X2JEJ4_DROME Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X2JEJ4, Species DROME (Drosophila melanogaster, Fruit fly), Gene PhKgamma, Length 391 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	41.7	Very low	251 Å²	251	155.1 Å²	155.1	100%	1.236	81%	0.811	S	S	*	*				0	84.7	0	-79.3	173	154	0	0	107
2	A	38.9	Very low	42.3	Very low	100 Å²	100	151.9 Å²	151.9	83%	0.826	80%	0.796	S	S	*	*			trans	-172.3	88.9	175	0	0	0	0	0	106.3
3	K	35.6	Very low	43.2	Very low	194 Å²	194	152 Å²	152	84%	0.843	79%	0.786	S	S	*	*			trans	-157.9	106.2	165.7	-102.1	-169.5	174.7	-172.3	0	103
4	D	35.9	Very low	44.4	Very low	167 Å²	167	149.5 Å²	149.5	89%	0.893	77%	0.774	S	S	*	*			trans	166.3	47.6	157.1	-77.9	-13.5	0	0	0	110
5	E	37.6	Very low	45.4	Very low	196 Å²	196	140 Å²	140	92%	0.916	73%	0.726	S	S	*	*			trans	-126.6	14.6	174.2	-82.6	-168.9	171.3	0	0	113.2
6	E	37.6	Very low	47.1	Very low	191 Å²	191	132.1 Å²	132.1	89%	0.893	69%	0.688	S	S	*	*	S	Bend	trans	-108.5	12.4	-169.5	-132.5	172.2	-169	0	0	115.8
7	D	37.6	Very low	49	Very low	165 Å²	165	131.2 Å²	131.2	88%	0.882	68%	0.677	S	S	*	*	S	Bend	trans	-113.3	9.9	-175.6	-115.6	13.2	0	0	0	115.1
8	D	45.3	Very low	51.2	Low	113 Å²	113	125.4 Å²	125.4	60%	0.604	66%	0.656	S	S	*	*			trans	-101.5	14.5	-168.6	-116.4	-22.7	0	0	0	115.6	R38	D8-R38 IonicContact OD1-CZ 3.47Å; D8-R38 IonicContact OD1-NH1 3.79Å; D8-R38 PolarHBondContact OD1-NH1 3.5Å; D8-R38 IonicContact OD1-NH2 2.73Å
9	L	47.4	Very low	53.4	Low	171 Å²	171	118.9 Å²	118.9	90%	0.895	62%	0.621	S	S	*	*			trans	-107.1	91.8	-178.4	-77.2	159.4	0	0	0	111.9
10	L	50.3	Low	55.3	Low	74 Å²	74	117 Å²	117	39%	0.387	61%	0.606	S	S	.	*			trans	-70.5	138.4	162.5	-73.2	165.1	0	0	0	110.1	I53	L10-I53 HydrophobicContact CD1-CD1 3.93Å
11	P	54.9	Low	57.1	Low	84 Å²	84	115 Å²	115	55%	0.545	61%	0.606	S	S	.	*			trans	-87.2	157.6	-173	32.1	-30.2	0	0	0	114.5	F102	P11-F102 HydrophobicContact CG-CE2 3.99Å; P11-F102 HydrophobicContact CG-CZ 3.91Å; P11-F102 WeakPolarHBondContact O-CD2 3.45Å; P11-F102 WeakPolarHBondContact O-CE2 3.19Å
12	D	49.8	Very low	59.9	Low	117 Å²	117	106.2 Å²	106.2	63%	0.626	56%	0.562	S	S	*	*			trans	74.4	139.1	168.3	-131.4	-9.2	0	0	0	121.9	A16	D12-A16 WeakPolarHBondContact O-CB 3.47Å
13	K	54.1	Low	62.7	Low	153 Å²	153	101.5 Å²	101.5	67%	0.665	52%	0.522	S	S	*	.	S	Bend	trans	-103.2	-11.8	-136.8	-91.2	177.6	179.3	173	0	117.4	K17	K13-K17 WeakPolarHBondContact O-CB 3.48Å; K13-K17 WeakPolarHBondContact O-CD 3.31Å; K13-K17 WeakPolarHBondContact O-CE 3.3Å; K13-K17 WeakPolarHBondContact O-CG 2.9Å; K13-K17 PolarHBondContact O-N 3.14Å
14	D	58.8	Low	65.6	Low	117 Å²	117	96.4 Å²	96.4	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-100	-47.3	-170.9	-72.2	-21	0	0	0	115.6	K17 G18	D14-K17 WeakPolarHBondContact O-CB 3.48Å; D14-K17 PolarHBondContact O-N 2.83Å; D14-K17 IonicContact OD1-NZ 2.73Å; D14-K17 PolarHBondContact OD1-NZ 3.32Å; D14-G18 PolarHBondContact O-N 3.39Å
15	A	60	Low	68.4	Low	7 Å²	7	89.9 Å²	89.9	6%	0.058	47%	0.468	C	S	.	.	H	α-helix	trans	-69.5	-38.2	169.4	0	0	0	0	0	112	K17 G18 F19 F97 E98 F104	A15-K17 VanDerWaalsContact C-N 3.31Å; A15-K17 PolarHBondContact O-N 3.37Å; A15-G18 PolarHBondContact O-N 2.89Å; A15-F19 PolarHBondContact O-N 2.59Å; A15-F97 HydrophobicContact CB-CB 4.37Å; A15-E98 VanDerWaalsContact CB-C 3.47Å; A15-F104 HydrophobicContact CB-CD2 4.28Å; A15-F104 HydrophobicContact CB-CE2 4.23Å
16	A	72.3	Confident	71.2	Confident	13 Å²	13	83.2 Å²	83.2	11%	0.107	44%	0.436	C	S	.	.	H	α-helix	trans	-51.8	-51	168.1	0	0	0	0	0	110.3	D12 G18 F19 Y20	D12-A16 WeakPolarHBondContact O-CB 3.47Å; A16-G18 VanDerWaalsContact C-N 3.31Å; A16-G18 PolarHBondContact O-N 2.66Å; A16-F19 PolarHBondContact O-N 3.33Å; A16-Y20 VanDerWaalsContact C-CD2 3.44Å; A16-Y20 HydrophobicContact CB-CD2 3.78Å; A16-Y20 HydrophobicContact CB-CE2 3.68Å; A16-Y20 WeakPolarHBondContact O-CB 3.33Å; A16-Y20 WeakPolarHBondContact O-CD2 3.38Å; A16-Y20 PolarHBondContact O-N 3.13Å
17	K	80.3	Confident	74	Confident	117 Å²	117	78.6 Å²	78.6	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-54.8	-45.3	177.7	-91	167.7	-150.4	159.5	0	112.3	K13 D14 A15 A21	K13-K17 WeakPolarHBondContact O-CB 3.48Å; K13-K17 WeakPolarHBondContact O-CD 3.31Å; K13-K17 WeakPolarHBondContact O-CE 3.3Å; K13-K17 WeakPolarHBondContact O-CG 2.9Å; K13-K17 PolarHBondContact O-N 3.14Å; D14-K17 WeakPolarHBondContact O-CB 3.48Å; D14-K17 PolarHBondContact O-N 2.83Å; D14-K17 IonicContact OD1-NZ 2.73Å; D14-K17 PolarHBondContact OD1-NZ 3.32Å; A15-K17 VanDerWaalsContact C-N 3.31Å; A15-K17 PolarHBondContact O-N 3.37Å; K17-A21 WeakPolarHBondContact O-CB 3.46Å; K17-A21 PolarHBondContact O-N 3.43Å
18	G	87.9	Confident	76.7	Confident	28 Å²	28	73.7 Å²	73.7	29%	0.289	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-50	177.9	0	0	0	0	0	112.4	D14 A15 A16 A21 K22	D14-G18 PolarHBondContact O-N 3.39Å; A15-G18 PolarHBondContact O-N 2.89Å; A16-G18 VanDerWaalsContact C-N 3.31Å; A16-G18 PolarHBondContact O-N 2.66Å; G18-A21 PolarHBondContact O-N 2.66Å; G18-K22 PolarHBondContact O-N 2.85Å
19	F	92.9	Very high	78.9	Confident	1 Å²	1	72.5 Å²	72.5	0%	0.004	38%	0.381	C	S	.	.	H	α-helix	trans	-61	-53.8	176.4	173.4	-98.9	0	0	0	111.8	A15 A16 A21 K22 Y23 P25 C40 A51 F97 F104 V106	A15-F19 PolarHBondContact O-N 2.59Å; A16-F19 PolarHBondContact O-N 3.33Å; F19-A21 PolarHBondContact O-N 2.83Å; F19-K22 PolarHBondContact O-N 2.65Å; F19-K22 VanDerWaalsContact O-N 3.13Å; F19-Y23 HydrophobicContact CD2-CD2 4.01Å; F19-Y23 HydrophobicContact CD2-CG 4.35Å; F19-Y23 HydrophobicContact CE2-CD2 4.12Å; F19-Y23 HydrophobicContact CE2-CG 4.04Å; F19-Y23 PolarHBondContact O-N 2.88Å; F19-P25 HydrophobicContact CE1-CB 4.15Å; F19-P25 HydrophobicContact CE1-CG 4.15Å; F19-P25 HydrophobicContact CZ-CB 4.45Å; F19-C40 HydrophobicContact CZ-CB 4.01Å; F19-A51 HydrophobicContact CE2-CB 3.64Å; F19-A51 HydrophobicContact CZ-CB 3.76Å; F19-F97 HydrophobicContact CB-CD2 3.96Å; F19-F97 HydrophobicContact CB-CE2 4.32Å; F19-F97 HydrophobicContact CB-CG 4.12Å; F19-F97 HydrophobicContact CD2-CD2 4.09Å; F19-F97 HydrophobicContact CD2-CE2 4.09Å; F19-F104 HydrophobicContact CB-CD1 4.18Å; F19-F104 HydrophobicContact CB-CG 4.28Å; F19-F104 HydrophobicContact CD1-CD1 4.03Å; F19-F104 HydrophobicContact CD1-CE1 4.11Å; F19-F104 HydrophobicContact CD2-CB 4.35Å; F19-F104 HydrophobicContact CD2-CD1 4.11Å; F19-F104 HydrophobicContact CD2-CG 4.5Å; F19-F104 HydrophobicContact CE1-CD1 4.48Å; F19-F104 AromaticContact CG-CD1 3.82Å; F19-F104 HydrophobicContact CG-CD1 3.82Å; F19-F104 HydrophobicContact CG-CE1 4.29Å; F19-F104 HydrophobicContact CG-CG 4.32Å; F19-V106 HydrophobicContact CD2-CG2 4.16Å; F19-V106 HydrophobicContact CE2-CG2 4.05Å
20	Y	91.8	Very high	80.9	Confident	81 Å²	81	65.8 Å²	65.8	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-20.6	-179	-69.8	-71.3	0	0	0	113.1	A16 P25 K43	A16-Y20 VanDerWaalsContact C-CD2 3.44Å; A16-Y20 HydrophobicContact CB-CD2 3.78Å; A16-Y20 HydrophobicContact CB-CE2 3.68Å; A16-Y20 WeakPolarHBondContact O-CB 3.33Å; A16-Y20 WeakPolarHBondContact O-CD2 3.38Å; A16-Y20 PolarHBondContact O-N 3.13Å; Y20-P25 HydrophobicContact CD1-CG 3.95Å; Y20-P25 HydrophobicContact CE1-CG 3.47Å; Y20-P25 VanDerWaalsContact CE1-CG 3.47Å; Y20-K43 WeakPolarHBondContact O-CE 3.48Å; Y20-K43 PolarHBondContact O-NZ 2.72Å
21	A	93.6	Very high	82.6	Confident	74 Å²	74	71.4 Å²	71.4	61%	0.612	37%	0.369	S	S	*	.	H	α-helix	trans	-70.3	-39.2	173	0	0	0	0	0	111.5	K17 G18 F19	K17-A21 WeakPolarHBondContact O-CB 3.46Å; K17-A21 PolarHBondContact O-N 3.43Å; G18-A21 PolarHBondContact O-N 2.66Å; F19-A21 PolarHBondContact O-N 2.83Å
22	K	96.3	Very high	83.6	Confident	68 Å²	68	69.6 Å²	69.6	30%	0.296	37%	0.366	S	S	.	.	H	α-helix	trans	-96.4	-34.3	-175.6	-172.4	172.4	177.9	-169.7	0	113.8	G18 F19 E42 K43 D95	G18-K22 PolarHBondContact O-N 2.85Å; F19-K22 PolarHBondContact O-N 2.65Å; F19-K22 VanDerWaalsContact O-N 3.13Å; K22-E42 WeakPolarHBondContact CE-OE1 3.22Å; K22-E42 HydrophobicContact CG-CG 4.49Å; K22-E42 IonicContact NZ-OE1 3.77Å; K22-E42 PolarHBondContact NZ-OE1 3.43Å; K22-K43 WeakPolarHBondContact O-CB 3.31Å; K22-K43 WeakPolarHBondContact O-CG 3.4Å; K22-K43 PolarHBondContact O-N 3.27Å; K22-D95 WeakPolarHBondContact CD-OD2 3.48Å; K22-D95 WeakPolarHBondContact CE-OD2 3.37Å; K22-D95 IonicContact NZ-OD1 3.33Å; K22-D95 IonicContact NZ-OD2 2.66Å; K22-D95 PolarHBondContact NZ-OD2 3.25Å
23	Y	97.4	Very high	84.7	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.2	-173.3	-65.8	-82.7	0	0	0	112.1	F19 I41 E42 F49 D95 F97 V106	F19-Y23 HydrophobicContact CD2-CD2 4.01Å; F19-Y23 HydrophobicContact CD2-CG 4.35Å; F19-Y23 HydrophobicContact CE2-CD2 4.12Å; F19-Y23 HydrophobicContact CE2-CG 4.04Å; F19-Y23 PolarHBondContact O-N 2.88Å; Y23-I41 CarbonylContact C-O 3.52Å; Y23-I41 WeakPolarHBondContact CA-O 3.34Å; Y23-E42 HydrophobicContact CD1-CB 4Å; Y23-E42 HydrophobicContact CE1-CB 3.65Å; Y23-E42 HydrophobicContact CE1-CG 4.12Å; Y23-F49 HydrophobicContact CD1-CD2 4.4Å; Y23-F49 AromaticContact CE1-CD2 3.69Å; Y23-F49 HydrophobicContact CE1-CD2 3.69Å; Y23-F49 HydrophobicContact CE1-CE2 4.05Å; Y23-F49 HydrophobicContact CE1-CG 4.22Å; Y23-D95 HydrophobicContact CE2-CB 4.36Å; Y23-D95 WeakPolarHBondContact CE2-OD2 3.45Å; Y23-D95 PolarHBondContact OH-OD2 2.81Å; Y23-F97 HydrophobicContact CD2-CE2 4.08Å; Y23-F97 HydrophobicContact CD2-CZ 4.23Å; Y23-F97 AromaticContact CE2-CE2 3.94Å; Y23-F97 HydrophobicContact CE2-CE2 3.94Å; Y23-F97 HydrophobicContact CE2-CZ 4.03Å; Y23-V106 HydrophobicContact CD2-CG2 4.29Å; Y23-V106 HydrophobicContact CE1-CG1 3.92Å; Y23-V106 HydrophobicContact CE2-CG1 4.3Å; Y23-V106 HydrophobicContact CE2-CG2 4.02Å
24	E	96.3	Very high	86	Confident	88 Å²	88	66.6 Å²	66.6	41%	0.411	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.8	168.9	-167.8	-165.8	170.8	0	0	108.8	K26 C40 I41 K43	E24-K26 IonicContact OE1-NZ 3.68Å; E24-K26 PolarHBondContact OE1-NZ 2.86Å; E24-K26 WeakPolarHBondContact OE2-CE 3.41Å; E24-K26 IonicContact OE2-NZ 2.66Å; E24-K26 PolarHBondContact OE2-NZ 2.78Å; E24-C40 CarbonylContact O-C 3.47Å; E24-C40 VanDerWaalsContact O-CA 3.23Å; E24-C40 WeakPolarHBondContact O-CA 3.14Å; E24-I41 PolarHBondContact N-O 3.21Å; E24-I41 PolarHBondContact O-N 3.17Å; E24-K43 HydrophobicContact CB-CG 4.4Å
25	P	95.3	Very high	87.3	Confident	30 Å²	30	62.2 Å²	62.2	20%	0.195	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	150.9	177.1	26	-27.5	0	0	0	111.7	F19 Y20	F19-P25 HydrophobicContact CE1-CB 4.15Å; F19-P25 HydrophobicContact CE1-CG 4.15Å; F19-P25 HydrophobicContact CZ-CB 4.45Å; Y20-P25 HydrophobicContact CD1-CG 3.95Å; Y20-P25 HydrophobicContact CE1-CG 3.47Å; Y20-P25 VanDerWaalsContact CE1-CG 3.47Å
26	K	96.3	Very high	88.9	Confident	55 Å²	55	63.7 Å²	63.7	24%	0.239	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	-144.3	-178.8	-56.6	-66.1	-177.7	-178.1	0	109.4	E24 R38 R39 I41	E24-K26 IonicContact OE1-NZ 3.68Å; E24-K26 PolarHBondContact OE1-NZ 2.86Å; E24-K26 WeakPolarHBondContact OE2-CE 3.41Å; E24-K26 IonicContact OE2-NZ 2.66Å; E24-K26 PolarHBondContact OE2-NZ 2.78Å; K26-R38 PolarHBondContact O-NE 2.82Å; K26-R38 PolarHBondContact O-NH2 2.8Å; K26-R39 WeakPolarHBondContact CA-O 3.42Å; K26-R39 HydrophobicContact CB-CB 4.27Å; K26-R39 WeakPolarHBondContact CB-O 3.36Å; K26-R39 PolarHBondContact N-O 2.77Å; K26-I41 HydrophobicContact CD-CD1 4.46Å; K26-I41 VanDerWaalsContact CE-CD1 3.43Å; K26-I41 HydrophobicContact CG-CD1 4.34Å; K26-I41 HydrophobicContact CG-CG1 4.15Å
27	E	95.5	Very high	90	Very high	94 Å²	94	65 Å²	65	44%	0.439	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	157.1	-179.3	71.1	-80.1	-175.3	0	0	113.3	R38 R39	E27-R38 WeakPolarHBondContact O-CA 3.43Å; E27-R39 VanDerWaalsContact CD-NE 3.32Å; E27-R39 PolarHBondContact O-N 3.25Å; E27-R39 IonicContact OE1-CZ 2.72Å; E27-R39 IonicContact OE1-NE 3.26Å; E27-R39 PolarHBondContact OE1-NE 3.4Å; E27-R39 IonicContact OE1-NH2 2.65Å; E27-R39 PolarHBondContact OE1-NH2 3.22Å; E27-R39 IonicContact OE2-CZ 2.96Å; E27-R39 IonicContact OE2-NE 3.2Å; E27-R39 PolarHBondContact OE2-NE 2.85Å; E27-R39 IonicContact OE2-NH2 3.71Å; E27-R39 PolarHBondContact OE2-NH2 2.98Å
28	I	95.2	Very high	90.7	Very high	63 Å²	63	60.9 Å²	60.9	32%	0.323	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	127.7	173.1	-65	169.1	0	0	0	108.5	G30 R31 T36 R38	I28-G30 WeakPolarHBondContact CG2-O 3.47Å; I28-R31 VanDerWaalsContact CD1-NH2 3.25Å; I28-R31 HydrophobicContact CG2-CG 3.9Å; I28-T36 HydrophobicContact CD1-CG2 4.22Å; I28-T36 HydrophobicContact CG1-CG2 4.07Å; I28-T36 HydrophobicContact CG2-CG2 3.93Å; I28-R38 HydrophobicContact CG1-CG 3.88Å
29	L	91.7	Very high	91.2	Very high	88 Å²	88	61.4 Å²	61.4	46%	0.461	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-32.4	175	-59.9	177.8	0	0	0	111.6	V37 R39 A50 L109	L29-V37 HydrophobicContact CB-CG1 4.31Å; L29-V37 HydrophobicContact CD1-CG1 4.44Å; L29-V37 PolarHBondContact N-O 3.07Å; L29-R39 HydrophobicContact CD1-CB 4.03Å; L29-R39 HydrophobicContact CD2-CB 4.13Å; L29-R39 HydrophobicContact CG-CB 4.11Å; L29-A50 HydrophobicContact CD1-CB 4.18Å; L29-L109 HydrophobicContact CD1-CD1 3.77Å
30	G	87.8	Confident	91.4	Very high	29 Å²	29	61.4 Å²	61.4	30%	0.299	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	158.3	179.8	0	0	0	0	0	113.1	I28 V37	I28-G30 WeakPolarHBondContact CG2-O 3.47Å; G30-V37 PolarHBondContact N-O 3.4Å; G30-V37 PolarHBondContact O-N 2.73Å
31	R	86.6	Confident	91.7	Very high	192 Å²	192	59 Å²	59	73%	0.725	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.5	175.2	-65.1	-173.3	-178.7	-156.4	0.6	109.6	I28 T36	I28-R31 VanDerWaalsContact CD1-NH2 3.25Å; I28-R31 HydrophobicContact CG2-CG 3.9Å; R31-T36 HydrophobicContact CG-CG2 4.31Å
32	G	76.1	Confident	91.9	Very high	47 Å²	47	56.5 Å²	56.5	49%	0.485	29%	0.294	S	S	.	.			trans	-104.6	-173.2	168.8	0	0	0	0	0	111.6	S35	G32-S35 WeakPolarHBondContact CA-O 3.29Å; G32-S35 PolarHBondContact N-O 3.04Å
33	I	73.6	Confident	92	Very high	166 Å²	166	59 Å²	59	85%	0.851	31%	0.305	S	S	*	.	S	Bend	trans	-65.4	-44.7	-177	-61.1	169.8	0	0	0	111.7
34	S	79.8	Confident	91.9	Very high	40 Å²	40	67.5 Å²	67.5	28%	0.28	35%	0.345	S	S	.	.	S	Bend	trans	-125.9	16.5	-179.4	59.4	0	0	0	0	112.9	D55	S34-D55 PolarHBondContact O-N 2.96Å
35	S	87.9	Confident	91.9	Very high	26 Å²	26	67.4 Å²	67.4	18%	0.182	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.8	179.3	63.3	0	0	0	0	113.2	G32 I53	G32-S35 WeakPolarHBondContact CA-O 3.29Å; G32-S35 PolarHBondContact N-O 3.04Å; S35-I53 CarbonylContact C-O 3.56Å; S35-I53 WeakPolarHBondContact CA-O 3.46Å; S35-I53 WeakPolarHBondContact CB-O 3.19Å
36	T	92.8	Very high	92	Very high	37 Å²	37	68.3 Å²	68.3	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.4	173	-64	0	0	0	0	109.1	I28 R31 R38 I53	I28-T36 HydrophobicContact CD1-CG2 4.22Å; I28-T36 HydrophobicContact CG1-CG2 4.07Å; I28-T36 HydrophobicContact CG2-CG2 3.93Å; R31-T36 HydrophobicContact CG-CG2 4.31Å; T36-R38 HydrophobicContact CG2-CG 4.18Å; T36-I53 PolarHBondContact N-O 2.92Å; T36-I53 PolarHBondContact O-N 3.05Å
37	V	94.9	Very high	92	Very high	42 Å²	42	71.4 Å²	71.4	26%	0.255	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.4	175.9	-174.2	0	0	0	0	108.9	L29 G30 A50 A51 K52	L29-V37 HydrophobicContact CB-CG1 4.31Å; L29-V37 HydrophobicContact CD1-CG1 4.44Å; L29-V37 PolarHBondContact N-O 3.07Å; G30-V37 PolarHBondContact N-O 3.4Å; G30-V37 PolarHBondContact O-N 2.73Å; V37-A50 HydrophobicContact CG1-CB 4.21Å; V37-A51 CarbonylContact C-O 3.5Å; V37-A51 WeakPolarHBondContact CA-O 3.34Å; V37-K52 HydrophobicContact CG2-CB 4.21Å; V37-K52 HydrophobicContact CG2-CG 4.19Å
38	R	96.1	Very high	92.1	Very high	30 Å²	30	71 Å²	71	11%	0.113	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.8	176.8	-64.5	-176.4	76.9	144.9	1.3	110.6	D8 K26 E27 I28 T36 A50 A51 I53	D8-R38 IonicContact OD1-CZ 3.47Å; D8-R38 IonicContact OD1-NH1 3.79Å; D8-R38 PolarHBondContact OD1-NH1 3.5Å; D8-R38 IonicContact OD1-NH2 2.73Å; K26-R38 PolarHBondContact O-NE 2.82Å; K26-R38 PolarHBondContact O-NH2 2.8Å; E27-R38 WeakPolarHBondContact O-CA 3.43Å; I28-R38 HydrophobicContact CG1-CG 3.88Å; T36-R38 HydrophobicContact CG2-CG 4.18Å; R38-A50 CarbonylContact O-C 3.59Å; R38-A50 WeakPolarHBondContact O-CA 3.33Å; R38-A51 PolarHBondContact N-O 2.72Å; R38-A51 PolarHBondContact O-N 3.3Å; R38-I53 HydrophobicContact CG-CD1 4.35Å
39	R	97.4	Very high	92.3	Very high	39 Å²	39	68.1 Å²	68.1	15%	0.147	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	142.4	162.5	-171.7	174.5	61.6	90.8	5.5	108.1	K26 E27 L29 E48 F49 L109	K26-R39 WeakPolarHBondContact CA-O 3.42Å; K26-R39 HydrophobicContact CB-CB 4.27Å; K26-R39 WeakPolarHBondContact CB-O 3.36Å; K26-R39 PolarHBondContact N-O 2.77Å; E27-R39 VanDerWaalsContact CD-NE 3.32Å; E27-R39 PolarHBondContact O-N 3.25Å; E27-R39 IonicContact OE1-CZ 2.72Å; E27-R39 IonicContact OE1-NE 3.26Å; E27-R39 PolarHBondContact OE1-NE 3.4Å; E27-R39 IonicContact OE1-NH2 2.65Å; E27-R39 PolarHBondContact OE1-NH2 3.22Å; E27-R39 IonicContact OE2-CZ 2.96Å; E27-R39 IonicContact OE2-NE 3.2Å; E27-R39 PolarHBondContact OE2-NE 2.85Å; E27-R39 IonicContact OE2-NH2 3.71Å; E27-R39 PolarHBondContact OE2-NH2 2.98Å; L29-R39 HydrophobicContact CD1-CB 4.03Å; L29-R39 HydrophobicContact CD2-CB 4.13Å; L29-R39 HydrophobicContact CG-CB 4.11Å; R39-E48 IonicContact CZ-OE1 3.56Å; R39-E48 IonicContact NH1-OE1 3.74Å; R39-E48 PolarHBondContact NH1-OE1 3.26Å; R39-F49 WeakPolarHBondContact CA-O 3.23Å; R39-L109 HydrophobicContact CG-CD2 4.22Å
40	C	97.8	Very high	92.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.5	171.6	63.7	0	0	0	0	111.2	F19 E24 E48 F49	F19-C40 HydrophobicContact CZ-CB 4.01Å; E24-C40 CarbonylContact O-C 3.47Å; E24-C40 VanDerWaalsContact O-CA 3.23Å; E24-C40 WeakPolarHBondContact O-CA 3.14Å; C40-E48 CarbonylContact O-C 3.6Å; C40-E48 WeakPolarHBondContact O-CA 3.02Å; C40-F49 PolarHBondContact N-O 2.97Å; C40-F49 PolarHBondContact O-N 3.3Å
41	I	97.9	Very high	93	Very high	32 Å²	32	63.1 Å²	63.1	16%	0.164	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.7	179.3	-54.7	-173.6	0	0	0	108.4	Y23 E24 K26 K43 K47 E48	Y23-I41 CarbonylContact C-O 3.52Å; Y23-I41 WeakPolarHBondContact CA-O 3.34Å; E24-I41 PolarHBondContact N-O 3.21Å; E24-I41 PolarHBondContact O-N 3.17Å; K26-I41 HydrophobicContact CD-CD1 4.46Å; K26-I41 VanDerWaalsContact CE-CD1 3.43Å; K26-I41 HydrophobicContact CG-CD1 4.34Å; K26-I41 HydrophobicContact CG-CG1 4.15Å; I41-K43 PolarHBondContact O-N 3.29Å; I41-K47 WeakPolarHBondContact CA-O 3.02Å; I41-E48 HydrophobicContact CG1-CG 4.38Å
42	E	97.9	Very high	93.4	Very high	20 Å²	20	55.4 Å²	55.4	9%	0.093	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	122.7	171.5	-176.4	174.6	-131.5	0	0	109.7	K22 Y23 E44 T45 G46 K47 F49	K22-E42 WeakPolarHBondContact CE-OE1 3.22Å; K22-E42 HydrophobicContact CG-CG 4.49Å; K22-E42 IonicContact NZ-OE1 3.77Å; K22-E42 PolarHBondContact NZ-OE1 3.43Å; Y23-E42 HydrophobicContact CD1-CB 4Å; Y23-E42 HydrophobicContact CE1-CB 3.65Å; Y23-E42 HydrophobicContact CE1-CG 4.12Å; E42-E44 VanDerWaalsContact C-N 3.31Å; E42-E44 PolarHBondContact O-N 3.07Å; E42-T45 PolarHBondContact O-N 3.02Å; E42-T45 WeakPolarHBondContact OE2-CB 2.89Å; E42-T45 WeakPolarHBondContact OE2-CG2 3.18Å; E42-T45 PolarHBondContact OE2-OG1 2.9Å; E42-G46 VanDerWaalsContact O-CA 3.3Å; E42-G46 WeakPolarHBondContact O-CA 3.45Å; E42-G46 PolarHBondContact O-N 2.92Å; E42-K47 PolarHBondContact N-O 3.09Å; E42-F49 HydrophobicContact CB-CD2 4.18Å; E42-F49 HydrophobicContact CB-CE2 3.76Å
43	K	97.1	Very high	94.3	Very high	121 Å²	121	53.5 Å²	53.5	53%	0.526	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-31.6	-170.7	-69.7	177.2	175.5	-179.9	0	113.8	Y20 K22 E24 I41	Y20-K43 WeakPolarHBondContact O-CE 3.48Å; Y20-K43 PolarHBondContact O-NZ 2.72Å; K22-K43 WeakPolarHBondContact O-CB 3.31Å; K22-K43 WeakPolarHBondContact O-CG 3.4Å; K22-K43 PolarHBondContact O-N 3.27Å; E24-K43 HydrophobicContact CB-CG 4.4Å; I41-K43 PolarHBondContact O-N 3.29Å
44	E	96.2	Very high	95.1	Very high	178 Å²	178	46 Å²	46	83%	0.832	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-42	-177.6	-173.9	175.7	179.5	0	0	112.2	E42	E42-E44 VanDerWaalsContact C-N 3.31Å; E42-E44 PolarHBondContact O-N 3.07Å
45	T	96.9	Very high	95.5	Very high	86 Å²	86	46.7 Å²	46.7	53%	0.528	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-19.2	-172.1	67.9	0	0	0	0	113.6	E42 K47	E42-T45 PolarHBondContact O-N 3.02Å; E42-T45 WeakPolarHBondContact OE2-CB 2.89Å; E42-T45 WeakPolarHBondContact OE2-CG2 3.18Å; E42-T45 PolarHBondContact OE2-OG1 2.9Å; T45-K47 PolarHBondContact O-N 3.17Å; T45-K47 VanDerWaalsContact OG1-CB 3.31Å; T45-K47 WeakPolarHBondContact OG1-CB 3.13Å; T45-K47 PolarHBondContact OG1-N 3.04Å; T45-K47 VanDerWaalsContact OG1-N 3.14Å
46	G	96.5	Very high	95.2	Very high	49 Å²	49	45.7 Å²	45.7	51%	0.505	24%	0.236	S	C	.	.			trans	71.9	6.8	-170.2	0	0	0	0	0	114.1	E42	E42-G46 VanDerWaalsContact O-CA 3.3Å; E42-G46 WeakPolarHBondContact O-CA 3.45Å; E42-G46 PolarHBondContact O-N 2.92Å
47	K	97.2	Very high	94.2	Very high	120 Å²	120	46.5 Å²	46.5	52%	0.522	25%	0.251	S	S	.	.			trans	-74.1	140.5	-179.7	-174.6	175.6	173.9	-171.1	0	111.1	I41 E42 T45 F49	I41-K47 WeakPolarHBondContact CA-O 3.02Å; E42-K47 PolarHBondContact N-O 3.09Å; T45-K47 PolarHBondContact O-N 3.17Å; T45-K47 VanDerWaalsContact OG1-CB 3.31Å; T45-K47 WeakPolarHBondContact OG1-CB 3.13Å; T45-K47 PolarHBondContact OG1-N 3.04Å; T45-K47 VanDerWaalsContact OG1-N 3.14Å; K47-F49 HydrophobicContact CB-CE2 3.79Å; K47-F49 HydrophobicContact CB-CZ 4.31Å; K47-F49 HydrophobicContact CD-CE1 4.42Å; K47-F49 HydrophobicContact CD-CE2 4.03Å; K47-F49 HydrophobicContact CD-CZ 3.68Å; K47-F49 HydrophobicContact CG-CD2 4.47Å; K47-F49 HydrophobicContact CG-CE2 3.77Å; K47-F49 HydrophobicContact CG-CZ 3.94Å; K47-F49 VanDerWaalsContact O-CD2 3.29Å; K47-F49 WeakPolarHBondContact O-CD2 3.38Å
