71Å; T257-V337 PolarHBondContact N-O 2.79Å; T257-V337 PolarHBondContact OG1-O 2.77Å; T257-H338 PolarHBondContact OG1-N 3.29Å; T257-P339 WeakPolarHBondContact O-CD 3.4Å
258	C	78.8	Confident	74.8	Confident	29 Å²	29	33.1 Å²	33.1	20%	0.196	17%	0.172	C	C	.	.			trans	-149.3	137.2	178.6	-179.2	0	0	0	0	108.8	C260 H261 Y309 K313	C258-C260 PolarHBondContact O-N 3.16Å; C258-C260 PolarHBondContact SG-SG 3.35Å; C258-H261 PolarHBondContact O-N 2.84Å; C258-H261 PolarHBondContact O-ND1 2.98Å; C258-Y309 HydrophobicContact CB-CE1 4.19Å; C258-K313 HydrophobicContact CB-CB 4.41Å; C258-K313 HydrophobicContact CB-CG 3.97Å
259	E	73.9	Confident	72.3	Confident	47 Å²	47	38 Å²	38	22%	0.22	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-51.2	-25.4	-177.7	-166.6	67.4	178.8	0	0	114	H261 R262 H338 N341	E259-H261 PolarHBondContact O-N 3.35Å; E259-H261 IonicContact OE2-CE1 3.96Å; E259-R262 WeakPolarHBondContact O-CB 3.41Å; E259-R262 WeakPolarHBondContact O-CG 3.21Å; E259-R262 PolarHBondContact O-N 3.01Å; E259-R262 WeakPolarHBondContact OE1-CD 3.49Å; E259-R262 IonicContact OE1-CZ 3.65Å; E259-R262 IonicContact OE1-NE 3.7Å; E259-R262 IonicContact OE1-NH1 2.79Å; E259-R262 PolarHBondContact OE1-NH1 2.98Å; E259-H338 PolarHBondContact N-ND1 2.92Å; E259-H338 VanDerWaalsContact N-ND1 3.19Å; E259-N341 WeakPolarHBondContact CB-OD1 3.37Å
260	C	71.6	Confident	69.8	Low	25 Å²	25	39.1 Å²	39.1	17%	0.169	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-57.5	-18.1	175.5	73.1	0	0	0	0	114	C258 R262 L263 C310	C258-C260 PolarHBondContact O-N 3.16Å; C258-C260 PolarHBondContact SG-SG 3.35Å; C260-R262 PolarHBondContact O-N 2.9Å; C260-L263 HydrophobicContact CB-CD1 4.35Å; C260-L263 WeakPolarHBondContact O-CB 3.46Å; C260-L263 WeakPolarHBondContact O-CG 3.47Å; C260-L263 PolarHBondContact O-N 3.04Å; C260-L263 VanDerWaalsContact O-N 3.12Å; C260-C310 WeakPolarHBondContact CB-SG 3.26Å; C260-C310 PolarHBondContact O-SG 3.45Å
261	H	62.8	Low	67.6	Low	19 Å²	19	44.7 Å²	44.7	9%	0.088	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-55.8	-29.9	169.8	72.5	-82.8	0	0	0	112.7	C258 E259 L263 Y264 K313 L314	C258-H261 PolarHBondContact O-N 2.84Å; C258-H261 PolarHBondContact O-ND1 2.98Å; E259-H261 PolarHBondContact O-N 3.35Å; E259-H261 IonicContact OE2-CE1 3.96Å; H261-L263 PolarHBondContact O-N 3.04Å; H261-Y264 PolarHBondContact O-N 2.79Å; H261-K313 HydrophobicContact CB-CB 4.27Å; H261-L314 HydrophobicContact CB-CB 4.1Å
262	R	66.8	Low	65	Low	55 Å²	55	52.9 Å²	52.9	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-70.1	-17.9	179.8	-61.2	-179	78.8	163.3	9.3	113.5	E259 C260 Y264 V265 Y266	E259-R262 WeakPolarHBondContact O-CB 3.41Å; E259-R262 WeakPolarHBondContact O-CG 3.21Å; E259-R262 PolarHBondContact O-N 3.01Å; E259-R262 WeakPolarHBondContact OE1-CD 3.49Å; E259-R262 IonicContact OE1-CZ 3.65Å; E259-R262 IonicContact OE1-NE 3.7Å; E259-R262 IonicContact OE1-NH1 2.79Å; E259-R262 PolarHBondContact OE1-NH1 2.98Å; C260-R262 PolarHBondContact O-N 2.9Å; R262-Y264 PolarHBondContact O-N 2.79Å; R262-Y264 VanDerWaalsContact O-N 3.15Å; R262-V265 PolarHBondContact O-N 3.12Å; R262-Y266 HydrophobicContact CB-CD2 3.73Å; R262-Y266 HydrophobicContact CB-CE2 3.81Å; R262-Y266 HydrophobicContact CG-CE2 4.49Å; R262-Y266 VanDerWaalsContact CZ-OH 3.27Å; R262-Y266 VanDerWaalsContact NE-CE2 3.32Å; R262-Y266 PolarHBondContact NH2-OH 2.54Å; R262-Y266 WeakPolarHBondContact O-CB 3.32Å; R262-Y266 VanDerWaalsContact O-CD2 3.32Å; R262-Y266 WeakPolarHBondContact O-CD2 3.38Å; R262-Y266 PolarHBondContact O-N 2.69Å
263	L	64.6	Low	62.6	Low	55 Å²	55	58.7 Å²	58.7	29%	0.288	29%	0.291	S	S	.	.	H	α-helix	trans	-58	-29.6	177.7	-68.1	173.9	0	0	0	112	C260 H261 F277 F281	C260-L263 HydrophobicContact CB-CD1 4.35Å; C260-L263 WeakPolarHBondContact O-CB 3.46Å; C260-L263 WeakPolarHBondContact O-CG 3.47Å; C260-L263 PolarHBondContact O-N 3.04Å; C260-L263 VanDerWaalsContact O-N 3.12Å; H261-L263 PolarHBondContact O-N 3.04Å; L263-F277 HydrophobicContact CD1-CD1 4.41Å; L263-F281 HydrophobicContact CB-CD2 4.41Å; L263-F281 HydrophobicContact CB-CE2 4.13Å; L263-F281 HydrophobicContact CB-CZ 4.29Å; L263-F281 HydrophobicContact CD1-CE2 4.08Å; L263-F281 HydrophobicContact CD1-CZ 4.4Å
264	Y	63.4	Low	60	Low	10 Å²	10	67.5 Å²	67.5	4%	0.039	33%	0.333	C	S	.	.	H	α-helix	trans	-82.1	-40.5	171.6	-79.4	-75.9	0	0	0	113.6	H261 R262 H267 L268 F281 L289 R307 C310 L311 L314	H261-Y264 PolarHBondContact O-N 2.79Å; R262-Y264 PolarHBondContact O-N 2.79Å; R262-Y264 VanDerWaalsContact O-N 3.15Å; Y264-H267 PolarHBondContact O-N 3.34Å; Y264-L268 WeakPolarHBondContact O-CG 3.27Å; Y264-L268 PolarHBondContact O-N 3.26Å; Y264-F281 AromaticContact CD1-CD1 3.81Å; Y264-F281 HydrophobicContact CD1-CD1 3.81Å; Y264-F281 HydrophobicContact CD1-CE1 4.21Å; Y264-F281 HydrophobicContact CD2-CD1 4.23Å; Y264-F281 AromaticContact CD2-CE1 3.84Å; Y264-F281 HydrophobicContact CD2-CE1 3.84Å; Y264-F281 AromaticContact CE1-CD1 3.52Å; Y264-F281 HydrophobicContact CE1-CD1 3.52Å; Y264-F281 AromaticContact CE1-CE1 3.77Å; Y264-F281 HydrophobicContact CE1-CE1 3.77Å; Y264-F281 AromaticContact CE2-CD1 3.96Å; Y264-F281 HydrophobicContact CE2-CD1 3.96Å; Y264-F281 AromaticContact CE2-CE1 3.35Å; Y264-F281 HydrophobicContact CE2-CE1 3.35Å; Y264-F281 HydrophobicContact CE2-CZ 4.34Å; Y264-F281 HydrophobicContact CG-CD1 4.19Å; Y264-F281 HydrophobicContact CG-CE1 4.28Å; Y264-F281 AromaticContact CZ-CD1 3.64Å; Y264-F281 AromaticContact CZ-CE1 3.35Å; Y264-L289 HydrophobicContact CD1-CD1 3.47Å; Y264-L289 VanDerWaalsContact CD1-CD1 3.47Å; Y264-L289 HydrophobicContact CE1-CD1 3.37Å; Y264-L289 HydrophobicContact CG-CD1 4.28Å; Y264-R307 WeakPolarHBondContact OH-CG 3.34Å; Y264-R307 PolarHBondContact OH-NE 3.08Å; Y264-C310 HydrophobicContact CD2-CB 4.14Å; Y264-C310 HydrophobicContact CE2-CB 3.93Å; Y264-L311 HydrophobicContact CE2-CB 3.76Å; Y264-L311 HydrophobicContact CE2-CD1 4.16Å; Y264-L314 HydrophobicContact CG-CD2 4.42Å
265	V	54.5	Low	57.5	Low	57 Å²	57	72.3 Å²	72.3	35%	0.345	36%	0.358	S	S	.	.	H	α-helix	trans	-66.4	-44.3	-177.4	-177.8	0	0	0	0	110.9	R262 H267 L268 C269 L314	R262-V265 PolarHBondContact O-N 3.12Å; V265-H267 PolarHBondContact O-N 3.35Å; V265-L268 PolarHBondContact O-N 2.77Å; V265-C269 PolarHBondContact O-N 3.08Å; V265-L314 HydrophobicContact CG2-CD1 3.88Å
266	Y	48.1	Very low	55	Low	116 Å²	116	83.5 Å²	83.5	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-33.8	175.3	-82.3	-66.6	0	0	0	112	R262 C270	R262-Y266 HydrophobicContact CB-CD2 3.73Å; R262-Y266 HydrophobicContact CB-CE2 3.81Å; R262-Y266 HydrophobicContact CG-CE2 4.49Å; R262-Y266 VanDerWaalsContact CZ-OH 3.27Å; R262-Y266 VanDerWaalsContact NE-CE2 3.32Å; R262-Y266 PolarHBondContact NH2-OH 2.54Å; R262-Y266 WeakPolarHBondContact O-CB 3.32Å; R262-Y266 VanDerWaalsContact O-CD2 3.32Å; R262-Y266 WeakPolarHBondContact O-CD2 3.38Å; R262-Y266 PolarHBondContact O-N 2.69Å; Y266-C270 WeakPolarHBondContact O-CA 3.43Å; Y266-C270 VanDerWaalsContact O-CB 3.29Å; Y266-C270 WeakPolarHBondContact O-CB 3.43Å; Y266-C270 PolarHBondContact O-N 3.11Å
267	H	48.1	Very low	52.8	Low	49 Å²	49	88.6 Å²	88.6	23%	0.227	42%	0.423	C	S	.	.	H	α-helix	trans	-77	-27.2	179.4	-152.3	70.7	0	0	0	112.9	Y264 V265 F281 Q282 S283	Y264-H267 PolarHBondContact O-N 3.34Å; V265-H267 PolarHBondContact O-N 3.35Å; H267-F281 PolarHBondContact CD2-O 2.82Å; H267-F281 PolarHBondContact CE1-O 2.99Å; H267-F281 PolarHBondContact ND1-O 3.44Å; H267-F281 PolarHBondContact NE2-O 3.15Å; H267-Q282 VanDerWaalsContact NE2-C 3.27Å; H267-S283 VanDerWaalsContact CD2-CA 3.4Å; H267-S283 WeakPolarHBondContact CD2-CA 3.46Å; H267-S283 PolarHBondContact CD2-N 3.16Å; H267-S283 PolarHBondContact NE2-N 2.89Å
268	L	44.6	Very low	50.6	Low	88 Å²	88	90.4 Å²	90.4	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-71.7	-37.6	170.1	-72.7	165.5	0	0	0	112.5	Y264 V265 L289	Y264-L268 WeakPolarHBondContact O-CG 3.27Å; Y264-L268 PolarHBondContact O-N 3.26Å; V265-L268 PolarHBondContact O-N 2.77Å; L268-L289 HydrophobicContact CD1-CD2 3.98Å
269	C	39.3	Very low	49.1	Very low	103 Å²	103	93 Å²	93	70%	0.696	46%	0.46	S	S	*	.	H	α-helix	trans	-97.7	-23.8	-173	-65.8	0	0	0	0	114.9	V265	V265-C269 PolarHBondContact O-N 3.08Å
270	C	35.9	Very low	47.8	Very low	57 Å²	57	95.2 Å²	95.2	39%	0.385	47%	0.473	S	S	.	.			trans	-127.7	100.5	-173.9	-57.4	0	0	0	0	110	Y266 H272	Y266-C270 WeakPolarHBondContact O-CA 3.43Å; Y266-C270 VanDerWaalsContact O-CB 3.29Å; Y266-C270 WeakPolarHBondContact O-CB 3.43Å; Y266-C270 PolarHBondContact O-N 3.11Å; C270-H272 PolarHBondContact O-N 2.96Å
271	Q	42.4	Very low	47	Very low	180 Å²	180	94.3 Å²	94.3	84%	0.841	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	6.9	172.8	-70.5	-172.7	-13.8	0	0	114.1
272	H	36.5	Very low	46.7	Very low	173 Å²	173	101 Å²	101	80%	0.801	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	29	-162.3	-84.1	47.8	0	0	0	115.6	C270	C270-H272 PolarHBondContact O-N 2.96Å
273	Y	39.5	Very low	46.4	Very low	153 Å²	153	102.6 Å²	102.6	60%	0.6	52%	0.517	S	S	*	.			trans	-114.6	87	173.3	-163.2	-110.7	0	0	0	112.2	L275	Y273-L275 VanDerWaalsContact C-N 3.3Å; Y273-L275 HydrophobicContact CD1-CB 4.08Å; Y273-L275 HydrophobicContact CE1-CB 3.52Å; Y273-L275 HydrophobicContact CE1-CD1 4.23Å; Y273-L275 HydrophobicContact CE1-CD2 4.46Å; Y273-L275 HydrophobicContact CE1-CG 4.26Å; Y273-L275 HydrophobicContact CE2-CD1 3.94Å; Y273-L275 PolarHBondContact O-N 3.14Å
274	E	35.8	Very low	46.8	Very low	185 Å²	185	101 Å²	101	86%	0.864	51%	0.508	S	S	*	.			trans	-81.3	66.4	169.5	-70.1	-166.7	155.3	0	0	111.5
275	L	37.1	Very low	47.6	Very low	101 Å²	101	104.2 Å²	104.2	53%	0.529	53%	0.531	S	S	.	.	S	Bend	trans	-102.7	144.1	156.7	-114.3	85.6	0	0	0	109.1	Y273 F277 S278	Y273-L275 VanDerWaalsContact C-N 3.3Å; Y273-L275 HydrophobicContact CD1-CB 4.08Å; Y273-L275 HydrophobicContact CE1-CB 3.52Å; Y273-L275 HydrophobicContact CE1-CD1 4.23Å; Y273-L275 HydrophobicContact CE1-CD2 4.46Å; Y273-L275 HydrophobicContact CE1-CG 4.26Å; Y273-L275 HydrophobicContact CE2-CD1 3.94Å; Y273-L275 PolarHBondContact O-N 3.14Å; L275-F277 PolarHBondContact O-N 3.1Å; L275-S278 PolarHBondContact O-N 3.3Å
276	Y	38.8	Very low	48.9	Very low	236 Å²	236	106.5 Å²	106.5	93%	0.925	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.9	-14.5	-175.9	-123.8	-97.8	0	0	0	119.1