48	E	97.8	Very high	92.7	Very high	86 Å²	86	45.9 Å²	45.9	40%	0.402	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	145.2	179.8	-52.7	-164.9	140.5	0	0	112.7	R39 C40 I41 L109	R39-E48 IonicContact CZ-OE1 3.56Å; R39-E48 IonicContact NH1-OE1 3.74Å; R39-E48 PolarHBondContact NH1-OE1 3.26Å; C40-E48 CarbonylContact O-C 3.6Å; C40-E48 WeakPolarHBondContact O-CA 3.02Å; I41-E48 HydrophobicContact CG1-CG 4.38Å; E48-L109 HydrophobicContact CB-CD2 3.75Å; E48-L109 WeakPolarHBondContact OE2-CD2 3.26Å
49	F	98.2	Very high	90.7	Very high	3 Å²	3	50 Å²	50	1%	0.013	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	172.2	-177.7	-65.9	-87.8	0	0	0	110.6	Y23 R39 C40 E42 K47 Q94 V106 F107	Y23-F49 HydrophobicContact CD1-CD2 4.4Å; Y23-F49 AromaticContact CE1-CD2 3.69Å; Y23-F49 HydrophobicContact CE1-CD2 3.69Å; Y23-F49 HydrophobicContact CE1-CE2 4.05Å; Y23-F49 HydrophobicContact CE1-CG 4.22Å; R39-F49 WeakPolarHBondContact CA-O 3.23Å; C40-F49 PolarHBondContact N-O 2.97Å; C40-F49 PolarHBondContact O-N 3.3Å; E42-F49 HydrophobicContact CB-CD2 4.18Å; E42-F49 HydrophobicContact CB-CE2 3.76Å; K47-F49 HydrophobicContact CB-CE2 3.79Å; K47-F49 HydrophobicContact CB-CZ 4.31Å; K47-F49 HydrophobicContact CD-CE1 4.42Å; K47-F49 HydrophobicContact CD-CE2 4.03Å; K47-F49 HydrophobicContact CD-CZ 3.68Å; K47-F49 HydrophobicContact CG-CD2 4.47Å; K47-F49 HydrophobicContact CG-CE2 3.77Å; K47-F49 HydrophobicContact CG-CZ 3.94Å; K47-F49 VanDerWaalsContact O-CD2 3.29Å; K47-F49 WeakPolarHBondContact O-CD2 3.38Å; F49-Q94 HydrophobicContact CD1-CB 4.25Å; F49-Q94 HydrophobicContact CD1-CG 4.36Å; F49-Q94 HydrophobicContact CE1-CB 3.98Å; F49-Q94 HydrophobicContact CE1-CG 3.75Å; F49-Q94 HydrophobicContact CZ-CG 4.15Å; F49-V106 HydrophobicContact CB-CG1 3.68Å; F49-V106 HydrophobicContact CD1-CG1 4.11Å; F49-V106 HydrophobicContact CG-CG1 3.97Å; F49-F107 WeakPolarHBondContact CA-O 3.38Å; F49-F107 WeakPolarHBondContact CB-O 3.45Å; F49-F107 WeakPolarHBondContact CD1-O 3.23Å
50	A	97.9	Very high	88.6	Confident	12 Å²	12	49.8 Å²	49.8	10%	0.099	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.7	171	0	0	0	0	0	110.2	L29 V37 R38 F107 L109	L29-A50 HydrophobicContact CD1-CB 4.18Å; V37-A50 HydrophobicContact CG1-CB 4.21Å; R38-A50 CarbonylContact O-C 3.59Å; R38-A50 WeakPolarHBondContact O-CA 3.33Å; A50-F107 PolarHBondContact N-O 3.44Å; A50-F107 PolarHBondContact O-N 3.16Å; A50-L109 HydrophobicContact CB-CD1 4.13Å
51	A	97.1	Very high	86.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.7	176.7	0	0	0	0	0	110.4	F19 V37 R38 L105	F19-A51 HydrophobicContact CE2-CB 3.64Å; F19-A51 HydrophobicContact CZ-CB 3.76Å; V37-A51 CarbonylContact C-O 3.5Å; V37-A51 WeakPolarHBondContact CA-O 3.34Å; R38-A51 PolarHBondContact N-O 2.72Å; R38-A51 PolarHBondContact O-N 3.3Å; A51-L105 CarbonylContact C-O 3.58Å; A51-L105 WeakPolarHBondContact CA-O 3.49Å
52	K	95.2	Very high	83.8	Confident	30 Å²	30	62.7 Å²	62.7	13%	0.13	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.7	168.3	-176.7	180	179.5	-175.8	0	107.9	V37 I54 E77 F104 L105 F107 D171	V37-K52 HydrophobicContact CG2-CB 4.21Å; V37-K52 HydrophobicContact CG2-CG 4.19Å; K52-I54 HydrophobicContact CG-CG1 4.27Å; K52-E77 IonicContact NZ-OE1 3.04Å; K52-E77 PolarHBondContact NZ-OE1 3.48Å; K52-E77 IonicContact NZ-OE2 3.4Å; K52-F104 WeakPolarHBondContact O-CA 3.49Å; K52-L105 HydrophobicContact CB-CB 4.34Å; K52-L105 PolarHBondContact N-O 2.7Å; K52-L105 PolarHBondContact O-N 3.42Å; K52-F107 HydrophobicContact CB-CD2 4.35Å; K52-F107 HydrophobicContact CB-CE2 3.97Å; K52-F107 HydrophobicContact CD-CE2 4.28Å; K52-D171 IonicContact NZ-OD1 3.7Å; K52-D171 PolarHBondContact NZ-OD1 3.19Å
53	I	93.3	Very high	81.4	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.036	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.5	-179.5	-49.5	173.9	0	0	0	107	L10 S35 T36 R38 F102 F104	L10-I53 HydrophobicContact CD1-CD1 3.93Å; S35-I53 CarbonylContact C-O 3.56Å; S35-I53 WeakPolarHBondContact CA-O 3.46Å; S35-I53 WeakPolarHBondContact CB-O 3.19Å; T36-I53 PolarHBondContact N-O 2.92Å; T36-I53 PolarHBondContact O-N 3.05Å; R38-I53 HydrophobicContact CG-CD1 4.35Å; I53-F102 HydrophobicContact CG2-CD1 4.14Å; I53-F104 HydrophobicContact CB-CD1 4.4Å; I53-F104 HydrophobicContact CB-CE1 4.4Å; I53-F104 HydrophobicContact CD1-CD1 4.26Å; I53-F104 HydrophobicContact CD1-CE1 3.95Å; I53-F104 HydrophobicContact CG1-CD1 3.75Å; I53-F104 HydrophobicContact CG1-CE1 3.86Å; I53-F104 HydrophobicContact CG2-CD1 4.12Å; I53-F104 HydrophobicContact CG2-CE1 3.76Å; I53-F104 HydrophobicContact CG2-CZ 4.03Å
54	I	90.8	Very high	79	Confident	8 Å²	8	67.3 Å²	67.3	4%	0.041	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127	-178.9	-58.3	167.8	0	0	0	107.9	K52 M70 T74 F102 V103 L105	K52-I54 HydrophobicContact CG-CG1 4.27Å; I54-M70 HydrophobicContact CG2-SD 4.22Å; I54-T74 HydrophobicContact CD1-CG2 3.71Å; I54-F102 VanDerWaalsContact O-CA 3.26Å; I54-F102 WeakPolarHBondContact O-CA 3.36Å; I54-V103 HydrophobicContact CB-CB 4.34Å; I54-V103 PolarHBondContact N-O 3.29Å; I54-V103 PolarHBondContact O-N 2.67Å; I54-L105 HydrophobicContact CD1-CD1 4Å; I54-L105 HydrophobicContact CD1-CG 4.46Å
55	D	88.3	Confident	77.1	Confident	54 Å²	54	60.9 Å²	60.9	29%	0.289	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113.6	175.9	-172.8	-20.1	0	0	0	109.8	S34 G57 A58 F102	S34-D55 PolarHBondContact O-N 2.96Å; D55-G57 VanDerWaalsContact C-N 3.34Å; D55-G57 WeakPolarHBondContact OD1-CA 3.39Å; D55-G57 PolarHBondContact OD1-N 2.65Å; D55-A58 HydrophobicContact CB-CB 4Å; D55-A58 PolarHBondContact OD1-N 2.73Å; D55-F102 HydrophobicContact CB-CD1 4.07Å; D55-F102 HydrophobicContact CB-CE1 3.67Å
56	L	82.6	Confident	75.4	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.031	36%	0.364	C	S	.	.	S	Bend	trans	-78.9	-18.7	-179.7	-60.1	174.9	0	0	0	112.8	P67 M70 L71 A101 V103	L56-P67 WeakPolarHBondContact O-CB 3.41Å; L56-M70 HydrophobicContact CD2-CB 4.42Å; L56-M70 HydrophobicContact CD2-CG 4.17Å; L56-M70 HydrophobicContact CD2-SD 4.37Å; L56-L71 HydrophobicContact CD1-CD1 3.94Å; L56-L71 HydrophobicContact CD2-CB 4.25Å; L56-L71 HydrophobicContact CD2-CD1 4.37Å; L56-A101 WeakPolarHBondContact CB-O 3.47Å; L56-A101 PolarHBondContact N-O 2.98Å; L56-V103 HydrophobicContact CD1-CG2 3.97Å; L56-V103 HydrophobicContact CD2-CG2 4.13Å; L56-V103 HydrophobicContact CG-CG2 4.22Å
57	G	71.2	Confident	74	Confident	53 Å²	53	62.3 Å²	62.3	55%	0.546	36%	0.361	S	S	.	.	S	Bend	trans	-91.5	-10.8	179.2	0	0	0	0	0	113.9	D55 T59	D55-G57 VanDerWaalsContact C-N 3.34Å; D55-G57 WeakPolarHBondContact OD1-CA 3.39Å; D55-G57 PolarHBondContact OD1-N 2.65Å; G57-T59 PolarHBondContact O-N 2.69Å; G57-T59 VanDerWaalsContact O-N 3.13Å
58	A	63.5	Low	72.7	Confident	29 Å²	29	64.8 Å²	64.8	24%	0.24	37%	0.368	C	S	.	.			trans	-63.9	112.1	-179.4	0	0	0	0	0	111.7	D55 T60	D55-A58 HydrophobicContact CB-CB 4Å; D55-A58 PolarHBondContact OD1-N 2.73Å; A58-T60 PolarHBondContact O-N 3.4Å
59	T	53.2	Low	71.7	Confident	117 Å²	117	66.9 Å²	66.9	72%	0.718	38%	0.378	S	S	*	.			trans	-67.3	122.1	168.7	16.5	0	0	0	0	109.8	G57	G57-T59 PolarHBondContact O-N 2.69Å; G57-T59 VanDerWaalsContact O-N 3.13Å
60	T	53.5	Low	70.7	Confident	35 Å²	35	68 Å²	68	22%	0.215	38%	0.383	C	S	.	.			trans	-66	154	167.6	60.5	0	0	0	0	110	A58 S62 G63 T65	A58-T60 PolarHBondContact O-N 3.4Å; T60-S62 PolarHBondContact O-N 2.96Å; T60-S62 PolarHBondContact OG1-OG 2.97Å; T60-G63 PolarHBondContact O-N 3.09Å; T60-T65 WeakPolarHBondContact CG2-OG1 3.26Å; T60-T65 PolarHBondContact OG1-OG1 3.49Å
61	E	47.2	Very low	70.1	Confident	212 Å²	212	68.9 Å²	68.9	99%	0.991	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-19.7	177	-66.1	-176.3	168	0	0	113.4
62	S	48.5	Very low	69.6	Low	91 Å²	91	75 Å²	75	64%	0.636	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.5	177.5	20.6	0	0	0	0	115.5	T60 E64	T60-S62 PolarHBondContact O-N 2.96Å; T60-S62 PolarHBondContact OG1-OG 2.97Å; S62-E64 PolarHBondContact O-N 2.79Å
63	G	46.8	Very low	69.2	Low	60 Å²	60	75.6 Å²	75.6	62%	0.619	43%	0.426	S	S	*	.	S	Bend	trans	67.3	1	173.1	0	0	0	0	0	116.5	T60	T60-G63 PolarHBondContact O-N 3.09Å
64	E	47.7	Very low	69	Low	178 Å²	178	75.6 Å²	75.6	83%	0.832	43%	0.426	S	S	*	.			trans	-122.6	58.2	-173.2	-69.7	-174.5	169.3	0	0	112	S62	S62-E64 PolarHBondContact O-N 2.79Å
65	T	55.9	Low	69	Low	43 Å²	43	81.3 Å²	81.3	26%	0.264	45%	0.447	S	S	.	.			trans	-123.9	108.2	170.7	-35.1	0	0	0	0	110	T60 P67 M70	T60-T65 WeakPolarHBondContact CG2-OG1 3.26Å; T60-T65 PolarHBondContact OG1-OG1 3.49Å; T65-P67 WeakPolarHBondContact O-CD 3.47Å; T65-M70 HydrophobicContact CG2-CE 4.15Å
66	N	61.3	Low	69.3	Low	96 Å²	96	83 Å²	83	51%	0.513	45%	0.453	S	S	.	.			trans	-70.6	117.6	168.6	-176.3	-10.7	0	0	0	107.7	Y68 H69	N66-Y68 PolarHBondContact O-N 2.77Å; N66-Y68 WeakPolarHBondContact OD1-CB 3.46Å; N66-Y68 VanDerWaalsContact OD1-CD2 3.25Å; N66-Y68 WeakPolarHBondContact OD1-CD2 3.28Å; N66-Y68 PolarHBondContact OD1-N 2.94Å; N66-H69 WeakPolarHBondContact O-CB 3.07Å; N66-H69 PolarHBondContact O-N 2.89Å
67	P	66.4	Low	69.8	Low	68 Å²	68	83.2 Å²	83.2	44%	0.442	45%	0.454	S	S	.	.	H	α-helix	trans	-49.2	-31.9	179.7	-30.7	36.9	0	0	0	113.8	L56 T65 H69 M70 L71	L56-P67 WeakPolarHBondContact O-CB 3.41Å; T65-P67 WeakPolarHBondContact O-CD 3.47Å; P67-H69 VanDerWaalsContact C-N 3.33Å; P67-H69 PolarHBondContact O-N 3.46Å; P67-M70 PolarHBondContact O-N 2.77Å; P67-L71 PolarHBondContact O-N 2.77Å; P67-L71 VanDerWaalsContact O-N 3.1Å
68	Y	70	Confident	71	Confident	172 Å²	172	81.1 Å²	81.1	68%	0.675	43%	0.43	S	S	*	.	H	α-helix	trans	-58.7	-40.1	175.5	-75.3	-85.3	0	0	0	113.2	N66 L71 E72	N66-Y68 PolarHBondContact O-N 2.77Å; N66-Y68 WeakPolarHBondContact OD1-CB 3.46Å; N66-Y68 VanDerWaalsContact OD1-CD2 3.25Å; N66-Y68 WeakPolarHBondContact OD1-CD2 3.28Å; N66-Y68 PolarHBondContact OD1-N 2.94Å; Y68-L71 PolarHBondContact O-N 2.91Å; Y68-E72 WeakPolarHBondContact O-CG 3.48Å; Y68-E72 PolarHBondContact O-N 2.88Å
69	H	76.3	Confident	72.6	Confident	131 Å²	131	82.7 Å²	82.7	61%	0.606	44%	0.439	S	S	*	.	H	α-helix	trans	-70.8	-34.7	-178.7	-169.7	-88.1	0	0	0	112.1	N66 P67 A73	N66-H69 WeakPolarHBondContact O-CB 3.07Å; N66-H69 PolarHBondContact O-N 2.89Å; P67-H69 VanDerWaalsContact C-N 3.33Å; P67-H69 PolarHBondContact O-N 3.46Å; H69-A73 WeakPolarHBondContact O-CB 3.49Å; H69-A73 PolarHBondContact O-N 2.78Å
70	M	79	Confident	74.7	Confident	26 Å²	26	77.3 Å²	77.3	13%	0.128	41%	0.406	C	S	.	.	H	α-helix	trans	-69.8	-39.5	176.1	-169.8	179.1	-64.1	0	0	111.5	I54 L56 T65 P67 A73 T74	I54-M70 HydrophobicContact CG2-SD 4.22Å; L56-M70 HydrophobicContact CD2-CB 4.42Å; L56-M70 HydrophobicContact CD2-CG 4.17Å; L56-M70 HydrophobicContact CD2-SD 4.37Å; T65-M70 HydrophobicContact CG2-CE 4.15Å; P67-M70 PolarHBondContact O-N 2.77Å; M70-A73 PolarHBondContact O-N 2.89Å; M70-T74 WeakPolarHBondContact O-CB 3.38Å; M70-T74 PolarHBondContact O-N 2.83Å; M70-T74 PolarHBondContact O-OG1 3.32Å
71	L	83.8	Confident	76.8	Confident	31 Å²	31	75.8 Å²	75.8	16%	0.162	40%	0.396	C	S	.	.	H	α-helix	trans	-63.6	-44.5	175.4	-178.3	60.7	0	0	0	111.7	L56 P67 Y68 T74 R75 E98 V103	L56-L71 HydrophobicContact CD1-CD1 3.94Å; L56-L71 HydrophobicContact CD2-CB 4.25Å; L56-L71 HydrophobicContact CD2-CD1 4.37Å; P67-L71 PolarHBondContact O-N 2.77Å; P67-L71 VanDerWaalsContact O-N 3.1Å; Y68-L71 PolarHBondContact O-N 2.91Å; L71-T74 PolarHBondContact O-N 3.17Å; L71-R75 HydrophobicContact CD1-CG 4.39Å; L71-R75 WeakPolarHBondContact O-CB 3.43Å; L71-R75 WeakPolarHBondContact O-CG 3.46Å; L71-R75 PolarHBondContact O-N 3.49Å; L71-E98 HydrophobicContact CD1-CG 4.42Å; L71-V103 HydrophobicContact CD1-CG2 4.29Å
72	E	86.3	Confident	79.2	Confident	128 Å²	128	73.1 Å²	73.1	60%	0.598	38%	0.377	S	S	*	.	H	α-helix	trans	-61.1	-45.2	176.1	-75.8	-178.5	171	0	0	112.2	Y68 T74 R75 Q76	Y68-E72 WeakPolarHBondContact O-CG 3.48Å; Y68-E72 PolarHBondContact O-N 2.88Å; E72-T74 VanDerWaalsContact C-N 3.33Å; E72-T74 PolarHBondContact O-N 3.34Å; E72-R75 PolarHBondContact O-N 2.87Å; E72-Q76 PolarHBondContact O-N 2.79Å
73	A	86.6	Confident	81.5	Confident	43 Å²	43	72 Å²	72	36%	0.355	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-42.8	175.3	0	0	0	0	0	112	H69 M70 Q76 E77	H69-A73 WeakPolarHBondContact O-CB 3.49Å; H69-A73 PolarHBondContact O-N 2.78Å; M70-A73 PolarHBondContact O-N 2.89Å; A73-Q76 WeakPolarHBondContact O-CB 2.93Å; A73-Q76 PolarHBondContact O-N 2.88Å; A73-E77 PolarHBondContact O-N 3.1Å
74	T	90.1	Very high	83.9	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.043	33%	0.333	C	S	.	.	H	α-helix	trans	-65.6	-42.1	177.9	-54.4	0	0	0	0	111.6	I54 M70 L71 E72 Q76 E77 I78 V103	I54-T74 HydrophobicContact CD1-CG2 3.71Å; M70-T74 WeakPolarHBondContact O-CB 3.38Å; M70-T74 PolarHBondContact O-N 2.83Å; M70-T74 PolarHBondContact O-OG1 3.32Å; L71-T74 PolarHBondContact O-N 3.17Å; E72-T74 VanDerWaalsContact C-N 3.33Å; E72-T74 PolarHBondContact O-N 3.34Å; T74-Q76 VanDerWaalsContact C-N 3.31Å; T74-Q76 PolarHBondContact O-N 2.94Å; T74-E77 WeakPolarHBondContact O-CB 2.98Å; T74-E77 PolarHBondContact O-N 2.84Å; T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CD1 3.25Å; T74-I78 VanDerWaalsContact O-CG1 3.3Å; T74-I78 WeakPolarHBondContact O-CG1 3.16Å; T74-I78 PolarHBondContact O-N 3.28Å; T74-V103 HydrophobicContact CG2-CB 4.1Å; T74-V103 HydrophobicContact CG2-CG1 3.84Å; T74-V103 HydrophobicContact CG2-CG2 4.15Å
75	R	91.9	Very high	86.1	Confident	128 Å²	128	64.7 Å²	64.7	48%	0.483	31%	0.313	S	S	.	.	H	α-helix	trans	-64.5	-36	175.5	-75.3	177.1	174.6	173.1	0.3	112	L71 E72 S79 E98	L71-R75 HydrophobicContact CD1-CG 4.39Å; L71-R75 WeakPolarHBondContact O-CB 3.43Å; L71-R75 WeakPolarHBondContact O-CG 3.46Å; L71-R75 PolarHBondContact O-N 3.49Å; E72-R75 PolarHBondContact O-N 2.87Å; R75-S79 WeakPolarHBondContact O-CB 3.37Å; R75-S79 PolarHBondContact O-N 2.96Å; R75-E98 IonicContact CZ-OE1 3.09Å; R75-E98 VanDerWaalsContact CZ-OE1 3.25Å; R75-E98 IonicContact NE-OE1 3.42Å; R75-E98 PolarHBondContact NE-OE1 2.92Å; R75-E98 IonicContact NE-OE2 3.37Å; R75-E98 IonicContact NH2-OE1 2.85Å; R75-E98 PolarHBondContact NH2-OE1 3.32Å
76	Q	92.7	Very high	87.9	Confident	89 Å²	89	65.5 Å²	65.5	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-45.5	172.3	-178.9	177.7	-25.5	0	0	111.4	E72 A73 T74 I78 S79 I80 A175	E72-Q76 PolarHBondContact O-N 2.79Å; A73-Q76 WeakPolarHBondContact O-CB 2.93Å; A73-Q76 PolarHBondContact O-N 2.88Å; T74-Q76 VanDerWaalsContact C-N 3.31Å; T74-Q76 PolarHBondContact O-N 2.94Å; Q76-I78 PolarHBondContact O-N 3.15Å; Q76-S79 WeakPolarHBondContact O-CB 3.39Å; Q76-S79 PolarHBondContact O-N 3.21Å; Q76-I80 HydrophobicContact CG-CD1 4.27Å; Q76-I80 WeakPolarHBondContact O-CG1 3.45Å; Q76-I80 PolarHBondContact O-N 3.42Å; Q76-A175 PolarHBondContact NE2-O 2.85Å
77	E	94.8	Very high	89.7	Confident	11 Å²	11	62.4 Å²	62.4	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-49	174.4	-178.6	-179.6	-173	0	0	111.1	K52 A73 T74 S79 I80 L81 F172	K52-E77 IonicContact NZ-OE1 3.04Å; K52-E77 PolarHBondContact NZ-OE1 3.48Å; K52-E77 IonicContact NZ-OE2 3.4Å; A73-E77 PolarHBondContact O-N 3.1Å; T74-E77 WeakPolarHBondContact O-CB 2.98Å; T74-E77 PolarHBondContact O-N 2.84Å; E77-S79 VanDerWaalsContact C-N 3.33Å; E77-S79 PolarHBondContact O-N 3.14Å; E77-I80 PolarHBondContact O-N 3.36Å; E77-L81 HydrophobicContact CG-CD1 3.85Å; E77-L81 HydrophobicContact CG-CG 4.43Å; E77-L81 WeakPolarHBondContact O-CB 3.49Å; E77-L81 WeakPolarHBondContact O-CG 3.07Å; E77-L81 PolarHBondContact O-N 3.49Å; E77-F172 HydrophobicContact CG-CB 4.19Å
78	I	95.7	Very high	91.2	Very high	9 Å²	9	62.9 Å²	62.9	5%	0.046	32%	0.315	C	S	.	.	H	α-helix	trans	-57.9	-44.5	177	-67.6	158.5	0	0	0	111.4	T74 Q76 I80 L81 R82 L93 V96 V103 L105	T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CD1 3.25Å; T74-I78 VanDerWaalsContact O-CG1 3.3Å; T74-I78 WeakPolarHBondContact O-CG1 3.16Å; T74-I78 PolarHBondContact O-N 3.28Å; Q76-I78 PolarHBondContact O-N 3.15Å; I78-I80 PolarHBondContact O-N 3.36Å; I78-L81 PolarHBondContact O-N 3.22Å; I78-R82 HydrophobicContact CG2-CG 4.48Å; I78-R82 WeakPolarHBondContact O-CB 3.26Å; I78-R82 WeakPolarHBondContact O-CG 3.37Å; I78-R82 PolarHBondContact O-N 2.92Å; I78-L93 HydrophobicContact CG2-CD2 4.3Å; I78-V96 HydrophobicContact CD1-CG1 3.85Å; I78-V96 HydrophobicContact CG1-CG1 4.48Å; I78-V96 HydrophobicContact CG1-CG2 4.44Å; I78-V96 HydrophobicContact CG2-CG2 4.1Å; I78-V103 HydrophobicContact CD1-CG1 4.28Å; I78-L105 HydrophobicContact CD1-CD2 3.83Å; I78-L105 HydrophobicContact CG1-CD2 3.59Å
79	S	97.1	Very high	92.5	Very high	61 Å²	61	56.7 Å²	56.7	43%	0.427	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-45.9	178.6	-178.6	0	0	0	0	111.4	R75 Q76 E77 R82 Q83	R75-S79 WeakPolarHBondContact O-CB 3.37Å; R75-S79 PolarHBondContact O-N 2.96Å; Q76-S79 WeakPolarHBondContact O-CB 3.39Å; Q76-S79 PolarHBondContact O-N 3.21Å; E77-S79 VanDerWaalsContact C-N 3.33Å; E77-S79 PolarHBondContact O-N 3.14Å; S79-R82 PolarHBondContact O-N 3.49Å; S79-Q83 WeakPolarHBondContact O-CG 3.36Å; S79-Q83 PolarHBondContact O-N 2.89Å
80	I	97.8	Very high	93.6	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-48.8	177.7	-70.8	174.3	0	0	0	110.7	Q76 E77 I78 R82 Q83 V84 I149 F172 A175	Q76-I80 HydrophobicContact CG-CD1 4.27Å; Q76-I80 WeakPolarHBondContact O-CG1 3.45Å; Q76-I80 PolarHBondContact O-N 3.42Å; E77-I80 PolarHBondContact O-N 3.36Å; I78-I80 PolarHBondContact O-N 3.36Å; I80-R82 VanDerWaalsContact C-N 3.27Å; I80-R82 PolarHBondContact O-N 3.22Å; I80-Q83 WeakPolarHBondContact O-CA 3.42Å; I80-Q83 WeakPolarHBondContact O-CB 3.32Å; I80-Q83 PolarHBondContact O-N 2.88Å; I80-V84 WeakPolarHBondContact O-CG2 3.47Å; I80-V84 PolarHBondContact O-N 3.41Å; I80-V84 VanDerWaalsContact O-N 3.09Å; I80-I149 HydrophobicContact CG2-CD1 4.24Å; I80-I149 HydrophobicContact CG2-CG2 4.05Å; I80-F172 HydrophobicContact CG2-CB 4.2Å; I80-F172 HydrophobicContact CG2-CD1 3.61Å; I80-F172 HydrophobicContact CG2-CE1 4.38Å; I80-F172 HydrophobicContact CG2-CG 4.19Å; I80-A175 VanDerWaalsContact CD1-C 3.43Å; I80-A175 HydrophobicContact CD1-CB 3.76Å; I80-A175 WeakPolarHBondContact CD1-O 3.44Å; I80-A175 HydrophobicContact CG2-CB 4.09Å
81	L	97.5	Very high	94.5	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-43	178.2	-77.6	167.8	0	0	0	112	E77 I78 Q83 V84 M85 I91 L93 F107 F172	E77-L81 HydrophobicContact CG-CD1 3.85Å; E77-L81 HydrophobicContact CG-CG 4.43Å; E77-L81 WeakPolarHBondContact O-CB 3.49Å; E77-L81 WeakPolarHBondContact O-CG 3.07Å; E77-L81 PolarHBondContact O-N 3.49Å; I78-L81 PolarHBondContact O-N 3.22Å; L81-Q83 VanDerWaalsContact C-N 3.32Å; L81-Q83 PolarHBondContact O-N 3.38Å; L81-V84 WeakPolarHBondContact O-CG2 3.37Å; L81-V84 PolarHBondContact O-N 3.38Å; L81-M85 PolarHBondContact O-N 3.04Å; L81-I91 HydrophobicContact CD2-CG2 4.07Å; L81-L93 HydrophobicContact CB-CB 4.25Å; L81-L93 HydrophobicContact CB-CD2 3.87Å; L81-L93 HydrophobicContact CD1-CD2 4.08Å; L81-F107 HydrophobicContact CD1-CE1 3.72Å; L81-F107 HydrophobicContact CD1-CZ 3.78Å; L81-F107 HydrophobicContact CD2-CE1 4.13Å; L81-F172 HydrophobicContact CD2-CB 4.28Å; L81-F172 HydrophobicContact CD2-CD2 3.47Å; L81-F172 VanDerWaalsContact CD2-CD2 3.47Å; L81-F172 HydrophobicContact CD2-CE2 4.07Å; L81-F172 HydrophobicContact CD2-CG 4.06Å; L81-F172 HydrophobicContact CG-CB 4.26Å; L81-F172 HydrophobicContact CG-CD2 4.34Å; L81-F172 HydrophobicContact CG-CG 4.49Å
82	R	96.9	Very high	95	Very high	157 Å²	157	50.3 Å²	50.3	59%	0.592	26%	0.262	S	S	*	.	H	α-helix	trans	-63.3	-35	175.3	-74.2	177.2	175.3	174.2	1.4	113.1	I78 S79 I80	I78-R82 HydrophobicContact CG2-CG 4.48Å; I78-R82 WeakPolarHBondContact O-CB 3.26Å; I78-R82 WeakPolarHBondContact O-CG 3.37Å; I78-R82 PolarHBondContact O-N 2.92Å; S79-R82 PolarHBondContact O-N 3.49Å; I80-R82 VanDerWaalsContact C-N 3.27Å; I80-R82 PolarHBondContact O-N 3.22Å
83	Q	96.9	Very high	95.6	Very high	67 Å²	67	44.5 Å²	44.5	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-72.4	-27.7	177.2	-69.1	-177.4	51.4	0	0	113.4	S79 I80 L81 K147 I149	S79-Q83 WeakPolarHBondContact O-CG 3.36Å; S79-Q83 PolarHBondContact O-N 2.89Å; I80-Q83 WeakPolarHBondContact O-CA 3.42Å; I80-Q83 WeakPolarHBondContact O-CB 3.32Å; I80-Q83 PolarHBondContact O-N 2.88Å; L81-Q83 VanDerWaalsContact C-N 3.32Å; L81-Q83 PolarHBondContact O-N 3.38Å; Q83-K147 WeakPolarHBondContact O-CE 3.47Å; Q83-I149 HydrophobicContact CB-CD1 4.47Å
84	V	97.3	Very high	96.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-101.2	-3.8	-176.1	-58.2	0	0	0	0	113.9	I80 L81 I90 Y143 I144 K147 I149 F172	I80-V84 WeakPolarHBondContact O-CG2 3.47Å; I80-V84 PolarHBondContact O-N 3.41Å; I80-V84 VanDerWaalsContact O-N 3.09Å; L81-V84 WeakPolarHBondContact O-CG2 3.37Å; L81-V84 PolarHBondContact O-N 3.38Å; V84-I90 HydrophobicContact CB-CG2 4.22Å; V84-I90 HydrophobicContact CG2-CG2 3.67Å; V84-Y143 HydrophobicContact CB-CE1 3.99Å; V84-Y143 HydrophobicContact CG1-CE1 4.5Å; V84-Y143 VanDerWaalsContact O-CE1 3.23Å; V84-Y143 WeakPolarHBondContact O-CE1 3.46Å; V84-I144 HydrophobicContact CB-CG2 4.32Å; V84-I144 HydrophobicContact CG1-CG2 3.82Å; V84-K147 HydrophobicContact CG1-CD 4.33Å; V84-I149 HydrophobicContact CG1-CD1 3.56Å; V84-F172 HydrophobicContact CG2-CE1 4.28Å; V84-F172 HydrophobicContact CG2-CZ 4.16Å
85	M	94.6	Very high	96.4	Very high	84 Å²	84	48 Å²	48	41%	0.414	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	146.6	178.5	-171.2	-176.8	-62.4	0	0	112.9	L81 L93	L81-M85 PolarHBondContact O-N 3.04Å; M85-L93 HydrophobicContact CE-CB 4.39Å; M85-L93 WeakPolarHBondContact CE-O 3.4Å
86	G	93.8	Very high	96.5	Very high	60 Å²	60	43.7 Å²	43.7	62%	0.619	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.4	0.9	172.6	0	0	0	0	0	115.3	D92	G86-D92 PolarHBondContact N-OD1 2.96Å
87	H	97.7	Very high	96.6	Very high	31 Å²	31	41.2 Å²	41.2	14%	0.144	22%	0.22	C	C	.	.			trans	-87	133.4	172.2	-172.6	-92.2	0	0	0	110.8	Y89 I90 Y143	H87-Y89 AromaticContact CE1-CD2 3.66Å; H87-Y89 PolarHBondContact ND1-N 3.01Å; H87-Y89 PolarHBondContact O-N 3.14Å; H87-I90 HydrophobicContact CB-CB 4.22Å; H87-I90 HydrophobicContact CB-CG1 3.84Å; H87-I90 PolarHBondContact O-N 3.04Å; H87-Y143 HydrophobicContact CB-CD1 3.67Å; H87-Y143 HydrophobicContact CB-CD2 4.3Å; H87-Y143 HydrophobicContact CB-CE1 3.52Å; H87-Y143 HydrophobicContact CB-CE2 4.15Å; H87-Y143 HydrophobicContact CB-CG 4.05Å; H87-Y143 AromaticContact CD2-CD1 3.92Å; H87-Y143 AromaticContact CD2-CD2 3.38Å; H87-Y143 WeakPolarHBondContact CD2-CD2 3.47Å; H87-Y143 AromaticContact CD2-CE2 3.89Å; H87-Y143 AromaticContact CD2-CG 3.36Å; H87-Y143 AromaticContact CG-CD1 3.72Å; H87-Y143 AromaticContact CG-CG 3.66Å; H87-Y143 AromaticContact NE2-CG 3.95Å
88	P	97.4	Very high	96.4	Very high	78 Å²	78	44.5 Å²	44.5	51%	0.506	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-26.5	-171.7	21.6	-34.8	0	0	0	114.8	K168	P88-K168 WeakPolarHBondContact O-CD 3.48Å; P88-K168 WeakPolarHBondContact O-CE 3.35Å; P88-K168 PolarHBondContact O-NZ 2.8Å
89	Y	98.4	Very high	95.9	Very high	43 Å²	43	45.2 Å²	45.2	17%	0.169	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	12.2	-178.8	-46.4	-52	0	0	0	114.8	H87 Q136 E139 V167 I169	H87-Y89 AromaticContact CE1-CD2 3.66Å; H87-Y89 PolarHBondContact ND1-N 3.01Å; H87-Y89 PolarHBondContact O-N 3.14Å; Y89-Q136 HydrophobicContact CD1-CB 3.76Å; Y89-Q136 HydrophobicContact CD1-CG 3.94Å; Y89-Q136 HydrophobicContact CD2-CB 4.04Å; Y89-Q136 HydrophobicContact CD2-CG 4.49Å; Y89-Q136 WeakPolarHBondContact CD2-O 3.37Å; Y89-Q136 HydrophobicContact CE1-CB 3.81Å; Y89-Q136 HydrophobicContact CE1-CG 3.44Å; Y89-Q136 VanDerWaalsContact CE1-CG 3.44Å; Y89-Q136 HydrophobicContact CE2-CB 4.14Å; Y89-Q136 HydrophobicContact CE2-CG 4.12Å; Y89-Q136 HydrophobicContact CG-CB 3.86Å; Y89-Q136 HydrophobicContact CG-CG 4.42Å; Y89-E139 HydrophobicContact CD2-CB 3.82Å; Y89-E139 HydrophobicContact CE2-CB 3.87Å; Y89-E139 WeakPolarHBondContact CE2-OE2 3.43Å; Y89-E139 PolarHBondContact OH-OE2 2.96Å; Y89-V167 VanDerWaalsContact CA-O 3.32Å; Y89-V167 WeakPolarHBondContact CA-O 3.24Å; Y89-I169 PolarHBondContact O-N 3.25Å
90	I	98.4	Very high	95.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-110.8	143.4	170.1	-54.1	-56.9	0	0	0	107.6	V84 H87 D92 Y143 I144 I169 F172	V84-I90 HydrophobicContact CB-CG2 4.22Å; V84-I90 HydrophobicContact CG2-CG2 3.67Å; H87-I90 HydrophobicContact CB-CB 4.22Å; H87-I90 HydrophobicContact CB-CG1 3.84Å; H87-I90 PolarHBondContact O-N 3.04Å; I90-D92 PolarHBondContact O-N 2.66Å; I90-Y143 HydrophobicContact CG1-CD1 4.15Å; I90-I144 HydrophobicContact CD1-CG2 3.94Å; I90-I144 HydrophobicContact CG1-CG2 4.43Å; I90-I169 HydrophobicContact CD1-CB 3.91Å; I90-I169 HydrophobicContact CD1-CD1 3.99Å; I90-I169 HydrophobicContact CD1-CG1 4.35Å; I90-F172 HydrophobicContact CD1-CZ 4.29Å; I90-F172 HydrophobicContact CG2-CE2 3.83Å; I90-F172 HydrophobicContact CG2-CZ 3.75Å
91	I	97.8	Very high	94.3	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.015	27%	0.272	C	S	.	.			trans	-64.1	131.2	175.8	-164	76	0	0	0	110.6	L81 F107 E108 L160 K168 I169	L81-I91 HydrophobicContact CD2-CG2 4.07Å; I91-F107 HydrophobicContact CG1-CB 4.03Å; I91-F107 HydrophobicContact CG1-CD1 3.75Å; I91-F107 HydrophobicContact CG1-CG 4.21Å; I91-F107 HydrophobicContact CG2-CD1 4.03Å; I91-F107 HydrophobicContact CG2-CE1 4.1Å; I91-E108 WeakPolarHBondContact CA-OE1 3.39Å; I91-E108 HydrophobicContact CD1-CG 3.41Å; I91-E108 VanDerWaalsContact CD1-CG 3.41Å; I91-E108 HydrophobicContact CG1-CG 4.1Å; I91-L160 HydrophobicContact CD1-CD1 4.34Å; I91-K168 HydrophobicContact CD1-CB 4.21Å; I91-I169 WeakPolarHBondContact CB-O 3.48Å; I91-I169 WeakPolarHBondContact CG2-O 3.36Å; I91-I169 PolarHBondContact N-O 3.04Å
92	D	96.3	Very high	93.9	Very high	51 Å²	51	51.6 Å²	51.6	27%	0.273	27%	0.274	S	S	.	.			trans	-85.4	125	175.5	-80.2	-27.9	0	0	0	111.5	G86 I90 F107 E108	G86-D92 PolarHBondContact N-OD1 2.96Å; I90-D92 PolarHBondContact O-N 2.66Å; D92-F107 VanDerWaalsContact O-CA 3.31Å; D92-F107 WeakPolarHBondContact O-CA 3.42Å; D92-E108 HydrophobicContact CB-CG 4.4Å; D92-E108 PolarHBondContact N-OE1 2.91Å; D92-E108 PolarHBondContact O-N 2.79Å
93	L	97.5	Very high	93.7	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.5	170.8	178.1	67.6	0	0	0	109.4	I78 L81 M85 V96 L105 V106 F107	I78-L93 HydrophobicContact CG2-CD2 4.3Å; L81-L93 HydrophobicContact CB-CB 4.25Å; L81-L93 HydrophobicContact CB-CD2 3.87Å; L81-L93 HydrophobicContact CD1-CD2 4.08Å; M85-L93 HydrophobicContact CE-CB 4.39Å; M85-L93 WeakPolarHBondContact CE-O 3.4Å; L93-V96 HydrophobicContact CD1-CG2 4.14Å; L93-V96 HydrophobicContact CD2-CG2 3.71Å; L93-V96 HydrophobicContact CG-CG2 4.11Å; L93-L105 HydrophobicContact CD1-CB 3.89Å; L93-L105 HydrophobicContact CD1-CD2 4.34Å; L93-V106 CarbonylContact C-O 3.54Å; L93-F107 HydrophobicContact CB-CD1 4.24Å; L93-F107 HydrophobicContact CB-CE1 4.05Å; L93-F107 HydrophobicContact CD1-CD1 4.09Å; L93-F107 HydrophobicContact CD1-CE1 3.74Å; L93-F107 HydrophobicContact CD1-CE2 4.38Å; L93-F107 HydrophobicContact CD1-CZ 3.9Å; L93-F107 HydrophobicContact CG-CE1 4.46Å
94	Q	96.6	Very high	93.6	Very high	88 Å²	88	41.2 Å²	41.2	41%	0.411	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-55.8	-177.2	180	60.1	55.5	0	0	112.4	F49 V106	F49-Q94 HydrophobicContact CD1-CB 4.25Å; F49-Q94 HydrophobicContact CD1-CG 4.36Å; F49-Q94 HydrophobicContact CE1-CB 3.98Å; F49-Q94 HydrophobicContact CE1-CG 3.75Å; F49-Q94 HydrophobicContact CZ-CG 4.15Å; Q94-V106 WeakPolarHBondContact CA-O 3.47Å; Q94-V106 HydrophobicContact CB-CB 4.47Å; Q94-V106 HydrophobicContact CB-CG1 4.27Å; Q94-V106 WeakPolarHBondContact CB-O 3.43Å; Q94-V106 PolarHBondContact N-O 3.06Å
95	D	96.4	Very high	93.5	Very high	37 Å²	37	41.2 Å²	41.2	20%	0.198	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157.1	-174.7	-77.7	-28.4	0	0	0	111.4	K22 Y23 F97 V106	K22-D95 WeakPolarHBondContact CD-OD2 3.48Å; K22-D95 WeakPolarHBondContact CE-OD2 3.37Å; K22-D95 IonicContact NZ-OD1 3.33Å; K22-D95 IonicContact NZ-OD2 2.66Å; K22-D95 PolarHBondContact NZ-OD2 3.25Å; Y23-D95 HydrophobicContact CE2-CB 4.36Å; Y23-D95 WeakPolarHBondContact CE2-OD2 3.45Å; Y23-D95 PolarHBondContact OH-OD2 2.81Å; D95-F97 HydrophobicContact CB-CE2 3.76Å; D95-F97 HydrophobicContact CB-CZ 4.09Å; D95-V106 HydrophobicContact CB-CB 4.1Å; D95-V106 HydrophobicContact CB-CG2 4.15Å; D95-V106 PolarHBondContact N-O 3.14Å; D95-V106 PolarHBondContact O-N 2.87Å
96	V	95.9	Very high	93.7	Very high	37 Å²	37	37.2 Å²	37.2	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.2	176.2	179.3	0	0	0	0	109.1	I78 L93 F104 L105	I78-V96 HydrophobicContact CD1-CG1 3.85Å; I78-V96 HydrophobicContact CG1-CG1 4.48Å; I78-V96 HydrophobicContact CG1-CG2 4.44Å; I78-V96 HydrophobicContact CG2-CG2 4.1Å; L93-V96 HydrophobicContact CD1-CG2 4.14Å; L93-V96 HydrophobicContact CD2-CG2 3.71Å; L93-V96 HydrophobicContact CG-CG2 4.11Å; V96-F104 WeakPolarHBondContact CA-O 3.3Å; V96-L105 HydrophobicContact CB-CD2 4.45Å; V96-L105 HydrophobicContact CG1-CD2 3.97Å; V96-L105 HydrophobicContact CG2-CD2 3.94Å
97	F	94.3	Very high	93.9	Very high	37 Å²	37	35.1 Å²	35.1	16%	0.162	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.8	171	-50	-92.4	0	0	0	109.2	A15 F19 Y23 D95 V103 F104 V106	A15-F97 HydrophobicContact CB-CB 4.37Å; F19-F97 HydrophobicContact CB-CD2 3.96Å; F19-F97 HydrophobicContact CB-CE2 4.32Å; F19-F97 HydrophobicContact CB-CG 4.12Å; F19-F97 HydrophobicContact CD2-CD2 4.09Å; F19-F97 HydrophobicContact CD2-CE2 4.09Å; Y23-F97 HydrophobicContact CD2-CE2 4.08Å; Y23-F97 HydrophobicContact CD2-CZ 4.23Å; Y23-F97 AromaticContact CE2-CE2 3.94Å; Y23-F97 HydrophobicContact CE2-CE2 3.94Å; Y23-F97 HydrophobicContact CE2-CZ 4.03Å; D95-F97 HydrophobicContact CB-CE2 3.76Å; D95-F97 HydrophobicContact CB-CZ 4.09Å; F97-V103 CarbonylContact O-C 3.56Å; F97-V103 WeakPolarHBondContact O-CA 3.45Å; F97-F104 HydrophobicContact CB-CB 4.11Å; F97-F104 HydrophobicContact CB-CD2 4.38Å; F97-F104 HydrophobicContact CD2-CB 4.18Å; F97-F104 PolarHBondContact N-O 3.48Å; F97-F104 PolarHBondContact O-N 2.7Å; F97-V106 HydrophobicContact CD2-CG2 4.38Å; F97-V106 HydrophobicContact CE2-CG2 3.97Å
98	E	89.8	Confident	93.8	Very high	80 Å²	80	35.6 Å²	35.6	37%	0.374	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.9	-173.5	-177.1	-179.8	152.3	0	0	110	A15 L71 R75 V103	A15-E98 VanDerWaalsContact CB-C 3.47Å; L71-E98 HydrophobicContact CD1-CG 4.42Å; R75-E98 IonicContact CZ-OE1 3.09Å; R75-E98 VanDerWaalsContact CZ-OE1 3.25Å; R75-E98 IonicContact NE-OE1 3.42Å; R75-E98 PolarHBondContact NE-OE1 2.92Å; R75-E98 IonicContact NE-OE2 3.37Å; R75-E98 IonicContact NH2-OE1 2.85Å; R75-E98 PolarHBondContact NH2-OE1 3.32Å; E98-V103 HydrophobicContact CG-CG2 4.25Å
99	S	85	Confident	93.8	Very high	24 Å²	24	33.7 Å²	33.7	17%	0.168	17%	0.174	C	C	.	.			trans	-129.6	176.7	166.1	62.3	0	0	0	0	110.4	A101 F102	S99-A101 PolarHBondContact O-N 3.11Å; S99-F102 PolarHBondContact N-O 3.05Å; S99-F102 PolarHBondContact OG-N 2.92Å; S99-F102 VanDerWaalsContact OG-N 3.1Å; S99-F102 PolarHBondContact OG-O 2.72Å
100	D	80.1	Confident	93.8	Very high	166 Å²	166	32.2 Å²	32.2	89%	0.888	17%	0.17	S	C	*	.	S	Bend	trans	-62	-23.8	177	-60.4	-25.4	0	0	0	113.5
101	A	82.8	Confident	93.6	Very high	26 Å²	26	35.4 Å²	35.4	22%	0.215	19%	0.191	C	C	.	.	S	Bend	trans	-110.8	-28.4	-176.7	0	0	0	0	0	113.9	L56 S99	L56-A101 WeakPolarHBondContact CB-O 3.47Å; L56-A101 PolarHBondContact N-O 2.98Å; S99-A101 PolarHBondContact O-N 3.11Å
102	F	88.1	Confident	93.5	Very high	10 Å²	10	40.4 Å²	40.4	4%	0.044	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	147.8	-172.9	-65.3	-82.7	0	0	0	112.9	P11 I53 I54 D55 S99 F104	P11-F102 HydrophobicContact CG-CE2 3.99Å; P11-F102 HydrophobicContact CG-CZ 3.91Å; P11-F102 WeakPolarHBondContact O-CD2 3.45Å; P11-F102 WeakPolarHBondContact O-CE2 3.19Å; I53-F102 HydrophobicContact CG2-CD1 4.14Å; I54-F102 VanDerWaalsContact O-CA 3.26Å; I54-F102 WeakPolarHBondContact O-CA 3.36Å; D55-F102 HydrophobicContact CB-CD1 4.07Å; D55-F102 HydrophobicContact CB-CE1 3.67Å; S99-F102 PolarHBondContact N-O 3.05Å; S99-F102 PolarHBondContact OG-N 2.92Å; S99-F102 VanDerWaalsContact OG-N 3.1Å; S99-F102 PolarHBondContact OG-O 2.72Å; F102-F104 HydrophobicContact CB-CD2 4.35Å; F102-F104 HydrophobicContact CB-CE2 3.67Å; F102-F104 HydrophobicContact CB-CZ 4.29Å
103	V	91.9	Very high	93.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.2	167.8	-172.7	0	0	0	0	109.5	I54 L56 L71 T74 I78 F97 E98 L105	I54-V103 HydrophobicContact CB-CB 4.34Å; I54-V103 PolarHBondContact N-O 3.29Å; I54-V103 PolarHBondContact O-N 2.67Å; L56-V103 HydrophobicContact CD1-CG2 3.97Å; L56-V103 HydrophobicContact CD2-CG2 4.13Å; L56-V103 HydrophobicContact CG-CG2 4.22Å; L71-V103 HydrophobicContact CD1-CG2 4.29Å; T74-V103 HydrophobicContact CG2-CB 4.1Å; T74-V103 HydrophobicContact CG2-CG1 3.84Å; T74-V103 HydrophobicContact CG2-CG2 4.15Å; I78-V103 HydrophobicContact CD1-CG1 4.28Å; F97-V103 CarbonylContact O-C 3.56Å; F97-V103 WeakPolarHBondContact O-CA 3.45Å; E98-V103 HydrophobicContact CG-CG2 4.25Å; V103-L105 HydrophobicContact CG1-CD2 3.87Å; V103-L105 HydrophobicContact CG1-CG 4.33Å
104	F	94.8	Very high	93.4	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.9	175.8	-59.3	-107.1	0	0	0	108.8	A15 F19 K52 I53 V96 F97 F102	A15-F104 HydrophobicContact CB-CD2 4.28Å; A15-F104 HydrophobicContact CB-CE2 4.23Å; F19-F104 HydrophobicContact CB-CD1 4.18Å; F19-F104 HydrophobicContact CB-CG 4.28Å; F19-F104 HydrophobicContact CD1-CD1 4.03Å; F19-F104 HydrophobicContact CD1-CE1 4.11Å; F19-F104 HydrophobicContact CD2-CB 4.35Å; F19-F104 HydrophobicContact CD2-CD1 4.11Å; F19-F104 HydrophobicContact CD2-CG 4.5Å; F19-F104 HydrophobicContact CE1-CD1 4.48Å; F19-F104 AromaticContact CG-CD1 3.82Å; F19-F104 HydrophobicContact CG-CD1 3.82Å; F19-F104 HydrophobicContact CG-CE1 4.29Å; F19-F104 HydrophobicContact CG-CG 4.32Å; K52-F104 WeakPolarHBondContact O-CA 3.49Å; I53-F104 HydrophobicContact CB-CD1 4.4Å; I53-F104 HydrophobicContact CB-CE1 4.4Å; I53-F104 HydrophobicContact CD1-CD1 4.26Å; I53-F104 HydrophobicContact CD1-CE1 3.95Å; I53-F104 HydrophobicContact CG1-CD1 3.75Å; I53-F104 HydrophobicContact CG1-CE1 3.86Å; I53-F104 HydrophobicContact CG2-CD1 4.12Å; I53-F104 HydrophobicContact CG2-CE1 3.76Å; I53-F104 HydrophobicContact CG2-CZ 4.03Å; V96-F104 WeakPolarHBondContact CA-O 3.3Å; F97-F104 HydrophobicContact CB-CB 4.11Å; F97-F104 HydrophobicContact CB-CD2 4.38Å; F97-F104 HydrophobicContact CD2-CB 4.18Å; F97-F104 PolarHBondContact N-O 3.48Å; F97-F104 PolarHBondContact O-N 2.7Å; F102-F104 HydrophobicContact CB-CD2 4.35Å; F102-F104 HydrophobicContact CB-CE2 3.67Å; F102-F104 HydrophobicContact CB-CZ 4.29Å
105	L	96.1	Very high	93.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.7	173.8	-54.2	-178.5	0	0	0	108.6	A51 K52 I54 I78 L93 V96 V103 F107	A51-L105 CarbonylContact C-O 3.58Å; A51-L105 WeakPolarHBondContact CA-O 3.49Å; K52-L105 HydrophobicContact CB-CB 4.34Å; K52-L105 PolarHBondContact N-O 2.7Å; K52-L105 PolarHBondContact O-N 3.42Å; I54-L105 HydrophobicContact CD1-CD1 4Å; I54-L105 HydrophobicContact CD1-CG 4.46Å; I78-L105 HydrophobicContact CD1-CD2 3.83Å; I78-L105 HydrophobicContact CG1-CD2 3.59Å; L93-L105 HydrophobicContact CD1-CB 3.89Å; L93-L105 HydrophobicContact CD1-CD2 4.34Å; V96-L105 HydrophobicContact CB-CD2 4.45Å; V96-L105 HydrophobicContact CG1-CD2 3.97Å; V96-L105 HydrophobicContact CG2-CD2 3.94Å; V103-L105 HydrophobicContact CG1-CD2 3.87Å; V103-L105 HydrophobicContact CG1-CG 4.33Å; L105-F107 HydrophobicContact CB-CD2 4.18Å; L105-F107 HydrophobicContact CB-CE2 3.41Å; L105-F107 VanDerWaalsContact CB-CE2 3.41Å; L105-F107 HydrophobicContact CB-CZ 3.86Å; L105-F107 HydrophobicContact CD1-CE2 4.18Å; L105-F107 HydrophobicContact CD1-CZ 4.06Å; L105-F107 HydrophobicContact CG-CE2 4.45Å
106	V	97.8	Very high	93.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.4	179.7	-174.8	0	0	0	0	109.1	F19 Y23 F49 L93 Q94 D95 F97	F19-V106 HydrophobicContact CD2-CG2 4.16Å; F19-V106 HydrophobicContact CE2-CG2 4.05Å; Y23-V106 HydrophobicContact CD2-CG2 4.29Å; Y23-V106 HydrophobicContact CE1-CG1 3.92Å; Y23-V106 HydrophobicContact CE2-CG1 4.3Å; Y23-V106 HydrophobicContact CE2-CG2 4.02Å; F49-V106 HydrophobicContact CB-CG1 3.68Å; F49-V106 HydrophobicContact CD1-CG1 4.11Å; F49-V106 HydrophobicContact CG-CG1 3.97Å; L93-V106 CarbonylContact C-O 3.54Å; Q94-V106 WeakPolarHBondContact CA-O 3.47Å; Q94-V106 HydrophobicContact CB-CB 4.47Å; Q94-V106 HydrophobicContact CB-CG1 4.27Å; Q94-V106 WeakPolarHBondContact CB-O 3.43Å; Q94-V106 PolarHBondContact N-O 3.06Å; D95-V106 HydrophobicContact CB-CB 4.1Å; D95-V106 HydrophobicContact CB-CG2 4.15Å; D95-V106 PolarHBondContact N-O 3.14Å; D95-V106 PolarHBondContact O-N 2.87Å; F97-V106 HydrophobicContact CD2-CG2 4.38Å; F97-V106 HydrophobicContact CE2-CG2 3.97Å
107	F	97.9	Very high	93.2	Very high	15 Å²	15	42.9 Å²	42.9	7%	0.066	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	158.2	-179.4	-64.9	-81.8	0	0	0	111.8	F49 A50 K52 L81 I91 D92 L93 L105	F49-F107 WeakPolarHBondContact CA-O 3.38Å; F49-F107 WeakPolarHBondContact CB-O 3.45Å; F49-F107 WeakPolarHBondContact CD1-O 3.23Å; A50-F107 PolarHBondContact N-O 3.44Å; A50-F107 PolarHBondContact O-N 3.16Å; K52-F107 HydrophobicContact CB-CD2 4.35Å; K52-F107 HydrophobicContact CB-CE2 3.97Å; K52-F107 HydrophobicContact CD-CE2 4.28Å; L81-F107 HydrophobicContact CD1-CE1 3.72Å; L81-F107 HydrophobicContact CD1-CZ 3.78Å; L81-F107 HydrophobicContact CD2-CE1 4.13Å; I91-F107 HydrophobicContact CG1-CB 4.03Å; I91-F107 HydrophobicContact CG1-CD1 3.75Å; I91-F107 HydrophobicContact CG1-CG 4.21Å; I91-F107 HydrophobicContact CG2-CD1 4.03Å; I91-F107 HydrophobicContact CG2-CE1 4.1Å; D92-F107 VanDerWaalsContact O-CA 3.31Å; D92-F107 WeakPolarHBondContact O-CA 3.42Å; L93-F107 HydrophobicContact CB-CD1 4.24Å; L93-F107 HydrophobicContact CB-CE1 4.05Å; L93-F107 HydrophobicContact CD1-CD1 4.09Å; L93-F107 HydrophobicContact CD1-CE1 3.74Å; L93-F107 HydrophobicContact CD1-CE2 4.38Å; L93-F107 HydrophobicContact CD1-CZ 3.9Å; L93-F107 HydrophobicContact CG-CE1 4.46Å; L105-F107 HydrophobicContact CB-CD2 4.18Å; L105-F107 HydrophobicContact CB-CE2 3.41Å; L105-F107 VanDerWaalsContact CB-CE2 3.41Å; L105-F107 HydrophobicContact CB-CZ 3.86Å; L105-F107 HydrophobicContact CD1-CE2 4.18Å; L105-F107 HydrophobicContact CD1-CZ 4.06Å; L105-F107 HydrophobicContact CG-CE2 4.45Å
108	E	96.9	Very high	93.2	Very high	42 Å²	42	43.4 Å²	43.4	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	141.7	163.9	69.2	179.7	135.6	0	0	111.2	I91 D92 K168	I91-E108 WeakPolarHBondContact CA-OE1 3.39Å; I91-E108 HydrophobicContact CD1-CG 3.41Å; I91-E108 VanDerWaalsContact CD1-CG 3.41Å; I91-E108 HydrophobicContact CG1-CG 4.1Å; D92-E108 HydrophobicContact CB-CG 4.4Å; D92-E108 PolarHBondContact N-OE1 2.91Å; D92-E108 PolarHBondContact O-N 2.79Å; E108-K168 WeakPolarHBondContact OE1-CD 3.41Å; E108-K168 VanDerWaalsContact OE1-CE 3.25Å; E108-K168 WeakPolarHBondContact OE1-CE 3.46Å; E108-K168 IonicContact OE1-NZ 2.85Å; E108-K168 PolarHBondContact OE1-NZ 3.42Å; E108-K168 VanDerWaalsContact OE2-CE 3.22Å; E108-K168 WeakPolarHBondContact OE2-CE 3.47Å; E108-K168 IonicContact OE2-NZ 2.65Å; E108-K168 PolarHBondContact OE2-NZ 3.4Å
109	L	97.3	Very high	93.3	Very high	37 Å²	37	40 Å²	40	19%	0.194	21%	0.213	C	C	.	.			trans	-80.4	128.7	178.7	-176.9	63.9	0	0	0	110.5	L29 R39 E48 A50 P111	L29-L109 HydrophobicContact CD1-CD1 3.77Å; R39-L109 HydrophobicContact CG-CD2 4.22Å; E48-L109 HydrophobicContact CB-CD2 3.75Å; E48-L109 WeakPolarHBondContact OE2-CD2 3.26Å; A50-L109 HydrophobicContact CB-CD1 4.13Å; L109-P111 VanDerWaalsContact O-CD 3.28Å; L109-P111 WeakPolarHBondContact O-CD 3.1Å
110	C	97.4	Very high	93.4	Very high	12 Å²	12	43 Å²	43	8%	0.081	23%	0.231	C	C	.	.			trans	-106.9	89.8	171.8	-67.3	0	0	0	0	110	K112 G113 L160 L161	C110-K112 PolarHBondContact O-N 3.03Å; C110-K112 VanDerWaalsContact O-N 3.16Å; C110-G113 PolarHBondContact O-N 3.37Å; C110-L160 HydrophobicContact CB-CB 3.57Å; C110-L160 HydrophobicContact CB-CD1 3.99Å; C110-L160 HydrophobicContact CB-CG 4.37Å; C110-L161 CarbonylContact C-O 3.54Å; C110-L161 WeakPolarHBondContact CB-O 3.38Å
111	P	95.4	Very high	93.9	Very high	68 Å²	68	39.3 Å²	39.3	44%	0.442	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.8	-166.5	28.1	-35.2	0	0	0	114.5	L109 G113 E163	L109-P111 VanDerWaalsContact O-CD 3.28Å; L109-P111 WeakPolarHBondContact O-CD 3.1Å; P111-G113 VanDerWaalsContact C-N 3.3Å; P111-E163 HydrophobicContact CG-CB 4.38Å; P111-E163 HydrophobicContact CG-CG 3.38Å
112	K	96.1	Very high	94.2	Very high	107 Å²	107	40.8 Å²	40.8	47%	0.465	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	2.7	172.5	-59.3	-59.6	179.5	-167	0	112.9	C110 L161 D162	C110-K112 PolarHBondContact O-N 3.03Å; C110-K112 VanDerWaalsContact O-N 3.16Å; K112-L161 HydrophobicContact CB-CB 3.57Å; K112-L161 WeakPolarHBondContact CB-O 3.45Å; K112-L161 PolarHBondContact N-O 2.88Å; K112-L161 VanDerWaalsContact N-O 3.14Å; K112-D162 WeakPolarHBondContact CG-O 3.16Å
113	G	95.4	Very high	94	Very high	27 Å²	27	45.2 Å²	45.2	28%	0.278	25%	0.251	S	S	.	.			trans	67.2	-152.3	173	0	0	0	0	0	112.8	C110 P111 L160 L161	C110-G113 PolarHBondContact O-N 3.37Å; P111-G113 VanDerWaalsContact C-N 3.3Å; G113-L160 CarbonylContact O-C 3.59Å; G113-L160 WeakPolarHBondContact O-CA 3.48Å; G113-L161 PolarHBondContact O-N 2.99Å
114	E	95.9	Very high	93.8	Very high	70 Å²	70	48.4 Å²	48.4	33%	0.327	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-77.1	145.6	-175.9	-59.7	177.6	-163.4	0	0	112.3	F116 D117 Y118 E157 L160	E114-F116 HydrophobicContact CB-CB 4.41Å; E114-F116 PolarHBondContact O-N 2.73Å; E114-D117 PolarHBondContact O-N 2.67Å; E114-Y118 PolarHBondContact O-N 3.27Å; E114-E157 WeakPolarHBondContact OE2-CA 3.5Å; E114-L160 HydrophobicContact CB-CD2 4.46Å; E114-L160 HydrophobicContact CG-CD2 3.81Å
115	L	97.2	Very high	93.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-28.9	171.6	176.2	61.9	0	0	0	111.2	Y118 L119 I133 I137 P156 I159 L161 L226	L115-Y118 HydrophobicContact CD1-CD1 4.1Å; L115-Y118 PolarHBondContact O-N 2.96Å; L115-L119 WeakPolarHBondContact O-CB 3.37Å; L115-L119 PolarHBondContact O-N 3.22Å; L115-I133 HydrophobicContact CD1-CD1 4.12Å; L115-I133 HydrophobicContact CD1-CG2 4.4Å; L115-I133 HydrophobicContact CD2-CG2 3.91Å; L115-I137 HydrophobicContact CD2-CD1 4.38Å; L115-P156 HydrophobicContact CB-CB 4.45Å; L115-P156 WeakPolarHBondContact CB-O 3.37Å; L115-P156 HydrophobicContact CG-CB 4.38Å; L115-P156 PolarHBondContact N-O 2.68Å; L115-I159 HydrophobicContact CB-CB 4Å; L115-I159 HydrophobicContact CB-CG2 3.9Å; L115-I159 VanDerWaalsContact CB-O 3.3Å; L115-I159 WeakPolarHBondContact CB-O 3.37Å; L115-I159 HydrophobicContact CD2-CB 4.07Å; L115-I159 HydrophobicContact CD2-CD1 4.04Å; L115-I159 HydrophobicContact CD2-CG2 3.75Å; L115-I159 HydrophobicContact CG-CG2 4.46Å; L115-I159 PolarHBondContact N-O 3.32Å; L115-L161 HydrophobicContact CD1-CD1 4.31Å; L115-L226 HydrophobicContact CD1-CD2 4.05Å; L115-L226 HydrophobicContact CD2-CD1 4.28Å; L115-L226 HydrophobicContact CD2-CD2 4.05Å; L115-L226 HydrophobicContact CG-CD2 4.04Å