277	F	40.7	Very low	50.7	Low	116 Å²	116	107.5 Å²	107.5	51%	0.509	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-15.9	172	-88.7	-94.4	0	0	0	114.8	L263 L275 A279 N280 L306	L263-F277 HydrophobicContact CD1-CD1 4.41Å; L275-F277 PolarHBondContact O-N 3.1Å; F277-A279 VanDerWaalsContact C-N 3.28Å; F277-A279 PolarHBondContact O-N 3.46Å; F277-N280 PolarHBondContact O-N 2.92Å; F277-L306 HydrophobicContact CD1-CD2 3.84Å; F277-L306 HydrophobicContact CE1-CD2 3.5Å
278	S	40.5	Very low	52.5	Low	44 Å²	44	110.4 Å²	110.4	31%	0.308	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-64.8	-28	-176.1	68.9	0	0	0	0	113.7	L275 N280 F281	L275-S278 PolarHBondContact O-N 3.3Å; S278-N280 PolarHBondContact O-N 2.8Å; S278-F281 CarbonylContact O-C 3.48Å; S278-F281 PolarHBondContact O-N 3.42Å; S278-F281 VanDerWaalsContact O-O 3.11Å
279	A	45.4	Very low	54.4	Low	84 Å²	84	106.3 Å²	106.3	69%	0.694	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-57.2	-24	-177.8	0	0	0	0	0	113.8	F277	F277-A279 VanDerWaalsContact C-N 3.28Å; F277-A279 PolarHBondContact O-N 3.46Å
280	N	46.9	Very low	56.8	Low	94 Å²	94	104.9 Å²	104.9	50%	0.503	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-98.3	-9.8	179.6	-71.8	-35.3	0	0	0	114.7	F277 S278	F277-N280 PolarHBondContact O-N 2.92Å; S278-N280 PolarHBondContact O-N 2.8Å
281	F	55.5	Low	59.4	Low	6 Å²	6	103.6 Å²	103.6	3%	0.026	52%	0.519	C	S	.	.			trans	-124	90.5	-178.3	-66.3	-78.8	0	0	0	107.6	L263 Y264 H267 S278 L306 R307 C310	L263-F281 HydrophobicContact CB-CD2 4.41Å; L263-F281 HydrophobicContact CB-CE2 4.13Å; L263-F281 HydrophobicContact CB-CZ 4.29Å; L263-F281 HydrophobicContact CD1-CE2 4.08Å; L263-F281 HydrophobicContact CD1-CZ 4.4Å; Y264-F281 AromaticContact CD1-CD1 3.81Å; Y264-F281 HydrophobicContact CD1-CD1 3.81Å; Y264-F281 HydrophobicContact CD1-CE1 4.21Å; Y264-F281 HydrophobicContact CD2-CD1 4.23Å; Y264-F281 AromaticContact CD2-CE1 3.84Å; Y264-F281 HydrophobicContact CD2-CE1 3.84Å; Y264-F281 AromaticContact CE1-CD1 3.52Å; Y264-F281 HydrophobicContact CE1-CD1 3.52Å; Y264-F281 AromaticContact CE1-CE1 3.77Å; Y264-F281 HydrophobicContact CE1-CE1 3.77Å; Y264-F281 AromaticContact CE2-CD1 3.96Å; Y264-F281 HydrophobicContact CE2-CD1 3.96Å; Y264-F281 AromaticContact CE2-CE1 3.35Å; Y264-F281 HydrophobicContact CE2-CE1 3.35Å; Y264-F281 HydrophobicContact CE2-CZ 4.34Å; Y264-F281 HydrophobicContact CG-CD1 4.19Å; Y264-F281 HydrophobicContact CG-CE1 4.28Å; Y264-F281 AromaticContact CZ-CD1 3.64Å; Y264-F281 AromaticContact CZ-CE1 3.35Å; H267-F281 PolarHBondContact CD2-O 2.82Å; H267-F281 PolarHBondContact CE1-O 2.99Å; H267-F281 PolarHBondContact ND1-O 3.44Å; H267-F281 PolarHBondContact NE2-O 3.15Å; S278-F281 CarbonylContact O-C 3.48Å; S278-F281 PolarHBondContact O-N 3.42Å; S278-F281 VanDerWaalsContact O-O 3.11Å; F281-L306 HydrophobicContact CE2-CD2 4.36Å; F281-R307 HydrophobicContact CE1-CB 4.42Å; F281-R307 HydrophobicContact CE1-CG 4.11Å; F281-C310 HydrophobicContact CZ-CB 4.38Å
282	Q	56.3	Low	61.7	Low	159 Å²	159	100 Å²	100	74%	0.743	50%	0.501	S	S	*	.			trans	-77.7	152.9	167.7	-74.2	178.4	-12.4	0	0	110.2	H267 M284	H267-Q282 VanDerWaalsContact NE2-C 3.27Å; Q282-M284 PolarHBondContact O-N 2.98Å
283	S	61.6	Low	64.3	Low	89 Å²	89	97.4 Å²	97.4	62%	0.622	49%	0.489	S	S	*	.			trans	-66.6	123.2	174.7	43.1	0	0	0	0	107.9	H267	H267-S283 VanDerWaalsContact CD2-CA 3.4Å; H267-S283 WeakPolarHBondContact CD2-CA 3.46Å; H267-S283 PolarHBondContact CD2-N 3.16Å; H267-S283 PolarHBondContact NE2-N 2.89Å
284	M	72	Confident	66.6	Low	20 Å²	20	90.8 Å²	90.8	10%	0.099	46%	0.464	C	S	.	.			trans	-129.7	134.6	-170.6	-171	-173.7	-29.2	0	0	108.3	Q282 E288 L289	Q282-M284 PolarHBondContact O-N 2.98Å; M284-E288 HydrophobicContact CG-CB 3.65Å; M284-E288 HydrophobicContact CG-CG 3.69Å; M284-E288 HydrophobicContact SD-CB 3.93Å; M284-E288 HydrophobicContact SD-CG 3.63Å; M284-L289 HydrophobicContact CE-CD1 4.21Å; M284-L289 WeakPolarHBondContact SD-CA 3.35Å; M284-L289 HydrophobicContact SD-CB 4.14Å; M284-L289 HydrophobicContact SD-CD1 4.46Å; M284-L289 PolarHBondContact SD-N 3.09Å
285	P	79.5	Confident	69.3	Low	79 Å²	79	83.2 Å²	83.2	51%	0.513	43%	0.429	S	S	.	.			trans	-51.5	145.6	170.9	-24.9	34	0	0	0	111.1	D287 E288 L289	P285-D287 PolarHBondContact O-N 3.26Å; P285-E288 HydrophobicContact CB-CB 4.43Å; P285-E288 WeakPolarHBondContact CD-OE2 3.27Å; P285-E288 PolarHBondContact O-N 3.31Å; P285-L289 PolarHBondContact O-N 2.94Å
286	I	83	Confident	72.1	Confident	105 Å²	105	78.4 Å²	78.4	54%	0.538	40%	0.404	S	S	.	.	H	α-helix	trans	-58.6	-36.5	-176.7	-166.5	165.2	0	0	0	112.4	E288 L289 F290	I286-E288 VanDerWaalsContact C-N 3.34Å; I286-E288 PolarHBondContact O-N 2.83Å; I286-L289 WeakPolarHBondContact O-CB 3.49Å; I286-L289 PolarHBondContact O-N 3.19Å; I286-F290 HydrophobicContact CD1-CE2 4.31Å; I286-F290 HydrophobicContact CG1-CD2 3.8Å; I286-F290 HydrophobicContact CG1-CE2 3.77Å; I286-F290 VanDerWaalsContact O-CD2 3.31Å; I286-F290 WeakPolarHBondContact O-CD2 3.43Å; I286-F290 PolarHBondContact O-N 2.76Å; I286-F290 VanDerWaalsContact O-N 3.1Å
287	D	84.4	Confident	74.6	Confident	136 Å²	136	67.6 Å²	67.6	73%	0.727	36%	0.363	S	S	*	.	H	α-helix	trans	-66.5	-36.9	178.6	-60.3	-40.5	0	0	0	111.9	P285 S291	P285-D287 PolarHBondContact O-N 3.26Å; D287-S291 PolarHBondContact O-N 3.26Å
288	E	86	Confident	76.9	Confident	110 Å²	110	66.6 Å²	66.6	51%	0.514	37%	0.366	S	S	.	.	H	α-helix	trans	-75.5	-35	175.7	-171.6	-170.9	163.2	0	0	110.8	M284 P285 I286 F290 S291 N294	M284-E288 HydrophobicContact CG-CB 3.65Å; M284-E288 HydrophobicContact CG-CG 3.69Å; M284-E288 HydrophobicContact SD-CB 3.93Å; M284-E288 HydrophobicContact SD-CG 3.63Å; P285-E288 HydrophobicContact CB-CB 4.43Å; P285-E288 WeakPolarHBondContact CD-OE2 3.27Å; P285-E288 PolarHBondContact O-N 3.31Å; I286-E288 VanDerWaalsContact C-N 3.34Å; I286-E288 PolarHBondContact O-N 2.83Å; E288-F290 VanDerWaalsContact C-N 3.28Å; E288-F290 PolarHBondContact O-N 2.79Å; E288-S291 VanDerWaalsContact O-CB 3.28Å; E288-S291 WeakPolarHBondContact O-CB 3.4Å; E288-S291 PolarHBondContact O-N 3.4Å; E288-S291 VanDerWaalsContact O-N 3.13Å; E288-S291 PolarHBondContact O-OG 3.43Å; E288-N294 WeakPolarHBondContact O-CB 3.16Å
289	L	85.6	Confident	79.3	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-38.6	175.7	-178.8	66	0	0	0	111.9	Y264 L268 M284 P285 I286 N294 L311 L314	Y264-L289 HydrophobicContact CD1-CD1 3.47Å; Y264-L289 VanDerWaalsContact CD1-CD1 3.47Å; Y264-L289 HydrophobicContact CE1-CD1 3.37Å; Y264-L289 HydrophobicContact CG-CD1 4.28Å; L268-L289 HydrophobicContact CD1-CD2 3.98Å; M284-L289 HydrophobicContact CE-CD1 4.21Å; M284-L289 WeakPolarHBondContact SD-CA 3.35Å; M284-L289 HydrophobicContact SD-CB 4.14Å; M284-L289 HydrophobicContact SD-CD1 4.46Å; M284-L289 PolarHBondContact SD-N 3.09Å; P285-L289 PolarHBondContact O-N 2.94Å; I286-L289 WeakPolarHBondContact O-CB 3.49Å; I286-L289 PolarHBondContact O-N 3.19Å; L289-N294 PolarHBondContact O-ND2 3.17Å; L289-L311 HydrophobicContact CD1-CD1 3.89Å; L289-L311 HydrophobicContact CG-CD1 4.27Å; L289-L314 HydrophobicContact CD2-CD2 4.37Å
290	F	89.1	Confident	81.5	Confident	73 Å²	73	65.4 Å²	65.4	32%	0.32	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	16.5	177.3	-61.5	-68.3	0	0	0	113.4	I286 E288 L295 L314 L318	I286-F290 HydrophobicContact CD1-CE2 4.31Å; I286-F290 HydrophobicContact CG1-CD2 3.8Å; I286-F290 HydrophobicContact CG1-CE2 3.77Å; I286-F290 VanDerWaalsContact O-CD2 3.31Å; I286-F290 WeakPolarHBondContact O-CD2 3.43Å; I286-F290 PolarHBondContact O-N 2.76Å; I286-F290 VanDerWaalsContact O-N 3.1Å; E288-F290 VanDerWaalsContact C-N 3.28Å; E288-F290 PolarHBondContact O-N 2.79Å; F290-L295 HydrophobicContact CB-CD1 4.43Å; F290-L295 HydrophobicContact CD1-CD2 4.2Å; F290-L295 WeakPolarHBondContact O-CD1 3.46Å; F290-L314 HydrophobicContact CZ-CD2 4.24Å; F290-L318 HydrophobicContact CE1-CD1 3.79Å; F290-L318 HydrophobicContact CE2-CD1 4.29Å; F290-L318 HydrophobicContact CZ-CD1 3.36Å
291	S	90.8	Very high	83.5	Confident	29 Å²	29	66.6 Å²	66.6	20%	0.203	37%	0.372	C	S	.	.	S	Bend	trans	-62.4	151.6	170	66.2	0	0	0	0	110.6	D287 E288 E293 N294 L295	D287-S291 PolarHBondContact O-N 3.26Å; E288-S291 VanDerWaalsContact O-CB 3.28Å; E288-S291 WeakPolarHBondContact O-CB 3.4Å; E288-S291 PolarHBondContact O-N 3.4Å; E288-S291 VanDerWaalsContact O-N 3.13Å; E288-S291 PolarHBondContact O-OG 3.43Å; S291-E293 PolarHBondContact O-N 2.96Å; S291-N294 PolarHBondContact O-N 2.9Å; S291-N294 WeakPolarHBondContact OG-CB 2.84Å; S291-N294 PolarHBondContact OG-N 3.12Å; S291-L295 WeakPolarHBondContact O-CG 3.3Å; S291-L295 PolarHBondContact O-N 3.39Å
292	F	91.4	Very high	84.9	Confident	105 Å²	105	69.2 Å²	69.2	46%	0.461	39%	0.392	S	S	.	.	H	α-helix	trans	-60	-39.9	179.2	-179.9	-94.2	0	0	0	111.3	L223 N294 L295 S296 V298	L223-F292 HydrophobicContact CD2-CE2 3.82Å; L223-F292 HydrophobicContact CD2-CZ 4.03Å; F292-N294 VanDerWaalsContact C-N 3.28Å; F292-N294 PolarHBondContact O-N 3.42Å; F292-L295 PolarHBondContact O-N 3.48Å; F292-S296 CarbonylContact O-C 3.48Å; F292-S296 WeakPolarHBondContact O-CA 3.19Å; F292-S296 PolarHBondContact O-N 3.02Å; F292-V298 HydrophobicContact CE1-CG1 4.38Å
293	E	89.9	Confident	86.5	Confident	119 Å²	119	63 Å²	63	56%	0.556	36%	0.361	S	S	*	.	H	α-helix	trans	-63.8	-32.8	-179.9	-64.3	73.2	-162.6	0	0	112.2	S291 P297	S291-E293 PolarHBondContact O-N 2.96Å; E293-P297 VanDerWaalsContact O-CA 3.22Å; E293-P297 WeakPolarHBondContact O-CA 3.32Å
294	N	88.8	Confident	87.7	Confident	14 Å²	14	60.6 Å²	60.6	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-84.4	-38.6	177.5	-171.2	43.5	0	0	0	112.6	E288 L289 S291 F292 R307 L311	E288-N294 WeakPolarHBondContact O-CB 3.16Å; L289-N294 PolarHBondContact O-ND2 3.17Å; S291-N294 PolarHBondContact O-N 2.9Å; S291-N294 WeakPolarHBondContact OG-CB 2.84Å; S291-N294 PolarHBondContact OG-N 3.12Å; F292-N294 VanDerWaalsContact C-N 3.28Å; F292-N294 PolarHBondContact O-N 3.42Å; N294-R307 VanDerWaalsContact OD1-CZ 3.27Å; N294-R307 PolarHBondContact OD1-NE 3.41Å; N294-R307 PolarHBondContact OD1-NH2 2.82Å; N294-L311 WeakPolarHBondContact ND2-CD2 3.24Å; N294-L311 WeakPolarHBondContact O-CD2 3.27Å
295	L	92.6	Very high	88.4	Confident	25 Å²	25	60.8 Å²	60.8	13%	0.131	35%	0.348	C	S	.	.	H	α-helix	trans	-70.2	-40.4	177.2	-71.5	172.8	0	0	0	112.2	F227 F290 S291 F292 L311 C315	F227-L295 WeakPolarHBondContact CB-O 3.49Å; F227-L295 HydrophobicContact CD2-CB 4.12Å; F227-L295 HydrophobicContact CD2-CD2 4.38Å; F227-L295 WeakPolarHBondContact CD2-O 3.45Å; F227-L295 HydrophobicContact CE2-CB 3.82Å; F227-L295 HydrophobicContact CE2-CD1 4.32Å; F227-L295 HydrophobicContact CE2-CD2 3.96Å; F227-L295 HydrophobicContact CE2-CG 4.27Å; F227-L295 WeakPolarHBondContact CG-O 3.49Å; F227-L295 HydrophobicContact CZ-CB 4.04Å; F227-L295 HydrophobicContact CZ-CD1 4.4Å; F290-L295 HydrophobicContact CB-CD1 4.43Å; F290-L295 HydrophobicContact CD1-CD2 4.2Å; F290-L295 WeakPolarHBondContact O-CD1 3.46Å; S291-L295 WeakPolarHBondContact O-CG 3.3Å; S291-L295 PolarHBondContact O-N 3.39Å; F292-L295 PolarHBondContact O-N 3.48Å; L295-L311 HydrophobicContact CD2-CD1 4.26Å; L295-L311 HydrophobicContact CD2-CD2 3.76Å; L295-L311 HydrophobicContact CD2-CG 3.79Å; L295-L311 HydrophobicContact CG-CD2 4.45Å; L295-C315 VanDerWaalsContact CD2-SG 3.54Å
296	S	94.9	Very high	88.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	34%	0.335	C	S	.	.	S	Bend	trans	-132.6	75.7	-177.9	177	0	0	0	0	110.5	E224 F292 V298	E224-S296 PolarHBondContact N-OG 3.12Å; F292-S296 CarbonylContact O-C 3.48Å; F292-S296 WeakPolarHBondContact O-CA 3.19Å; F292-S296 PolarHBondContact O-N 3.02Å; S296-V298 PolarHBondContact O-N 3.48Å
297	P	91.4	Very high	88.7	Confident	8 Å²	8	57.5 Å²	57.5	5%	0.052	32%	0.322	C	S	.	.			trans	-51.3	132.1	-180	-28.8	35.9	0	0	0	113.1	W216 E293 Y303	W216-P297 PolarHBondContact NE1-O 3.5Å; E293-P297 VanDerWaalsContact O-CA 3.22Å; E293-P297 WeakPolarHBondContact O-CA 3.32Å; P297-Y303 HydrophobicContact CB-CD2 4.32Å; P297-Y303 HydrophobicContact CG-CD2 4.19Å
298	V	89.9	Confident	88.8	Confident	96 Å²	96	51.3 Å²	51.3	58%	0.582	29%	0.29	S	S	*	.	S	Bend	trans	-87.7	-3.5	-175.3	-61.7	0	0	0	0	114.2	W216 F292 S296	W216-V298 WeakPolarHBondContact CZ2-O 3.06Å; F292-V298 HydrophobicContact CE1-CG1 4.38Å; S296-V298 PolarHBondContact O-N 3.48Å
299	S	90.9	Very high	88.9	Confident	35 Å²	35	47.2 Å²	47.2	25%	0.245	27%	0.27	C	S	.	.	S	Bend	trans	-148.1	156.4	-177.7	75.7	0	0	0	0	112.2	S301 S302 Y303	S299-S301 VanDerWaalsContact C-N 3.26Å; S299-S301 PolarHBondContact O-N 3.44Å; S299-S301 PolarHBondContact OG-OG 3.16Å; S299-S302 PolarHBondContact O-N 3.26Å; S299-S302 PolarHBondContact O-OG 2.99Å; S299-S302 PolarHBondContact OG-N 3.2Å; S299-S302 PolarHBondContact OG-OG 3.44Å; S299-Y303 PolarHBondContact O-N 2.9Å
300	A	90.8	Very high	89	Confident	67 Å²	67	47.1 Å²	47.1	55%	0.554	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-62.8	-32.2	173.6	0	0	0	0	0	113	W216 S302 Y303	W216-A300 HydrophobicContact CB-CB 3.94Å; W216-A300 HydrophobicContact CD2-CB 4.34Å; W216-A300 HydrophobicContact CE3-CB 4.13Å; W216-A300 HydrophobicContact CG-CB 4.3Å; A300-S302 VanDerWaalsContact C-N 3.33Å; A300-S302 PolarHBondContact O-N 3.2Å; A300-Y303 PolarHBondContact O-N 2.8Å
301	S	88.9	Confident	88.9	Confident	119 Å²	119	43.8 Å²	43.8	83%	0.832	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-69.2	-27.8	179.9	41.4	0	0	0	0	113.9	S299	S299-S301 VanDerWaalsContact C-N 3.26Å; S299-S301 PolarHBondContact O-N 3.44Å; S299-S301 PolarHBondContact OG-OG 3.16Å
302	S	85.9	Confident	89	Confident	62 Å²	62	42.4 Å²	42.4	43%	0.434	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-93.9	-3.6	176.2	57.5	0	0	0	0	113.2	S299 A300	S299-S302 PolarHBondContact O-N 3.26Å; S299-S302 PolarHBondContact O-OG 2.99Å; S299-S302 PolarHBondContact OG-N 3.2Å; S299-S302 PolarHBondContact OG-OG 3.44Å; A300-S302 VanDerWaalsContact C-N 3.33Å; A300-S302 PolarHBondContact O-N 3.2Å
303	Y	88.3	Confident	89	Confident	27 Å²	27	37.7 Å²	37.7	11%	0.106	22%	0.224	C	C	.	.			trans	-90	133.1	-175.3	-176.6	-104.1	0	0	0	112.6	E213 W216 E224 T226 P297 S299 A300 A308	E213-Y303 PolarHBondContact O-OH 3.32Å; W216-Y303 HydrophobicContact CB-CD1 3.75Å; W216-Y303 HydrophobicContact CB-CD2 4.44Å; W216-Y303 HydrophobicContact CB-CE1 4.46Å; W216-Y303 HydrophobicContact CB-CG 3.72Å; W216-Y303 AromaticContact CD1-CD2 3.74Å; W216-Y303 AromaticContact CD1-CG 3.72Å; W216-Y303 HydrophobicContact CG-CG 4.12Å; E224-Y303 HydrophobicContact CG-CD2 4.04Å; E224-Y303 HydrophobicContact CG-CE2 3.74Å; E224-Y303 VanDerWaalsContact OE1-CE2 3.31Å; E224-Y303 WeakPolarHBondContact OE1-CE2 3.27Å; E224-Y303 PolarHBondContact OE1-OH 3.01Å; T226-Y303 PolarHBondContact OG1-OH 2.83Å; P297-Y303 HydrophobicContact CB-CD2 4.32Å; P297-Y303 HydrophobicContact CG-CD2 4.19Å; S299-Y303 PolarHBondContact O-N 2.9Å; A300-Y303 PolarHBondContact O-N 2.8Å; Y303-A308 HydrophobicContact CD2-CB 4.29Å; Y303-A308 HydrophobicContact CE2-CB 3.49Å; Y303-A308 VanDerWaalsContact CE2-CB 3.49Å
304	S	88.1	Confident	88.9	Confident	40 Å²	40	32.4 Å²	32.4	28%	0.28	20%	0.2	S	C	.	.			trans	-129.9	121.2	165.3	164.9	0	0	0	0	108.6	L306 R307 A308	S304-L306 PolarHBondContact O-N 2.8Å; S304-R307 WeakPolarHBondContact O-CB 3.08Å; S304-R307 PolarHBondContact O-N 3.19Å; S304-R307 VanDerWaalsContact O-N 3.13Å; S304-R307 WeakPolarHBondContact OG-CB 3.41Å; S304-R307 PolarHBondContact OG-N 3.47Å; S304-A308 WeakPolarHBondContact O-CB 3.49Å; S304-A308 PolarHBondContact O-N 2.77Å
305	S	85.2	Confident	89.1	Confident	23 Å²	23	32 Å²	32	16%	0.161	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-42.4	-174.5	53.4	0	0	0	0	112.9	F212 E213 Y309	F212-S305 WeakPolarHBondContact CZ-OG 3.42Å; E213-S305 VanDerWaalsContact O-CB 3.23Å; E213-S305 WeakPolarHBondContact O-CB 3.21Å; S305-Y309 VanDerWaalsContact O-CB 3.3Å; S305-Y309 WeakPolarHBondContact O-CB 3.45Å; S305-Y309 PolarHBondContact O-N 2.67Å
306	L	84.1	Confident	89.1	Confident	47 Å²	47	31 Å²	31	25%	0.246	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-45.5	174	-178.6	69.1	0	0	0	111.1	F277 F281 S304 Y309 C310	F277-L306 HydrophobicContact CD1-CD2 3.84Å; F277-L306 HydrophobicContact CE1-CD2 3.5Å; F281-L306 HydrophobicContact CE2-CD2 4.36Å; S304-L306 PolarHBondContact O-N 2.8Å; L306-Y309 PolarHBondContact O-N 3.48Å; L306-C310 WeakPolarHBondContact O-CB 3.37Å; L306-C310 PolarHBondContact O-N 3.04Å; L306-C310 PolarHBondContact O-SG 3.07Å
307	R	84.7	Confident	88.8	Confident	68 Å²	68	32.5 Å²	32.5	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-52.6	179.9	-171.4	179.9	167.7	150	-14	110.8	Y264 F281 N294 S304 Y309 C310 L311	Y264-R307 WeakPolarHBondContact OH-CG 3.34Å; Y264-R307 PolarHBondContact OH-NE 3.08Å; F281-R307 HydrophobicContact CE1-CB 4.42Å; F281-R307 HydrophobicContact CE1-CG 4.11Å; N294-R307 VanDerWaalsContact OD1-CZ 3.27Å; N294-R307 PolarHBondContact OD1-NE 3.41Å; N294-R307 PolarHBondContact OD1-NH2 2.82Å; S304-R307 WeakPolarHBondContact O-CB 3.08Å; S304-R307 PolarHBondContact O-N 3.19Å; S304-R307 VanDerWaalsContact O-N 3.13Å; S304-R307 WeakPolarHBondContact OG-CB 3.41Å; S304-R307 PolarHBondContact OG-N 3.47Å; R307-Y309 PolarHBondContact O-N 2.85Å; R307-C310 PolarHBondContact O-N 2.84Å; R307-L311 VanDerWaalsContact O-CB 3.29Å; R307-L311 WeakPolarHBondContact O-CB 3.1Å; R307-L311 PolarHBondContact O-N 2.71Å
308	A	88.1	Confident	88.8	Confident	7 Å²	7	35.9 Å²	35.9	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-43.5	178.3	0	0	0	0	0	112.1	Y303 S304 S312	Y303-A308 HydrophobicContact CD2-CB 4.29Å; Y303-A308 HydrophobicContact CE2-CB 3.49Å; Y303-A308 VanDerWaalsContact CE2-CB 3.49Å; S304-A308 WeakPolarHBondContact O-CB 3.49Å; S304-A308 PolarHBondContact O-N 2.77Å; A308-S312 WeakPolarHBondContact O-CB 3.2Å; A308-S312 PolarHBondContact O-N 3.35Å; A308-S312 PolarHBondContact O-OG 3.17Å
309	Y	88	Confident	89	Confident	24 Å²	24	32.2 Å²	32.2	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-50.5	176.6	-175.6	-100.1	0	0	0	112	I211 F212 T226 N230 C258 S305 L306 R307 L311 S312 K313 L347	I211-Y309 WeakPolarHBondContact O-CD2 3.39Å; F212-Y309 HydrophobicContact CB-CD2 4.34Å; F212-Y309 HydrophobicContact CD2-CD1 4.27Å; F212-Y309 AromaticContact CD2-CD2 3.92Å; F212-Y309 HydrophobicContact CD2-CD2 3.92Å; F212-Y309 AromaticContact CD2-CG 3.7Å; F212-Y309 HydrophobicContact CD2-CG 3.7Å; F212-Y309 HydrophobicContact CE2-CG 4.26Å; T226-Y309 HydrophobicContact CG2-CD2 4.35Å; N230-Y309 WeakPolarHBondContact ND2-CD2 3.15Å; C258-Y309 HydrophobicContact CB-CE1 4.19Å; S305-Y309 VanDerWaalsContact O-CB 3.3Å; S305-Y309 WeakPolarHBondContact O-CB 3.45Å; S305-Y309 PolarHBondContact O-N 2.67Å; L306-Y309 PolarHBondContact O-N 3.48Å; R307-Y309 PolarHBondContact O-N 2.85Å; Y309-L311 VanDerWaalsContact C-N 3.34Å; Y309-L311 PolarHBondContact O-N 3.44Å; Y309-S312 PolarHBondContact O-N 3.21Å; Y309-S312 PolarHBondContact O-OG 3.48Å; Y309-K313 HydrophobicContact CD1-CG 4.48Å; Y309-K313 HydrophobicContact CE1-CG 4.07Å; Y309-K313 HydrophobicContact CE2-CG 4.44Å; Y309-K313 WeakPolarHBondContact O-CG 3.49Å; Y309-K313 PolarHBondContact O-N 3.32Å; Y309-K313 VanDerWaalsContact O-N 3.08Å; Y309-K313 WeakPolarHBondContact OH-CE 3.43Å; Y309-L347 HydrophobicContact CE2-CD2 3.78Å
310	C	86.1	Confident	89	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-44.7	178.3	-67.7	0	0	0	0	112.1	C260 Y264 F281 L306 R307 K313 L314	C260-C310 WeakPolarHBondContact CB-SG 3.26Å; C260-C310 PolarHBondContact O-SG 3.45Å; Y264-C310 HydrophobicContact CD2-CB 4.14Å; Y264-C310 HydrophobicContact CE2-CB 3.93Å; F281-C310 HydrophobicContact CZ-CB 4.38Å; L306-C310 WeakPolarHBondContact O-CB 3.37Å; L306-C310 PolarHBondContact O-N 3.04Å; L306-C310 PolarHBondContact O-SG 3.07Å; R307-C310 PolarHBondContact O-N 2.84Å; C310-K313 PolarHBondContact O-N 2.93Å; C310-L314 PolarHBondContact O-N 3.27Å
311	L	89	Confident	88.9	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-43.5	179.3	-171.2	57.6	0	0	0	111	Y264 L289 N294 L295 R307 Y309 K313 L314 C315	Y264-L311 HydrophobicContact CE2-CB 3.76Å; Y264-L311 HydrophobicContact CE2-CD1 4.16Å; L289-L311 HydrophobicContact CD1-CD1 3.89Å; L289-L311 HydrophobicContact CG-CD1 4.27Å; N294-L311 WeakPolarHBondContact ND2-CD2 3.24Å; N294-L311 WeakPolarHBondContact O-CD2 3.27Å; L295-L311 HydrophobicContact CD2-CD1 4.26Å; L295-L311 HydrophobicContact CD2-CD2 3.76Å; L295-L311 HydrophobicContact CD2-CG 3.79Å; L295-L311 HydrophobicContact CG-CD2 4.45Å; R307-L311 VanDerWaalsContact O-CB 3.29Å; R307-L311 WeakPolarHBondContact O-CB 3.1Å; R307-L311 PolarHBondContact O-N 2.71Å; Y309-L311 VanDerWaalsContact C-N 3.34Å; Y309-L311 PolarHBondContact O-N 3.44Å; L311-K313 VanDerWaalsContact C-N 3.26Å; L311-K313 PolarHBondContact O-N 2.79Å; L311-L314 HydrophobicContact CD1-CD2 4.27Å; L311-L314 WeakPolarHBondContact O-CB 3.34Å; L311-L314 PolarHBondContact O-N 3.3Å; L311-L314 VanDerWaalsContact O-N 3.13Å; L311-C315 PolarHBondContact O-N 3.49Å; L311-C315 PolarHBondContact O-SG 3.41Å