116	F	94.1	Very high	93.6	Very high	80 Å²	80	52.2 Å²	52.2	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-51.5	172.9	-175.3	-99.1	0	0	0	112.5	E114 Y118 L119 T120 P156 E157	E114-F116 HydrophobicContact CB-CB 4.41Å; E114-F116 PolarHBondContact O-N 2.73Å; F116-Y118 VanDerWaalsContact C-N 3.31Å; F116-Y118 PolarHBondContact O-N 2.86Å; F116-L119 PolarHBondContact O-N 2.88Å; F116-T120 WeakPolarHBondContact O-CB 3.32Å; F116-T120 PolarHBondContact O-N 3.25Å; F116-T120 PolarHBondContact O-OG1 3.41Å; F116-P156 HydrophobicContact CB-CB 3.87Å; F116-P156 HydrophobicContact CD2-CB 4.31Å; F116-P156 PolarHBondContact N-O 3.13Å; F116-E157 HydrophobicContact CB-CG 3.93Å; F116-E157 HydrophobicContact CD2-CG 4.39Å; F116-E157 HydrophobicContact CG-CG 4.04Å
117	D	92.8	Very high	93.5	Very high	93 Å²	93	53.9 Å²	53.9	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-40.8	177.5	-72.4	-25.6	0	0	0	111.2	E114 L119 T120 S121	E114-D117 PolarHBondContact O-N 2.67Å; D117-L119 PolarHBondContact O-N 2.78Å; D117-T120 PolarHBondContact O-N 3.14Å; D117-S121 PolarHBondContact O-N 3.06Å
118	Y	94.8	Very high	93.3	Very high	48 Å²	48	60.7 Å²	60.7	19%	0.188	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-48.5	174.8	-179.3	-121.4	0	0	0	111.4	E114 L115 F116 T120 S121 V122 L125 K129 L161	E114-Y118 PolarHBondContact O-N 3.27Å; L115-Y118 HydrophobicContact CD1-CD1 4.1Å; L115-Y118 PolarHBondContact O-N 2.96Å; F116-Y118 VanDerWaalsContact C-N 3.31Å; F116-Y118 PolarHBondContact O-N 2.86Å; Y118-T120 PolarHBondContact O-N 3.39Å; Y118-S121 PolarHBondContact O-N 3.32Å; Y118-S121 PolarHBondContact O-OG 2.97Å; Y118-V122 HydrophobicContact CE2-CG1 4.04Å; Y118-V122 WeakPolarHBondContact O-CG2 3.2Å; Y118-V122 PolarHBondContact O-N 2.82Å; Y118-L125 HydrophobicContact CD1-CD2 4.35Å; Y118-L125 HydrophobicContact CE1-CD1 4.45Å; Y118-L125 HydrophobicContact CE1-CD2 3.66Å; Y118-K129 WeakPolarHBondContact OH-CE 3.39Å; Y118-K129 PolarHBondContact OH-NZ 3.44Å; Y118-L161 HydrophobicContact CD1-CD1 3.8Å; Y118-L161 HydrophobicContact CG-CD1 3.79Å
119	L	91.7	Very high	93.2	Very high	8 Å²	8	61.7 Å²	61.7	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-45.6	176.4	179.6	66.5	0	0	0	111.2	L115 F116 D117 S121 V122 V123 L125 T225 L226	L115-L119 WeakPolarHBondContact O-CB 3.37Å; L115-L119 PolarHBondContact O-N 3.22Å; F116-L119 PolarHBondContact O-N 2.88Å; D117-L119 PolarHBondContact O-N 2.78Å; L119-S121 PolarHBondContact O-N 3.38Å; L119-V122 CarbonylContact O-C 3.53Å; L119-V122 PolarHBondContact O-N 2.84Å; L119-V122 VanDerWaalsContact O-N 3.12Å; L119-V123 WeakPolarHBondContact O-CA 3.41Å; L119-V123 PolarHBondContact O-N 2.98Å; L119-L125 HydrophobicContact CD1-CG 4.21Å; L119-T225 HydrophobicContact CD2-CG2 3.76Å; L119-L226 HydrophobicContact CD1-CD2 4.31Å; L119-L226 HydrophobicContact CD2-CD2 4.25Å
120	T	87.8	Confident	93.2	Very high	89 Å²	89	59.9 Å²	59.9	55%	0.546	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-38.1	179	-60.6	0	0	0	0	111.7	F116 D117 Y118 V122	F116-T120 WeakPolarHBondContact O-CB 3.32Å; F116-T120 PolarHBondContact O-N 3.25Å; F116-T120 PolarHBondContact O-OG1 3.41Å; D117-T120 PolarHBondContact O-N 3.14Å; Y118-T120 PolarHBondContact O-N 3.39Å; T120-V122 VanDerWaalsContact C-N 3.34Å; T120-V122 PolarHBondContact O-N 2.86Å
121	S	89.8	Confident	93.2	Very high	87 Å²	87	61.4 Å²	61.4	61%	0.608	33%	0.333	S	S	*	.	H	α-helix	trans	-69.1	-27.1	178.5	78	0	0	0	0	114.3	D117 Y118 L119	D117-S121 PolarHBondContact O-N 3.06Å; Y118-S121 PolarHBondContact O-N 3.32Å; Y118-S121 PolarHBondContact O-OG 2.97Å; L119-S121 PolarHBondContact O-N 3.38Å
122	V	88.1	Confident	93.2	Very high	58 Å²	58	60.9 Å²	60.9	35%	0.352	33%	0.329	S	S	.	.	H	α-helix	trans	-113.2	-4.6	-176.2	-57.4	0	0	0	0	114.1	Y118 L119 T120 T124 L125	Y118-V122 HydrophobicContact CE2-CG1 4.04Å; Y118-V122 WeakPolarHBondContact O-CG2 3.2Å; Y118-V122 PolarHBondContact O-N 2.82Å; L119-V122 CarbonylContact O-C 3.53Å; L119-V122 PolarHBondContact O-N 2.84Å; L119-V122 VanDerWaalsContact O-N 3.12Å; T120-V122 VanDerWaalsContact C-N 3.34Å; T120-V122 PolarHBondContact O-N 2.86Å; V122-T124 PolarHBondContact O-N 2.79Å; V122-L125 HydrophobicContact CG2-CD2 3.56Å
123	V	84.3	Confident	93.3	Very high	102 Å²	102	55.9 Å²	55.9	62%	0.618	31%	0.307	S	S	*	.	S	Bend	trans	66.3	-50.9	-176.9	-170.6	0	0	0	0	114.2	L119 G229	L119-V123 WeakPolarHBondContact O-CA 3.41Å; L119-V123 PolarHBondContact O-N 2.98Å; V123-G229 VanDerWaalsContact O-CA 3.22Å; V123-G229 WeakPolarHBondContact O-CA 3.45Å
124	T	87.9	Confident	93.5	Very high	67 Å²	67	54.6 Å²	54.6	41%	0.411	29%	0.294	S	S	.	.	S	Bend	trans	-142.7	156.8	177.5	66.3	0	0	0	0	111.8	V122	V122-T124 PolarHBondContact O-N 2.79Å
125	L	92.3	Very high	93.6	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.042	29%	0.294	C	S	.	.			trans	-106.1	137.7	174.4	-61.4	-176	0	0	0	111.6	Y118 L119 V122 K129 T130 I133 L226	Y118-L125 HydrophobicContact CD1-CD2 4.35Å; Y118-L125 HydrophobicContact CE1-CD1 4.45Å; Y118-L125 HydrophobicContact CE1-CD2 3.66Å; L119-L125 HydrophobicContact CD1-CG 4.21Å; V122-L125 HydrophobicContact CG2-CD2 3.56Å; L125-K129 HydrophobicContact CD1-CG 4.41Å; L125-K129 HydrophobicContact CD2-CG 4.4Å; L125-T130 WeakPolarHBondContact CB-OG1 3.46Å; L125-I133 HydrophobicContact CD1-CD1 3.62Å; L125-L226 WeakPolarHBondContact CB-O 3.39Å; L125-L226 HydrophobicContact CD1-CB 4.28Å; L125-L226 HydrophobicContact CD1-CD1 4.45Å; L125-L226 HydrophobicContact CD1-CD2 3.87Å; L125-L226 HydrophobicContact CD1-CG 4.41Å; L125-L226 PolarHBondContact N-O 3.35Å
126	S	94.4	Very high	93.6	Very high	78 Å²	78	55.7 Å²	55.7	55%	0.545	30%	0.296	S	S	.	.			trans	-58.4	147.4	168.7	70.9	0	0	0	0	110.8	K128 K129 T130	S126-K128 PolarHBondContact O-N 2.84Å; S126-K129 PolarHBondContact O-N 3.32Å; S126-K129 PolarHBondContact OG-N 3.25Å; S126-T130 PolarHBondContact O-N 3.43Å; S126-T130 PolarHBondContact O-OG1 2.87Å
127	E	95.2	Very high	93.9	Very high	36 Å²	36	51.9 Å²	51.9	17%	0.168	28%	0.279	C	S	.	.	H	α-helix	trans	-51.8	-32.6	175.7	-69.5	-173.8	-155	0	0	113.5	R131 L227 I260 S261 P264	E127-R131 WeakPolarHBondContact O-CB 3.31Å; E127-R131 PolarHBondContact O-N 3.31Å; E127-R131 PolarHBondContact O-NH1 2.85Å; E127-L227 HydrophobicContact CG-CD2 4.06Å; E127-I260 HydrophobicContact CG-CD1 4.29Å; E127-I260 WeakPolarHBondContact OE1-CA 3.24Å; E127-S261 VanDerWaalsContact CD-OG 3.25Å; E127-S261 WeakPolarHBondContact OE1-CB 3.47Å; E127-S261 PolarHBondContact OE1-N 2.98Å; E127-S261 PolarHBondContact OE1-OG 2.88Å; E127-S261 PolarHBondContact OE2-OG 3.31Å; E127-P264 HydrophobicContact CG-CG 4.42Å
128	K	94.3	Very high	94.1	Very high	158 Å²	158	47.4 Å²	47.4	69%	0.687	26%	0.255	S	S	*	.	H	α-helix	trans	-62.5	-46.9	175.9	-173.6	-175.9	175.3	-170.1	0	111.5	S126 T132	S126-K128 PolarHBondContact O-N 2.84Å; K128-T132 PolarHBondContact O-N 3.02Å; K128-T132 PolarHBondContact O-OG1 3.3Å
129	K	95.1	Very high	94.3	Very high	62 Å²	62	47.7 Å²	47.7	27%	0.27	26%	0.258	S	S	.	.	H	α-helix	trans	-71.7	-43.2	180	-170.2	128.9	-172.6	-174	0	110.7	Y118 L125 S126 R131 T132 I133	Y118-K129 WeakPolarHBondContact OH-CE 3.39Å; Y118-K129 PolarHBondContact OH-NZ 3.44Å; L125-K129 HydrophobicContact CD1-CG 4.41Å; L125-K129 HydrophobicContact CD2-CG 4.4Å; S126-K129 PolarHBondContact O-N 3.32Å; S126-K129 PolarHBondContact OG-N 3.25Å; K129-R131 VanDerWaalsContact C-N 3.31Å; K129-R131 PolarHBondContact O-N 2.88Å; K129-T132 PolarHBondContact O-N 3.04Å; K129-T132 VanDerWaalsContact O-N 3.13Å; K129-I133 HydrophobicContact CG-CD1 3.81Å; K129-I133 PolarHBondContact O-N 3.37Å
130	T	97.1	Very high	94.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-43.7	173.9	-52.5	0	0	0	0	111.6	L125 S126 T132 I133 M134 M223 L226 L227	L125-T130 WeakPolarHBondContact CB-OG1 3.46Å; S126-T130 PolarHBondContact O-N 3.43Å; S126-T130 PolarHBondContact O-OG1 2.87Å; T130-T132 VanDerWaalsContact C-N 3.34Å; T130-T132 PolarHBondContact O-N 3.35Å; T130-I133 PolarHBondContact O-N 2.81Å; T130-M134 HydrophobicContact CG2-CG 3.83Å; T130-M134 VanDerWaalsContact O-CB 3.24Å; T130-M134 WeakPolarHBondContact O-CB 2.95Å; T130-M134 VanDerWaalsContact O-CG 3.29Å; T130-M134 WeakPolarHBondContact O-CG 3.47Å; T130-M134 PolarHBondContact O-N 2.85Å; T130-M223 HydrophobicContact CG2-CG 4.26Å; T130-L226 HydrophobicContact CG2-CB 4.1Å; T130-L226 HydrophobicContact CG2-CD1 4.37Å; T130-L227 HydrophobicContact CG2-CD2 3.94Å; T130-L227 HydrophobicContact CG2-CG 4Å
131	R	97	Very high	95.2	Very high	43 Å²	43	43 Å²	43	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-44.3	175.8	-176	-171.2	-64.8	95.2	5.4	112.4	E127 K129 R135 F290 F291	E127-R131 WeakPolarHBondContact O-CB 3.31Å; E127-R131 PolarHBondContact O-N 3.31Å; E127-R131 PolarHBondContact O-NH1 2.85Å; K129-R131 VanDerWaalsContact C-N 3.31Å; K129-R131 PolarHBondContact O-N 2.88Å; R131-R135 VanDerWaalsContact O-CB 3.24Å; R131-R135 WeakPolarHBondContact O-CB 3.48Å; R131-R135 PolarHBondContact O-N 3.13Å; R131-F290 HydrophobicContact CB-CE1 3.9Å; R131-F290 HydrophobicContact CB-CE2 4.28Å; R131-F290 HydrophobicContact CB-CZ 3.66Å; R131-F290 WeakPolarHBondContact CD-O 3.35Å; R131-F290 HydrophobicContact CG-CD1 4.47Å; R131-F290 HydrophobicContact CG-CE1 4.13Å; R131-F290 HydrophobicContact CG-CZ 4.26Å; R131-F290 WeakPolarHBondContact CG-O 3.11Å; R131-F290 PolarHBondContact NE-O 2.94Å; R131-F291 HydrophobicContact CG-CD1 3.91Å; R131-F291 HydrophobicContact CG-CE1 4.4Å; R131-F291 WeakPolarHBondContact O-CE1 3.41Å
132	T	96.4	Very high	95.6	Very high	57 Å²	57	42 Å²	42	35%	0.35	22%	0.216	S	C	.	.	H	α-helix	trans	-63.5	-52.2	178.1	-60.4	0	0	0	0	110.9	K128 K129 T130 R135 Q136	K128-T132 PolarHBondContact O-N 3.02Å; K128-T132 PolarHBondContact O-OG1 3.3Å; K129-T132 PolarHBondContact O-N 3.04Å; K129-T132 VanDerWaalsContact O-N 3.13Å; T130-T132 VanDerWaalsContact C-N 3.34Å; T130-T132 PolarHBondContact O-N 3.35Å; T132-R135 PolarHBondContact O-N 3.12Å; T132-Q136 WeakPolarHBondContact O-CG 3.34Å; T132-Q136 PolarHBondContact O-N 3.31Å
133	I	98.1	Very high	96.1	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-50.8	-177.9	-72.5	165.4	0	0	0	110.8	L115 L125 K129 T130 R135 Q136 I137 V167 L226	L115-I133 HydrophobicContact CD1-CD1 4.12Å; L115-I133 HydrophobicContact CD1-CG2 4.4Å; L115-I133 HydrophobicContact CD2-CG2 3.91Å; L125-I133 HydrophobicContact CD1-CD1 3.62Å; K129-I133 HydrophobicContact CG-CD1 3.81Å; K129-I133 PolarHBondContact O-N 3.37Å; T130-I133 PolarHBondContact O-N 2.81Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 3.47Å; I133-Q136 PolarHBondContact O-N 3.45Å; I133-Q136 VanDerWaalsContact O-N 3.14Å; I133-I137 HydrophobicContact CG2-CD1 3.68Å; I133-I137 HydrophobicContact CG2-CG1 4.43Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.97Å; I133-V167 HydrophobicContact CB-CG2 4.4Å; I133-V167 HydrophobicContact CG2-CG2 3.85Å; I133-L226 HydrophobicContact CG2-CD1 3.9Å
134	M	98.6	Very high	96.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-34.9	-179	-70.2	-53.6	-50	0	0	112.5	T130 Q136 I137 F138 C219 I222 M223 L226 F291	T130-M134 HydrophobicContact CG2-CG 3.83Å; T130-M134 VanDerWaalsContact O-CB 3.24Å; T130-M134 WeakPolarHBondContact O-CB 2.95Å; T130-M134 VanDerWaalsContact O-CG 3.29Å; T130-M134 WeakPolarHBondContact O-CG 3.47Å; T130-M134 PolarHBondContact O-N 2.85Å; M134-Q136 VanDerWaalsContact C-N 3.34Å; M134-I137 HydrophobicContact CE-CD1 4.33Å; M134-I137 HydrophobicContact CE-CG2 4.49Å; M134-I137 PolarHBondContact O-N 2.92Å; M134-I137 HydrophobicContact SD-CD1 3.78Å; M134-F138 HydrophobicContact CB-CD2 4.32Å; M134-F138 HydrophobicContact CB-CE2 4.31Å; M134-F138 HydrophobicContact CE-CD2 4Å; M134-F138 HydrophobicContact CE-CE2 3.4Å; M134-F138 HydrophobicContact CE-CZ 3.84Å; M134-F138 WeakPolarHBondContact O-CB 3.38Å; M134-F138 WeakPolarHBondContact O-CD2 3.38Å; M134-F138 PolarHBondContact O-N 3.2Å; M134-C219 HydrophobicContact CE-CB 4.08Å; M134-C219 WeakPolarHBondContact CE-O 3.18Å; M134-I222 HydrophobicContact SD-CG2 3.91Å; M134-M223 HydrophobicContact CE-CB 3.91Å; M134-M223 HydrophobicContact CG-CB 4.06Å; M134-M223 HydrophobicContact CG-CG 3.96Å; M134-M223 HydrophobicContact CG-SD 4.33Å; M134-M223 HydrophobicContact SD-CB 3.83Å; M134-M223 HydrophobicContact SD-CG 4.4Å; M134-L226 HydrophobicContact CG-CD1 4.35Å; M134-L226 HydrophobicContact SD-CD1 3.85Å; M134-F291 HydrophobicContact CB-CE1 3.95Å; M134-F291 HydrophobicContact CB-CZ 3.93Å
135	R	98.3	Very high	97.3	Very high	85 Å²	85	34.8 Å²	34.8	32%	0.321	17%	0.165	S	C	.	.	H	α-helix	trans	-61.3	-46	175	-179.7	169.9	55.5	164.6	6.6	111	R131 T132 I133 F138 E139 L286 F291	R131-R135 VanDerWaalsContact O-CB 3.24Å; R131-R135 WeakPolarHBondContact O-CB 3.48Å; R131-R135 PolarHBondContact O-N 3.13Å; T132-R135 PolarHBondContact O-N 3.12Å; I133-R135 VanDerWaalsContact C-N 3.29Å; I133-R135 PolarHBondContact O-N 3.47Å; R135-F138 PolarHBondContact O-N 3.05Å; R135-E139 HydrophobicContact CG-CG 4.3Å; R135-E139 VanDerWaalsContact CG-OE1 3.31Å; R135-E139 WeakPolarHBondContact CG-OE1 3.07Å; R135-E139 WeakPolarHBondContact O-CB 3.38Å; R135-E139 VanDerWaalsContact O-CG 3.26Å; R135-E139 WeakPolarHBondContact O-CG 3.04Å; R135-E139 PolarHBondContact O-N 2.88Å; R135-L286 HydrophobicContact CG-CD2 4.34Å; R135-F291 HydrophobicContact CB-CD1 3.68Å; R135-F291 HydrophobicContact CB-CE1 3.75Å; R135-F291 HydrophobicContact CG-CD1 4.32Å
136	Q	98.6	Very high	97.5	Very high	8 Å²	8	38.3 Å²	38.3	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-40.8	178.3	-63.3	-179.2	-25.3	0	0	111.8	Y89 T132 I133 M134 E139 G140 N166 V167	Y89-Q136 HydrophobicContact CD1-CB 3.76Å; Y89-Q136 HydrophobicContact CD1-CG 3.94Å; Y89-Q136 HydrophobicContact CD2-CB 4.04Å; Y89-Q136 HydrophobicContact CD2-CG 4.49Å; Y89-Q136 WeakPolarHBondContact CD2-O 3.37Å; Y89-Q136 HydrophobicContact CE1-CB 3.81Å; Y89-Q136 HydrophobicContact CE1-CG 3.44Å; Y89-Q136 VanDerWaalsContact CE1-CG 3.44Å; Y89-Q136 HydrophobicContact CE2-CB 4.14Å; Y89-Q136 HydrophobicContact CE2-CG 4.12Å; Y89-Q136 HydrophobicContact CG-CB 3.86Å; Y89-Q136 HydrophobicContact CG-CG 4.42Å; T132-Q136 WeakPolarHBondContact O-CG 3.34Å; T132-Q136 PolarHBondContact O-N 3.31Å; I133-Q136 PolarHBondContact O-N 3.45Å; I133-Q136 VanDerWaalsContact O-N 3.14Å; M134-Q136 VanDerWaalsContact C-N 3.34Å; Q136-E139 PolarHBondContact O-N 3.46Å; Q136-G140 PolarHBondContact O-N 3.37Å; Q136-N166 PolarHBondContact NE2-OD1 3.33Å; Q136-N166 VanDerWaalsContact OE1-CA 3.31Å; Q136-V167 HydrophobicContact CB-CB 3.86Å; Q136-V167 HydrophobicContact CB-CG1 4.48Å; Q136-V167 HydrophobicContact CB-CG2 4.19Å
137	I	98.8	Very high	97.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.4	-51.8	173.7	-65.5	164.4	0	0	0	110.1	L115 I133 M134 E139 G140 V141 I159 V167 I222	L115-I137 HydrophobicContact CD2-CD1 4.38Å; I133-I137 HydrophobicContact CG2-CD1 3.68Å; I133-I137 HydrophobicContact CG2-CG1 4.43Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.97Å; M134-I137 HydrophobicContact CE-CD1 4.33Å; M134-I137 HydrophobicContact CE-CG2 4.49Å; M134-I137 PolarHBondContact O-N 2.92Å; M134-I137 HydrophobicContact SD-CD1 3.78Å; I137-E139 PolarHBondContact O-N 2.89Å; I137-G140 PolarHBondContact O-N 3.2Å; I137-V141 HydrophobicContact CG2-CG2 4.33Å; I137-V141 WeakPolarHBondContact O-CG2 3.26Å; I137-V141 PolarHBondContact O-N 2.82Å; I137-I159 HydrophobicContact CD1-CD1 3.57Å; I137-I159 HydrophobicContact CG1-CD1 3.97Å; I137-V167 HydrophobicContact CG1-CG1 3.82Å; I137-V167 HydrophobicContact CG1-CG2 4.06Å; I137-I222 HydrophobicContact CD1-CG2 4.24Å
138	F	98.8	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-34.3	-179.5	-76	-61.9	0	0	0	113.1	M134 R135 V141 E142 C219 V282 V285 L286 F291	M134-F138 HydrophobicContact CB-CD2 4.32Å; M134-F138 HydrophobicContact CB-CE2 4.31Å; M134-F138 HydrophobicContact CE-CD2 4Å; M134-F138 HydrophobicContact CE-CE2 3.4Å; M134-F138 HydrophobicContact CE-CZ 3.84Å; M134-F138 WeakPolarHBondContact O-CB 3.38Å; M134-F138 WeakPolarHBondContact O-CD2 3.38Å; M134-F138 PolarHBondContact O-N 3.2Å; R135-F138 PolarHBondContact O-N 3.05Å; F138-V141 PolarHBondContact O-N 2.87Å; F138-E142 WeakPolarHBondContact O-CB 3.28Å; F138-E142 PolarHBondContact O-N 2.77Å; F138-C219 HydrophobicContact CD1-CB 4.22Å; F138-C219 HydrophobicContact CE1-CB 3.34Å; F138-C219 HydrophobicContact CE2-CB 4.45Å; F138-C219 HydrophobicContact CZ-CB 3.48Å; F138-C219 VanDerWaalsContact CZ-CB 3.48Å; F138-V282 HydrophobicContact CB-CG2 4.26Å; F138-V282 HydrophobicContact CD1-CG2 4.15Å; F138-V282 VanDerWaalsContact O-CG2 3.25Å; F138-V282 WeakPolarHBondContact O-CG2 3.22Å; F138-V285 HydrophobicContact CB-CG1 4.29Å; F138-V285 HydrophobicContact CD1-CB 4.35Å; F138-V285 HydrophobicContact CD1-CG1 3.67Å; F138-V285 HydrophobicContact CD2-CG1 3.41Å; F138-V285 VanDerWaalsContact CD2-CG1 3.41Å; F138-V285 HydrophobicContact CE1-CB 4.4Å; F138-V285 HydrophobicContact CE1-CG1 3.71Å; F138-V285 HydrophobicContact CE1-CG2 4.2Å; F138-V285 HydrophobicContact CE2-CG1 3.47Å; F138-V285 VanDerWaalsContact CE2-CG1 3.47Å; F138-V285 HydrophobicContact CG-CG1 3.53Å; F138-V285 HydrophobicContact CZ-CG1 3.61Å; F138-V285 HydrophobicContact CZ-CG2 4.45Å; F138-L286 HydrophobicContact CB-CD2 3.71Å; F138-L286 HydrophobicContact CB-CG 4.18Å; F138-F291 AromaticContact CD2-CE2 3.95Å; F138-F291 HydrophobicContact CD2-CE2 3.95Å; F138-F291 AromaticContact CD2-CZ 3.6Å; F138-F291 HydrophobicContact CD2-CZ 3.6Å; F138-F291 HydrophobicContact CE2-CE2 4.24Å; F138-F291 AromaticContact CE2-CZ 3.92Å; F138-F291 HydrophobicContact CE2-CZ 3.92Å
139	E	98.6	Very high	98	Very high	53 Å²	53	30.7 Å²	30.7	25%	0.248	16%	0.158	C	C	.	.	H	α-helix	trans	-63.4	-41.5	172	-75.6	168.6	175.4	0	0	110.9	Y89 R135 Q136 I137 Y143 L286	Y89-E139 HydrophobicContact CD2-CB 3.82Å; Y89-E139 HydrophobicContact CE2-CB 3.87Å; Y89-E139 WeakPolarHBondContact CE2-OE2 3.43Å; Y89-E139 PolarHBondContact OH-OE2 2.96Å; R135-E139 HydrophobicContact CG-CG 4.3Å; R135-E139 VanDerWaalsContact CG-OE1 3.31Å; R135-E139 WeakPolarHBondContact CG-OE1 3.07Å; R135-E139 WeakPolarHBondContact O-CB 3.38Å; R135-E139 VanDerWaalsContact O-CG 3.26Å; R135-E139 WeakPolarHBondContact O-CG 3.04Å; R135-E139 PolarHBondContact O-N 2.88Å; Q136-E139 PolarHBondContact O-N 3.46Å; I137-E139 PolarHBondContact O-N 2.89Å; E139-Y143 PolarHBondContact O-N 3Å; E139-Y143 VanDerWaalsContact O-N 3.14Å; E139-L286 HydrophobicContact CG-CD1 4.23Å; E139-L286 HydrophobicContact CG-CD2 3.9Å
140	G	98.7	Very high	98.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-43	172.2	0	0	0	0	0	113.3	Q136 I137 Y143 I144	Q136-G140 PolarHBondContact O-N 3.37Å; I137-G140 PolarHBondContact O-N 3.2Å; G140-Y143 WeakPolarHBondContact O-CB 3.27Å; G140-Y143 PolarHBondContact O-N 2.77Å; G140-I144 PolarHBondContact O-N 2.91Å; G140-I144 VanDerWaalsContact O-N 3.15Å
141	V	98.8	Very high	98.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.4	-42.6	176.8	172.5	0	0	0	0	111.3	I137 F138 Y143 I144 H145 L154 I169 D215 I216 V282	I137-V141 HydrophobicContact CG2-CG2 4.33Å; I137-V141 WeakPolarHBondContact O-CG2 3.26Å; I137-V141 PolarHBondContact O-N 2.82Å; F138-V141 PolarHBondContact O-N 2.87Å; V141-Y143 VanDerWaalsContact C-N 3.27Å; V141-Y143 PolarHBondContact O-N 3.17Å; V141-I144 VanDerWaalsContact O-CG1 3.25Å; V141-I144 WeakPolarHBondContact O-CG1 3.25Å; V141-I144 PolarHBondContact O-N 3.26Å; V141-H145 WeakPolarHBondContact CG1-CE1 3.38Å; V141-H145 VanDerWaalsContact O-CB 3.28Å; V141-H145 WeakPolarHBondContact O-CB 3.41Å; V141-H145 PolarHBondContact O-CD2 3.45Å; V141-H145 VanDerWaalsContact O-CG 3.24Å; V141-H145 PolarHBondContact O-N 3.24Å; V141-L154 HydrophobicContact CG2-CD1 3.72Å; V141-I169 HydrophobicContact CG2-CD1 4.24Å; V141-D215 HydrophobicContact CG1-CB 4.3Å; V141-I216 HydrophobicContact CG1-CD1 4.18Å; V141-V282 HydrophobicContact CB-CG2 4.41Å; V141-V282 HydrophobicContact CG1-CG2 4.24Å
142	E	98.6	Very high	98.2	Very high	66 Å²	66	27.1 Å²	27.1	31%	0.308	14%	0.143	S	C	.	.	H	α-helix	trans	-57.3	-44.2	174.9	-176.8	178.8	-131.4	0	0	111	F138 H145 A146 V282 K283 L286	F138-E142 WeakPolarHBondContact O-CB 3.28Å; F138-E142 PolarHBondContact O-N 2.77Å; E142-H145 PolarHBondContact O-N 3.45Å; E142-A146 WeakPolarHBondContact O-CB 3.49Å; E142-A146 PolarHBondContact O-N 3.29Å; E142-V282 HydrophobicContact CB-CB 4.49Å; E142-V282 HydrophobicContact CB-CG1 3.95Å; E142-V282 HydrophobicContact CB-CG2 3.75Å; E142-V282 HydrophobicContact CG-CG1 4.07Å; E142-K283 WeakPolarHBondContact OE1-CG 3.25Å; E142-L286 HydrophobicContact CB-CD1 4.2Å; E142-L286 WeakPolarHBondContact OE2-CD1 3.33Å
143	Y	98.7	Very high	98.3	Very high	58 Å²	58	24.7 Å²	24.7	23%	0.227	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-41.9	-178.8	175.3	-98.3	0	0	0	113.6	V84 H87 I90 E139 G140 V141 K147	V84-Y143 HydrophobicContact CB-CE1 3.99Å; V84-Y143 HydrophobicContact CG1-CE1 4.5Å; V84-Y143 VanDerWaalsContact O-CE1 3.23Å; V84-Y143 WeakPolarHBondContact O-CE1 3.46Å; H87-Y143 HydrophobicContact CB-CD1 3.67Å; H87-Y143 HydrophobicContact CB-CD2 4.3Å; H87-Y143 HydrophobicContact CB-CE1 3.52Å; H87-Y143 HydrophobicContact CB-CE2 4.15Å; H87-Y143 HydrophobicContact CB-CG 4.05Å; H87-Y143 AromaticContact CD2-CD1 3.92Å; H87-Y143 AromaticContact CD2-CD2 3.38Å; H87-Y143 WeakPolarHBondContact CD2-CD2 3.47Å; H87-Y143 AromaticContact CD2-CE2 3.89Å; H87-Y143 AromaticContact CD2-CG 3.36Å; H87-Y143 AromaticContact CG-CD1 3.72Å; H87-Y143 AromaticContact CG-CG 3.66Å; H87-Y143 AromaticContact NE2-CG 3.95Å; I90-Y143 HydrophobicContact CG1-CD1 4.15Å; E139-Y143 PolarHBondContact O-N 3Å; E139-Y143 VanDerWaalsContact O-N 3.14Å; G140-Y143 WeakPolarHBondContact O-CB 3.27Å; G140-Y143 PolarHBondContact O-N 2.77Å; V141-Y143 VanDerWaalsContact C-N 3.27Å; V141-Y143 PolarHBondContact O-N 3.17Å; Y143-K147 VanDerWaalsContact CE1-NZ 3.35Å; Y143-K147 PolarHBondContact O-NZ 3.29Å; Y143-K147 WeakPolarHBondContact OH-CE 3.43Å; Y143-K147 PolarHBondContact OH-NZ 3.13Å; Y143-K147 VanDerWaalsContact OH-NZ 3.17Å