312	S	91.8	Very high	89	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-59.1	-37.1	175.2	77	0	0	0	0	112.6	N230 A308 Y309 C315 C316	N230-S312 WeakPolarHBondContact CB-OG 3.4Å; N230-S312 PolarHBondContact ND2-OG 3.08Å; N230-S312 VanDerWaalsContact ND2-OG 3.07Å; A308-S312 WeakPolarHBondContact O-CB 3.2Å; A308-S312 PolarHBondContact O-N 3.35Å; A308-S312 PolarHBondContact O-OG 3.17Å; Y309-S312 PolarHBondContact O-N 3.21Å; Y309-S312 PolarHBondContact O-OG 3.48Å; S312-C315 PolarHBondContact O-N 3.23Å; S312-C316 PolarHBondContact O-N 3.28Å; S312-C316 VanDerWaalsContact O-N 3.17Å; S312-C316 PolarHBondContact O-SG 3.49Å
313	K	90.9	Very high	89.2	Confident	5 Å²	5	22 Å²	22	2%	0.022	12%	0.123	C	C	.	.	H	α-helix	trans	-75.9	-31.6	177.3	-65.8	-53	-166.7	179.5	0	112.7	T256 C258 H261 Y309 C310 L311 C316 V317	T256-K313 PolarHBondContact O-NZ 3.44Å; C258-K313 HydrophobicContact CB-CB 4.41Å; C258-K313 HydrophobicContact CB-CG 3.97Å; H261-K313 HydrophobicContact CB-CB 4.27Å; Y309-K313 HydrophobicContact CD1-CG 4.48Å; Y309-K313 HydrophobicContact CE1-CG 4.07Å; Y309-K313 HydrophobicContact CE2-CG 4.44Å; Y309-K313 WeakPolarHBondContact O-CG 3.49Å; Y309-K313 PolarHBondContact O-N 3.32Å; Y309-K313 VanDerWaalsContact O-N 3.08Å; Y309-K313 WeakPolarHBondContact OH-CE 3.43Å; C310-K313 PolarHBondContact O-N 2.93Å; L311-K313 VanDerWaalsContact C-N 3.26Å; L311-K313 PolarHBondContact O-N 2.79Å; K313-C316 PolarHBondContact O-N 2.88Å; K313-V317 PolarHBondContact O-N 2.93Å
314	L	89.2	Confident	89.3	Confident	8 Å²	8	22.1 Å²	22.1	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-45.8	169.1	178.9	62.6	0	0	0	110.8	H261 Y264 V265 L289 F290 C310 L311 C316 V317 L318	H261-L314 HydrophobicContact CB-CB 4.1Å; Y264-L314 HydrophobicContact CG-CD2 4.42Å; V265-L314 HydrophobicContact CG2-CD1 3.88Å; L289-L314 HydrophobicContact CD2-CD2 4.37Å; F290-L314 HydrophobicContact CZ-CD2 4.24Å; C310-L314 PolarHBondContact O-N 3.27Å; L311-L314 HydrophobicContact CD1-CD2 4.27Å; L311-L314 WeakPolarHBondContact O-CB 3.34Å; L311-L314 PolarHBondContact O-N 3.3Å; L311-L314 VanDerWaalsContact O-N 3.13Å; L314-C316 VanDerWaalsContact C-N 3.26Å; L314-C316 PolarHBondContact O-N 3.05Å; L314-V317 PolarHBondContact O-N 2.83Å; L314-V317 VanDerWaalsContact O-N 3.08Å; L314-L318 HydrophobicContact CD1-CD1 4.29Å; L314-L318 HydrophobicContact CD1-CG 4.29Å; L314-L318 HydrophobicContact CG-CD1 4.04Å; L314-L318 HydrophobicContact CG-CG 4.46Å; L314-L318 WeakPolarHBondContact O-CG 3.47Å; L314-L318 PolarHBondContact O-N 3.48Å
315	C	92.7	Very high	89.3	Confident	6 Å²	6	26.1 Å²	26.1	4%	0.041	14%	0.143	C	C	.	.	H	α-helix	trans	-56.8	-39.9	174.5	-64	0	0	0	0	111.9	Y231 L295 L311 S312 V317 L318 F319	Y231-C315 HydrophobicContact CD1-CB 3.8Å; Y231-C315 HydrophobicContact CD2-CB 3.44Å; Y231-C315 VanDerWaalsContact CD2-CB 3.44Å; Y231-C315 HydrophobicContact CE1-CB 3.97Å; Y231-C315 HydrophobicContact CE2-CB 3.65Å; Y231-C315 WeakPolarHBondContact CE2-O 3.37Å; Y231-C315 HydrophobicContact CG-CB 3.51Å; L295-C315 VanDerWaalsContact CD2-SG 3.54Å; L311-C315 PolarHBondContact O-N 3.49Å; L311-C315 PolarHBondContact O-SG 3.41Å; S312-C315 PolarHBondContact O-N 3.23Å; C315-V317 PolarHBondContact O-N 2.91Å; C315-L318 PolarHBondContact O-N 2.99Å; C315-F319 WeakPolarHBondContact O-CB 3.5Å; C315-F319 PolarHBondContact O-N 3.08Å
316	C	92.6	Very high	89.2	Confident	4 Å²	4	32.9 Å²	32.9	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-40.2	174.9	-65.5	0	0	0	0	113.4	N230 L255 T257 S312 K313 L314 A320	N230-C316 PolarHBondContact O-SG 3.49Å; L255-C316 HydrophobicContact CD2-CB 4.41Å; T257-C316 HydrophobicContact CG2-CB 3.91Å; S312-C316 PolarHBondContact O-N 3.28Å; S312-C316 VanDerWaalsContact O-N 3.17Å; S312-C316 PolarHBondContact O-SG 3.49Å; K313-C316 PolarHBondContact O-N 2.88Å; L314-C316 VanDerWaalsContact C-N 3.26Å; L314-C316 PolarHBondContact O-N 3.05Å; C316-A320 WeakPolarHBondContact O-CB 3.21Å; C316-A320 PolarHBondContact O-N 3.17Å
317	V	88.4	Confident	89.1	Confident	33 Å²	33	30.6 Å²	30.6	20%	0.2	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-50.5	176.9	174.8	0	0	0	0	110.3	T257 K313 L314 C315 F319 A320 A321	T257-V317 HydrophobicContact CG2-CG2 3.62Å; K313-V317 PolarHBondContact O-N 2.93Å; L314-V317 PolarHBondContact O-N 2.83Å; L314-V317 VanDerWaalsContact O-N 3.08Å; C315-V317 PolarHBondContact O-N 2.91Å; V317-F319 VanDerWaalsContact C-N 3.3Å; V317-F319 PolarHBondContact O-N 3.26Å; V317-A320 PolarHBondContact O-N 3.4Å; V317-A321 PolarHBondContact O-N 2.89Å
318	L	90.9	Very high	88.4	Confident	79 Å²	79	30.6 Å²	30.6	41%	0.414	16%	0.163	S	C	.	.	H	α-helix	trans	-62.3	-40.1	179.6	-66.5	174.7	0	0	0	111.7	F290 L314 C315 A321 A322	F290-L318 HydrophobicContact CE1-CD1 3.79Å; F290-L318 HydrophobicContact CE2-CD1 4.29Å; F290-L318 HydrophobicContact CZ-CD1 3.36Å; L314-L318 HydrophobicContact CD1-CD1 4.29Å; L314-L318 HydrophobicContact CD1-CG 4.29Å; L314-L318 HydrophobicContact CG-CD1 4.04Å; L314-L318 HydrophobicContact CG-CG 4.46Å; L314-L318 WeakPolarHBondContact O-CG 3.47Å; L314-L318 PolarHBondContact O-N 3.48Å; C315-L318 PolarHBondContact O-N 2.99Å; L318-A321 PolarHBondContact O-N 2.76Å; L318-A322 VanDerWaalsContact O-CB 3.27Å; L318-A322 WeakPolarHBondContact O-CB 3.13Å; L318-A322 PolarHBondContact O-N 3.17Å
319	F	94.2	Very high	88.1	Confident	18 Å²	18	38 Å²	38	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-41.7	175.1	173.3	-130	0	0	0	112	Y231 F235 T238 L255 C315 V317 A321 A322 L323	Y231-F319 HydrophobicContact CE2-CB 3.68Å; Y231-F319 HydrophobicContact CE2-CD1 4.25Å; Y231-F319 HydrophobicContact CE2-CG 4.08Å; F235-F319 HydrophobicContact CB-CZ 4.46Å; F235-F319 HydrophobicContact CD2-CD2 4.01Å; F235-F319 AromaticContact CD2-CE2 3.62Å; F235-F319 HydrophobicContact CD2-CE2 3.62Å; F235-F319 HydrophobicContact CD2-CZ 4.01Å; F235-F319 HydrophobicContact CE2-CE2 4.23Å; T238-F319 HydrophobicContact CG2-CZ 3.95Å; L255-F319 HydrophobicContact CD2-CD1 3.45Å; L255-F319 VanDerWaalsContact CD2-CD1 3.45Å; L255-F319 HydrophobicContact CD2-CE1 3.83Å; C315-F319 WeakPolarHBondContact O-CB 3.5Å; C315-F319 PolarHBondContact O-N 3.08Å; V317-F319 VanDerWaalsContact C-N 3.3Å; V317-F319 PolarHBondContact O-N 3.26Å; F319-A321 VanDerWaalsContact C-N 3.32Å; F319-A321 PolarHBondContact O-N 3.08Å; F319-A322 PolarHBondContact O-N 2.8Å; F319-L323 HydrophobicContact CD2-CB 4.33Å; F319-L323 HydrophobicContact CE1-CD2 4.33Å; F319-L323 HydrophobicContact CE2-CB 4.15Å; F319-L323 HydrophobicContact CE2-CD1 4.04Å; F319-L323 HydrophobicContact CE2-CD2 4.07Å; F319-L323 HydrophobicContact CE2-CG 4.33Å; F319-L323 HydrophobicContact CZ-CD1 4.4Å; F319-L323 HydrophobicContact CZ-CD2 3.79Å; F319-L323 WeakPolarHBondContact O-CB 3.46Å; F319-L323 PolarHBondContact O-N 3.22Å
320	A	90.7	Very high	87.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-43.8	176.3	0	0	0	0	0	111.9	L255 C316 V317 Q324 C334 A336	L255-A320 HydrophobicContact CD1-CB 4.04Å; C316-A320 WeakPolarHBondContact O-CB 3.21Å; C316-A320 PolarHBondContact O-N 3.17Å; V317-A320 PolarHBondContact O-N 3.4Å; A320-Q324 WeakPolarHBondContact O-CB 3.16Å; A320-Q324 PolarHBondContact O-N 3.46Å; A320-C334 VanDerWaalsContact CA-SG 3.57Å; A320-A336 HydrophobicContact CB-CB 3.73Å
321	A	88.3	Confident	87.8	Confident	26 Å²	26	45.5 Å²	45.5	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-54.6	175.5	0	0	0	0	0	111.5	V317 L318 F319 L323 Q324 D325 F397	V317-A321 PolarHBondContact O-N 2.89Å; L318-A321 PolarHBondContact O-N 2.76Å; F319-A321 VanDerWaalsContact C-N 3.32Å; F319-A321 PolarHBondContact O-N 3.08Å; A321-L323 PolarHBondContact O-N 2.87Å; A321-Q324 WeakPolarHBondContact O-CB 3.23Å; A321-Q324 PolarHBondContact O-N 3.49Å; A321-D325 PolarHBondContact O-N 2.98Å; A321-D325 VanDerWaalsContact O-N 3.12Å; A321-F397 HydrophobicContact CB-CE1 3.6Å; A321-F397 HydrophobicContact CB-CZ 4.29Å
322	A	91.7	Very high	87.6	Confident	33 Å²	33	45.7 Å²	45.7	27%	0.273	24%	0.237	S	C	.	.	H	α-helix	trans	-67.1	-27.1	-176.9	0	0	0	0	0	112.5	L318 F319 R326	L318-A322 VanDerWaalsContact O-CB 3.27Å; L318-A322 WeakPolarHBondContact O-CB 3.13Å; L318-A322 PolarHBondContact O-N 3.17Å; F319-A322 PolarHBondContact O-N 2.8Å; A322-R326 VanDerWaalsContact CB-NH1 3.29Å; A322-R326 WeakPolarHBondContact O-CG 3.31Å; A322-R326 PolarHBondContact O-NH1 3.22Å
323	L	90.9	Very high	87.4	Confident	10 Å²	10	46.2 Å²	46.2	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-74.4	-44.2	174.2	-168	63.2	0	0	0	110.7	T238 W242 F319 A321 D325 R326 M327 C334	T238-L323 HydrophobicContact CG2-CD1 4.29Å; T238-L323 HydrophobicContact CG2-CD2 3.96Å; W242-L323 HydrophobicContact CH2-CD1 4.4Å; W242-L323 HydrophobicContact CZ3-CD1 3.74Å; F319-L323 HydrophobicContact CD2-CB 4.33Å; F319-L323 HydrophobicContact CE1-CD2 4.33Å; F319-L323 HydrophobicContact CE2-CB 4.15Å; F319-L323 HydrophobicContact CE2-CD1 4.04Å; F319-L323 HydrophobicContact CE2-CD2 4.07Å; F319-L323 HydrophobicContact CE2-CG 4.33Å; F319-L323 HydrophobicContact CZ-CD1 4.4Å; F319-L323 HydrophobicContact CZ-CD2 3.79Å; F319-L323 WeakPolarHBondContact O-CB 3.46Å; F319-L323 PolarHBondContact O-N 3.22Å; A321-L323 PolarHBondContact O-N 2.87Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 3.28Å; L323-R326 PolarHBondContact O-N 2.98Å; L323-M327 HydrophobicContact CD1-CE 3.8Å; L323-M327 HydrophobicContact CD1-CG 4.2Å; L323-M327 HydrophobicContact CD1-SD 4.22Å; L323-M327 HydrophobicContact CD2-CE 3.7Å; L323-M327 HydrophobicContact CD2-SD 4.02Å; L323-M327 HydrophobicContact CG-CE 3.71Å; L323-M327 HydrophobicContact CG-CG 4.05Å; L323-M327 HydrophobicContact CG-SD 3.67Å; L323-M327 WeakPolarHBondContact O-CB 3.46Å; L323-M327 VanDerWaalsContact O-CG 3.3Å; L323-M327 WeakPolarHBondContact O-CG 3.38Å; L323-M327 PolarHBondContact O-N 3.08Å; L323-C334 HydrophobicContact CB-CB 4.37Å; L323-C334 HydrophobicContact CD2-CB 4.25Å; L323-C334 HydrophobicContact CG-CB 4.36Å
324	Q	90	Very high	87.3	Confident	30 Å²	30	46 Å²	46	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-45.1	176.7	177.1	57.4	34.8	0	0	111.8	A320 A321 R326 M327 S328 C334	A320-Q324 WeakPolarHBondContact O-CB 3.16Å; A320-Q324 PolarHBondContact O-N 3.46Å; A321-Q324 WeakPolarHBondContact O-CB 3.23Å; A321-Q324 PolarHBondContact O-N 3.49Å; Q324-R326 VanDerWaalsContact C-N 3.32Å; Q324-R326 PolarHBondContact O-N 3.5Å; Q324-M327 PolarHBondContact O-N 3.44Å; Q324-S328 PolarHBondContact O-N 3.21Å; Q324-C334 HydrophobicContact CB-CB 4.24Å; Q324-C334 PolarHBondContact OE1-O 2.66Å