144	I	98.5	Very high	98.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-74.7	-36.5	176.8	65.4	174	0	0	0	111	V84 I90 G140 V141 A146 K147 I149 H151 F172	V84-I144 HydrophobicContact CB-CG2 4.32Å; V84-I144 HydrophobicContact CG1-CG2 3.82Å; I90-I144 HydrophobicContact CD1-CG2 3.94Å; I90-I144 HydrophobicContact CG1-CG2 4.43Å; G140-I144 PolarHBondContact O-N 2.91Å; G140-I144 VanDerWaalsContact O-N 3.15Å; V141-I144 VanDerWaalsContact O-CG1 3.25Å; V141-I144 WeakPolarHBondContact O-CG1 3.25Å; V141-I144 PolarHBondContact O-N 3.26Å; I144-A146 VanDerWaalsContact C-N 3.31Å; I144-A146 PolarHBondContact O-N 2.92Å; I144-K147 PolarHBondContact O-N 3.31Å; I144-I149 HydrophobicContact CB-CB 4.25Å; I144-I149 HydrophobicContact CB-CG2 4.36Å; I144-I149 WeakPolarHBondContact O-CB 3.27Å; I144-I149 PolarHBondContact O-N 3.29Å; I144-H151 HydrophobicContact CD1-CB 3.98Å; I144-F172 HydrophobicContact CD1-CE1 4.47Å; I144-F172 HydrophobicContact CG2-CE1 4.16Å; I144-F172 HydrophobicContact CG2-CZ 4.39Å
145	H	98.1	Very high	98.3	Very high	17 Å²	17	26.2 Å²	26.2	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-65	-35.8	176.6	-75.3	-170.6	0	0	0	111.9	V141 E142 K147 S148 I149 Q212 D215	V141-H145 WeakPolarHBondContact CG1-CE1 3.38Å; V141-H145 VanDerWaalsContact O-CB 3.28Å; V141-H145 WeakPolarHBondContact O-CB 3.41Å; V141-H145 PolarHBondContact O-CD2 3.45Å; V141-H145 VanDerWaalsContact O-CG 3.24Å; V141-H145 PolarHBondContact O-N 3.24Å; E142-H145 PolarHBondContact O-N 3.45Å; H145-K147 PolarHBondContact O-N 3.44Å; H145-K147 VanDerWaalsContact O-N 3.14Å; H145-S148 PolarHBondContact O-N 2.86Å; H145-I149 PolarHBondContact CD2-O 3.07Å; H145-I149 VanDerWaalsContact CD2-O 3.26Å; H145-Q212 PolarHBondContact CE1-O 3.21Å; H145-Q212 PolarHBondContact O-NE2 2.97Å; H145-D215 IonicContact CD2-OD2 3.29Å; H145-D215 IonicContact CE1-OD2 3.25Å; H145-D215 IonicContact NE2-OD2 2.66Å; H145-D215 PolarHBondContact NE2-OD2 2.96Å
146	A	97.7	Very high	98.2	Very high	82 Å²	82	22.1 Å²	22.1	68%	0.678	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.1	174.2	0	0	0	0	0	113.8	E142 I144	E142-A146 WeakPolarHBondContact O-CB 3.49Å; E142-A146 PolarHBondContact O-N 3.29Å; I144-A146 VanDerWaalsContact C-N 3.31Å; I144-A146 PolarHBondContact O-N 2.92Å
147	K	97.8	Very high	98.1	Very high	58 Å²	58	24.3 Å²	24.3	25%	0.252	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	12.9	174	-66	178.5	-178.2	58	0	113.1	Q83 V84 Y143 I144 H145 I149 Q177	Q83-K147 WeakPolarHBondContact O-CE 3.47Å; V84-K147 HydrophobicContact CG1-CD 4.33Å; Y143-K147 VanDerWaalsContact CE1-NZ 3.35Å; Y143-K147 PolarHBondContact O-NZ 3.29Å; Y143-K147 WeakPolarHBondContact OH-CE 3.43Å; Y143-K147 PolarHBondContact OH-NZ 3.13Å; Y143-K147 VanDerWaalsContact OH-NZ 3.17Å; I144-K147 PolarHBondContact O-N 3.31Å; H145-K147 PolarHBondContact O-N 3.44Å; H145-K147 VanDerWaalsContact O-N 3.14Å; K147-I149 HydrophobicContact CB-CD1 3.85Å; K147-I149 HydrophobicContact CB-CG1 4.2Å; K147-I149 HydrophobicContact CD-CD1 4.38Å; K147-I149 PolarHBondContact O-N 3.45Å; K147-Q177 PolarHBondContact O-NE2 2.87Å
148	S	97.6	Very high	98	Very high	54 Å²	54	24.9 Å²	24.9	38%	0.378	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	25.3	-173.5	-53.4	0	0	0	0	113.6	H145 Q177 L178	H145-S148 PolarHBondContact O-N 2.86Å; S148-Q177 CarbonylContact O-C 3.59Å; S148-Q177 WeakPolarHBondContact O-CA 3.18Å; S148-L178 VanDerWaalsContact CB-O 3.26Å; S148-L178 WeakPolarHBondContact CB-O 3.5Å; S148-L178 PolarHBondContact O-N 2.95Å
149	I	98.3	Very high	98	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.7	178.1	-64.6	161.9	0	0	0	109.2	I80 Q83 V84 I144 H145 K147 A175 K176 Q177	I80-I149 HydrophobicContact CG2-CD1 4.24Å; I80-I149 HydrophobicContact CG2-CG2 4.05Å; Q83-I149 HydrophobicContact CB-CD1 4.47Å; V84-I149 HydrophobicContact CG1-CD1 3.56Å; I144-I149 HydrophobicContact CB-CB 4.25Å; I144-I149 HydrophobicContact CB-CG2 4.36Å; I144-I149 WeakPolarHBondContact O-CB 3.27Å; I144-I149 PolarHBondContact O-N 3.29Å; H145-I149 PolarHBondContact CD2-O 3.07Å; H145-I149 VanDerWaalsContact CD2-O 3.26Å; K147-I149 HydrophobicContact CB-CD1 3.85Å; K147-I149 HydrophobicContact CB-CG1 4.2Å; K147-I149 HydrophobicContact CD-CD1 4.38Å; K147-I149 PolarHBondContact O-N 3.45Å; I149-A175 HydrophobicContact CG2-CB 4.28Å; I149-K176 WeakPolarHBondContact CA-O 3.21Å; I149-Q177 HydrophobicContact CG1-CB 4.05Å; I149-Q177 HydrophobicContact CG1-CG 4.19Å
150	V	98.1	Very high	98	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.1	170.4	-168.4	0	0	0	0	108.4	R152 A175 K176 L178 Q212 V214 D215	V150-R152 HydrophobicContact CB-CG 4.13Å; V150-R152 HydrophobicContact CG1-CG 3.59Å; V150-A175 CarbonylContact O-C 3.41Å; V150-A175 WeakPolarHBondContact O-CA 3.42Å; V150-A175 WeakPolarHBondContact O-CB 3.38Å; V150-K176 PolarHBondContact N-O 3.03Å; V150-K176 PolarHBondContact O-N 3.19Å; V150-L178 HydrophobicContact CG2-CD1 3.52Å; V150-L178 HydrophobicContact CG2-CG 3.93Å; V150-Q212 HydrophobicContact CG2-CB 4.39Å; V150-Q212 HydrophobicContact CG2-CG 3.64Å; V150-V214 HydrophobicContact CG1-CG2 3.67Å; V150-D215 WeakPolarHBondContact CG1-OD2 3.49Å
151	H	98.5	Very high	98	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.			trans	-80.7	-44.2	-178	-172.1	-50.4	0	0	0	113	I144 D153 L154 T170 D171 F174 D215	I144-H151 HydrophobicContact CD1-CB 3.98Å; H151-D153 PolarHBondContact ND1-N 2.88Å; H151-D153 PolarHBondContact O-N 3.2Å; H151-D153 VanDerWaalsContact O-N 3.14Å; H151-L154 HydrophobicContact CB-CD1 4.43Å; H151-L154 HydrophobicContact CB-CD2 4.26Å; H151-L154 HydrophobicContact CB-CG 3.98Å; H151-L154 VanDerWaalsContact CD2-CD2 3.46Å; H151-L154 WeakPolarHBondContact CD2-CD2 3.48Å; H151-T170 PolarHBondContact NE2-O 2.98Å; H151-D171 PolarHBondContact CE1-O 3.1Å; H151-F174 CarbonylContact O-C 3.38Å; H151-D215 PolarHBondContact N-OD1 3.35Å; H151-D215 PolarHBondContact N-OD2 3.47Å
152	R	97.6	Very high	97.8	Very high	29 Å²	29	25.5 Å²	25.5	11%	0.109	14%	0.137	C	C	.	.	S	Bend	trans	67.4	-2.4	176.4	-52.7	-169.2	-70.9	176.4	-1.4	118.1	V150 F174 N186 C188 Y210 D215	V150-R152 HydrophobicContact CB-CG 4.13Å; V150-R152 HydrophobicContact CG1-CG 3.59Å; R152-F174 HydrophobicContact CB-CB 4.41Å; R152-F174 PolarHBondContact NE-O 3.43Å; R152-F174 PolarHBondContact NH2-O 3.48Å; R152-N186 PolarHBondContact NH1-ND2 2.77Å; R152-N186 VanDerWaalsContact NH1-ND2 3.16Å; R152-N186 PolarHBondContact NH1-OD1 2.98Å; R152-C188 VanDerWaalsContact CZ-SG 3.56Å; R152-Y210 HydrophobicContact CG-CE2 4.42Å; R152-Y210 PolarHBondContact NH1-OH 3.31Å; R152-D215 PolarHBondContact N-OD1 2.91Å
153	D	97.6	Very high	97.6	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.032	15%	0.154	C	C	.	.			trans	-144.8	43.4	175.8	-161.2	39.6	0	0	0	111.7	H151 K155 N158 F174 G189 T190	H151-D153 PolarHBondContact ND1-N 2.88Å; H151-D153 PolarHBondContact O-N 3.2Å; H151-D153 VanDerWaalsContact O-N 3.14Å; D153-K155 PolarHBondContact O-N 2.9Å; D153-K155 IonicContact OD1-NZ 3.37Å; D153-K155 VanDerWaalsContact OD2-CE 3.28Å; D153-K155 WeakPolarHBondContact OD2-CE 3.46Å; D153-K155 IonicContact OD2-NZ 3.5Å; D153-K155 PolarHBondContact OD2-NZ 3.26Å; D153-K155 VanDerWaalsContact OD2-NZ 3.07Å; D153-N158 PolarHBondContact O-ND2 2.9Å; D153-N158 PolarHBondContact OD2-ND2 3.36Å; D153-F174 HydrophobicContact CB-CB 4.33Å; D153-F174 HydrophobicContact CB-CD2 3.69Å; D153-F174 HydrophobicContact CB-CG 4.41Å; D153-G189 VanDerWaalsContact OD1-CA 3.26Å; D153-G189 WeakPolarHBondContact OD1-CA 3.46Å; D153-T190 WeakPolarHBondContact OD1-CB 3.49Å; D153-T190 PolarHBondContact OD1-N 3.45Å; D153-T190 PolarHBondContact OD1-OG1 3.15Å
154	L	98.6	Very high	97.4	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.174	C	C	.	.			trans	-70.6	122.1	172.3	-70.8	172	0	0	0	110	V141 H151 I169 D215 A218 I222	V141-L154 HydrophobicContact CG2-CD1 3.72Å; H151-L154 HydrophobicContact CB-CD1 4.43Å; H151-L154 HydrophobicContact CB-CD2 4.26Å; H151-L154 HydrophobicContact CB-CG 3.98Å; H151-L154 VanDerWaalsContact CD2-CD2 3.46Å; H151-L154 WeakPolarHBondContact CD2-CD2 3.48Å; L154-I169 HydrophobicContact CD2-CG2 3.88Å; L154-D215 HydrophobicContact CD1-CB 3.68Å; L154-A218 HydrophobicContact CB-CB 3.86Å; L154-I222 HydrophobicContact CB-CD1 4.18Å
155	K	97.7	Very high	97.1	Very high	32 Å²	32	35 Å²	35	14%	0.139	19%	0.187	C	C	.	.			trans	-157.6	162.2	176.9	59.9	-176.4	167.2	-170.7	0	109.4	D153 E157 N158 I159 T190 Y193	D153-K155 PolarHBondContact O-N 2.9Å; D153-K155 IonicContact OD1-NZ 3.37Å; D153-K155 VanDerWaalsContact OD2-CE 3.28Å; D153-K155 WeakPolarHBondContact OD2-CE 3.46Å; D153-K155 IonicContact OD2-NZ 3.5Å; D153-K155 PolarHBondContact OD2-NZ 3.26Å; D153-K155 VanDerWaalsContact OD2-NZ 3.07Å; K155-E157 VanDerWaalsContact CB-OE2 3.31Å; K155-E157 WeakPolarHBondContact CB-OE2 3.43Å; K155-E157 HydrophobicContact CD-CB 4.17Å; K155-E157 WeakPolarHBondContact CD-OE2 3.47Å; K155-E157 HydrophobicContact CG-CB 4.12Å; K155-E157 VanDerWaalsContact CG-OE2 3.31Å; K155-E157 WeakPolarHBondContact CG-OE2 3.35Å; K155-E157 PolarHBondContact O-N 3.47Å; K155-N158 VanDerWaalsContact CE-CG 3.46Å; K155-N158 VanDerWaalsContact CE-ND2 3.26Å; K155-N158 WeakPolarHBondContact CE-ND2 3.23Å; K155-N158 WeakPolarHBondContact CE-OD1 3.39Å; K155-N158 HydrophobicContact CG-CB 4.07Å; K155-N158 PolarHBondContact O-N 3.42Å; K155-I159 PolarHBondContact O-N 3.33Å; K155-T190 HydrophobicContact CD-CG2 4.37Å; K155-T190 WeakPolarHBondContact CD-OG1 3.42Å; K155-T190 PolarHBondContact NZ-OG1 2.88Å; K155-Y193 HydrophobicContact CB-CD1 4.15Å; K155-Y193 HydrophobicContact CB-CD2 3.76Å; K155-Y193 HydrophobicContact CB-CE1 4.06Å; K155-Y193 HydrophobicContact CB-CE2 3.63Å; K155-Y193 HydrophobicContact CB-CG 4.03Å
156	P	97.2	Very high	97.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-57.2	-27.4	-179.9	-25.7	37	0	0	0	114.7	L115 F116 N158 I159 Y193 I222	L115-P156 HydrophobicContact CB-CB 4.45Å; L115-P156 WeakPolarHBondContact CB-O 3.37Å; L115-P156 HydrophobicContact CG-CB 4.38Å; L115-P156 PolarHBondContact N-O 2.68Å; F116-P156 HydrophobicContact CB-CB 3.87Å; F116-P156 HydrophobicContact CD2-CB 4.31Å; F116-P156 PolarHBondContact N-O 3.13Å; P156-N158 VanDerWaalsContact C-N 3.33Å; P156-I159 PolarHBondContact O-N 2.79Å; P156-Y193 VanDerWaalsContact CD-CZ 3.46Å; P156-Y193 WeakPolarHBondContact CD-OH 3.27Å; P156-I222 HydrophobicContact CG-CG1 4.32Å
157	E	95.6	Very high	97.1	Very high	53 Å²	53	32.8 Å²	32.8	25%	0.248	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-67.8	-33.4	175.2	-57.4	91	139.6	0	0	111.6	E114 F116 K155 I159	E114-E157 WeakPolarHBondContact OE2-CA 3.5Å; F116-E157 HydrophobicContact CB-CG 3.93Å; F116-E157 HydrophobicContact CD2-CG 4.39Å; F116-E157 HydrophobicContact CG-CG 4.04Å; K155-E157 VanDerWaalsContact CB-OE2 3.31Å; K155-E157 WeakPolarHBondContact CB-OE2 3.43Å; K155-E157 HydrophobicContact CD-CB 4.17Å; K155-E157 WeakPolarHBondContact CD-OE2 3.47Å; K155-E157 HydrophobicContact CG-CB 4.12Å; K155-E157 VanDerWaalsContact CG-OE2 3.31Å; K155-E157 WeakPolarHBondContact CG-OE2 3.35Å; K155-E157 PolarHBondContact O-N 3.47Å; E157-I159 VanDerWaalsContact C-N 3.27Å; E157-I159 PolarHBondContact O-N 3.43Å
158	N	97.4	Very high	97.1	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.064	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-92.6	17.5	178.9	-69.4	-1.7	0	0	0	112.7	D153 K155 P156 T170 D171	D153-N158 PolarHBondContact O-ND2 2.9Å; D153-N158 PolarHBondContact OD2-ND2 3.36Å; K155-N158 VanDerWaalsContact CE-CG 3.46Å; K155-N158 VanDerWaalsContact CE-ND2 3.26Å; K155-N158 WeakPolarHBondContact CE-ND2 3.23Å; K155-N158 WeakPolarHBondContact CE-OD1 3.39Å; K155-N158 HydrophobicContact CG-CB 4.07Å; K155-N158 PolarHBondContact O-N 3.42Å; P156-N158 VanDerWaalsContact C-N 3.33Å; N158-T170 WeakPolarHBondContact O-CG2 3.39Å; N158-T170 PolarHBondContact O-N 3.5Å; N158-D171 HydrophobicContact CB-CB 4.4Å
159	I	98.5	Very high	97.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	110.7	174	-66.1	163.4	0	0	0	107.9	L115 I137 K155 P156 E157 V167 I222	L115-I159 HydrophobicContact CB-CB 4Å; L115-I159 HydrophobicContact CB-CG2 3.9Å; L115-I159 VanDerWaalsContact CB-O 3.3Å; L115-I159 WeakPolarHBondContact CB-O 3.37Å; L115-I159 HydrophobicContact CD2-CB 4.07Å; L115-I159 HydrophobicContact CD2-CD1 4.04Å; L115-I159 HydrophobicContact CD2-CG2 3.75Å; L115-I159 HydrophobicContact CG-CG2 4.46Å; L115-I159 PolarHBondContact N-O 3.32Å; I137-I159 HydrophobicContact CD1-CD1 3.57Å; I137-I159 HydrophobicContact CG1-CD1 3.97Å; K155-I159 PolarHBondContact O-N 3.33Å; P156-I159 PolarHBondContact O-N 2.79Å; E157-I159 VanDerWaalsContact C-N 3.27Å; E157-I159 PolarHBondContact O-N 3.43Å; I159-V167 HydrophobicContact CG2-CB 4.29Å; I159-V167 HydrophobicContact CG2-CG1 3.76Å; I159-V167 HydrophobicContact CG2-CG2 3.96Å; I159-I222 HydrophobicContact CD1-CD1 3.87Å; I159-I222 HydrophobicContact CD1-CG2 4.46Å
160	L	98.1	Very high	97.1	Very high	36 Å²	36	29.2 Å²	29.2	19%	0.188	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	160.8	177.3	-56.6	-179.6	0	0	0	111.4	I91 C110 G113 E114 V167 K168 T170	I91-L160 HydrophobicContact CD1-CD1 4.34Å; C110-L160 HydrophobicContact CB-CB 3.57Å; C110-L160 HydrophobicContact CB-CD1 3.99Å; C110-L160 HydrophobicContact CB-CG 4.37Å; G113-L160 CarbonylContact O-C 3.59Å; G113-L160 WeakPolarHBondContact O-CA 3.48Å; E114-L160 HydrophobicContact CB-CD2 4.46Å; E114-L160 HydrophobicContact CG-CD2 3.81Å; L160-V167 CarbonylContact O-C 3.56Å; L160-V167 WeakPolarHBondContact O-CA 3.29Å; L160-K168 HydrophobicContact CB-CB 4.31Å; L160-K168 PolarHBondContact N-O 2.71Å; L160-K168 PolarHBondContact O-N 2.85Å; L160-T170 HydrophobicContact CD1-CG2 3.99Å; L160-T170 HydrophobicContact CD2-CG2 4.44Å; L160-T170 HydrophobicContact CG-CG2 3.76Å
161	L	98.1	Very high	96.9	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	126.2	178.7	-64.2	177	0	0	0	110.8	C110 K112 G113 L115 Y118 N166 V167	C110-L161 CarbonylContact C-O 3.54Å; C110-L161 WeakPolarHBondContact CB-O 3.38Å; K112-L161 HydrophobicContact CB-CB 3.57Å; K112-L161 WeakPolarHBondContact CB-O 3.45Å; K112-L161 PolarHBondContact N-O 2.88Å; K112-L161 VanDerWaalsContact N-O 3.14Å; G113-L161 PolarHBondContact O-N 2.99Å; L115-L161 HydrophobicContact CD1-CD1 4.31Å; Y118-L161 HydrophobicContact CD1-CD1 3.8Å; Y118-L161 HydrophobicContact CG-CD1 3.79Å; L161-N166 WeakPolarHBondContact CA-O 3.46Å; L161-V167 HydrophobicContact CD2-CG2 4.35Å
162	D	96	Very high	96.8	Very high	29 Å²	29	31.2 Å²	31.2	16%	0.155	16%	0.155	C	C	.	.			trans	-72.8	180	172.9	80.7	0.3	0	0	0	111.8	K112 N164 H165 N166	K112-D162 WeakPolarHBondContact CG-O 3.16Å; D162-N164 PolarHBondContact O-N 2.85Å; D162-N164 VanDerWaalsContact O-N 3.09Å; D162-N164 VanDerWaalsContact OD1-C 3.26Å; D162-N164 VanDerWaalsContact OD1-CA 3.26Å; D162-N164 WeakPolarHBondContact OD1-CA 3.3Å; D162-N164 WeakPolarHBondContact OD1-CB 3.43Å; D162-N164 PolarHBondContact OD1-N 2.91Å; D162-H165 PolarHBondContact O-N 2.99Å; D162-H165 PolarHBondContact OD1-N 2.86Å; D162-N166 PolarHBondContact N-O 2.77Å; D162-N166 PolarHBondContact OD1-N 3.21Å; D162-N166 PolarHBondContact OD1-ND2 3.31Å; D162-N166 WeakPolarHBondContact OD2-CB 3.33Å; D162-N166 PolarHBondContact OD2-ND2 3.3Å
163	E	93.9	Very high	96.6	Very high	144 Å²	144	31.4 Å²	31.4	67%	0.673	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-32.7	177.6	-67.6	-178.4	170.2	0	0	114.1	P111	P111-E163 HydrophobicContact CG-CB 4.38Å; P111-E163 HydrophobicContact CG-CG 3.38Å
164	N	93.9	Very high	96.4	Very high	121 Å²	121	35.2 Å²	35.2	65%	0.647	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	5.3	-177.6	-62.5	-57	0	0	0	113	D162 N166	D162-N164 PolarHBondContact O-N 2.85Å; D162-N164 VanDerWaalsContact O-N 3.09Å; D162-N164 VanDerWaalsContact OD1-C 3.26Å; D162-N164 VanDerWaalsContact OD1-CA 3.26Å; D162-N164 WeakPolarHBondContact OD1-CA 3.3Å; D162-N164 WeakPolarHBondContact OD1-CB 3.43Å; D162-N164 PolarHBondContact OD1-N 2.91Å; N164-N166 VanDerWaalsContact C-N 3.25Å; N164-N166 PolarHBondContact O-N 3.37Å
165	H	93.4	Very high	96.3	Very high	60 Å²	60	35.2 Å²	35.2	28%	0.278	18%	0.182	S	C	.	.			trans	60.7	30	-171.6	-51.4	67.4	0	0	0	113.7	D162	D162-H165 PolarHBondContact O-N 2.99Å; D162-H165 PolarHBondContact OD1-N 2.86Å
166	N	96.4	Very high	96.3	Very high	51 Å²	51	36.4 Å²	36.4	27%	0.273	19%	0.187	S	C	.	.			trans	-78.9	148.1	163.4	-54	-58.5	0	0	0	109.9	Q136 L161 D162 N164	Q136-N166 PolarHBondContact NE2-OD1 3.33Å; Q136-N166 VanDerWaalsContact OE1-CA 3.31Å; L161-N166 WeakPolarHBondContact CA-O 3.46Å; D162-N166 PolarHBondContact N-O 2.77Å; D162-N166 PolarHBondContact OD1-N 3.21Å; D162-N166 PolarHBondContact OD1-ND2 3.31Å; D162-N166 WeakPolarHBondContact OD2-CB 3.33Å; D162-N166 PolarHBondContact OD2-ND2 3.3Å; N164-N166 VanDerWaalsContact C-N 3.25Å; N164-N166 PolarHBondContact O-N 3.37Å
167	V	98	Very high	96.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	140.3	179	160.9	0	0	0	0	111.7	Y89 I133 Q136 I137 I159 L160 L161 I169	Y89-V167 VanDerWaalsContact CA-O 3.32Å; Y89-V167 WeakPolarHBondContact CA-O 3.24Å; I133-V167 HydrophobicContact CB-CG2 4.4Å; I133-V167 HydrophobicContact CG2-CG2 3.85Å; Q136-V167 HydrophobicContact CB-CB 3.86Å; Q136-V167 HydrophobicContact CB-CG1 4.48Å; Q136-V167 HydrophobicContact CB-CG2 4.19Å; I137-V167 HydrophobicContact CG1-CG1 3.82Å; I137-V167 HydrophobicContact CG1-CG2 4.06Å; I159-V167 HydrophobicContact CG2-CB 4.29Å; I159-V167 HydrophobicContact CG2-CG1 3.76Å; I159-V167 HydrophobicContact CG2-CG2 3.96Å; L160-V167 CarbonylContact O-C 3.56Å; L160-V167 WeakPolarHBondContact O-CA 3.29Å; L161-V167 HydrophobicContact CD2-CG2 4.35Å; V167-I169 HydrophobicContact CG1-CG1 4.15Å
168	K	98.5	Very high	96.3	Very high	16 Å²	16	38.4 Å²	38.4	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	109.1	164	-66.5	-68.2	-169.4	156	0	108.9	P88 I91 E108 L160	P88-K168 WeakPolarHBondContact O-CD 3.48Å; P88-K168 WeakPolarHBondContact O-CE 3.35Å; P88-K168 PolarHBondContact O-NZ 2.8Å; I91-K168 HydrophobicContact CD1-CB 4.21Å; E108-K168 WeakPolarHBondContact OE1-CD 3.41Å; E108-K168 VanDerWaalsContact OE1-CE 3.25Å; E108-K168 WeakPolarHBondContact OE1-CE 3.46Å; E108-K168 IonicContact OE1-NZ 2.85Å; E108-K168 PolarHBondContact OE1-NZ 3.42Å; E108-K168 VanDerWaalsContact OE2-CE 3.22Å; E108-K168 WeakPolarHBondContact OE2-CE 3.47Å; E108-K168 IonicContact OE2-NZ 2.65Å; E108-K168 PolarHBondContact OE2-NZ 3.4Å; L160-K168 HydrophobicContact CB-CB 4.31Å; L160-K168 PolarHBondContact N-O 2.71Å; L160-K168 PolarHBondContact O-N 2.85Å
169	I	98.7	Very high	96.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.1	173.4	-59.7	175	0	0	0	108	Y89 I90 I91 V141 L154 V167 F172	Y89-I169 PolarHBondContact O-N 3.25Å; I90-I169 HydrophobicContact CD1-CB 3.91Å; I90-I169 HydrophobicContact CD1-CD1 3.99Å; I90-I169 HydrophobicContact CD1-CG1 4.35Å; I91-I169 WeakPolarHBondContact CB-O 3.48Å; I91-I169 WeakPolarHBondContact CG2-O 3.36Å; I91-I169 PolarHBondContact N-O 3.04Å; V141-I169 HydrophobicContact CG2-CD1 4.24Å; L154-I169 HydrophobicContact CD2-CG2 3.88Å; V167-I169 HydrophobicContact CG1-CG1 4.15Å; I169-F172 HydrophobicContact CG2-CE2 4.39Å; I169-F172 HydrophobicContact CG2-CZ 4.22Å
170	T	97	Very high	95.8	Very high	22 Å²	22	55 Å²	55	14%	0.135	27%	0.274	C	S	.	.			trans	-131.5	179	-176.4	-167.7	0	0	0	0	111.4	H151 N158 L160	H151-T170 PolarHBondContact NE2-O 2.98Å; N158-T170 WeakPolarHBondContact O-CG2 3.39Å; N158-T170 PolarHBondContact O-N 3.5Å; L160-T170 HydrophobicContact CD1-CG2 3.99Å; L160-T170 HydrophobicContact CD2-CG2 4.44Å; L160-T170 HydrophobicContact CG-CG2 3.76Å
171	D	93.4	Very high	95.4	Very high	40 Å²	40	56.7 Å²	56.7	21%	0.214	30%	0.301	C	S	.	.			trans	60.8	72.3	175.7	-160.4	19.2	0	0	0	114.6	K52 H151 N158 G173	K52-D171 IonicContact NZ-OD1 3.7Å; K52-D171 PolarHBondContact NZ-OD1 3.19Å; H151-D171 PolarHBondContact CE1-O 3.1Å; N158-D171 HydrophobicContact CB-CB 4.4Å; D171-G173 PolarHBondContact O-N 3.37Å
172	F	96.5	Very high	95.2	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-84.9	14.9	177.9	-73.3	-99.2	0	0	0	112.7	E77 I80 L81 V84 I90 I144 I169 F174 A175	E77-F172 HydrophobicContact CG-CB 4.19Å; I80-F172 HydrophobicContact CG2-CB 4.2Å; I80-F172 HydrophobicContact CG2-CD1 3.61Å; I80-F172 HydrophobicContact CG2-CE1 4.38Å; I80-F172 HydrophobicContact CG2-CG 4.19Å; L81-F172 HydrophobicContact CD2-CB 4.28Å; L81-F172 HydrophobicContact CD2-CD2 3.47Å; L81-F172 VanDerWaalsContact CD2-CD2 3.47Å; L81-F172 HydrophobicContact CD2-CE2 4.07Å; L81-F172 HydrophobicContact CD2-CG 4.06Å; L81-F172 HydrophobicContact CG-CB 4.26Å; L81-F172 HydrophobicContact CG-CD2 4.34Å; L81-F172 HydrophobicContact CG-CG 4.49Å; V84-F172 HydrophobicContact CG2-CE1 4.28Å; V84-F172 HydrophobicContact CG2-CZ 4.16Å; I90-F172 HydrophobicContact CD1-CZ 4.29Å; I90-F172 HydrophobicContact CG2-CE2 3.83Å; I90-F172 HydrophobicContact CG2-CZ 3.75Å; I144-F172 HydrophobicContact CD1-CE1 4.47Å; I144-F172 HydrophobicContact CG2-CE1 4.16Å; I144-F172 HydrophobicContact CG2-CZ 4.39Å; I169-F172 HydrophobicContact CG2-CE2 4.39Å; I169-F172 HydrophobicContact CG2-CZ 4.22Å; F172-F174 PolarHBondContact O-N 2.77Å; F172-A175 HydrophobicContact CB-CB 3.91Å; F172-A175 HydrophobicContact CD1-CB 3.68Å; F172-A175 HydrophobicContact CG-CB 4.26Å; F172-A175 VanDerWaalsContact O-CB 3.27Å; F172-A175 WeakPolarHBondContact O-CB 3.26Å; F172-A175 PolarHBondContact O-N 3.24Å