325	D	87.1	Confident	87.2	Confident	123 Å²	123	46.4 Å²	46.4	66%	0.658	24%	0.242	S	C	*	.	H	α-helix	trans	-58.2	-45	178.1	-71.2	-17	0	0	0	111.7	A321 L323 S328	A321-D325 PolarHBondContact O-N 2.98Å; A321-D325 VanDerWaalsContact O-N 3.12Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 3.28Å; D325-S328 PolarHBondContact O-OG 2.82Å
326	R	84.4	Confident	86.8	Confident	165 Å²	165	47 Å²	47	62%	0.623	25%	0.247	S	C	*	.	H	α-helix	trans	-74	-27.3	179.4	-66.6	179.6	-177.9	95.5	-3.4	113.6	A322 L323 Q324	A322-R326 VanDerWaalsContact CB-NH1 3.29Å; A322-R326 WeakPolarHBondContact O-CG 3.31Å; A322-R326 PolarHBondContact O-NH1 3.22Å; L323-R326 PolarHBondContact O-N 2.98Å; Q324-R326 VanDerWaalsContact C-N 3.32Å; Q324-R326 PolarHBondContact O-N 3.5Å
327	M	80.4	Confident	86.2	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-89.9	-18	-174.5	-85.9	-167.2	170.9	0	0	113.9	W242 M245 I253 L323 Q324 Q329 H330 L332 C334	W242-M327 HydrophobicContact CE3-CE 3.84Å; W242-M327 HydrophobicContact CH2-CE 3.93Å; W242-M327 HydrophobicContact CH2-CG 3.52Å; W242-M327 HydrophobicContact CZ3-CE 3.17Å; W242-M327 HydrophobicContact CZ3-CG 3.79Å; W242-M327 HydrophobicContact CZ3-SD 4.29Å; M245-M327 HydrophobicContact SD-CE 3.79Å; I253-M327 HydrophobicContact CD1-CE 3.61Å; I253-M327 HydrophobicContact CD1-SD 3.53Å; I253-M327 VanDerWaalsContact CD1-SD 3.53Å; I253-M327 HydrophobicContact CG1-CE 4.16Å; I253-M327 HydrophobicContact CG1-SD 4.48Å; L323-M327 HydrophobicContact CD1-CE 3.8Å; L323-M327 HydrophobicContact CD1-CG 4.2Å; L323-M327 HydrophobicContact CD1-SD 4.22Å; L323-M327 HydrophobicContact CD2-CE 3.7Å; L323-M327 HydrophobicContact CD2-SD 4.02Å; L323-M327 HydrophobicContact CG-CE 3.71Å; L323-M327 HydrophobicContact CG-CG 4.05Å; L323-M327 HydrophobicContact CG-SD 3.67Å; L323-M327 WeakPolarHBondContact O-CB 3.46Å; L323-M327 VanDerWaalsContact O-CG 3.3Å; L323-M327 WeakPolarHBondContact O-CG 3.38Å; L323-M327 PolarHBondContact O-N 3.08Å; Q324-M327 PolarHBondContact O-N 3.44Å; M327-Q329 PolarHBondContact O-N 3.35Å; M327-H330 PolarHBondContact O-N 3.47Å; M327-L332 HydrophobicContact CB-CB 3.78Å; M327-L332 HydrophobicContact CE-CD1 3.89Å; M327-L332 HydrophobicContact CG-CB 3.97Å; M327-L332 HydrophobicContact CG-CD1 3.99Å; M327-L332 HydrophobicContact SD-CB 3.67Å; M327-L332 HydrophobicContact SD-CD1 3.89Å; M327-L332 HydrophobicContact SD-CG 4.41Å; M327-C334 HydrophobicContact SD-CB 4.35Å
328	S	71.8	Confident	85.6	Confident	67 Å²	67	47.1 Å²	47.1	47%	0.469	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-52.2	-30.9	-176.8	60.8	0	0	0	0	113.8	Q324 D325 H330	Q324-S328 PolarHBondContact O-N 3.21Å; D325-S328 PolarHBondContact O-OG 2.82Å; S328-H330 VanDerWaalsContact C-N 3.29Å; S328-H330 PolarHBondContact O-N 2.92Å
329	Q	80.2	Confident	84.5	Confident	164 Å²	164	44 Å²	44	77%	0.766	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-76.4	-10.2	178.7	-59.5	-179.9	-0.4	0	0	114.2	M327	M327-Q329 PolarHBondContact O-N 3.35Å
330	H	82.6	Confident	82.9	Confident	74 Å²	74	43.4 Å²	43.4	34%	0.343	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-115.5	15.9	-171.5	-63.1	-52.3	0	0	0	114	A249 M327 S328 L332	A249-H330 WeakPolarHBondContact CB-O 3.3Å; M327-H330 PolarHBondContact O-N 3.47Å; S328-H330 VanDerWaalsContact C-N 3.29Å; S328-H330 PolarHBondContact O-N 2.92Å; H330-L332 HydrophobicContact CB-CD1 4.1Å; H330-L332 HydrophobicContact CB-CG 4.08Å; H330-L332 PolarHBondContact O-N 2.92Å
331	N	85.2	Confident	80.8	Confident	107 Å²	107	48.2 Å²	48.2	57%	0.572	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	31.5	-173.1	-65.6	-33.2	0	0	0	113.1	A249 P250	A249-N331 HydrophobicContact CB-CB 4.31Å; P250-N331 WeakPolarHBondContact CA-O 3.45Å
332	L	86.6	Confident	78.9	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140.7	175.6	-66	179.1	0	0	0	109.2	M245 K246 A249 A251 M327 H330	M245-L332 HydrophobicContact CB-CD1 4.18Å; M245-L332 WeakPolarHBondContact O-CD2 3.34Å; K246-L332 HydrophobicContact CG-CD1 4.31Å; A249-L332 HydrophobicContact CB-CD2 4.21Å; A251-L332 HydrophobicContact CB-CD2 3.64Å; A251-L332 WeakPolarHBondContact O-CA 3.42Å; M327-L332 HydrophobicContact CB-CB 3.78Å; M327-L332 HydrophobicContact CE-CD1 3.89Å; M327-L332 HydrophobicContact CG-CB 3.97Å; M327-L332 HydrophobicContact CG-CD1 3.99Å; M327-L332 HydrophobicContact SD-CB 3.67Å; M327-L332 HydrophobicContact SD-CD1 3.89Å; M327-L332 HydrophobicContact SD-CG 4.41Å; H330-L332 HydrophobicContact CB-CD1 4.1Å; H330-L332 HydrophobicContact CB-CG 4.08Å; H330-L332 PolarHBondContact O-N 2.92Å
333	C	87.6	Confident	76.7	Confident	13 Å²	13	50 Å²	50	9%	0.088	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.1	177.9	176.9	0	0	0	0	109.7	A251 R252 I253	A251-C333 PolarHBondContact O-N 3Å; R252-C333 CarbonylContact C-O 3.6Å; R252-C333 WeakPolarHBondContact CA-O 3.41Å; R252-C333 HydrophobicContact CG-CB 4.3Å; I253-C333 PolarHBondContact N-O 3.38Å
334	C	88.2	Confident	74.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128.8	177.3	-178.2	0	0	0	0	109.9	I253 L255 A320 L323 Q324 M327	I253-C334 HydrophobicContact CB-CB 4.33Å; I253-C334 CarbonylContact O-C 3.59Å; I253-C334 WeakPolarHBondContact O-CA 3.39Å; L255-C334 WeakPolarHBondContact CD1-SG 3.01Å; A320-C334 VanDerWaalsContact CA-SG 3.57Å; L323-C334 HydrophobicContact CB-CB 4.37Å; L323-C334 HydrophobicContact CD2-CB 4.25Å; L323-C334 HydrophobicContact CG-CB 4.36Å; Q324-C334 HydrophobicContact CB-CB 4.24Å; Q324-C334 PolarHBondContact OE1-O 2.66Å; M327-C334 HydrophobicContact SD-CB 4.35Å
335	V	86.3	Confident	72.2	Confident	15 Å²	15	53.3 Å²	53.3	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.4	-179	-65	0	0	0	0	111.3	I253 V254 L255 V337 M378	I253-V335 PolarHBondContact O-N 2.95Å; V254-V335 WeakPolarHBondContact CA-O 3.14Å; V254-V335 HydrophobicContact CB-CG2 4.34Å; V254-V335 HydrophobicContact CG1-CG2 4.25Å; V254-V335 HydrophobicContact CG2-CG2 3.91Å; L255-V335 PolarHBondContact N-O 3.12Å; V335-V337 HydrophobicContact CG2-CG2 4.38Å; V335-M378 HydrophobicContact CB-SD 4.28Å; V335-M378 HydrophobicContact CG1-SD 4.16Å; V335-M378 HydrophobicContact CG2-CB 3.95Å; V335-M378 HydrophobicContact CG2-CG 3.96Å; V335-M378 HydrophobicContact CG2-SD 4.09Å
336	A	84.4	Confident	70.5	Confident	18 Å²	18	52.5 Å²	52.5	15%	0.149	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.9	169.2	0	0	0	0	0	109.8	L255 T257 A320	L255-A336 CarbonylContact O-C 3.55Å; L255-A336 WeakPolarHBondContact O-CA 3.47Å; T257-A336 HydrophobicContact CG2-CB 3.71Å; A320-A336 HydrophobicContact CB-CB 3.73Å
337	V	81	Confident	68.8	Low	4 Å²	4	46.5 Å²	46.5	2%	0.024	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.8	-174	164.2	0	0	0	0	110.2	V254 L255 T256 T257 V335 F374 M378	V254-V337 HydrophobicContact CG1-CB 4.08Å; V254-V337 HydrophobicContact CG1-CG2 3.7Å; L255-V337 PolarHBondContact O-N 2.97Å; T256-V337 CarbonylContact C-O 3.52Å; T256-V337 WeakPolarHBondContact CA-O 3.47Å; T257-V337 PolarHBondContact N-O 2.79Å; T257-V337 PolarHBondContact OG1-O 2.77Å; V335-V337 HydrophobicContact CG2-CG2 4.38Å; V337-F374 HydrophobicContact CB-CB 4.43Å; V337-F374 HydrophobicContact CG1-CB 3.14Å; V337-F374 HydrophobicContact CG1-CD1 4.36Å; V337-F374 HydrophobicContact CG1-CG 3.92Å; V337-M378 HydrophobicContact CG2-CB 4.49Å; V337-M378 HydrophobicContact CG2-CG 3.71Å
338	H	76.1	Confident	67.3	Low	37 Å²	37	48.9 Å²	48.9	17%	0.171	26%	0.26	C	S	.	.			trans	-95.2	125.6	170.3	155.3	72.2	0	0	0	109.9	T257 E259 G340 N341	T257-H338 PolarHBondContact OG1-N 3.29Å; E259-H338 PolarHBondContact N-ND1 2.92Å; E259-H338 VanDerWaalsContact N-ND1 3.19Å; H338-G340 WeakPolarHBondContact CE1-CA 3.31Å; H338-G340 PolarHBondContact CE1-N 3.33Å; H338-G340 PolarHBondContact CE1-O 3.43Å; H338-G340 PolarHBondContact ND1-N 2.89Å; H338-G340 WeakPolarHBondContact NE2-CA 3.3Å; H338-G340 PolarHBondContact NE2-N 2.9Å; H338-G340 VanDerWaalsContact NE2-N 3.2Å; H338-G340 PolarHBondContact O-N 3.43Å; H338-N341 PolarHBondContact CE1-N 3.39Å; H338-N341 PolarHBondContact CE1-OD1 3.13Å; H338-N341 PolarHBondContact NE2-N 2.91Å
339	P	67.7	Low	66.3	Low	13 Å²	13	54.5 Å²	54.5	8%	0.084	27%	0.271	C	S	.	.			trans	-73.3	-23.8	-176	28.1	-33.3	0	0	0	113.4	I134 T256 T257 L371 F374	I134-P339 HydrophobicContact CD1-CB 4.06Å; I134-P339 HydrophobicContact CD1-CG 4.29Å; T256-P339 HydrophobicContact CG2-CG 4.45Å; T257-P339 WeakPolarHBondContact O-CD 3.4Å; P339-L371 HydrophobicContact CB-CB 3.96Å; P339-L371 HydrophobicContact CB-CD2 3.96Å; P339-L371 HydrophobicContact CB-CG 4.37Å; P339-L371 WeakPolarHBondContact O-CD2 3.39Å; P339-F374 WeakPolarHBondContact O-CE2 3.32Å
340	G	59.1	Low	64.8	Low	6 Å²	6	50.8 Å²	50.8	6%	0.062	26%	0.264	C	S	.	.			trans	139.5	155.6	-177.4	0	0	0	0	0	113	H338	H338-G340 WeakPolarHBondContact CE1-CA 3.31Å; H338-G340 PolarHBondContact CE1-N 3.33Å; H338-G340 PolarHBondContact CE1-O 3.43Å; H338-G340 PolarHBondContact ND1-N 2.89Å; H338-G340 WeakPolarHBondContact NE2-CA 3.3Å; H338-G340 PolarHBondContact NE2-N 2.9Å; H338-G340 VanDerWaalsContact NE2-N 3.2Å; H338-G340 PolarHBondContact O-N 3.43Å
341	N	47.4	Very low	63	Low	101 Å²	101	52 Å²	52	54%	0.54	27%	0.266	S	S	.	.	S	Bend	trans	-74.1	131.6	172.7	-71.4	-23.1	0	0	0	109.2	E259 H338	E259-N341 WeakPolarHBondContact CB-OD1 3.37Å; H338-N341 PolarHBondContact CE1-N 3.39Å; H338-N341 PolarHBondContact CE1-OD1 3.13Å; H338-N341 PolarHBondContact NE2-N 2.91Å
342	V	47.6	Very low	61	Low	71 Å²	71	55 Å²	55	43%	0.43	27%	0.274	S	S	.	.	S	Bend	trans	70.1	88.1	178.8	-166.6	0	0	0	0	113.2	C361 A365	V342-C361 HydrophobicContact CG1-CB 3.46Å; V342-C361 VanDerWaalsContact CG1-CB 3.46Å; V342-A365 HydrophobicContact CG1-CB 3.88Å; V342-A365 VanDerWaalsContact O-CA 3.3Å; V342-A365 WeakPolarHBondContact O-CA 3.44Å; V342-A365 VanDerWaalsContact O-CB 3.31Å; V342-A365 WeakPolarHBondContact O-CB 3.41Å
343	V	45.7	Very low	59	Low	24 Å²	24	58 Å²	58	15%	0.145	29%	0.294	C	S	.	.			trans	-111.8	123.5	172.8	-173.8	0	0	0	0	110.1	I134 T345 L368 L371	I134-V343 HydrophobicContact CD1-CG1 4.38Å; V343-T345 HydrophobicContact CB-CG2 4.05Å; V343-T345 HydrophobicContact CG1-CG2 3.2Å; V343-T345 PolarHBondContact O-N 3.36Å; V343-L368 HydrophobicContact CG1-CD2 4.23Å; V343-L371 HydrophobicContact CB-CD1 3.94Å; V343-L371 HydrophobicContact CG1-CD1 3.17Å; V343-L371 HydrophobicContact CG2-CD1 3.5Å; V343-L371 VanDerWaalsContact CG2-CD1 3.5Å; V343-L371 HydrophobicContact CG2-CD2 4.06Å; V343-L371 HydrophobicContact CG2-CG 4.48Å