173	G	93.2	Very high	95.2	Very high	33 Å²	33	62.7 Å²	62.7	34%	0.34	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-60	-29.2	-178.3	0	0	0	0	0	114	D171	D171-G173 PolarHBondContact O-N 3.37Å
174	F	94.3	Very high	95.2	Very high	87 Å²	87	56 Å²	56	38%	0.382	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-96.1	-1.6	171.7	-65.6	-64.1	0	0	0	113.7	H151 R152 D153 F172 C188	H151-F174 CarbonylContact O-C 3.38Å; R152-F174 HydrophobicContact CB-CB 4.41Å; R152-F174 PolarHBondContact NE-O 3.43Å; R152-F174 PolarHBondContact NH2-O 3.48Å; D153-F174 HydrophobicContact CB-CB 4.33Å; D153-F174 HydrophobicContact CB-CD2 3.69Å; D153-F174 HydrophobicContact CB-CG 4.41Å; F172-F174 PolarHBondContact O-N 2.77Å; F174-C188 HydrophobicContact CD1-CB 3.67Å; F174-C188 HydrophobicContact CE1-CB 4.01Å; F174-C188 HydrophobicContact CG-CB 4.36Å
175	A	97.2	Very high	95.2	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.008	29%	0.29	C	S	.	.			trans	-69.1	150.5	-176.3	0	0	0	0	0	111.8	Q76 I80 I149 V150 F172	Q76-A175 PolarHBondContact NE2-O 2.85Å; I80-A175 VanDerWaalsContact CD1-C 3.43Å; I80-A175 HydrophobicContact CD1-CB 3.76Å; I80-A175 WeakPolarHBondContact CD1-O 3.44Å; I80-A175 HydrophobicContact CG2-CB 4.09Å; I149-A175 HydrophobicContact CG2-CB 4.28Å; V150-A175 CarbonylContact O-C 3.41Å; V150-A175 WeakPolarHBondContact O-CA 3.42Å; V150-A175 WeakPolarHBondContact O-CB 3.38Å; F172-A175 HydrophobicContact CB-CB 3.91Å; F172-A175 HydrophobicContact CD1-CB 3.68Å; F172-A175 HydrophobicContact CG-CB 4.26Å; F172-A175 VanDerWaalsContact O-CB 3.27Å; F172-A175 WeakPolarHBondContact O-CB 3.26Å; F172-A175 PolarHBondContact O-N 3.24Å
176	K	96.6	Very high	95.1	Very high	58 Å²	58	55 Å²	55	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	135.1	174.5	-175.6	163.4	167.2	-163.9	0	110.9	I149 V150 L178 E182 L184	I149-K176 WeakPolarHBondContact CA-O 3.21Å; V150-K176 PolarHBondContact N-O 3.03Å; V150-K176 PolarHBondContact O-N 3.19Å; K176-L178 HydrophobicContact CG-CD2 4.49Å; K176-E182 WeakPolarHBondContact CE-OE1 3.49Å; K176-E182 IonicContact NZ-OE1 3.37Å; K176-E182 PolarHBondContact NZ-OE1 2.84Å; K176-L184 HydrophobicContact CD-CD2 3.63Å; K176-L184 HydrophobicContact CG-CD2 4.42Å
177	Q	97	Very high	94.9	Very high	82 Å²	82	56 Å²	56	38%	0.383	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.7	168.6	-173.5	167.2	35.2	0	0	109.2	K147 S148 I149	K147-Q177 PolarHBondContact O-NE2 2.87Å; S148-Q177 CarbonylContact O-C 3.59Å; S148-Q177 WeakPolarHBondContact O-CA 3.18Å; I149-Q177 HydrophobicContact CG1-CB 4.05Å; I149-Q177 HydrophobicContact CG1-CG 4.19Å
178	L	96.2	Very high	94.6	Very high	13 Å²	13	56.8 Å²	56.8	7%	0.068	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-96.4	141.3	-179.2	-60.2	-175.4	0	0	0	111.1	S148 V150 K176 E182 L184 S211	S148-L178 VanDerWaalsContact CB-O 3.26Å; S148-L178 WeakPolarHBondContact CB-O 3.5Å; S148-L178 PolarHBondContact O-N 2.95Å; V150-L178 HydrophobicContact CG2-CD1 3.52Å; V150-L178 HydrophobicContact CG2-CG 3.93Å; K176-L178 HydrophobicContact CG-CD2 4.49Å; L178-E182 WeakPolarHBondContact CA-OE2 3.31Å; L178-E182 HydrophobicContact CB-CB 4.39Å; L178-E182 HydrophobicContact CD2-CB 4.5Å; L178-E182 HydrophobicContact CD2-CG 4.28Å; L178-L184 HydrophobicContact CD2-CD1 3.89Å; L178-L184 HydrophobicContact CD2-CD2 3.61Å; L178-L184 HydrophobicContact CD2-CG 3.65Å; L178-S211 WeakPolarHBondContact CD1-OG 3.37Å
179	Q	95.1	Very high	94.3	Very high	155 Å²	155	57 Å²	57	72%	0.724	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-77.1	162.1	162.4	-59	-178.3	6.7	0	0	110.4	G181 E182	Q179-G181 PolarHBondContact O-N 3.37Å; Q179-E182 HydrophobicContact CB-CB 4.17Å; Q179-E182 PolarHBondContact N-OE2 3.27Å; Q179-E182 VanDerWaalsContact O-CB 3.27Å; Q179-E182 WeakPolarHBondContact O-CB 3.45Å; Q179-E182 PolarHBondContact O-N 3.06Å
180	E	91.1	Very high	93.9	Very high	204 Å²	204	58.7 Å²	58.7	95%	0.953	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	123.9	178.4	-171.4	173.8	-175.5	0	0	110.6	E182	E180-E182 PolarHBondContact O-N 3.17Å
181	G	89.4	Confident	93.7	Very high	73 Å²	73	60 Å²	60	75%	0.753	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-3.7	-176.8	0	0	0	0	0	115.4	Q179 K183	Q179-G181 PolarHBondContact O-N 3.37Å; G181-K183 PolarHBondContact O-N 2.94Å
182	E	94.3	Very high	93.8	Very high	53 Å²	53	59 Å²	59	25%	0.248	33%	0.33	C	S	.	.			trans	-65.2	134.5	176.4	-171.6	-176	173.7	0	0	110.8	K176 L178 Q179 E180	K176-E182 WeakPolarHBondContact CE-OE1 3.49Å; K176-E182 IonicContact NZ-OE1 3.37Å; K176-E182 PolarHBondContact NZ-OE1 2.84Å; L178-E182 WeakPolarHBondContact CA-OE2 3.31Å; L178-E182 HydrophobicContact CB-CB 4.39Å; L178-E182 HydrophobicContact CD2-CB 4.5Å; L178-E182 HydrophobicContact CD2-CG 4.28Å; Q179-E182 HydrophobicContact CB-CB 4.17Å; Q179-E182 PolarHBondContact N-OE2 3.27Å; Q179-E182 VanDerWaalsContact O-CB 3.27Å; Q179-E182 WeakPolarHBondContact O-CB 3.45Å; Q179-E182 PolarHBondContact O-N 3.06Å; E180-E182 PolarHBondContact O-N 3.17Å
183	K	94.4	Very high	93.8	Very high	103 Å²	103	60.3 Å²	60.3	45%	0.448	34%	0.335	S	S	.	.			trans	-120.5	143.3	172.6	-64.4	-64	-172	-178.5	0	110	G181 E213	G181-K183 PolarHBondContact O-N 2.94Å; K183-E213 IonicContact NZ-OE1 2.69Å
184	L	94.2	Very high	94	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.016	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-94.6	146.7	179.1	-59.2	177.1	0	0	0	110.5	K176 L178 G209 Y210	K176-L184 HydrophobicContact CD-CD2 3.63Å; K176-L184 HydrophobicContact CG-CD2 4.42Å; L178-L184 HydrophobicContact CD2-CD1 3.89Å; L178-L184 HydrophobicContact CD2-CD2 3.61Å; L178-L184 HydrophobicContact CD2-CG 3.65Å; L184-G209 CarbonylContact O-C 3.43Å; L184-G209 WeakPolarHBondContact O-CA 3.26Å; L184-Y210 HydrophobicContact CB-CD1 4.27Å; L184-Y210 HydrophobicContact CB-CD2 4Å; L184-Y210 HydrophobicContact CB-CE1 3.86Å; L184-Y210 HydrophobicContact CB-CE2 3.58Å; L184-Y210 HydrophobicContact CB-CG 4.32Å; L184-Y210 VanDerWaalsContact CB-CZ 3.48Å; L184-Y210 HydrophobicContact CD1-CD2 4.4Å; L184-Y210 HydrophobicContact CD1-CE2 3.74Å; L184-Y210 HydrophobicContact CG-CE2 4.28Å; L184-Y210 PolarHBondContact N-O 2.94Å; L184-Y210 WeakPolarHBondContact O-CD1 3.47Å; L184-Y210 WeakPolarHBondContact O-CE1 3.41Å; L184-Y210 PolarHBondContact O-N 3.11Å
185	T	93.8	Very high	94.2	Very high	90 Å²	90	55.2 Å²	55.2	55%	0.552	30%	0.304	S	S	*	.			trans	-126.8	-21.3	-178.7	54.1	0	0	0	0	113	C201	T185-C201 WeakPolarHBondContact O-CB 3.46Å
186	N	91.6	Very high	94.2	Very high	71 Å²	71	55.1 Å²	55.1	38%	0.38	30%	0.304	S	S	.	.			trans	-70.5	140.1	-178.1	70	-71.4	0	0	0	111.4	R152 Y210	R152-N186 PolarHBondContact NH1-ND2 2.77Å; R152-N186 VanDerWaalsContact NH1-ND2 3.16Å; R152-N186 PolarHBondContact NH1-OD1 2.98Å; N186-Y210 WeakPolarHBondContact O-CE1 3.38Å; N186-Y210 PolarHBondContact O-OH 3.16Å
187	L	92.4	Very high	94.2	Very high	71 Å²	71	53 Å²	53	37%	0.372	29%	0.294	S	S	.	.			trans	-82.1	125.1	173.1	-174.4	63.5	0	0	0	109.9	L194 T198 L199 N202	L187-L194 HydrophobicContact CD1-CD1 3.78Å; L187-T198 HydrophobicContact CD1-CG2 3.77Å; L187-L199 HydrophobicContact CD1-CD2 4.32Å; L187-N202 HydrophobicContact CB-CB 4.02Å; L187-N202 HydrophobicContact CD1-CB 4.47Å; L187-N202 HydrophobicContact CD2-CB 3.92Å; L187-N202 HydrophobicContact CG-CB 4.36Å
188	C	91.6	Very high	94.1	Very high	16 Å²	16	49.3 Å²	49.3	11%	0.108	28%	0.278	C	S	.	.			trans	-154.1	162.4	172	59.5	0	0	0	0	109.8	R152 F174 L194	R152-C188 VanDerWaalsContact CZ-SG 3.56Å; F174-C188 HydrophobicContact CD1-CB 3.67Å; F174-C188 HydrophobicContact CE1-CB 4.01Å; F174-C188 HydrophobicContact CG-CB 4.36Å; C188-L194 WeakPolarHBondContact O-CD2 3.42Å
189	G	91.4	Very high	94.1	Very high	21 Å²	21	49 Å²	49	22%	0.216	28%	0.276	C	S	.	.	S	Bend	trans	96.9	-178.9	-177.6	0	0	0	0	0	114.2	D153	D153-G189 VanDerWaalsContact OD1-CA 3.26Å; D153-G189 WeakPolarHBondContact OD1-CA 3.46Å
190	T	92.2	Very high	93.9	Very high	36 Å²	36	45.4 Å²	45.4	22%	0.221	26%	0.258	C	S	.	.			trans	-89.5	124.6	-169.6	-54.9	0	0	0	0	111.9	D153 K155 G192 Y193 L194	D153-T190 WeakPolarHBondContact OD1-CB 3.49Å; D153-T190 PolarHBondContact OD1-N 3.45Å; D153-T190 PolarHBondContact OD1-OG1 3.15Å; K155-T190 HydrophobicContact CD-CG2 4.37Å; K155-T190 WeakPolarHBondContact CD-OG1 3.42Å; K155-T190 PolarHBondContact NZ-OG1 2.88Å; T190-G192 VanDerWaalsContact C-N 3.3Å; T190-G192 PolarHBondContact O-N 3.18Å; T190-Y193 HydrophobicContact CG2-CD2 3.97Å; T190-Y193 HydrophobicContact CG2-CE2 4.33Å; T190-Y193 PolarHBondContact O-N 3.46Å; T190-L194 PolarHBondContact O-N 3.42Å
191	P	92.8	Very high	93.9	Very high	50 Å²	50	36.7 Å²	36.7	33%	0.325	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-49.1	-37.4	-168.3	-33.3	36	0	0	0	117.6	Y193 M241 I245	P191-Y193 VanDerWaalsContact C-N 3.25Å; P191-Y193 PolarHBondContact O-N 2.93Å; P191-M241 HydrophobicContact CB-CE 3.92Å; P191-I245 VanDerWaalsContact O-CD1 3.31Å; P191-I245 WeakPolarHBondContact O-CD1 3.18Å
192	G	94.5	Very high	93.8	Very high	17 Å²	17	38 Å²	38	18%	0.175	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-71.6	-15.5	-179.6	0	0	0	0	0	114.9	T190	T190-G192 VanDerWaalsContact C-N 3.3Å; T190-G192 PolarHBondContact O-N 3.18Å
193	Y	97.7	Very high	93.4	Very high	29 Å²	29	39.5 Å²	39.5	11%	0.114	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-111	-4.2	-177.5	-59.3	-87.6	0	0	0	112.7	K155 P156 T190 P191 V221 I222	K155-Y193 HydrophobicContact CB-CD1 4.15Å; K155-Y193 HydrophobicContact CB-CD2 3.76Å; K155-Y193 HydrophobicContact CB-CE1 4.06Å; K155-Y193 HydrophobicContact CB-CE2 3.63Å; K155-Y193 HydrophobicContact CB-CG 4.03Å; P156-Y193 VanDerWaalsContact CD-CZ 3.46Å; P156-Y193 WeakPolarHBondContact CD-OH 3.27Å; T190-Y193 HydrophobicContact CG2-CD2 3.97Å; T190-Y193 HydrophobicContact CG2-CE2 4.33Å; T190-Y193 PolarHBondContact O-N 3.46Å; P191-Y193 VanDerWaalsContact C-N 3.25Å; P191-Y193 PolarHBondContact O-N 2.93Å; Y193-V221 HydrophobicContact CD1-CB 3.89Å; Y193-V221 HydrophobicContact CD1-CG1 3.44Å; Y193-V221 VanDerWaalsContact CD1-CG1 3.44Å; Y193-V221 HydrophobicContact CE1-CB 4.31Å; Y193-V221 HydrophobicContact CE1-CG1 3.56Å; Y193-V221 HydrophobicContact CG-CG1 4.29Å; Y193-I222 HydrophobicContact CD1-CG1 4.31Å; Y193-I222 HydrophobicContact CE1-CG1 4.06Å
194	L	97.4	Very high	92.9	Very high	12 Å²	12	40 Å²	40	6%	0.063	22%	0.22	C	C	.	.			trans	-67	137.8	179.4	-63.7	-179.8	0	0	0	111.6	L187 C188 T190 T198 L199 W217 I245	L187-L194 HydrophobicContact CD1-CD1 3.78Å; C188-L194 WeakPolarHBondContact O-CD2 3.42Å; T190-L194 PolarHBondContact O-N 3.42Å; L194-T198 HydrophobicContact CD2-CG2 4.32Å; L194-L199 HydrophobicContact CB-CD2 4.2Å; L194-L199 HydrophobicContact CB-CG 4.35Å; L194-L199 HydrophobicContact CD1-CD2 3.67Å; L194-W217 PolarHBondContact O-NE1 2.99Å; L194-I245 VanDerWaalsContact O-CG2 3.24Å; L194-I245 WeakPolarHBondContact O-CG2 3.35Å
195	A	97.6	Very high	92.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.008	26%	0.264	C	S	.	.			trans	-76.8	154.8	174.1	0	0	0	0	0	111.7	E197 T198 L199 V214 W217	A195-E197 VanDerWaalsContact C-N 3.28Å; A195-E197 HydrophobicContact CB-CG 4.43Å; A195-E197 WeakPolarHBondContact CB-OE1 3.25Å; A195-E197 WeakPolarHBondContact CB-OE2 3.36Å; A195-E197 PolarHBondContact O-N 3.32Å; A195-T198 WeakPolarHBondContact O-CB 3.19Å; A195-T198 PolarHBondContact O-N 3.14Å; A195-T198 VanDerWaalsContact O-N 3.12Å; A195-L199 PolarHBondContact O-N 3.13Å; A195-V214 HydrophobicContact CB-CB 4.01Å; A195-V214 HydrophobicContact CB-CG1 3.92Å; A195-W217 HydrophobicContact CB-CB 3.85Å; A195-W217 HydrophobicContact CB-CD2 4.31Å; A195-W217 HydrophobicContact CB-CG 3.79Å
196	P	97.4	Very high	91.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-55.4	-40.4	-179.9	-29	38.2	0	0	0	113.7	L199 K200 W217 I245 V274	P196-L199 PolarHBondContact O-N 3.12Å; P196-K200 WeakPolarHBondContact O-CG 3.25Å; P196-K200 PolarHBondContact O-N 3.14Å; P196-W217 HydrophobicContact CG-CE3 4.19Å; P196-W217 HydrophobicContact CG-CH2 3.5Å; P196-W217 HydrophobicContact CG-CZ2 3.91Å; P196-W217 HydrophobicContact CG-CZ3 3.66Å; P196-I245 HydrophobicContact CG-CG2 4.36Å; P196-I245 WeakPolarHBondContact CG-O 3.07Å; P196-V274 HydrophobicContact CB-CG1 4.01Å; P196-V274 HydrophobicContact CG-CB 4.48Å; P196-V274 HydrophobicContact CG-CG1 4.2Å; P196-V274 HydrophobicContact CG-CG2 4.37Å
197	E	96.6	Very high	91.6	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.056	27%	0.271	C	S	.	.	H	α-helix	trans	-67.8	-31.8	179.7	63.4	-85.3	-160.2	0	0	113.2	A195 K200 C201 V214 P276 R279	A195-E197 VanDerWaalsContact C-N 3.28Å; A195-E197 HydrophobicContact CB-CG 4.43Å; A195-E197 WeakPolarHBondContact CB-OE1 3.25Å; A195-E197 WeakPolarHBondContact CB-OE2 3.36Å; A195-E197 PolarHBondContact O-N 3.32Å; E197-K200 PolarHBondContact O-N 3.32Å; E197-C201 PolarHBondContact O-N 2.85Å; E197-C201 VanDerWaalsContact O-N 3.09Å; E197-C201 PolarHBondContact O-SG 3.49Å; E197-V214 HydrophobicContact CG-CG1 4.15Å; E197-P276 HydrophobicContact CB-CG 4.47Å; E197-P276 HydrophobicContact CG-CG 4.34Å; E197-R279 IonicContact OE1-CZ 3.9Å; E197-R279 IonicContact OE1-NH1 3.74Å; E197-R279 PolarHBondContact OE1-NH1 3.33Å; E197-R279 IonicContact OE1-NH2 3.86Å; E197-R279 PolarHBondContact OE1-NH2 2.89Å; E197-R279 IonicContact OE2-CZ 3.3Å; E197-R279 IonicContact OE2-NH1 2.86Å; E197-R279 IonicContact OE2-NH2 3.07Å; E197-R279 PolarHBondContact OE2-NH2 2.85Å
198	T	95.6	Very high	91.3	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-66.3	-42.4	173.9	-47.2	0	0	0	0	110.5	L187 L194 A195 C201 Y210 V214	L187-T198 HydrophobicContact CD1-CG2 3.77Å; L194-T198 HydrophobicContact CD2-CG2 4.32Å; A195-T198 WeakPolarHBondContact O-CB 3.19Å; A195-T198 PolarHBondContact O-N 3.14Å; A195-T198 VanDerWaalsContact O-N 3.12Å; T198-C201 PolarHBondContact O-N 2.88Å; T198-Y210 HydrophobicContact CG2-CD1 4.28Å; T198-Y210 HydrophobicContact CG2-CE1 3.83Å; T198-V214 WeakPolarHBondContact OG1-CG1 3.35Å
199	L	94.2	Very high	91.4	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-41	175.1	-62.8	179	0	0	0	111.9	L187 L194 A195 P196 C201 N202 M203 L242 I245 M246	L187-L199 HydrophobicContact CD1-CD2 4.32Å; L194-L199 HydrophobicContact CB-CD2 4.2Å; L194-L199 HydrophobicContact CB-CG 4.35Å; L194-L199 HydrophobicContact CD1-CD2 3.67Å; A195-L199 PolarHBondContact O-N 3.13Å; P196-L199 PolarHBondContact O-N 3.12Å; L199-C201 VanDerWaalsContact C-N 3.33Å; L199-C201 PolarHBondContact O-N 2.89Å; L199-N202 PolarHBondContact O-N 3.41Å; L199-M203 WeakPolarHBondContact O-CG 3.48Å; L199-M203 PolarHBondContact O-N 2.71Å; L199-M203 VanDerWaalsContact O-N 3.08Å; L199-L242 HydrophobicContact CD1-CB 4.41Å; L199-L242 HydrophobicContact CD1-CD2 3.97Å; L199-L242 HydrophobicContact CD2-CD2 3.93Å; L199-I245 HydrophobicContact CD1-CB 4.08Å; L199-I245 HydrophobicContact CD1-CG2 3.64Å; L199-M246 HydrophobicContact CB-CG 4.27Å; L199-M246 HydrophobicContact CD1-CG 3.95Å
200	K	92	Very high	91.6	Very high	80 Å²	80	48.7 Å²	48.7	35%	0.348	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-41.5	178.1	-75.9	173.1	-176.6	175.1	0	112.1	P196 E197 N202 M203 F204 S207 M246	P196-K200 WeakPolarHBondContact O-CG 3.25Å; P196-K200 PolarHBondContact O-N 3.14Å; E197-K200 PolarHBondContact O-N 3.32Å; K200-N202 PolarHBondContact O-N 3.4Å; K200-M203 PolarHBondContact O-N 2.72Å; K200-M203 VanDerWaalsContact O-N 3.12Å; K200-F204 HydrophobicContact CB-CD2 4.13Å; K200-F204 HydrophobicContact CG-CD2 4.18Å; K200-F204 HydrophobicContact CG-CE2 4.2Å; K200-F204 PolarHBondContact O-N 3.31Å; K200-S207 PolarHBondContact O-OG 3Å; K200-S207 VanDerWaalsContact O-OG 3.13Å; K200-M246 HydrophobicContact CG-CE 4.32Å
201	C	90.2	Very high	91.8	Very high	21 Å²	21	47.6 Å²	47.6	14%	0.142	28%	0.276	C	S	.	.	H	α-helix	trans	-59.3	-32.7	178.1	-67.1	0	0	0	0	113.3	T185 E197 T198 L199 G209	T185-C201 WeakPolarHBondContact O-CB 3.46Å; E197-C201 PolarHBondContact O-N 2.85Å; E197-C201 VanDerWaalsContact O-N 3.09Å; E197-C201 PolarHBondContact O-SG 3.49Å; T198-C201 PolarHBondContact O-N 2.88Å; L199-C201 VanDerWaalsContact C-N 3.33Å; L199-C201 PolarHBondContact O-N 2.89Å; C201-G209 VanDerWaalsContact SG-CA 3.5Å
202	N	87.1	Confident	92	Very high	100 Å²	100	47.6 Å²	47.6	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-83.3	-28	177.7	-168	73.7	0	0	0	113.4	L187 L199 K200	L187-N202 HydrophobicContact CB-CB 4.02Å; L187-N202 HydrophobicContact CD1-CB 4.47Å; L187-N202 HydrophobicContact CD2-CB 3.92Å; L187-N202 HydrophobicContact CG-CB 4.36Å; L199-N202 PolarHBondContact O-N 3.41Å; K200-N202 PolarHBondContact O-N 3.4Å
203	M	85.8	Confident	92.2	Very high	85 Å²	85	49.4 Å²	49.4	42%	0.419	28%	0.276	S	S	.	.	H	α-helix	trans	-92.8	-27.3	-174.9	-70.6	-176	170.7	0	0	113.8	L199 K200 L242 M246	L199-M203 WeakPolarHBondContact O-CG 3.48Å; L199-M203 PolarHBondContact O-N 2.71Å; L199-M203 VanDerWaalsContact O-N 3.08Å; K200-M203 PolarHBondContact O-N 2.72Å; K200-M203 VanDerWaalsContact O-N 3.12Å; M203-L242 HydrophobicContact CE-CD1 4.44Å; M203-M246 HydrophobicContact CE-SD 4.3Å; M203-M246 HydrophobicContact SD-CE 4.01Å; M203-M246 HydrophobicContact SD-SD 3.6Å
204	F	85.8	Confident	92.2	Very high	114 Å²	114	48.5 Å²	48.5	50%	0.5	27%	0.273	S	S	.	.	S	Bend	trans	-129.1	120	-173.8	-52.9	-76.1	0	0	0	111	K200 S207 M246	K200-F204 HydrophobicContact CB-CD2 4.13Å; K200-F204 HydrophobicContact CG-CD2 4.18Å; K200-F204 HydrophobicContact CG-CE2 4.2Å; K200-F204 PolarHBondContact O-N 3.31Å; F204-S207 PolarHBondContact O-N 3.38Å; F204-S207 PolarHBondContact O-OG 3.26Å; F204-M246 HydrophobicContact CE2-CE 3.82Å; F204-M246 HydrophobicContact CZ-CE 4.3Å
205	E	82.6	Confident	92.3	Very high	201 Å²	201	48 Å²	48	94%	0.939	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	141.8	170.6	-68.6	-177.9	-179.5	0	0	110.9	S207	E205-S207 VanDerWaalsContact C-N 3.33Å; E205-S207 PolarHBondContact O-N 2.88Å
206	G	80.4	Confident	92.3	Very high	86 Å²	86	48.1 Å²	48.1	89%	0.887	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	11.4	179.5	0	0	0	0	0	115.4
207	S	87.6	Confident	92.4	Very high	29 Å²	29	48.1 Å²	48.1	20%	0.203	27%	0.271	C	S	.	.			trans	-57.9	142.8	171	-68.4	0	0	0	0	111.5	K200 F204 E205 G209	K200-S207 PolarHBondContact O-OG 3Å; K200-S207 VanDerWaalsContact O-OG 3.13Å; F204-S207 PolarHBondContact O-N 3.38Å; F204-S207 PolarHBondContact O-OG 3.26Å; E205-S207 VanDerWaalsContact C-N 3.33Å; E205-S207 PolarHBondContact O-N 2.88Å; S207-G209 PolarHBondContact O-N 3.3Å
208	P	86.8	Confident	92.5	Very high	122 Å²	122	47.8 Å²	47.8	79%	0.792	27%	0.27	S	S	*	.			trans	-69.3	-0.9	-174.5	28.4	-36	0	0	0	114.8
209	G	93.3	Very high	92.7	Very high	11 Å²	11	47.5 Å²	47.5	11%	0.113	27%	0.268	C	S	.	.			trans	80.1	-178.4	-174.3	0	0	0	0	0	113.6	L184 C201 S207	L184-G209 CarbonylContact O-C 3.43Å; L184-G209 WeakPolarHBondContact O-CA 3.26Å; C201-G209 VanDerWaalsContact SG-CA 3.5Å; S207-G209 PolarHBondContact O-N 3.3Å
210	Y	95.8	Very high	92.9	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.016	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-134.2	166.8	-179.9	65.4	-93.9	0	0	0	111.6	R152 L184 N186 T198 V214	R152-Y210 HydrophobicContact CG-CE2 4.42Å; R152-Y210 PolarHBondContact NH1-OH 3.31Å; L184-Y210 HydrophobicContact CB-CD1 4.27Å; L184-Y210 HydrophobicContact CB-CD2 4Å; L184-Y210 HydrophobicContact CB-CE1 3.86Å; L184-Y210 HydrophobicContact CB-CE2 3.58Å; L184-Y210 HydrophobicContact CB-CG 4.32Å; L184-Y210 VanDerWaalsContact CB-CZ 3.48Å; L184-Y210 HydrophobicContact CD1-CD2 4.4Å; L184-Y210 HydrophobicContact CD1-CE2 3.74Å; L184-Y210 HydrophobicContact CG-CE2 4.28Å; L184-Y210 PolarHBondContact N-O 2.94Å; L184-Y210 WeakPolarHBondContact O-CD1 3.47Å; L184-Y210 WeakPolarHBondContact O-CE1 3.41Å; L184-Y210 PolarHBondContact O-N 3.11Å; N186-Y210 WeakPolarHBondContact O-CE1 3.38Å; N186-Y210 PolarHBondContact O-OH 3.16Å; T198-Y210 HydrophobicContact CG2-CD1 4.28Å; T198-Y210 HydrophobicContact CG2-CE1 3.83Å; Y210-V214 HydrophobicContact CD2-CB 4.47Å; Y210-V214 HydrophobicContact CD2-CG1 3.47Å; Y210-V214 VanDerWaalsContact CD2-CG1 3.47Å; Y210-V214 HydrophobicContact CD2-CG2 4.22Å; Y210-V214 HydrophobicContact CE2-CG1 4.3Å; Y210-V214 HydrophobicContact CE2-CG2 4.46Å; Y210-V214 HydrophobicContact CG-CG1 3.9Å
211	S	96.6	Very high	93.2	Very high	14 Å²	14	43.4 Å²	43.4	10%	0.098	25%	0.25	C	S	.	.			trans	-143.3	-146	179.2	-169.9	0	0	0	0	110.6	L178 E213 V214	L178-S211 WeakPolarHBondContact CD1-OG 3.37Å; S211-E213 WeakPolarHBondContact CA-OE2 3.48Å; S211-E213 VanDerWaalsContact CB-OE2 3.25Å; S211-E213 WeakPolarHBondContact CB-OE2 3.39Å; S211-E213 PolarHBondContact N-OE2 3.3Å; S211-E213 PolarHBondContact O-N 2.72Å; S211-E213 VanDerWaalsContact O-N 3.11Å; S211-V214 VanDerWaalsContact O-CG2 3.31Å; S211-V214 WeakPolarHBondContact O-CG2 3.4Å; S211-V214 PolarHBondContact O-N 2.86Å
212	Q	97.5	Very high	93.6	Very high	49 Å²	49	42.4 Å²	42.4	23%	0.229	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.9	-174.9	-73.5	176.9	-25.6	0	0	114.7	H145 V150 V214 D215	H145-Q212 PolarHBondContact CE1-O 3.21Å; H145-Q212 PolarHBondContact O-NE2 2.97Å; V150-Q212 HydrophobicContact CG2-CB 4.39Å; V150-Q212 HydrophobicContact CG2-CG 3.64Å; Q212-V214 PolarHBondContact O-N 3.48Å; Q212-V214 VanDerWaalsContact O-N 3.12Å; Q212-D215 PolarHBondContact O-N 3.49Å; Q212-D215 VanDerWaalsContact O-N 3.14Å