344	Y	38.8	Very low	57.1	Low	77 Å²	77	60 Å²	60	30%	0.302	30%	0.304	S	S	.	.			trans	-70.8	83	160.6	-168	-89.6	0	0	0	108.6	A358 R362	Y344-A358 HydrophobicContact CD2-CB 4.12Å; Y344-R362 HydrophobicContact CD2-CG 3.62Å; Y344-R362 HydrophobicContact CE2-CG 4.18Å; Y344-R362 VanDerWaalsContact CE2-NE 3.29Å; Y344-R362 HydrophobicContact CG-CG 4.05Å; Y344-R362 PolarHBondContact OH-NH2 3.3Å
345	T	48.1	Very low	55	Low	34 Å²	34	65.7 Å²	65.7	21%	0.209	33%	0.325	C	S	.	.			trans	-105.5	153.7	169.2	52.5	0	0	0	0	109.6	I134 V343 L347 L368	I134-T345 HydrophobicContact CD1-CG2 4.15Å; I134-T345 HydrophobicContact CG1-CG2 4.31Å; V343-T345 HydrophobicContact CB-CG2 4.05Å; V343-T345 HydrophobicContact CG1-CG2 3.2Å; V343-T345 PolarHBondContact O-N 3.36Å; T345-L347 PolarHBondContact O-N 3.1Å; T345-L347 WeakPolarHBondContact OG1-CB 3.21Å; T345-L368 HydrophobicContact CG2-CD2 4.22Å
346	N	52.1	Low	52.9	Low	106 Å²	106	71 Å²	71	57%	0.567	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63.8	1.1	167.2	-75.2	-28.6	0	0	0	113.1	F348 R349	N346-F348 PolarHBondContact O-N 2.77Å; N346-R349 VanDerWaalsContact O-CB 3.3Å; N346-R349 WeakPolarHBondContact O-CB 3.23Å; N346-R349 PolarHBondContact O-N 3.39Å; N346-R349 VanDerWaalsContact O-N 3.12Å
347	L	48	Very low	50.7	Low	39 Å²	39	74.5 Å²	74.5	20%	0.204	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-58.3	-34.4	180	-161.3	76.5	0	0	0	111.7	A210 F212 Y309 T345 R349	A210-L347 HydrophobicContact CB-CD1 4.33Å; A210-L347 WeakPolarHBondContact O-CD1 3.3Å; F212-L347 HydrophobicContact CB-CD2 4.12Å; F212-L347 HydrophobicContact CB-CG 3.87Å; Y309-L347 HydrophobicContact CE2-CD2 3.78Å; T345-L347 PolarHBondContact O-N 3.1Å; T345-L347 WeakPolarHBondContact OG1-CB 3.21Å; L347-R349 PolarHBondContact O-N 2.97Å
348	F	49.7	Very low	49	Very low	49 Å²	49	75.2 Å²	75.2	22%	0.215	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-93.5	21.6	179.8	-53.9	-71.4	0	0	0	113.8	F212 N346 S350 Y351 L354	F212-F348 HydrophobicContact CB-CD1 4.49Å; F212-F348 HydrophobicContact CB-CE1 4.48Å; F212-F348 HydrophobicContact CD1-CD1 4.2Å; F212-F348 HydrophobicContact CD1-CE1 4.47Å; F212-F348 AromaticContact CD2-CE1 3.99Å; F212-F348 HydrophobicContact CD2-CE1 3.99Å; F212-F348 HydrophobicContact CE2-CE1 4.35Å; F212-F348 HydrophobicContact CG-CD1 4.14Å; F212-F348 HydrophobicContact CG-CE1 4.06Å; N346-F348 PolarHBondContact O-N 2.77Å; F348-S350 PolarHBondContact O-N 3.35Å; F348-Y351 PolarHBondContact O-N 3.36Å; F348-Y351 VanDerWaalsContact O-N 3.08Å; F348-L354 HydrophobicContact CB-CB 4.29Å; F348-L354 HydrophobicContact CD1-CB 4.47Å; F348-L354 HydrophobicContact CD1-CD1 3.78Å; F348-L354 HydrophobicContact CE1-CD1 4.14Å; F348-L354 HydrophobicContact CG-CB 4.42Å
349	R	49.4	Very low	47.4	Very low	185 Å²	185	79 Å²	79	70%	0.698	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-29.7	-175.7	-176.1	175.4	178.8	176	0.2	113.2	N346 L347	N346-R349 VanDerWaalsContact O-CB 3.3Å; N346-R349 WeakPolarHBondContact O-CB 3.23Å; N346-R349 PolarHBondContact O-N 3.39Å; N346-R349 VanDerWaalsContact O-N 3.12Å; L347-R349 PolarHBondContact O-N 2.97Å
350	S	48.6	Very low	45.9	Very low	86 Å²	86	83 Å²	83	60%	0.601	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-4.8	-176.1	-53.7	0	0	0	0	114.9	F348	F348-S350 PolarHBondContact O-N 3.35Å
351	Y	45.2	Very low	44.8	Very low	99 Å²	99	84.4 Å²	84.4	39%	0.388	41%	0.413	S	S	.	.			trans	-117	99.1	-176	-152.4	-98.1	0	0	0	111.7	P214 F348 P353 L354 R355	P214-Y351 HydrophobicContact CB-CD2 3.93Å; P214-Y351 HydrophobicContact CG-CD2 4.17Å; F348-Y351 PolarHBondContact O-N 3.36Å; F348-Y351 VanDerWaalsContact O-N 3.08Å; Y351-P353 HydrophobicContact CD1-CB 4.15Å; Y351-P353 HydrophobicContact CD1-CG 4Å; Y351-P353 HydrophobicContact CE1-CB 3.93Å; Y351-P353 HydrophobicContact CE1-CG 3.7Å; Y351-L354 HydrophobicContact CD1-CB 3.74Å; Y351-L354 HydrophobicContact CD1-CD1 3.47Å; Y351-L354 VanDerWaalsContact CD1-CD1 3.47Å; Y351-L354 HydrophobicContact CD1-CG 3.52Å; Y351-L354 HydrophobicContact CE1-CD1 4.07Å; Y351-L354 HydrophobicContact CE1-CG 4.07Å; Y351-L354 HydrophobicContact CG-CB 4.44Å; Y351-L354 HydrophobicContact CG-CD1 3.98Å; Y351-L354 HydrophobicContact CG-CG 4.4Å; Y351-L354 PolarHBondContact O-N 3.2Å; Y351-R355 PolarHBondContact O-N 3.13Å
352	F	43.8	Very low	44.3	Very low	172 Å²	172	85.2 Å²	85.2	75%	0.754	41%	0.409	S	S	*	.	H	α-helix	trans	-56	-42.9	-175.9	-171.2	-94.8	0	0	0	114.3	L354 R355 F356	F352-L354 PolarHBondContact O-N 3.05Å; F352-R355 VanDerWaalsContact O-CB 3.3Å; F352-R355 WeakPolarHBondContact O-CB 3.49Å; F352-R355 PolarHBondContact O-N 3.49Å; F352-F356 PolarHBondContact O-N 3.23Å
353	P	44.6	Very low	43.7	Very low	69 Å²	69	86.9 Å²	86.9	45%	0.448	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-40.6	178.3	-19	29.5	0	0	0	113.3	Y351 R355 F356 I357	Y351-P353 HydrophobicContact CD1-CB 4.15Å; Y351-P353 HydrophobicContact CD1-CG 4Å; Y351-P353 HydrophobicContact CE1-CB 3.93Å; Y351-P353 HydrophobicContact CE1-CG 3.7Å; P353-R355 VanDerWaalsContact C-N 3.3Å; P353-R355 PolarHBondContact O-N 3.21Å; P353-F356 PolarHBondContact O-N 3Å; P353-I357 PolarHBondContact O-N 3.49Å
354	L	47.4	Very low	43.3	Very low	54 Å²	54	93.9 Å²	93.9	28%	0.283	45%	0.45	S	S	.	.	H	α-helix	trans	-71.4	-28.4	177.2	-77.9	165.5	0	0	0	111.1	F348 Y351 F352 F356 A358	F348-L354 HydrophobicContact CB-CB 4.29Å; F348-L354 HydrophobicContact CD1-CB 4.47Å; F348-L354 HydrophobicContact CD1-CD1 3.78Å; F348-L354 HydrophobicContact CE1-CD1 4.14Å; F348-L354 HydrophobicContact CG-CB 4.42Å; Y351-L354 HydrophobicContact CD1-CB 3.74Å; Y351-L354 HydrophobicContact CD1-CD1 3.47Å; Y351-L354 VanDerWaalsContact CD1-CD1 3.47Å; Y351-L354 HydrophobicContact CD1-CG 3.52Å; Y351-L354 HydrophobicContact CE1-CD1 4.07Å; Y351-L354 HydrophobicContact CE1-CG 4.07Å; Y351-L354 HydrophobicContact CG-CB 4.44Å; Y351-L354 HydrophobicContact CG-CD1 3.98Å; Y351-L354 HydrophobicContact CG-CG 4.4Å; Y351-L354 PolarHBondContact O-N 3.2Å; F352-L354 PolarHBondContact O-N 3.05Å; L354-F356 VanDerWaalsContact C-N 3.3Å; L354-F356 PolarHBondContact O-N 2.87Å; L354-A358 WeakPolarHBondContact O-CA 3.5Å; L354-A358 WeakPolarHBondContact O-CB 3.45Å; L354-A358 PolarHBondContact O-N 3.48Å
355	R	44.5	Very low	43.4	Very low	121 Å²	121	91 Å²	91	46%	0.457	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-40.7	169.4	-110.4	-178.3	166.6	-165.4	-4.3	111.7	Y351 F352 P353 F359	Y351-R355 PolarHBondContact O-N 3.13Å; F352-R355 VanDerWaalsContact O-CB 3.3Å; F352-R355 WeakPolarHBondContact O-CB 3.49Å; F352-R355 PolarHBondContact O-N 3.49Å; P353-R355 VanDerWaalsContact C-N 3.3Å; P353-R355 PolarHBondContact O-N 3.21Å; R355-F359 VanDerWaalsContact O-CB 3.23Å; R355-F359 WeakPolarHBondContact O-CB 3.37Å; R355-F359 PolarHBondContact O-N 2.81Å
356	F	40.7	Very low	43.2	Very low	126 Å²	126	91.5 Å²	91.5	55%	0.553	44%	0.441	S	S	*	.	H	α-helix	trans	-71.5	-45.9	177.8	-167.8	-105	0	0	0	111.9	F352 P353 L354 A358 F359 L360	F352-F356 PolarHBondContact O-N 3.23Å; P353-F356 PolarHBondContact O-N 3Å; L354-F356 VanDerWaalsContact C-N 3.3Å; L354-F356 PolarHBondContact O-N 2.87Å; F356-A358 PolarHBondContact O-N 3.19Å; F356-F359 WeakPolarHBondContact O-CB 2.93Å; F356-F359 PolarHBondContact O-N 3.24Å; F356-L360 HydrophobicContact CD1-CD1 3.77Å; F356-L360 HydrophobicContact CD1-CG 4.3Å; F356-L360 HydrophobicContact CE1-CD1 3.5Å; F356-L360 HydrophobicContact CE1-CG 4.11Å; F356-L360 HydrophobicContact CZ-CD1 4.22Å; F356-L360 HydrophobicContact CZ-CD2 4.48Å; F356-L360 HydrophobicContact CZ-CG 4.44Å; F356-L360 WeakPolarHBondContact O-CG 3.31Å; F356-L360 PolarHBondContact O-N 3.18Å
357	I	39.6	Very low	43	Very low	92 Å²	92	90 Å²	90	47%	0.472	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-44.6	173.8	-64.9	170.9	0	0	0	110.5	P353 F359 L360 C361	P353-I357 PolarHBondContact O-N 3.49Å; I357-F359 VanDerWaalsContact C-N 3.3Å; I357-F359 PolarHBondContact O-N 3.41Å; I357-L360 PolarHBondContact O-N 3.38Å; I357-C361 WeakPolarHBondContact O-CB 3.43Å; I357-C361 PolarHBondContact O-N 3.2Å; I357-C361 PolarHBondContact O-SG 3.37Å
358	A	44.4	Very low	43.1	Very low	18 Å²	18	90.6 Å²	90.6	15%	0.149	44%	0.439	C	S	.	.	H	α-helix	trans	-65	-32.9	176.3	0	0	0	0	0	112.5	Y344 L354 F356 R362	Y344-A358 HydrophobicContact CD2-CB 4.12Å; L354-A358 WeakPolarHBondContact O-CA 3.5Å; L354-A358 WeakPolarHBondContact O-CB 3.45Å; L354-A358 PolarHBondContact O-N 3.48Å; F356-A358 PolarHBondContact O-N 3.19Å; A358-R362 WeakPolarHBondContact O-CG 3.22Å; A358-R362 PolarHBondContact O-N 3.36Å; A358-R362 VanDerWaalsContact O-N 3.08Å
359	F	43.1	Very low	42.9	Very low	116 Å²	116	90.2 Å²	90.2	51%	0.509	44%	0.44	S	S	.	.	H	α-helix	trans	-68.3	-44	172.5	176.9	-95.2	0	0	0	111.5	R355 F356 I357 C361 R362	R355-F359 VanDerWaalsContact O-CB 3.23Å; R355-F359 WeakPolarHBondContact O-CB 3.37Å; R355-F359 PolarHBondContact O-N 2.81Å; F356-F359 WeakPolarHBondContact O-CB 2.93Å; F356-F359 PolarHBondContact O-N 3.24Å; I357-F359 VanDerWaalsContact C-N 3.3Å; I357-F359 PolarHBondContact O-N 3.41Å; F359-C361 VanDerWaalsContact C-N 3.33Å; F359-C361 PolarHBondContact O-N 3.45Å; F359-R362 VanDerWaalsContact O-CB 3.31Å; F359-R362 WeakPolarHBondContact O-CB 3.17Å; F359-R362 PolarHBondContact O-N 3.16Å
360	L	35.3	Very low	42.8	Very low	97 Å²	97	83.2 Å²	83.2	51%	0.508	42%	0.416	S	S	.	.	H	α-helix	trans	-66.1	-35.1	175.9	-70.5	176.5	0	0	0	112.5	F356 I357 R362 P363	F356-L360 HydrophobicContact CD1-CD1 3.77Å; F356-L360 HydrophobicContact CD1-CG 4.3Å; F356-L360 HydrophobicContact CE1-CD1 3.5Å; F356-L360 HydrophobicContact CE1-CG 4.11Å; F356-L360 HydrophobicContact CZ-CD1 4.22Å; F356-L360 HydrophobicContact CZ-CD2 4.48Å; F356-L360 HydrophobicContact CZ-CG 4.44Å; F356-L360 WeakPolarHBondContact O-CG 3.31Å; F356-L360 PolarHBondContact O-N 3.18Å; I357-L360 PolarHBondContact O-N 3.38Å; L360-R362 VanDerWaalsContact C-N 3.34Å; L360-P363 WeakPolarHBondContact O-CD 3.42Å
361	C	36.4	Very low	42.9	Very low	36 Å²	36	79.1 Å²	79.1	24%	0.243	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.2	177.6	-58.5	0	0	0	0	113.3	V342 I357 F359 F364 A365	V342-C361 HydrophobicContact CG1-CB 3.46Å; V342-C361 VanDerWaalsContact CG1-CB 3.46Å; I357-C361 WeakPolarHBondContact O-CB 3.43Å; I357-C361 PolarHBondContact O-N 3.2Å; I357-C361 PolarHBondContact O-SG 3.37Å; F359-C361 VanDerWaalsContact C-N 3.33Å; F359-C361 PolarHBondContact O-N 3.45Å; C361-F364 CarbonylContact O-C 3.49Å; C361-F364 WeakPolarHBondContact O-CA 3.36Å; C361-F364 PolarHBondContact O-N 3.46Å; C361-A365 WeakPolarHBondContact O-CB 3.44Å; C361-A365 PolarHBondContact O-N 3.49Å
362	R	37.7	Very low	43.1	Very low	119 Å²	119	74.4 Å²	74.4	45%	0.449	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-48.5	-45.8	176.6	-94.5	179.8	158.4	-172.3	-8.6	114.8	Y344 A358 F359 L360 F364 A365	Y344-R362 HydrophobicContact CD2-CG 3.62Å; Y344-R362 HydrophobicContact CE2-CG 4.18Å; Y344-R362 VanDerWaalsContact CE2-NE 3.29Å; Y344-R362 HydrophobicContact CG-CG 4.05Å; Y344-R362 PolarHBondContact OH-NH2 3.3Å; A358-R362 WeakPolarHBondContact O-CG 3.22Å; A358-R362 PolarHBondContact O-N 3.36Å; A358-R362 VanDerWaalsContact O-N 3.08Å; F359-R362 VanDerWaalsContact O-CB 3.31Å; F359-R362 WeakPolarHBondContact O-CB 3.17Å; F359-R362 PolarHBondContact O-N 3.16Å; L360-R362 VanDerWaalsContact C-N 3.34Å; R362-F364 PolarHBondContact O-N 2.84Å; R362-A365 PolarHBondContact O-N 3.13Å
363	P	34.8	Very low	43.5	Very low	106 Å²	106	66.3 Å²	66.3	69%	0.688	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-65.2	-18	177.1	22.4	-32	0	0	0	113.5	L360	L360-P363 WeakPolarHBondContact O-CD 3.42Å
364	F	37.2	Very low	44	Very low	171 Å²	171	63.6 Å²	63.6	75%	0.75	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-104.2	-8.2	176.4	-53.4	-74.8	0	0	0	113.1	C361 R362	C361-F364 CarbonylContact O-C 3.49Å; C361-F364 WeakPolarHBondContact O-CA 3.36Å; C361-F364 PolarHBondContact O-N 3.46Å; R362-F364 PolarHBondContact O-N 2.84Å
365	A	39.8	Very low	44.3	Very low	15 Å²	15	61 Å²	61	12%	0.124	30%	0.301	C	S	.	.	S	Bend	trans	-84.7	127.1	-178.6	0	0	0	0	0	109.8	V342 C361 R362 T367	V342-A365 HydrophobicContact CG1-CB 3.88Å; V342-A365 VanDerWaalsContact O-CA 3.3Å; V342-A365 WeakPolarHBondContact O-CA 3.44Å; V342-A365 VanDerWaalsContact O-CB 3.31Å; V342-A365 WeakPolarHBondContact O-CB 3.41Å; C361-A365 WeakPolarHBondContact O-CB 3.44Å; C361-A365 PolarHBondContact O-N 3.49Å; R362-A365 PolarHBondContact O-N 3.13Å; A365-T367 PolarHBondContact O-N 3.15Å
366	K	44.1	Very low	44.5	Very low	45 Å²	45	55.2 Å²	55.2	20%	0.196	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-56.1	139	174.4	-71.4	-175.6	-177.5	-174.2	0	110.3	A107 M370 L371	A107-K366 VanDerWaalsContact O-CE 3.27Å; A107-K366 WeakPolarHBondContact O-CE 3.35Å; K366-M370 HydrophobicContact CB-CB 4.25Å; K366-M370 HydrophobicContact CB-SD 4.18Å; K366-M370 HydrophobicContact CG-SD 4.22Å; K366-L371 HydrophobicContact CB-CD2 3.69Å; K366-L371 HydrophobicContact CB-CG 4.29Å; K366-L371 HydrophobicContact CD-CD2 3.84Å; K366-L371 HydrophobicContact CG-CD2 4.42Å
367	T	48.2	Very low	45.1	Very low	74 Å²	74	51 Å²	51	45%	0.454	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-66	148.6	175	58.5	0	0	0	0	109.8	A365 V369 M370 L371	A365-T367 PolarHBondContact O-N 3.15Å; T367-V369 PolarHBondContact O-N 3.21Å; T367-M370 HydrophobicContact CG2-CE 4.01Å; T367-M370 WeakPolarHBondContact O-CA 3.31Å; T367-M370 WeakPolarHBondContact O-CB 3.38Å; T367-M370 PolarHBondContact O-N 3.47Å; T367-M370 WeakPolarHBondContact OG1-CE 3.46Å; T367-M370 WeakPolarHBondContact OG1-CG 3.37Å; T367-L371 PolarHBondContact O-N 3.05Å
368	L	50.2	Low	45.6	Very low	52 Å²	52	47.3 Å²	47.3	27%	0.272	24%	0.241	S	C	.	.	H	α-helix	trans	-52.4	-32.7	-179.4	-65	170.1	0	0	0	112.6	I134 E137 V343 T345 L371 A372	I134-L368 HydrophobicContact CG1-CD2 3.64Å; E137-L368 HydrophobicContact CG-CB 3.97Å; V343-L368 HydrophobicContact CG1-CD2 4.23Å; T345-L368 HydrophobicContact CG2-CD2 4.22Å; L368-L371 HydrophobicContact CD2-CD1 4.33Å; L368-L371 WeakPolarHBondContact O-CB 3.46Å; L368-L371 PolarHBondContact O-N 2.89Å; L368-L371 VanDerWaalsContact O-N 3.12Å; L368-A372 PolarHBondContact O-N 3.12Å; L368-A372 VanDerWaalsContact O-N 3.16Å
369	V	46.3	Very low	45.8	Very low	41 Å²	41	46.8 Å²	46.8	25%	0.248	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-38.2	175.4	-170	0	0	0	0	112.3	T110 V111 E137 T367 L371	T110-V369 HydrophobicContact CG2-CG1 4.08Å; V111-V369 WeakPolarHBondContact CB-O 3.39Å; V111-V369 HydrophobicContact CG1-CG1 3.79Å; V111-V369 PolarHBondContact N-O 3.32Å; E137-V369 HydrophobicContact CG-CG2 4.12Å; T367-V369 PolarHBondContact O-N 3.21Å; V369-L371 PolarHBondContact O-N 2.85Å
370	M	46.4	Very low	46.1	Very low	38 Å²	38	42.5 Å²	42.5	19%	0.187	22%	0.22	C	C	.	.	H	α-helix	trans	-72.4	-16.6	173.8	-68.8	-178.5	-133.4	0	0	113	R108 S109 K366 T367 F373	R108-M370 HydrophobicContact CB-SD 4.45Å; R108-M370 WeakPolarHBondContact O-CG 3.46Å; S109-M370 WeakPolarHBondContact O-CA 2.83Å; K366-M370 HydrophobicContact CB-CB 4.25Å; K366-M370 HydrophobicContact CB-SD 4.18Å; K366-M370 HydrophobicContact CG-SD 4.22Å; T367-M370 HydrophobicContact CG2-CE 4.01Å; T367-M370 WeakPolarHBondContact O-CA 3.31Å; T367-M370 WeakPolarHBondContact O-CB 3.38Å; T367-M370 PolarHBondContact O-N 3.47Å; T367-M370 WeakPolarHBondContact OG1-CE 3.46Å; T367-M370 WeakPolarHBondContact OG1-CG 3.37Å; M370-F373 WeakPolarHBondContact O-CB 3.29Å
371	L	50.8	Low	46.7	Very low	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-89	-31.7	179.8	-55.8	175.5	0	0	0	110.7	I134 P339 V343 K366 T367 L368 V369 F373 F374	I134-L371 HydrophobicContact CD1-CB 3.85Å; I134-L371 HydrophobicContact CD1-CD1 3.56Å; I134-L371 HydrophobicContact CD1-CG 4.33Å; I134-L371 HydrophobicContact CG1-CB 3.96Å; I134-L371 HydrophobicContact CG1-CD1 3.79Å; I134-L371 HydrophobicContact CG2-CB 3.76Å; P339-L371 HydrophobicContact CB-CB 3.96Å; P339-L371 HydrophobicContact CB-CD2 3.96Å; P339-L371 HydrophobicContact CB-CG 4.37Å; P339-L371 WeakPolarHBondContact O-CD2 3.39Å; V343-L371 HydrophobicContact CB-CD1 3.94Å; V343-L371 HydrophobicContact CG1-CD1 3.17Å; V343-L371 HydrophobicContact CG2-CD1 3.5Å; V343-L371 VanDerWaalsContact CG2-CD1 3.5Å; V343-L371 HydrophobicContact CG2-CD2 4.06Å; V343-L371 HydrophobicContact CG2-CG 4.48Å; K366-L371 HydrophobicContact CB-CD2 3.69Å; K366-L371 HydrophobicContact CB-CG 4.29Å; K366-L371 HydrophobicContact CD-CD2 3.84Å; K366-L371 HydrophobicContact CG-CD2 4.42Å; T367-L371 PolarHBondContact O-N 3.05Å; L368-L371 HydrophobicContact CD2-CD1 4.33Å; L368-L371 WeakPolarHBondContact O-CB 3.46Å; L368-L371 PolarHBondContact O-N 2.89Å; L368-L371 VanDerWaalsContact O-N 3.12Å; V369-L371 PolarHBondContact O-N 2.85Å; L371-F373 PolarHBondContact O-N 3.04Å; L371-F374 PolarHBondContact O-N 2.94Å
372	A	49.6	Very low	47	Very low	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-19	170.6	0	0	0	0	0	112.7	V111 I134 E137 F138 L368 F374 Y375 S376	V111-A372 HydrophobicContact CB-CB 3.62Å; V111-A372 HydrophobicContact CG1-CB 4.11Å; V111-A372 HydrophobicContact CG2-CB 3.6Å; V111-A372 WeakPolarHBondContact CG2-O 3.37Å; I134-A372 HydrophobicContact CG2-CB 4.33Å; E137-A372 HydrophobicContact CB-CB 4.42Å; F138-A372 HydrophobicContact CB-CB 3.88Å; L368-A372 PolarHBondContact O-N 3.12Å; L368-A372 VanDerWaalsContact O-N 3.16Å; A372-F374 VanDerWaalsContact C-N 3.26Å; A372-F374 PolarHBondContact O-N 2.97Å; A372-Y375 PolarHBondContact O-N 3.28Å; A372-S376 PolarHBondContact O-N 2.65Å; A372-S376 VanDerWaalsContact O-N 3.13Å
373	F	52.2	Low	46.9	Very low	3 Å²	3	44.3 Å²	44.3	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-37.5	-53.9	166.6	173.1	-100.1	0	0	0	113	F105 V114 M370 L371 Y375 S376 Y377 F394	F105-F373 HydrophobicContact CB-CD2 4.46Å; F105-F373 HydrophobicContact CB-CE2 3.27Å; F105-F373 HydrophobicContact CB-CZ 3.53Å; F105-F373 HydrophobicContact CD1-CE2 4.32Å; F105-F373 HydrophobicContact CD2-CE2 4.06Å; F105-F373 HydrophobicContact CD2-CZ 4.38Å; F105-F373 AromaticContact CG-CE2 3.65Å; F105-F373 HydrophobicContact CG-CE2 3.65Å; F105-F373 HydrophobicContact CG-CZ 4.19Å; V114-F373 HydrophobicContact CG2-CD2 3.16Å; V114-F373 HydrophobicContact CG2-CE2 3.26Å; V114-F373 HydrophobicContact CG2-CG 4.25Å; V114-F373 HydrophobicContact CG2-CZ 4.47Å; M370-F373 WeakPolarHBondContact O-CB 3.29Å; L371-F373 PolarHBondContact O-N 3.04Å; F373-Y375 PolarHBondContact O-N 3.43Å; F373-S376 PolarHBondContact O-N 2.76Å; F373-Y377 HydrophobicContact CZ-CG 4.48Å; F373-Y377 WeakPolarHBondContact O-CB 3.37Å; F373-Y377 PolarHBondContact O-N 2.69Å; F373-F394 HydrophobicContact CE1-CD2 4.32Å; F373-F394 HydrophobicContact CE1-CE2 4.42Å; F373-F394 HydrophobicContact CZ-CE2 4.49Å
374	F	55.4	Low	46.9	Very low	11 Å²	11	40.2 Å²	40.2	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-72.6	-36.1	-168.6	-66.2	-93.5	0	0	0	112.4	V337 P339 L371 A372 S376 M378 F394	V337-F374 HydrophobicContact CB-CB 4.43Å; V337-F374 HydrophobicContact CG1-CB 3.14Å; V337-F374 HydrophobicContact CG1-CD1 4.36Å; V337-F374 HydrophobicContact CG1-CG 3.92Å; P339-F374 WeakPolarHBondContact O-CE2 3.32Å; L371-F374 PolarHBondContact O-N 2.94Å; A372-F374 VanDerWaalsContact C-N 3.26Å; A372-F374 PolarHBondContact O-N 2.97Å; F374-S376 VanDerWaalsContact C-N 3.35Å; F374-M378 WeakPolarHBondContact O-CB 3.46Å; F374-M378 WeakPolarHBondContact O-CG 3.28Å; F374-M378 PolarHBondContact O-N 3Å; F374-M378 VanDerWaalsContact O-N 3.1Å; F374-F394 HydrophobicContact CD1-CB 4.01Å; F374-F394 HydrophobicContact CD1-CG 4.45Å; F374-F394 HydrophobicContact CE1-CB 3.65Å; F374-F394 AromaticContact CE1-CD1 3.54Å; F374-F394 HydrophobicContact CE1-CD1 3.54Å; F374-F394 HydrophobicContact CE1-CE1 4.43Å; F374-F394 AromaticContact CE1-CG 3.76Å; F374-F394 HydrophobicContact CE1-CG 3.76Å; F374-F394 HydrophobicContact CZ-CD1 4.01Å
375	Y	52.9	Low	46.7	Very low	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-45.4	171.8	-58.8	-75	0	0	0	110.2	I134 F138 V206 N208 V254 T256 A372 F373 Y377 M378 T379	I134-Y375 HydrophobicContact CG2-CD2 4.38Å; I134-Y375 HydrophobicContact CG2-CE2 3.69Å; F138-Y375 VanDerWaalsContact CD2-CB 3.46Å; F138-Y375 HydrophobicContact CD2-CD2 4.31Å; F138-Y375 HydrophobicContact CD2-CG 4.19Å; F138-Y375 HydrophobicContact CE2-CG 4.37Å; F138-Y375 HydrophobicContact CG-CD2 4.39Å; F138-Y375 HydrophobicContact CG-CG 4.46Å; V206-Y375 HydrophobicContact CG1-CD1 3.38Å; V206-Y375 HydrophobicContact CG1-CE1 3.37Å; V206-Y375 HydrophobicContact CG1-CG 4.29Å; N208-Y375 HydrophobicContact CB-CE1 4.31Å; N208-Y375 WeakPolarHBondContact CB-OH 3.27Å; N208-Y375 PolarHBondContact OD1-OH 3.04Å; V254-Y375 HydrophobicContact CB-CD1 4.4Å; V254-Y375 HydrophobicContact CG1-CD1 3.63Å; V254-Y375 HydrophobicContact CG1-CE1 4.06Å; T256-Y375 WeakPolarHBondContact CB-OH 3.06Å; T256-Y375 WeakPolarHBondContact CG2-OH 3.33Å; T256-Y375 WeakPolarHBondContact OG1-CE1 3.5Å; T256-Y375 PolarHBondContact OG1-OH 3.16Å; A372-Y375 PolarHBondContact O-N 3.28Å; F373-Y375 PolarHBondContact O-N 3.43Å; Y375-Y377 PolarHBondContact O-N 3.23Å; Y375-M378 PolarHBondContact O-N 3.34Å; Y375-T379 VanDerWaalsContact O-CB 3.23Å; Y375-T379 WeakPolarHBondContact O-CB 3.29Å; Y375-T379 WeakPolarHBondContact O-CG2 3.42Å; Y375-T379 PolarHBondContact O-N 3.33Å; Y375-T379 PolarHBondContact O-OG1 3.06Å