213	E	98	Very high	94.2	Very high	56 Å²	56	37.7 Å²	37.7	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-62.7	-24.3	-175.2	-50.6	82.8	178.9	0	0	112.1	K183 S211 D215 I216 W217 P276 R279	K183-E213 IonicContact NZ-OE1 2.69Å; S211-E213 WeakPolarHBondContact CA-OE2 3.48Å; S211-E213 VanDerWaalsContact CB-OE2 3.25Å; S211-E213 WeakPolarHBondContact CB-OE2 3.39Å; S211-E213 PolarHBondContact N-OE2 3.3Å; S211-E213 PolarHBondContact O-N 2.72Å; S211-E213 VanDerWaalsContact O-N 3.11Å; E213-D215 VanDerWaalsContact C-N 3.28Å; E213-D215 PolarHBondContact O-N 3.45Å; E213-I216 WeakPolarHBondContact O-CB 3.42Å; E213-I216 PolarHBondContact O-N 3.13Å; E213-W217 PolarHBondContact O-N 3.44Å; E213-P276 HydrophobicContact CB-CB 3.86Å; E213-P276 HydrophobicContact CG-CB 4.09Å; E213-R279 PolarHBondContact O-NH1 3.37Å
214	V	98.4	Very high	94.8	Very high	9 Å²	9	34 Å²	34	6%	0.055	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-33.3	178.2	-55.6	0	0	0	0	112.6	V150 A195 E197 T198 Y210 S211 Q212 I216 W217 A218	V150-V214 HydrophobicContact CG1-CG2 3.67Å; A195-V214 HydrophobicContact CB-CB 4.01Å; A195-V214 HydrophobicContact CB-CG1 3.92Å; E197-V214 HydrophobicContact CG-CG1 4.15Å; T198-V214 WeakPolarHBondContact OG1-CG1 3.35Å; Y210-V214 HydrophobicContact CD2-CB 4.47Å; Y210-V214 HydrophobicContact CD2-CG1 3.47Å; Y210-V214 VanDerWaalsContact CD2-CG1 3.47Å; Y210-V214 HydrophobicContact CD2-CG2 4.22Å; Y210-V214 HydrophobicContact CE2-CG1 4.3Å; Y210-V214 HydrophobicContact CE2-CG2 4.46Å; Y210-V214 HydrophobicContact CG-CG1 3.9Å; S211-V214 VanDerWaalsContact O-CG2 3.31Å; S211-V214 WeakPolarHBondContact O-CG2 3.4Å; S211-V214 PolarHBondContact O-N 2.86Å; Q212-V214 PolarHBondContact O-N 3.48Å; Q212-V214 VanDerWaalsContact O-N 3.12Å; V214-I216 VanDerWaalsContact C-N 3.29Å; V214-I216 PolarHBondContact O-N 2.99Å; V214-W217 WeakPolarHBondContact O-CB 3.39Å; V214-W217 PolarHBondContact O-N 3.38Å; V214-A218 PolarHBondContact O-N 3.12Å; V214-A218 VanDerWaalsContact O-N 3.08Å
215	D	98.8	Very high	95.3	Very high	1 Å²	1	29 Å²	29	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-69.9	-31.4	178.2	-69.7	-23	0	0	0	110.8	V141 H145 V150 H151 R152 L154 Q212 E213 A218 C219	V141-D215 HydrophobicContact CG1-CB 4.3Å; H145-D215 IonicContact CD2-OD2 3.29Å; H145-D215 IonicContact CE1-OD2 3.25Å; H145-D215 IonicContact NE2-OD2 2.66Å; H145-D215 PolarHBondContact NE2-OD2 2.96Å; V150-D215 WeakPolarHBondContact CG1-OD2 3.49Å; H151-D215 PolarHBondContact N-OD1 3.35Å; H151-D215 PolarHBondContact N-OD2 3.47Å; R152-D215 PolarHBondContact N-OD1 2.91Å; L154-D215 HydrophobicContact CD1-CB 3.68Å; Q212-D215 PolarHBondContact O-N 3.49Å; Q212-D215 VanDerWaalsContact O-N 3.14Å; E213-D215 VanDerWaalsContact C-N 3.28Å; E213-D215 PolarHBondContact O-N 3.45Å; D215-A218 PolarHBondContact O-N 3.38Å; D215-C219 PolarHBondContact O-N 2.91Å; D215-C219 PolarHBondContact O-SG 2.7Å
216	I	98.8	Very high	96	Very high	5 Å²	5	19.5 Å²	19.5	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-68.9	-39.4	175.6	-50.6	-55.7	0	0	0	111.2	V141 E213 V214 C219 G220 C271 R279 I280 V282	V141-I216 HydrophobicContact CG1-CD1 4.18Å; E213-I216 WeakPolarHBondContact O-CB 3.42Å; E213-I216 PolarHBondContact O-N 3.13Å; V214-I216 VanDerWaalsContact C-N 3.29Å; V214-I216 PolarHBondContact O-N 2.99Å; I216-C219 PolarHBondContact O-N 3.33Å; I216-G220 PolarHBondContact O-N 3.3Å; I216-C271 HydrophobicContact CG2-CB 4.24Å; I216-R279 HydrophobicContact CG2-CG 4.29Å; I216-I280 HydrophobicContact CG2-CG2 4.09Å; I216-I280 WeakPolarHBondContact CG2-O 3.42Å; I216-V282 HydrophobicContact CD1-CB 3.79Å; I216-V282 HydrophobicContact CD1-CG2 4.4Å
217	W	98.8	Very high	96.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-50.4	172.9	176.8	-84.4	0	0	0	110.6	L194 A195 P196 E213 V214 C219 G220 V221 F233 I245 L272	L194-W217 PolarHBondContact O-NE1 2.99Å; A195-W217 HydrophobicContact CB-CB 3.85Å; A195-W217 HydrophobicContact CB-CD2 4.31Å; A195-W217 HydrophobicContact CB-CG 3.79Å; P196-W217 HydrophobicContact CG-CE3 4.19Å; P196-W217 HydrophobicContact CG-CH2 3.5Å; P196-W217 HydrophobicContact CG-CZ2 3.91Å; P196-W217 HydrophobicContact CG-CZ3 3.66Å; E213-W217 PolarHBondContact O-N 3.44Å; V214-W217 WeakPolarHBondContact O-CB 3.39Å; V214-W217 PolarHBondContact O-N 3.38Å; W217-C219 VanDerWaalsContact C-N 3.31Å; W217-C219 PolarHBondContact O-N 3.44Å; W217-G220 WeakPolarHBondContact O-CA 3.33Å; W217-G220 PolarHBondContact O-N 3.26Å; W217-V221 PolarHBondContact O-N 3.28Å; W217-F233 HydrophobicContact CH2-CE2 4.14Å; W217-F233 AromaticContact CH2-CZ 3.82Å; W217-F233 HydrophobicContact CH2-CZ 3.82Å; W217-F233 HydrophobicContact CZ2-CD2 4.34Å; W217-F233 AromaticContact CZ2-CE2 3.38Å; W217-F233 HydrophobicContact CZ2-CE2 3.38Å; W217-F233 AromaticContact CZ2-CZ 3.52Å; W217-F233 HydrophobicContact CZ2-CZ 3.52Å; W217-I245 HydrophobicContact CZ2-CG2 3.92Å; W217-L272 HydrophobicContact CD2-CD2 3.85Å; W217-L272 HydrophobicContact CE3-CB 4.44Å; W217-L272 HydrophobicContact CE3-CD2 4.07Å; W217-L272 HydrophobicContact CG-CD2 4.26Å; W217-L272 HydrophobicContact CZ2-CD2 4.39Å; W217-L272 HydrophobicContact CZ3-CB 4.2Å; W217-L272 HydrophobicContact CZ3-CD2 4.43Å; W217-L272 WeakPolarHBondContact O-CD2 3.49Å
218	A	98.8	Very high	97	Very high	4 Å²	4	14.9 Å²	14.9	3%	0.033	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-41.6	178.1	0	0	0	0	0	112.1	L154 V214 D215 G220 V221 I222	L154-A218 HydrophobicContact CB-CB 3.86Å; V214-A218 PolarHBondContact O-N 3.12Å; V214-A218 VanDerWaalsContact O-N 3.08Å; D215-A218 PolarHBondContact O-N 3.38Å; A218-G220 VanDerWaalsContact C-N 3.32Å; A218-G220 PolarHBondContact O-N 2.95Å; A218-V221 WeakPolarHBondContact O-CB 3.16Å; A218-V221 PolarHBondContact O-N 2.89Å; A218-I222 WeakPolarHBondContact O-CG1 3.34Å; A218-I222 PolarHBondContact O-N 2.75Å
219	C	98.9	Very high	97.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.9	-36.8	172.9	-68.7	0	0	0	0	113.1	M134 F138 D215 I216 W217 I222 M223	M134-C219 HydrophobicContact CE-CB 4.08Å; M134-C219 WeakPolarHBondContact CE-O 3.18Å; F138-C219 HydrophobicContact CD1-CB 4.22Å; F138-C219 HydrophobicContact CE1-CB 3.34Å; F138-C219 HydrophobicContact CE2-CB 4.45Å; F138-C219 HydrophobicContact CZ-CB 3.48Å; F138-C219 VanDerWaalsContact CZ-CB 3.48Å; D215-C219 PolarHBondContact O-N 2.91Å; D215-C219 PolarHBondContact O-SG 2.7Å; I216-C219 PolarHBondContact O-N 3.33Å; W217-C219 VanDerWaalsContact C-N 3.31Å; W217-C219 PolarHBondContact O-N 3.44Å; C219-I222 PolarHBondContact O-N 3.48Å; C219-M223 WeakPolarHBondContact O-CB 3.31Å; C219-M223 PolarHBondContact O-N 2.87Å
220	G	98.8	Very high	97.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.2	-41.7	172.8	0	0	0	0	0	112.5	I216 W217 A218 M223 F224	I216-G220 PolarHBondContact O-N 3.3Å; W217-G220 WeakPolarHBondContact O-CA 3.33Å; W217-G220 PolarHBondContact O-N 3.26Å; A218-G220 VanDerWaalsContact C-N 3.32Å; A218-G220 PolarHBondContact O-N 2.95Å; G220-M223 PolarHBondContact O-N 3.48Å; G220-F224 WeakPolarHBondContact O-CB 3.4Å; G220-F224 PolarHBondContact O-N 3.48Å
221	V	98.8	Very high	97	Very high	1 Å²	1	15 Å²	15	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-63.3	-46.8	174.3	177.9	0	0	0	0	110.5	Y193 W217 A218 M223 F224 T225 P232 F233 L272	Y193-V221 HydrophobicContact CD1-CB 3.89Å; Y193-V221 HydrophobicContact CD1-CG1 3.44Å; Y193-V221 VanDerWaalsContact CD1-CG1 3.44Å; Y193-V221 HydrophobicContact CE1-CB 4.31Å; Y193-V221 HydrophobicContact CE1-CG1 3.56Å; Y193-V221 HydrophobicContact CG-CG1 4.29Å; W217-V221 PolarHBondContact O-N 3.28Å; A218-V221 WeakPolarHBondContact O-CB 3.16Å; A218-V221 PolarHBondContact O-N 2.89Å; V221-M223 PolarHBondContact O-N 3.46Å; V221-F224 PolarHBondContact O-N 3.06Å; V221-T225 PolarHBondContact O-N 2.74Å; V221-T225 PolarHBondContact O-OG1 3Å; V221-P232 HydrophobicContact CB-CG 4.31Å; V221-P232 HydrophobicContact CG1-CG 4.01Å; V221-P232 HydrophobicContact CG2-CG 4.13Å; V221-F233 HydrophobicContact CG2-CD2 4.44Å; V221-F233 HydrophobicContact CG2-CE2 4.24Å; V221-L272 HydrophobicContact CG2-CD2 3.89Å
222	I	98.8	Very high	97	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.5	-51	175.5	-67.2	161.3	0	0	0	110.2	M134 I137 L154 P156 I159 Y193 A218 C219 F224 T225 L226	M134-I222 HydrophobicContact SD-CG2 3.91Å; I137-I222 HydrophobicContact CD1-CG2 4.24Å; L154-I222 HydrophobicContact CB-CD1 4.18Å; P156-I222 HydrophobicContact CG-CG1 4.32Å; I159-I222 HydrophobicContact CD1-CD1 3.87Å; I159-I222 HydrophobicContact CD1-CG2 4.46Å; Y193-I222 HydrophobicContact CD1-CG1 4.31Å; Y193-I222 HydrophobicContact CE1-CG1 4.06Å; A218-I222 WeakPolarHBondContact O-CG1 3.34Å; A218-I222 PolarHBondContact O-N 2.75Å; C219-I222 PolarHBondContact O-N 3.48Å; I222-F224 VanDerWaalsContact C-N 3.31Å; I222-F224 PolarHBondContact O-N 2.83Å; I222-T225 PolarHBondContact O-N 3.25Å; I222-T225 VanDerWaalsContact O-N 3.12Å; I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.06Å; I222-L226 VanDerWaalsContact O-CG 3.31Å; I222-L226 WeakPolarHBondContact O-CG 3.48Å; I222-L226 PolarHBondContact O-N 3.15Å
223	M	98.6	Very high	96.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.2	-41.6	-178.6	-175.7	169.9	170.1	0	0	112.5	T130 M134 C219 G220 V221 L227 P264 L267 I268 F290	T130-M223 HydrophobicContact CG2-CG 4.26Å; M134-M223 HydrophobicContact CE-CB 3.91Å; M134-M223 HydrophobicContact CG-CB 4.06Å; M134-M223 HydrophobicContact CG-CG 3.96Å; M134-M223 HydrophobicContact CG-SD 4.33Å; M134-M223 HydrophobicContact SD-CB 3.83Å; M134-M223 HydrophobicContact SD-CG 4.4Å; C219-M223 WeakPolarHBondContact O-CB 3.31Å; C219-M223 PolarHBondContact O-N 2.87Å; G220-M223 PolarHBondContact O-N 3.48Å; V221-M223 PolarHBondContact O-N 3.46Å; M223-L227 HydrophobicContact CE-CD1 4.34Å; M223-L227 HydrophobicContact CG-CD1 4.35Å; M223-L227 WeakPolarHBondContact O-CG 3.27Å; M223-L227 PolarHBondContact O-N 2.87Å; M223-P264 HydrophobicContact CE-CB 3.47Å; M223-P264 VanDerWaalsContact CE-CB 3.47Å; M223-L267 HydrophobicContact CE-CB 4.27Å; M223-L267 HydrophobicContact CE-CD2 4.01Å; M223-L267 HydrophobicContact CE-CG 4.44Å; M223-L267 HydrophobicContact SD-CB 4.46Å; M223-L267 HydrophobicContact SD-CD2 3.74Å; M223-L267 HydrophobicContact SD-CG 4.07Å; M223-I268 HydrophobicContact CB-CG1 4.27Å; M223-I268 HydrophobicContact CE-CG1 4.35Å; M223-I268 HydrophobicContact CG-CD1 4.13Å; M223-I268 HydrophobicContact CG-CG1 3.97Å; M223-I268 HydrophobicContact SD-CG1 4.08Å; M223-F290 HydrophobicContact CE-CD1 3.73Å; M223-F290 HydrophobicContact CE-CD2 4.26Å; M223-F290 HydrophobicContact CE-CE1 3.43Å; M223-F290 VanDerWaalsContact CE-CE1 3.43Å; M223-F290 HydrophobicContact CE-CE2 4.03Å; M223-F290 HydrophobicContact CE-CG 4.13Å; M223-F290 HydrophobicContact CE-CZ 3.6Å; M223-F290 HydrophobicContact SD-CE1 4.28Å
224	F	98.6	Very high	96.6	Very high	8 Å²	8	18.8 Å²	18.8	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-58.8	-53.2	173.7	-173.5	-70.5	0	0	0	110.2	G220 V221 I222 L226 L227 V228 C230 P232 Y250 F252 W257 I268	G220-F224 WeakPolarHBondContact O-CB 3.4Å; G220-F224 PolarHBondContact O-N 3.48Å; V221-F224 PolarHBondContact O-N 3.06Å; I222-F224 VanDerWaalsContact C-N 3.31Å; I222-F224 PolarHBondContact O-N 2.83Å; F224-L226 VanDerWaalsContact C-N 3.34Å; F224-L226 PolarHBondContact O-N 3.36Å; F224-L227 PolarHBondContact O-N 2.96Å; F224-L227 VanDerWaalsContact O-N 3.15Å; F224-V228 HydrophobicContact CD1-CG2 3.8Å; F224-V228 HydrophobicContact CE1-CG2 3.53Å; F224-V228 HydrophobicContact CZ-CG2 4.31Å; F224-V228 WeakPolarHBondContact O-CG2 3.36Å; F224-V228 PolarHBondContact O-N 3Å; F224-C230 WeakPolarHBondContact CD1-O 3.07Å; F224-C230 WeakPolarHBondContact CE1-O 3.5Å; F224-P232 HydrophobicContact CB-CB 4.38Å; F224-P232 HydrophobicContact CB-CG 4.13Å; F224-P232 HydrophobicContact CD1-CB 3.86Å; F224-P232 HydrophobicContact CD1-CG 4.16Å; F224-P232 HydrophobicContact CD2-CB 3.71Å; F224-P232 HydrophobicContact CD2-CG 4.38Å; F224-P232 HydrophobicContact CE1-CB 4.02Å; F224-P232 HydrophobicContact CE2-CB 3.87Å; F224-P232 HydrophobicContact CG-CB 3.73Å; F224-P232 HydrophobicContact CG-CG 3.98Å; F224-P232 HydrophobicContact CZ-CB 4.02Å; F224-Y250 HydrophobicContact CD2-CD2 4.49Å; F224-Y250 HydrophobicContact CE2-CD2 4.13Å; F224-F252 HydrophobicContact CD2-CE1 4.1Å; F224-F252 HydrophobicContact CE2-CD1 4.09Å; F224-F252 HydrophobicContact CE2-CE1 4.02Å; F224-W257 AromaticContact CD1-CZ2 3.94Å; F224-W257 HydrophobicContact CD1-CZ2 3.94Å; F224-W257 AromaticContact CD2-CH2 3.92Å; F224-W257 HydrophobicContact CD2-CH2 3.92Å; F224-W257 AromaticContact CD2-CZ2 3.42Å; F224-W257 HydrophobicContact CD2-CZ2 3.42Å; F224-W257 VanDerWaalsContact CD2-CZ2 3.42Å; F224-W257 AromaticContact CE1-CZ2 3.85Å; F224-W257 HydrophobicContact CE1-CZ2 3.85Å; F224-W257 AromaticContact CE2-CE2 3.85Å; F224-W257 HydrophobicContact CE2-CH2 4.18Å; F224-W257 AromaticContact CE2-CZ2 3.32Å; F224-W257 HydrophobicContact CE2-CZ2 3.32Å; F224-W257 HydrophobicContact CG-CH2 4.24Å; F224-W257 AromaticContact CG-CZ2 3.74Å; F224-W257 HydrophobicContact CG-CZ2 3.74Å; F224-W257 AromaticContact CZ-CE2 3.83Å; F224-W257 AromaticContact CZ-CZ2 3.54Å; F224-W257 HydrophobicContact CZ-CZ2 3.54Å; F224-W257 AromaticContact CZ-NE1 3.58Å; F224-I268 HydrophobicContact CB-CD1 4.13Å; F224-I268 HydrophobicContact CD2-CD1 4.45Å; F224-I268 HydrophobicContact CD2-CG2 4.15Å
225	T	97.2	Very high	96.3	Very high	10 Å²	10	21.9 Å²	21.9	6%	0.061	12%	0.117	C	C	.	.	H	α-helix	trans	-60.9	-39.9	-177.7	-54.4	0	0	0	0	112.4	L119 V221 I222 L227 G229 C230 P231	L119-T225 HydrophobicContact CD2-CG2 3.76Å; V221-T225 PolarHBondContact O-N 2.74Å; V221-T225 PolarHBondContact O-OG1 3Å; I222-T225 PolarHBondContact O-N 3.25Å; I222-T225 VanDerWaalsContact O-N 3.12Å; T225-L227 VanDerWaalsContact C-N 3.29Å; T225-L227 PolarHBondContact O-N 3.19Å; T225-G229 VanDerWaalsContact O-CA 3.25Å; T225-G229 WeakPolarHBondContact O-CA 3.47Å; T225-G229 PolarHBondContact O-N 3.36Å; T225-C230 WeakPolarHBondContact CA-O 3.31Å; T225-P231 WeakPolarHBondContact OG1-CA 3.31Å
226	L	97.4	Very high	95.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-32.7	178.2	-68	-179.2	0	0	0	113	L115 L119 L125 T130 I133 M134 I222 F224	L115-L226 HydrophobicContact CD1-CD2 4.05Å; L115-L226 HydrophobicContact CD2-CD1 4.28Å; L115-L226 HydrophobicContact CD2-CD2 4.05Å; L115-L226 HydrophobicContact CG-CD2 4.04Å; L119-L226 HydrophobicContact CD1-CD2 4.31Å; L119-L226 HydrophobicContact CD2-CD2 4.25Å; L125-L226 WeakPolarHBondContact CB-O 3.39Å; L125-L226 HydrophobicContact CD1-CB 4.28Å; L125-L226 HydrophobicContact CD1-CD1 4.45Å; L125-L226 HydrophobicContact CD1-CD2 3.87Å; L125-L226 HydrophobicContact CD1-CG 4.41Å; L125-L226 PolarHBondContact N-O 3.35Å; T130-L226 HydrophobicContact CG2-CB 4.1Å; T130-L226 HydrophobicContact CG2-CD1 4.37Å; I133-L226 HydrophobicContact CG2-CD1 3.9Å; M134-L226 HydrophobicContact CG-CD1 4.35Å; M134-L226 HydrophobicContact SD-CD1 3.85Å; I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.06Å; I222-L226 VanDerWaalsContact O-CG 3.31Å; I222-L226 WeakPolarHBondContact O-CG 3.48Å; I222-L226 PolarHBondContact O-N 3.15Å; F224-L226 VanDerWaalsContact C-N 3.34Å; F224-L226 PolarHBondContact O-N 3.36Å
227	L	96.3	Very high	95.6	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-78.4	-37.5	-177.1	-72.1	166.8	0	0	0	113	E127 T130 M223 F224 T225 W257 I260 P264 I268	E127-L227 HydrophobicContact CG-CD2 4.06Å; T130-L227 HydrophobicContact CG2-CD2 3.94Å; T130-L227 HydrophobicContact CG2-CG 4Å; M223-L227 HydrophobicContact CE-CD1 4.34Å; M223-L227 HydrophobicContact CG-CD1 4.35Å; M223-L227 WeakPolarHBondContact O-CG 3.27Å; M223-L227 PolarHBondContact O-N 2.87Å; F224-L227 PolarHBondContact O-N 2.96Å; F224-L227 VanDerWaalsContact O-N 3.15Å; T225-L227 VanDerWaalsContact C-N 3.29Å; T225-L227 PolarHBondContact O-N 3.19Å; L227-W257 HydrophobicContact CB-CH2 4.24Å; L227-W257 HydrophobicContact CD1-CH2 3.99Å; L227-W257 HydrophobicContact CD1-CZ3 4.03Å; L227-I260 HydrophobicContact CD1-CG2 4.47Å; L227-I260 HydrophobicContact CD2-CD1 4.3Å; L227-P264 HydrophobicContact CD1-CB 3.79Å; L227-I268 HydrophobicContact CD1-CD1 3.89Å
228	V	92.8	Very high	95.2	Very high	13 Å²	13	45.4 Å²	45.4	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-122.8	-1.7	-171.4	-63.1	0	0	0	0	115	F224 C230 E256 W257	F224-V228 HydrophobicContact CD1-CG2 3.8Å; F224-V228 HydrophobicContact CE1-CG2 3.53Å; F224-V228 HydrophobicContact CZ-CG2 4.31Å; F224-V228 WeakPolarHBondContact O-CG2 3.36Å; F224-V228 PolarHBondContact O-N 3Å; V228-C230 PolarHBondContact O-N 3.34Å; V228-E256 HydrophobicContact CB-CB 4.09Å; V228-E256 HydrophobicContact CG1-CB 3.95Å; V228-W257 HydrophobicContact CB-CZ2 4.36Å; V228-W257 HydrophobicContact CG1-CD2 3.8Å; V228-W257 VanDerWaalsContact CG1-CE2 3.41Å; V228-W257 HydrophobicContact CG1-CE3 4.4Å; V228-W257 HydrophobicContact CG1-CG 4.15Å; V228-W257 HydrophobicContact CG1-CH2 4.32Å; V228-W257 HydrophobicContact CG1-CZ2 3.68Å; V228-W257 HydrophobicContact CG2-CZ2 3.71Å
229	G	90.8	Very high	94.9	Very high	34 Å²	34	52 Å²	52	35%	0.351	25%	0.247	S	C	.	.	S	Bend	trans	76.1	3.4	175.1	0	0	0	0	0	114.6	V123 T225	V123-G229 VanDerWaalsContact O-CA 3.22Å; V123-G229 WeakPolarHBondContact O-CA 3.45Å; T225-G229 VanDerWaalsContact O-CA 3.25Å; T225-G229 WeakPolarHBondContact O-CA 3.47Å; T225-G229 PolarHBondContact O-N 3.36Å
230	C	90.4	Very high	94.7	Very high	57 Å²	57	54.1 Å²	54.1	39%	0.385	26%	0.26	S	S	.	.	S	Bend	trans	-134.8	146.8	177.2	64.7	0	0	0	0	110.9	F224 T225 V228	F224-C230 WeakPolarHBondContact CD1-O 3.07Å; F224-C230 WeakPolarHBondContact CE1-O 3.5Å; T225-C230 WeakPolarHBondContact CA-O 3.31Å; V228-C230 PolarHBondContact O-N 3.34Å
231	P	94.1	Very high	94.5	Very high	48 Å²	48	55.2 Å²	55.2	31%	0.312	27%	0.265	S	S	.	.			trans	-74.3	151.3	-179.6	29.6	-34.3	0	0	0	112.1	T225 F233 W234	T225-P231 WeakPolarHBondContact OG1-CA 3.31Å; P231-F233 PolarHBondContact O-N 2.86Å; P231-W234 HydrophobicContact CG-CB 4.12Å
232	P	96.6	Very high	94.4	Very high	16 Å²	16	56 Å²	56	10%	0.104	27%	0.269	C	S	.	.	S	Bend	trans	-64.8	-29	-179.2	23.4	-31.2	0	0	0	113.1	V221 F224 Y250 L272	V221-P232 HydrophobicContact CB-CG 4.31Å; V221-P232 HydrophobicContact CG1-CG 4.01Å; V221-P232 HydrophobicContact CG2-CG 4.13Å; F224-P232 HydrophobicContact CB-CB 4.38Å; F224-P232 HydrophobicContact CB-CG 4.13Å; F224-P232 HydrophobicContact CD1-CB 3.86Å; F224-P232 HydrophobicContact CD1-CG 4.16Å; F224-P232 HydrophobicContact CD2-CB 3.71Å; F224-P232 HydrophobicContact CD2-CG 4.38Å; F224-P232 HydrophobicContact CE1-CB 4.02Å; F224-P232 HydrophobicContact CE2-CB 3.87Å; F224-P232 HydrophobicContact CG-CB 3.73Å; F224-P232 HydrophobicContact CG-CG 3.98Å; F224-P232 HydrophobicContact CZ-CB 4.02Å; P232-Y250 HydrophobicContact CB-CG 4.35Å; P232-L272 HydrophobicContact CB-CD1 4.32Å; P232-L272 HydrophobicContact CG-CD1 4.28Å
233	F	96.1	Very high	94.2	Very high	3 Å²	3	63.3 Å²	63.3	1%	0.013	30%	0.297	C	S	.	.	S	Bend	trans	-120.3	103.1	-179.5	-47.9	-72.2	0	0	0	109	W217 V221 P231 M241 N244 I245 Y250 L272	W217-F233 HydrophobicContact CH2-CE2 4.14Å; W217-F233 AromaticContact CH2-CZ 3.82Å; W217-F233 HydrophobicContact CH2-CZ 3.82Å; W217-F233 HydrophobicContact CZ2-CD2 4.34Å; W217-F233 AromaticContact CZ2-CE2 3.38Å; W217-F233 HydrophobicContact CZ2-CE2 3.38Å; W217-F233 AromaticContact CZ2-CZ 3.52Å; W217-F233 HydrophobicContact CZ2-CZ 3.52Å; V221-F233 HydrophobicContact CG2-CD2 4.44Å; V221-F233 HydrophobicContact CG2-CE2 4.24Å; P231-F233 PolarHBondContact O-N 2.86Å; F233-M241 HydrophobicContact CB-CG 4.29Å; F233-N244 HydrophobicContact CD1-CB 4.12Å; F233-I245 HydrophobicContact CB-CD1 4.27Å; F233-I245 HydrophobicContact CB-CG1 3.63Å; F233-I245 HydrophobicContact CD1-CG1 4.14Å; F233-I245 HydrophobicContact CD2-CG1 3.75Å; F233-I245 HydrophobicContact CE2-CG1 4.47Å; F233-I245 HydrophobicContact CG-CG1 3.57Å; F233-Y250 AromaticContact CE1-CD1 3.82Å; F233-Y250 HydrophobicContact CE1-CD1 3.82Å; F233-Y250 HydrophobicContact CE1-CG 4.31Å; F233-Y250 AromaticContact CZ-CD1 3.71Å; F233-Y250 HydrophobicContact CZ-CD1 3.71Å; F233-Y250 HydrophobicContact CZ-CG 4.35Å; F233-L272 HydrophobicContact CE2-CD1 4.35Å; F233-L272 HydrophobicContact CE2-CD2 4.49Å; F233-L272 HydrophobicContact CZ-CD1 4.37Å
234	W	91.1	Very high	94.2	Very high	180 Å²	180	64.7 Å²	64.7	68%	0.682	30%	0.304	S	S	*	.			trans	-141.9	138.3	173.2	-172.3	87.8	0	0	0	111.1	P231	P231-W234 HydrophobicContact CG-CB 4.12Å
235	H	92.1	Very high	94.1	Very high	75 Å²	75	64.3 Å²	64.3	35%	0.347	30%	0.302	S	S	.	.			trans	-158.6	144	170.6	-168.6	-92.3	0	0	0	109.8	K237 V240 M241	H235-K237 WeakPolarHBondContact ND1-CB 3.4Å; H235-K237 PolarHBondContact ND1-N 3.12Å; H235-K237 PolarHBondContact ND1-O 3.17Å; H235-K237 PolarHBondContact O-N 3.36Å; H235-K237 VanDerWaalsContact O-N 3.16Å; H235-V240 HydrophobicContact CB-CB 4.13Å; H235-V240 HydrophobicContact CB-CG1 4.14Å; H235-V240 WeakPolarHBondContact ND1-CB 3.46Å; H235-M241 HydrophobicContact CB-CB 4.2Å
236	R	89.9	Confident	94	Very high	230 Å²	230	65.9 Å²	65.9	87%	0.868	31%	0.31	S	S	*	.	S	Bend	trans	-55.6	-35	178.3	-176	177.2	179.2	-179.5	1.4	113.3
237	K	92.1	Very high	94	Very high	147 Å²	147	71.3 Å²	71.3	64%	0.639	34%	0.335	S	S	*	.	S	Bend	trans	-91.9	113.2	172.3	-60.9	-177.3	178.7	-178.8	0	109.6	H235 M239 V240 M241	H235-K237 WeakPolarHBondContact ND1-CB 3.4Å; H235-K237 PolarHBondContact ND1-N 3.12Å; H235-K237 PolarHBondContact ND1-O 3.17Å; H235-K237 PolarHBondContact O-N 3.36Å; H235-K237 VanDerWaalsContact O-N 3.16Å; K237-M239 VanDerWaalsContact C-N 3.29Å; K237-M239 PolarHBondContact O-N 3.06Å; K237-V240 HydrophobicContact CB-CB 4.46Å; K237-V240 HydrophobicContact CB-CG2 3.96Å; K237-V240 WeakPolarHBondContact O-CB 3.32Å; K237-V240 PolarHBondContact O-N 3.08Å; K237-M241 PolarHBondContact O-N 3.39Å