376	S	48.8	Very low	46.2	Very low	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-39.5	-178.5	-71.4	0	0	0	0	112.7	V111 L115 A372 F373 F374 T379 S380	V111-S376 WeakPolarHBondContact CG2-OG 3.43Å; L115-S376 WeakPolarHBondContact CD1-OG 3.48Å; L115-S376 WeakPolarHBondContact CG-OG 3.35Å; A372-S376 PolarHBondContact O-N 2.65Å; A372-S376 VanDerWaalsContact O-N 3.13Å; F373-S376 PolarHBondContact O-N 2.76Å; F374-S376 VanDerWaalsContact C-N 3.35Å; S376-T379 VanDerWaalsContact CA-OG1 3.3Å; S376-T379 WeakPolarHBondContact CA-OG1 3.44Å; S376-T379 PolarHBondContact O-N 2.89Å; S376-T379 PolarHBondContact O-OG1 3.49Å; S376-S380 VanDerWaalsContact O-CB 3.24Å; S376-S380 WeakPolarHBondContact O-CB 3.48Å; S376-S380 PolarHBondContact O-N 3.22Å; S376-S380 PolarHBondContact O-OG 3.48Å
377	Y	53.3	Low	45.3	Very low	37 Å²	37	38.7 Å²	38.7	15%	0.145	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-43.9	178.1	-167.4	-110.8	0	0	0	111.5	F105 V114 F373 Y375 S380 L381 H392	F105-Y377 AromaticContact CD2-CD2 3.79Å; F105-Y377 HydrophobicContact CD2-CD2 3.79Å; F105-Y377 AromaticContact CD2-CE2 3.7Å; F105-Y377 HydrophobicContact CD2-CE2 3.7Å; F105-Y377 AromaticContact CE2-CD2 3.88Å; F105-Y377 HydrophobicContact CE2-CD2 3.88Å; F105-Y377 AromaticContact CE2-CE2 3.85Å; F105-Y377 HydrophobicContact CE2-CE2 3.85Å; V114-Y377 HydrophobicContact CG1-CD2 4.31Å; F373-Y377 HydrophobicContact CZ-CG 4.48Å; F373-Y377 WeakPolarHBondContact O-CB 3.37Å; F373-Y377 PolarHBondContact O-N 2.69Å; Y375-Y377 PolarHBondContact O-N 3.23Å; Y377-S380 PolarHBondContact O-OG 3.32Å; Y377-L381 HydrophobicContact CD1-CD1 3.97Å; Y377-L381 HydrophobicContact CD2-CD1 4.41Å; Y377-L381 HydrophobicContact CE1-CD1 3.56Å; Y377-L381 HydrophobicContact CE2-CD1 4.07Å; Y377-L381 HydrophobicContact CE2-CG 4.47Å; Y377-L381 HydrophobicContact CG-CD1 4.36Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 2.99Å; Y377-H392 HydrophobicContact CE1-CB 4.11Å; Y377-H392 AromaticContact CE1-CD2 3.63Å; Y377-H392 AromaticContact CE1-CG 3.8Å; Y377-H392 AromaticContact CZ-CD2 3.71Å; Y377-H392 PolarHBondContact OH-CD2 3.34Å; Y377-H392 PolarHBondContact OH-NE2 3.1Å
378	M	50.8	Low	44.5	Very low	14 Å²	14	40.7 Å²	40.7	7%	0.069	25%	0.246	C	C	.	.	H	α-helix	trans	-73.7	-27.4	178.2	-70	-64	105.9	0	0	113.8	R252 V254 V335 V337 F374 Y375 L381	R252-M378 VanDerWaalsContact CD-O 3.27Å; R252-M378 WeakPolarHBondContact CD-O 3.06Å; V254-M378 HydrophobicContact CG2-CB 4.38Å; V335-M378 HydrophobicContact CB-SD 4.28Å; V335-M378 HydrophobicContact CG1-SD 4.16Å; V335-M378 HydrophobicContact CG2-CB 3.95Å; V335-M378 HydrophobicContact CG2-CG 3.96Å; V335-M378 HydrophobicContact CG2-SD 4.09Å; V337-M378 HydrophobicContact CG2-CB 4.49Å; V337-M378 HydrophobicContact CG2-CG 3.71Å; F374-M378 WeakPolarHBondContact O-CB 3.46Å; F374-M378 WeakPolarHBondContact O-CG 3.28Å; F374-M378 PolarHBondContact O-N 3Å; F374-M378 VanDerWaalsContact O-N 3.1Å; Y375-M378 PolarHBondContact O-N 3.34Å; M378-L381 HydrophobicContact CE-CD1 4.31Å
379	T	48.9	Very low	43.3	Very low	7 Å²	7	42.3 Å²	42.3	4%	0.043	26%	0.262	C	S	.	.	H	α-helix	trans	-84.4	-24.6	-179.5	53.2	0	0	0	0	113.5	F138 I204 R252 V254 Y375 S376	F138-T379 HydrophobicContact CZ-CG2 4.45Å; I204-T379 HydrophobicContact CB-CG2 4.31Å; I204-T379 HydrophobicContact CD1-CG2 3.86Å; I204-T379 HydrophobicContact CG1-CG2 4Å; I204-T379 HydrophobicContact CG2-CG2 3.34Å; R252-T379 PolarHBondContact NH1-O 3.28Å; V254-T379 HydrophobicContact CG2-CG2 4.12Å; Y375-T379 VanDerWaalsContact O-CB 3.23Å; Y375-T379 WeakPolarHBondContact O-CB 3.29Å; Y375-T379 WeakPolarHBondContact O-CG2 3.42Å; Y375-T379 PolarHBondContact O-N 3.33Å; Y375-T379 PolarHBondContact O-OG1 3.06Å; S376-T379 VanDerWaalsContact CA-OG1 3.3Å; S376-T379 WeakPolarHBondContact CA-OG1 3.44Å; S376-T379 PolarHBondContact O-N 2.89Å; S376-T379 PolarHBondContact O-OG1 3.49Å
380	S	49.4	Very low	42.4	Very low	27 Å²	27	42.5 Å²	42.5	19%	0.189	27%	0.265	C	S	.	.	H	α-helix	trans	-94.6	-25.8	-175.1	57	0	0	0	0	115.6	S376 Y377 P382	S376-S380 VanDerWaalsContact O-CB 3.24Å; S376-S380 WeakPolarHBondContact O-CB 3.48Å; S376-S380 PolarHBondContact O-N 3.22Å; S376-S380 PolarHBondContact O-OG 3.48Å; Y377-S380 PolarHBondContact O-OG 3.32Å; S380-P382 WeakPolarHBondContact O-CD 3.4Å
381	L	48.4	Very low	41.4	Very low	31 Å²	31	47.8 Å²	47.8	16%	0.162	29%	0.289	C	S	.	.			trans	-69.2	117.7	-172.1	-81.1	168.1	0	0	0	112.5	R252 Y377 M378 K383	R252-L381 VanDerWaalsContact CZ-O 3.27Å; R252-L381 PolarHBondContact NH2-O 3.32Å; Y377-L381 HydrophobicContact CD1-CD1 3.97Å; Y377-L381 HydrophobicContact CD2-CD1 4.41Å; Y377-L381 HydrophobicContact CE1-CD1 3.56Å; Y377-L381 HydrophobicContact CE2-CD1 4.07Å; Y377-L381 HydrophobicContact CE2-CG 4.47Å; Y377-L381 HydrophobicContact CG-CD1 4.36Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 2.99Å; M378-L381 HydrophobicContact CE-CD1 4.31Å; L381-K383 PolarHBondContact O-N 3.02Å
382	P	41.1	Very low	40.3	Very low	98 Å²	98	50.2 Å²	50.2	64%	0.636	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-61.4	-31.5	172.6	-19.4	31.7	0	0	0	112.2	S380 C384 L385	S380-P382 WeakPolarHBondContact O-CD 3.4Å; P382-C384 VanDerWaalsContact C-N 3.33Å; P382-C384 PolarHBondContact O-N 3.31Å; P382-L385 PolarHBondContact O-N 3.2Å
383	K	36.4	Very low	39.3	Very low	161 Å²	161	54.3 Å²	54.3	70%	0.7	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-71.5	-14.2	-167.3	-73.9	-173	173.3	-174.1	0	115.8	L381 L385 S387	L381-K383 PolarHBondContact O-N 3.02Å; K383-L385 PolarHBondContact O-N 2.83Å; K383-S387 PolarHBondContact O-OG 3.18Å
384	C	35	Very low	38.4	Very low	19 Å²	19	56.6 Å²	56.6	13%	0.128	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-72.7	-4.5	178	-63.7	0	0	0	0	113.8	P382	P382-C384 VanDerWaalsContact C-N 3.33Å; P382-C384 PolarHBondContact O-N 3.31Å
385	L	33.6	Very low	37.3	Very low	75 Å²	75	57 Å²	57	39%	0.393	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-82.2	-6.7	-175.3	-78.2	164.5	0	0	0	115.6	P250 P382 K383	P250-L385 HydrophobicContact CB-CD1 4.12Å; P250-L385 HydrophobicContact CB-CD2 3.55Å; P382-L385 PolarHBondContact O-N 3.2Å; K383-L385 PolarHBondContact O-N 2.83Å
386	G	27.4	Very low	36.3	Very low	78 Å²	78	63.4 Å²	63.4	80%	0.804	37%	0.371	S	S	*	.	S	Bend	trans	-134.6	-3.6	-175.8	0	0	0	0	0	116.2
387	S	26.6	Very low	35.3	Very low	47 Å²	47	68.3 Å²	68.3	33%	0.329	39%	0.392	S	S	.	.			trans	-133.4	102.9	-177.1	40.9	0	0	0	0	108.6	K383 S389 C390	K383-S387 PolarHBondContact O-OG 3.18Å; S387-S389 PolarHBondContact O-N 2.89Å; S387-C390 PolarHBondContact O-N 2.62Å; S387-C390 PolarHBondContact OG-SG 2.98Å
388	S	31.1	Very low	34.1	Very low	115 Å²	115	69.9 Å²	69.9	80%	0.804	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-0.4	171.3	42.4	0	0	0	0	113.9
389	S	25	Very low	32.8	Very low	86 Å²	86	79.4 Å²	79.4	60%	0.601	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	33.4	-172.8	53	0	0	0	0	113	S387 Q391	S387-S389 PolarHBondContact O-N 2.89Å; S389-Q391 PolarHBondContact O-N 2.91Å
390	C	27.4	Very low	32	Very low	45 Å²	45	83.1 Å²	83.1	30%	0.304	48%	0.48	S	S	.	.			trans	-70	76.4	166.7	-90.5	0	0	0	0	111	S387 H392	S387-C390 PolarHBondContact O-N 2.62Å; S387-C390 PolarHBondContact OG-SG 2.98Å; C390-H392 PolarHBondContact O-N 3.08Å
391	Q	24.4	Very low	31.1	Very low	149 Å²	149	86 Å²	86	70%	0.696	50%	0.495	S	S	*	.			trans	-57.6	78.9	162.6	-70.6	173.4	-25.1	0	0	109.6	S389	S389-Q391 PolarHBondContact O-N 2.91Å
392	H	29.5	Very low	30.1	Very low	51 Å²	51	89.1 Å²	89.1	24%	0.236	51%	0.514	C	S	.	.			trans	-79.4	136.6	158.6	-72.8	85.1	0	0	0	106.4	Y377 C390 F394 C395	Y377-H392 HydrophobicContact CE1-CB 4.11Å; Y377-H392 AromaticContact CE1-CD2 3.63Å; Y377-H392 AromaticContact CE1-CG 3.8Å; Y377-H392 AromaticContact CZ-CD2 3.71Å; Y377-H392 PolarHBondContact OH-CD2 3.34Å; Y377-H392 PolarHBondContact OH-NE2 3.1Å; C390-H392 PolarHBondContact O-N 3.08Å; H392-F394 PolarHBondContact O-N 2.91Å; H392-C395 PolarHBondContact O-N 3.06Å
393	S	27.5	Very low	29.4	Very low	86 Å²	86	88.5 Å²	88.5	60%	0.601	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	2.5	-177.5	-49.6	0	0	0	0	115.8
394	F	33.8	Very low	29	Very low	52 Å²	52	84 Å²	84	23%	0.228	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-13	179.3	-66.8	-59.4	0	0	0	113.4	F373 F374 H392	F373-F394 HydrophobicContact CE1-CD2 4.32Å; F373-F394 HydrophobicContact CE1-CE2 4.42Å; F373-F394 HydrophobicContact CZ-CE2 4.49Å; F374-F394 HydrophobicContact CD1-CB 4.01Å; F374-F394 HydrophobicContact CD1-CG 4.45Å; F374-F394 HydrophobicContact CE1-CB 3.65Å; F374-F394 AromaticContact CE1-CD1 3.54Å; F374-F394 HydrophobicContact CE1-CD1 3.54Å; F374-F394 HydrophobicContact CE1-CE1 4.43Å; F374-F394 AromaticContact CE1-CG 3.76Å; F374-F394 HydrophobicContact CE1-CG 3.76Å; F374-F394 HydrophobicContact CZ-CD1 4.01Å; H392-F394 PolarHBondContact O-N 2.91Å
395	C	31.3	Very low	28.6	Very low	18 Å²	18	88.3 Å²	88.3	12%	0.122	52%	0.519	C	S	.	.	S	Bend	trans	-109.3	80.5	173.9	-166.2	0	0	0	0	107.3	H392 F397	H392-C395 PolarHBondContact O-N 3.06Å; C395-F397 VanDerWaalsContact C-N 3.3Å; C395-F397 PolarHBondContact O-N 3.39Å
396	F	32.9	Very low	28.3	Very low	136 Å²	136	89.3 Å²	89.3	60%	0.596	53%	0.528	S	S	*	.			trans	-69.7	90.6	171.5	-83.1	-91.8	0	0	0	108.6	C398	F396-C398 VanDerWaalsContact C-N 3.26Å; F396-C398 PolarHBondContact O-N 3.11Å
397	F	27.1	Very low	28.3	Very low	103 Å²	103	90.2 Å²	90.2	45%	0.452	51%	0.507	S	S	.	.			trans	-73.9	98.1	139.7	-86	-87.1	0	0	0	104.9	A321 C395 N399	A321-F397 HydrophobicContact CB-CE1 3.6Å; A321-F397 HydrophobicContact CB-CZ 4.29Å; C395-F397 VanDerWaalsContact C-N 3.3Å; C395-F397 PolarHBondContact O-N 3.39Å; F397-N399 PolarHBondContact O-N 2.96Å; F397-N399 VanDerWaalsContact O-N 3.1Å
398	C	27.9	Very low	28.5	Very low	70 Å²	70	93.8 Å²	93.8	47%	0.473	52%	0.522	S	S	.	.			trans	-59.7	110.8	172.8	-64.4	0	0	0	0	107.7	F396	F396-C398 VanDerWaalsContact C-N 3.26Å; F396-C398 PolarHBondContact O-N 3.11Å
399	N	23.9	Very low	28.2	Very low	214 Å²	214	91.8 Å²	91.8	100%	1.144	50%	0.496	S	S	*	.			trans	-70.8	0	152.6	-85.5	-11.6	0	0	0	108.9	F397	F397-N399 PolarHBondContact O-N 2.96Å; F397-N399 VanDerWaalsContact O-N 3.1Å

Retrieved 399 of 399 residues in 107.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).