238	Q	91.8	Very high	94	Very high	122 Å²	122	71.9 Å²	71.9	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-52.8	-43	-178.8	-177.2	173	-41.7	0	0	113	V240 M241 L242	Q238-V240 PolarHBondContact O-N 2.78Å; Q238-V240 VanDerWaalsContact O-N 3.17Å; Q238-M241 HydrophobicContact CG-CE 4.25Å; Q238-M241 WeakPolarHBondContact O-CB 3.28Å; Q238-M241 PolarHBondContact O-N 3.48Å; Q238-L242 HydrophobicContact CG-CD1 4.24Å; Q238-L242 HydrophobicContact CG-CG 4.28Å; Q238-L242 WeakPolarHBondContact O-CG 3.4Å; Q238-L242 PolarHBondContact O-N 3.44Å
239	M	92.4	Very high	94.2	Very high	143 Å²	143	77.5 Å²	77.5	70%	0.704	37%	0.365	S	S	*	.	H	α-helix	trans	-58.8	-30.7	178.2	-72.4	-61.2	-161.1	0	0	114	K237 L242 R243	K237-M239 VanDerWaalsContact C-N 3.29Å; K237-M239 PolarHBondContact O-N 3.06Å; M239-L242 HydrophobicContact SD-CD1 4.36Å; M239-R243 WeakPolarHBondContact O-CB 3.33Å; M239-R243 PolarHBondContact O-N 2.87Å; M239-R243 VanDerWaalsContact O-N 3.08Å
240	V	94.5	Very high	94.5	Very high	45 Å²	45	78.4 Å²	78.4	27%	0.273	36%	0.358	S	S	.	.	H	α-helix	trans	-76.6	-38.4	176.5	179.6	0	0	0	0	110.6	H235 K237 Q238 R243 N244	H235-V240 HydrophobicContact CB-CB 4.13Å; H235-V240 HydrophobicContact CB-CG1 4.14Å; H235-V240 WeakPolarHBondContact ND1-CB 3.46Å; K237-V240 HydrophobicContact CB-CB 4.46Å; K237-V240 HydrophobicContact CB-CG2 3.96Å; K237-V240 WeakPolarHBondContact O-CB 3.32Å; K237-V240 PolarHBondContact O-N 3.08Å; Q238-V240 PolarHBondContact O-N 2.78Å; Q238-V240 VanDerWaalsContact O-N 3.17Å; V240-R243 PolarHBondContact O-N 2.98Å; V240-N244 VanDerWaalsContact O-CG 3.31Å; V240-N244 PolarHBondContact O-N 3.49Å
241	M	95.3	Very high	94.6	Very high	22 Å²	22	79.1 Å²	79.1	11%	0.108	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-47.9	173	-179.6	-174	76.3	0	0	110.7	P191 F233 H235 K237 Q238 R243 N244 I245	P191-M241 HydrophobicContact CB-CE 3.92Å; F233-M241 HydrophobicContact CB-CG 4.29Å; H235-M241 HydrophobicContact CB-CB 4.2Å; K237-M241 PolarHBondContact O-N 3.39Å; Q238-M241 HydrophobicContact CG-CE 4.25Å; Q238-M241 WeakPolarHBondContact O-CB 3.28Å; Q238-M241 PolarHBondContact O-N 3.48Å; M241-R243 VanDerWaalsContact C-N 3.31Å; M241-R243 PolarHBondContact O-N 3.42Å; M241-N244 PolarHBondContact O-N 3.43Å; M241-N244 VanDerWaalsContact O-N 3.15Å; M241-I245 HydrophobicContact CG-CD1 4.25Å; M241-I245 WeakPolarHBondContact O-CG1 3.5Å; M241-I245 PolarHBondContact O-N 2.98Å
242	L	94.9	Very high	94.6	Very high	17 Å²	17	79 Å²	79	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-40.4	176.5	-64.4	-179.6	0	0	0	111.9	L199 M203 Q238 M239 I245 M246	L199-L242 HydrophobicContact CD1-CB 4.41Å; L199-L242 HydrophobicContact CD1-CD2 3.97Å; L199-L242 HydrophobicContact CD2-CD2 3.93Å; M203-L242 HydrophobicContact CE-CD1 4.44Å; Q238-L242 HydrophobicContact CG-CD1 4.24Å; Q238-L242 HydrophobicContact CG-CG 4.28Å; Q238-L242 WeakPolarHBondContact O-CG 3.4Å; Q238-L242 PolarHBondContact O-N 3.44Å; M239-L242 HydrophobicContact SD-CD1 4.36Å; L242-I245 HydrophobicContact CD2-CD1 4.38Å; L242-I245 WeakPolarHBondContact O-CB 3.44Å; L242-I245 PolarHBondContact O-N 3.41Å; L242-M246 VanDerWaalsContact O-CG 3.31Å; L242-M246 WeakPolarHBondContact O-CG 3.29Å; L242-M246 PolarHBondContact O-N 3.07Å
243	R	96.1	Very high	94.2	Very high	155 Å²	155	81.8 Å²	81.8	59%	0.585	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-46.4	173.2	-176.5	-177.3	-60.7	179.4	-2.1	112.1	M239 V240 M241 I245 M246 E247	M239-R243 WeakPolarHBondContact O-CB 3.33Å; M239-R243 PolarHBondContact O-N 2.87Å; M239-R243 VanDerWaalsContact O-N 3.08Å; V240-R243 PolarHBondContact O-N 2.98Å; M241-R243 VanDerWaalsContact C-N 3.31Å; M241-R243 PolarHBondContact O-N 3.42Å; R243-I245 VanDerWaalsContact C-N 3.27Å; R243-I245 PolarHBondContact O-N 2.98Å; R243-M246 PolarHBondContact O-N 2.9Å; R243-M246 VanDerWaalsContact O-N 3.16Å; R243-E247 WeakPolarHBondContact CD-OE1 3.42Å; R243-E247 HydrophobicContact CG-CG 4.36Å; R243-E247 VanDerWaalsContact CG-OE1 3.24Å; R243-E247 WeakPolarHBondContact CG-OE1 3.42Å; R243-E247 WeakPolarHBondContact O-CB 3.48Å; R243-E247 WeakPolarHBondContact O-CG 3.26Å; R243-E247 PolarHBondContact O-N 2.66Å
244	N	97	Very high	93.2	Very high	29 Å²	29	86.2 Å²	86.2	16%	0.155	41%	0.407	C	S	.	.	H	α-helix	trans	-60.8	-38.4	177.9	-70	-15.8	0	0	0	111.5	F233 V240 M241 E247 G248 K249	F233-N244 HydrophobicContact CD1-CB 4.12Å; V240-N244 VanDerWaalsContact O-CG 3.31Å; V240-N244 PolarHBondContact O-N 3.49Å; M241-N244 PolarHBondContact O-N 3.43Å; M241-N244 VanDerWaalsContact O-N 3.15Å; N244-E247 PolarHBondContact O-N 2.88Å; N244-G248 PolarHBondContact O-N 3.18Å; N244-K249 HydrophobicContact CB-CB 4.31Å; N244-K249 PolarHBondContact O-N 3.1Å
245	I	97.4	Very high	93	Very high	0 Å²	0	82.3 Å²	82.3	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-60.2	-53.8	172.5	-68.1	166.5	0	0	0	109.6	P191 L194 P196 L199 W217 F233 M241 L242 R243 E247 G248	P191-I245 VanDerWaalsContact O-CD1 3.31Å; P191-I245 WeakPolarHBondContact O-CD1 3.18Å; L194-I245 VanDerWaalsContact O-CG2 3.24Å; L194-I245 WeakPolarHBondContact O-CG2 3.35Å; P196-I245 HydrophobicContact CG-CG2 4.36Å; P196-I245 WeakPolarHBondContact CG-O 3.07Å; L199-I245 HydrophobicContact CD1-CB 4.08Å; L199-I245 HydrophobicContact CD1-CG2 3.64Å; W217-I245 HydrophobicContact CZ2-CG2 3.92Å; F233-I245 HydrophobicContact CB-CD1 4.27Å; F233-I245 HydrophobicContact CB-CG1 3.63Å; F233-I245 HydrophobicContact CD1-CG1 4.14Å; F233-I245 HydrophobicContact CD2-CG1 3.75Å; F233-I245 HydrophobicContact CE2-CG1 4.47Å; F233-I245 HydrophobicContact CG-CG1 3.57Å; M241-I245 HydrophobicContact CG-CD1 4.25Å; M241-I245 WeakPolarHBondContact O-CG1 3.5Å; M241-I245 PolarHBondContact O-N 2.98Å; L242-I245 HydrophobicContact CD2-CD1 4.38Å; L242-I245 WeakPolarHBondContact O-CB 3.44Å; L242-I245 PolarHBondContact O-N 3.41Å; R243-I245 VanDerWaalsContact C-N 3.27Å; R243-I245 PolarHBondContact O-N 2.98Å; I245-E247 PolarHBondContact O-N 2.98Å; I245-G248 PolarHBondContact O-N 3.12Å
246	M	95.8	Very high	92.5	Very high	43 Å²	43	83.4 Å²	83.4	21%	0.212	41%	0.41	C	S	.	.	H	α-helix	trans	-58.3	-33.4	-178.8	-71.3	176.5	72.1	0	0	113.8	L199 K200 M203 F204 L242 R243	L199-M246 HydrophobicContact CB-CG 4.27Å; L199-M246 HydrophobicContact CD1-CG 3.95Å; K200-M246 HydrophobicContact CG-CE 4.32Å; M203-M246 HydrophobicContact CE-SD 4.3Å; M203-M246 HydrophobicContact SD-CE 4.01Å; M203-M246 HydrophobicContact SD-SD 3.6Å; F204-M246 HydrophobicContact CE2-CE 3.82Å; F204-M246 HydrophobicContact CZ-CE 4.3Å; L242-M246 VanDerWaalsContact O-CG 3.31Å; L242-M246 WeakPolarHBondContact O-CG 3.29Å; L242-M246 PolarHBondContact O-N 3.07Å; R243-M246 PolarHBondContact O-N 2.9Å; R243-M246 VanDerWaalsContact O-N 3.16Å
247	E	96.6	Very high	92.6	Very high	113 Å²	113	72.7 Å²	72.7	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-87	-8.7	177.6	-68.5	174.5	-170.9	0	0	113.2	R243 N244 I245 K249	R243-E247 WeakPolarHBondContact CD-OE1 3.42Å; R243-E247 HydrophobicContact CG-CG 4.36Å; R243-E247 VanDerWaalsContact CG-OE1 3.24Å; R243-E247 WeakPolarHBondContact CG-OE1 3.42Å; R243-E247 WeakPolarHBondContact O-CB 3.48Å; R243-E247 WeakPolarHBondContact O-CG 3.26Å; R243-E247 PolarHBondContact O-N 2.66Å; N244-E247 PolarHBondContact O-N 2.88Å; I245-E247 PolarHBondContact O-N 2.98Å; E247-K249 HydrophobicContact CB-CB 4.21Å; E247-K249 PolarHBondContact O-N 3.31Å
248	G	96.7	Very high	92.2	Very high	17 Å²	17	68.7 Å²	68.7	18%	0.175	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	30.9	-172.1	0	0	0	0	0	113	N244 I245 Y250	N244-G248 PolarHBondContact O-N 3.18Å; I245-G248 PolarHBondContact O-N 3.12Å; G248-Y250 VanDerWaalsContact O-CD1 3.23Å; G248-Y250 WeakPolarHBondContact O-CD1 3.39Å; G248-Y250 WeakPolarHBondContact O-CE1 3.45Å; G248-Y250 PolarHBondContact O-N 3.39Å
249	K	96.6	Very high	91.9	Very high	132 Å²	132	70.3 Å²	70.3	57%	0.574	38%	0.376	S	S	*	.			trans	-88.1	94.9	-172.9	-170.7	179.4	-178.1	176.7	0	111.7	N244 E247	N244-K249 HydrophobicContact CB-CB 4.31Å; N244-K249 PolarHBondContact O-N 3.1Å; E247-K249 HydrophobicContact CB-CB 4.21Å; E247-K249 PolarHBondContact O-N 3.31Å
250	Y	96.6	Very high	91.9	Very high	52 Å²	52	64.7 Å²	64.7	20%	0.204	35%	0.349	C	S	.	.			trans	-138.1	167	170.9	64.7	-82.7	0	0	0	109.8	F224 P232 F233 G248 F252 I268 R269 L272	F224-Y250 HydrophobicContact CD2-CD2 4.49Å; F224-Y250 HydrophobicContact CE2-CD2 4.13Å; P232-Y250 HydrophobicContact CB-CG 4.35Å; F233-Y250 AromaticContact CE1-CD1 3.82Å; F233-Y250 HydrophobicContact CE1-CD1 3.82Å; F233-Y250 HydrophobicContact CE1-CG 4.31Å; F233-Y250 AromaticContact CZ-CD1 3.71Å; F233-Y250 HydrophobicContact CZ-CD1 3.71Å; F233-Y250 HydrophobicContact CZ-CG 4.35Å; G248-Y250 VanDerWaalsContact O-CD1 3.23Å; G248-Y250 WeakPolarHBondContact O-CD1 3.39Å; G248-Y250 WeakPolarHBondContact O-CE1 3.45Å; G248-Y250 PolarHBondContact O-N 3.39Å; Y250-F252 HydrophobicContact CD2-CZ 4.38Å; Y250-F252 HydrophobicContact CE2-CE1 4.22Å; Y250-F252 HydrophobicContact CE2-CE2 4.01Å; Y250-F252 AromaticContact CE2-CZ 3.68Å; Y250-F252 HydrophobicContact CE2-CZ 3.68Å; Y250-I268 HydrophobicContact CE2-CG2 4.19Å; Y250-R269 WeakPolarHBondContact OH-CA 3.42Å; Y250-L272 HydrophobicContact CD1-CB 4.45Å; Y250-L272 HydrophobicContact CD1-CD1 4.08Å; Y250-L272 HydrophobicContact CD2-CD1 4.37Å; Y250-L272 HydrophobicContact CE1-CB 3.62Å; Y250-L272 HydrophobicContact CE1-CD1 3.89Å; Y250-L272 HydrophobicContact CE1-CG 4.43Å; Y250-L272 HydrophobicContact CE2-CD1 4.19Å; Y250-L272 HydrophobicContact CG-CD1 4.33Å
251	S	93.9	Very high	91.9	Very high	73 Å²	73	64.8 Å²	64.8	51%	0.51	35%	0.352	S	S	.	.			trans	-147.8	145.5	-178	53.9	0	0	0	0	112.4	T253	S251-T253 PolarHBondContact O-N 3.41Å; S251-T253 WeakPolarHBondContact OG-CG2 3.31Å
252	F	93.9	Very high	91.9	Very high	46 Å²	46	68.8 Å²	68.8	20%	0.202	37%	0.37	C	S	.	.			trans	-88.6	71.8	173.2	-55	-64	0	0	0	110.1	F224 Y250 W257 K265 I268 R269	F224-F252 HydrophobicContact CD2-CE1 4.1Å; F224-F252 HydrophobicContact CE2-CD1 4.09Å; F224-F252 HydrophobicContact CE2-CE1 4.02Å; Y250-F252 HydrophobicContact CD2-CZ 4.38Å; Y250-F252 HydrophobicContact CE2-CE1 4.22Å; Y250-F252 HydrophobicContact CE2-CE2 4.01Å; Y250-F252 AromaticContact CE2-CZ 3.68Å; Y250-F252 HydrophobicContact CE2-CZ 3.68Å; F252-W257 HydrophobicContact CB-CB 4.02Å; F252-W257 HydrophobicContact CB-CD2 3.99Å; F252-W257 HydrophobicContact CB-CE3 4.37Å; F252-W257 HydrophobicContact CB-CG 3.8Å; F252-W257 AromaticContact CD1-CD2 3.51Å; F252-W257 HydrophobicContact CD1-CD2 3.51Å; F252-W257 AromaticContact CD1-CE2 3.58Å; F252-W257 AromaticContact CD1-CE3 3.53Å; F252-W257 HydrophobicContact CD1-CE3 3.53Å; F252-W257 HydrophobicContact CD1-CG 4.21Å; F252-W257 AromaticContact CD1-CH2 3.76Å; F252-W257 HydrophobicContact CD1-CH2 3.76Å; F252-W257 AromaticContact CD1-CZ2 3.74Å; F252-W257 HydrophobicContact CD1-CZ2 3.74Å; F252-W257 AromaticContact CD1-CZ3 3.64Å; F252-W257 HydrophobicContact CD1-CZ3 3.64Å; F252-W257 HydrophobicContact CE1-CD2 4.45Å; F252-W257 HydrophobicContact CE1-CE3 4.19Å; F252-W257 AromaticContact CE1-CH2 3.74Å; F252-W257 HydrophobicContact CE1-CH2 3.74Å; F252-W257 HydrophobicContact CE1-CZ2 4.02Å; F252-W257 AromaticContact CE1-CZ3 3.81Å; F252-W257 HydrophobicContact CE1-CZ3 3.81Å; F252-W257 HydrophobicContact CG-CD2 4.2Å; F252-W257 HydrophobicContact CG-CE3 4.29Å; F252-K265 HydrophobicContact CD1-CG 4.15Å; F252-K265 HydrophobicContact CD2-CB 4.41Å; F252-K265 HydrophobicContact CD2-CG 4.46Å; F252-K265 HydrophobicContact CE1-CB 4.36Å; F252-K265 HydrophobicContact CE1-CG 4.25Å; F252-K265 HydrophobicContact CE2-CB 4.16Å; F252-K265 HydrophobicContact CG-CD 4.49Å; F252-K265 HydrophobicContact CG-CG 4.22Å; F252-K265 HydrophobicContact CZ-CB 4.1Å; F252-K265 HydrophobicContact CZ-CG 4.46Å; F252-I268 HydrophobicContact CE1-CB 4.35Å; F252-I268 HydrophobicContact CE1-CD1 4.34Å; F252-I268 HydrophobicContact CE1-CG2 3.97Å; F252-I268 HydrophobicContact CZ-CB 4.14Å; F252-I268 HydrophobicContact CZ-CG2 3.84Å; F252-R269 HydrophobicContact CE2-CG 3.71Å; F252-R269 HydrophobicContact CZ-CG 4.05Å
253	T	87.9	Confident	92	Very high	74 Å²	74	71 Å²	71	45%	0.454	38%	0.382	S	S	.	.			trans	-80.2	148.6	-175	44.7	0	0	0	0	112.9	S251 W257	S251-T253 PolarHBondContact O-N 3.41Å; S251-T253 WeakPolarHBondContact OG-CG2 3.31Å; T253-W257 WeakPolarHBondContact O-CB 3.46Å; T253-W257 VanDerWaalsContact O-CD1 3.29Å; T253-W257 PolarHBondContact O-N 2.96Å; T253-W257 VanDerWaalsContact O-N 3.16Å
254	S	75.6	Confident	92	Very high	95 Å²	95	63.7 Å²	63.7	66%	0.664	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	150.8	168.1	-64.8	0	0	0	0	110.4
255	P	85.4	Confident	92.1	Very high	98 Å²	98	63.3 Å²	63.3	64%	0.636	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.3	-16.2	8.2	33.2	-36.7	0	0	0	115.8	W257 A258	P255-W257 VanDerWaalsContact C-N 3.31Å; P255-W257 PolarHBondContact O-N 3.23Å; P255-A258 VanDerWaalsContact O-CB 3.31Å; P255-A258 WeakPolarHBondContact O-CB 3.42Å; P255-A258 PolarHBondContact O-N 3.46Å; P255-A258 VanDerWaalsContact O-N 3.16Å
256	E	82.9	Confident	92.2	Very high	99 Å²	99	65.9 Å²	65.9	46%	0.463	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-35.9	-166.8	-61.4	74.1	-161.9	0	0	112.9	V228	V228-E256 HydrophobicContact CB-CB 4.09Å; V228-E256 HydrophobicContact CG1-CB 3.95Å
257	W	90.1	Very high	92.3	Very high	5 Å²	5	63.9 Å²	63.9	2%	0.019	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	3.4	-178.1	-70.1	90.4	0	0	0	114.7	F224 L227 V228 F252 T253 P255 I260 K265 I268	F224-W257 AromaticContact CD1-CZ2 3.94Å; F224-W257 HydrophobicContact CD1-CZ2 3.94Å; F224-W257 AromaticContact CD2-CH2 3.92Å; F224-W257 HydrophobicContact CD2-CH2 3.92Å; F224-W257 AromaticContact CD2-CZ2 3.42Å; F224-W257 HydrophobicContact CD2-CZ2 3.42Å; F224-W257 VanDerWaalsContact CD2-CZ2 3.42Å; F224-W257 AromaticContact CE1-CZ2 3.85Å; F224-W257 HydrophobicContact CE1-CZ2 3.85Å; F224-W257 AromaticContact CE2-CE2 3.85Å; F224-W257 HydrophobicContact CE2-CH2 4.18Å; F224-W257 AromaticContact CE2-CZ2 3.32Å; F224-W257 HydrophobicContact CE2-CZ2 3.32Å; F224-W257 HydrophobicContact CG-CH2 4.24Å; F224-W257 AromaticContact CG-CZ2 3.74Å; F224-W257 HydrophobicContact CG-CZ2 3.74Å; F224-W257 AromaticContact CZ-CE2 3.83Å; F224-W257 AromaticContact CZ-CZ2 3.54Å; F224-W257 HydrophobicContact CZ-CZ2 3.54Å; F224-W257 AromaticContact CZ-NE1 3.58Å; L227-W257 HydrophobicContact CB-CH2 4.24Å; L227-W257 HydrophobicContact CD1-CH2 3.99Å; L227-W257 HydrophobicContact CD1-CZ3 4.03Å; V228-W257 HydrophobicContact CB-CZ2 4.36Å; V228-W257 HydrophobicContact CG1-CD2 3.8Å; V228-W257 VanDerWaalsContact CG1-CE2 3.41Å; V228-W257 HydrophobicContact CG1-CE3 4.4Å; V228-W257 HydrophobicContact CG1-CG 4.15Å; V228-W257 HydrophobicContact CG1-CH2 4.32Å; V228-W257 HydrophobicContact CG1-CZ2 3.68Å; V228-W257 HydrophobicContact CG2-CZ2 3.71Å; F252-W257 HydrophobicContact CB-CB 4.02Å; F252-W257 HydrophobicContact CB-CD2 3.99Å; F252-W257 HydrophobicContact CB-CE3 4.37Å; F252-W257 HydrophobicContact CB-CG 3.8Å; F252-W257 AromaticContact CD1-CD2 3.51Å; F252-W257 HydrophobicContact CD1-CD2 3.51Å; F252-W257 AromaticContact CD1-CE2 3.58Å; F252-W257 AromaticContact CD1-CE3 3.53Å; F252-W257 HydrophobicContact CD1-CE3 3.53Å; F252-W257 HydrophobicContact CD1-CG 4.21Å; F252-W257 AromaticContact CD1-CH2 3.76Å; F252-W257 HydrophobicContact CD1-CH2 3.76Å; F252-W257 AromaticContact CD1-CZ2 3.74Å; F252-W257 HydrophobicContact CD1-CZ2 3.74Å; F252-W257 AromaticContact CD1-CZ3 3.64Å; F252-W257 HydrophobicContact CD1-CZ3 3.64Å; F252-W257 HydrophobicContact CE1-CD2 4.45Å; F252-W257 HydrophobicContact CE1-CE3 4.19Å; F252-W257 AromaticContact CE1-CH2 3.74Å; F252-W257 HydrophobicContact CE1-CH2 3.74Å; F252-W257 HydrophobicContact CE1-CZ2 4.02Å; F252-W257 AromaticContact CE1-CZ3 3.81Å; F252-W257 HydrophobicContact CE1-CZ3 3.81Å; F252-W257 HydrophobicContact CG-CD2 4.2Å; F252-W257 HydrophobicContact CG-CE3 4.29Å; T253-W257 WeakPolarHBondContact O-CB 3.46Å; T253-W257 VanDerWaalsContact O-CD1 3.29Å; T253-W257 PolarHBondContact O-N 2.96Å; T253-W257 VanDerWaalsContact O-N 3.16Å; P255-W257 VanDerWaalsContact C-N 3.31Å; P255-W257 PolarHBondContact O-N 3.23Å; W257-I260 HydrophobicContact CE3-CB 3.96Å; W257-I260 HydrophobicContact CE3-CG1 4.15Å; W257-I260 HydrophobicContact CE3-CG2 3.88Å; W257-I260 HydrophobicContact CZ3-CB 4.44Å; W257-I260 HydrophobicContact CZ3-CG2 3.88Å; W257-I260 PolarHBondContact O-N 3.21Å; W257-K265 HydrophobicContact CE3-CD 4.34Å; W257-K265 HydrophobicContact CE3-CG 3.78Å; W257-K265 HydrophobicContact CZ3-CG 3.84Å; W257-K265 WeakPolarHBondContact O-CE 3.1Å; W257-K265 PolarHBondContact O-NZ 3.19Å; W257-I268 HydrophobicContact CH2-CD1 3.57Å; W257-I268 HydrophobicContact CZ3-CD1 4.11Å
258	A	84.2	Confident	92.4	Very high	62 Å²	62	58.5 Å²	58.5	51%	0.512	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-38.4	-175.5	0	0	0	0	0	112.4	P255	P255-A258 VanDerWaalsContact O-CB 3.31Å; P255-A258 WeakPolarHBondContact O-CB 3.42Å; P255-A258 PolarHBondContact O-N 3.46Å; P255-A258 VanDerWaalsContact O-N 3.16Å
259	D	86.4	Confident	92.5	Very high	156 Å²	156	62.2 Å²	62.2	83%	0.834	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	1.2	-176.8	-66.6	-40.8	0	0	0	113.8
260	I	91.5	Very high	92.6	Very high	25 Å²	25	59.6 Å²	59.6	13%	0.128	33%	0.328	C	S	.	.	S	Bend	trans	-92	129.5	179	-56	-58.5	0	0	0	110	E127 L227 W257 P264 K265	E127-I260 HydrophobicContact CG-CD1 4.29Å; E127-I260 WeakPolarHBondContact OE1-CA 3.24Å; L227-I260 HydrophobicContact CD1-CG2 4.47Å; L227-I260 HydrophobicContact CD2-CD1 4.3Å; W257-I260 HydrophobicContact CE3-CB 3.96Å; W257-I260 HydrophobicContact CE3-CG1 4.15Å; W257-I260 HydrophobicContact CE3-CG2 3.88Å; W257-I260 HydrophobicContact CZ3-CB 4.44Å; W257-I260 HydrophobicContact CZ3-CG2 3.88Å; W257-I260 PolarHBondContact O-N 3.21Å; I260-P264 HydrophobicContact CG2-CB 4.38Å; I260-P264 HydrophobicContact CG2-CG 3.54Å; I260-K265 HydrophobicContact CG2-CG 4.4Å; I260-K265 VanDerWaalsContact O-CE 3.28Å; I260-K265 WeakPolarHBondContact O-CE 3.37Å; I260-K265 PolarHBondContact O-NZ 3.27Å
261	S	94.4	Very high	92.7	Very high	48 Å²	48	57.1 Å²	57.1	34%	0.336	32%	0.318	S	S	.	.			trans	-66.8	168	179.3	69.1	0	0	0	0	112.9	E127 P264 K265	E127-S261 VanDerWaalsContact CD-OG 3.25Å; E127-S261 WeakPolarHBondContact OE1-CB 3.47Å; E127-S261 PolarHBondContact OE1-N 2.98Å; E127-S261 PolarHBondContact OE1-OG 2.88Å; E127-S261 PolarHBondContact OE2-OG 3.31Å; S261-P264 WeakPolarHBondContact O-CD 3.05Å; S261-P264 WeakPolarHBondContact O-CG 3.37Å; S261-P264 WeakPolarHBondContact OG-CD 3.26Å; S261-K265 WeakPolarHBondContact O-CD 3.27Å
262	E	95.6	Very high	92.9	Very high	105 Å²	105	54 Å²	54	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-73.1	-31.5	-178.7	-78.8	-54	126.7	0	0	113.8	K265 D266 R269	E262-K265 CarbonylContact O-C 3.56Å; E262-K265 WeakPolarHBondContact O-CB 3.41Å; E262-K265 PolarHBondContact O-N 3.35Å; E262-K265 VanDerWaalsContact O-N 3.08Å; E262-K265 VanDerWaalsContact OE1-CD 3.3Å; E262-K265 WeakPolarHBondContact OE1-CD 3.34Å; E262-K265 IonicContact OE1-NZ 3.48Å; E262-D266 WeakPolarHBondContact O-CB 3.25Å; E262-D266 PolarHBondContact O-N 3.33Å; E262-R269 IonicContact OE2-CZ 2.94Å; E262-R269 IonicContact OE2-NH1 2.72Å; E262-R269 PolarHBondContact OE2-NH1 3.3Å; E262-R269 VanDerWaalsContact OE2-NH1 3.09Å; E262-R269 IonicContact OE2-NH2 3.93Å; E262-R269 PolarHBondContact OE2-NH2 3.18Å
263	D	96.8	Very high	93.1	Very high	65 Å²	65	53.7 Å²	53.7	35%	0.348	30%	0.297	S	S	.	.	H	α-helix	trans	-54.7	-48.8	-178.8	-69.4	-8.8	0	0	0	114.1	L267 H288 F290	D263-L267 PolarHBondContact O-N 3.38Å; D263-H288 PolarHBondContact O-CE1 3Å; D263-F290 HydrophobicContact CB-CB 4.26Å; D263-F290 HydrophobicContact CB-CD2 4.32Å
264	P	97.4	Very high	93.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-36.1	174.5	23.7	-32.7	0	0	0	113	E127 M223 L227 I260 S261 L267 I268 F290	E127-P264 HydrophobicContact CG-CG 4.42Å; M223-P264 HydrophobicContact CE-CB 3.47Å; M223-P264 VanDerWaalsContact CE-CB 3.47Å; L227-P264 HydrophobicContact CD1-CB 3.79Å; I260-P264 HydrophobicContact CG2-CB 4.38Å; I260-P264 HydrophobicContact CG2-CG 3.54Å; S261-P264 WeakPolarHBondContact O-CD 3.05Å; S261-P264 WeakPolarHBondContact O-CG 3.37Å; S261-P264 WeakPolarHBondContact OG-CD 3.26Å; P264-L267 PolarHBondContact O-N 3.13Å; P264-I268 VanDerWaalsContact O-CG1 3.27Å; P264-I268 WeakPolarHBondContact O-CG1 3.11Å; P264-I268 PolarHBondContact O-N 2.77Å; P264-F290 HydrophobicContact CB-CD2 3.86Å; P264-F290 HydrophobicContact CB-CE2 3.67Å; P264-F290 HydrophobicContact CB-CZ 4.35Å; P264-F290 HydrophobicContact CG-CD2 4.32Å; P264-F290 HydrophobicContact CG-CE2 4.17Å
265	K	98.4	Very high	94.6	Very high	22 Å²	22	51.2 Å²	51.2	10%	0.096	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-43.7	177.2	-67	168.1	175.9	162.9	0	110.9	F252 W257 I260 S261 E262 I268 R269	F252-K265 HydrophobicContact CD1-CG 4.15Å; F252-K265 HydrophobicContact CD2-CB 4.41Å; F252-K265 HydrophobicContact CD2-CG 4.46Å; F252-K265 HydrophobicContact CE1-CB 4.36Å; F252-K265 HydrophobicContact CE1-CG 4.25Å; F252-K265 HydrophobicContact CE2-CB 4.16Å; F252-K265 HydrophobicContact CG-CD 4.49Å; F252-K265 HydrophobicContact CG-CG 4.22Å; F252-K265 HydrophobicContact CZ-CB 4.1Å; F252-K265 HydrophobicContact CZ-CG 4.46Å; W257-K265 HydrophobicContact CE3-CD 4.34Å; W257-K265 HydrophobicContact CE3-CG 3.78Å; W257-K265 HydrophobicContact CZ3-CG 3.84Å; W257-K265 WeakPolarHBondContact O-CE 3.1Å; W257-K265 PolarHBondContact O-NZ 3.19Å; I260-K265 HydrophobicContact CG2-CG 4.4Å; I260-K265 VanDerWaalsContact O-CE 3.28Å; I260-K265 WeakPolarHBondContact O-CE 3.37Å; I260-K265 PolarHBondContact O-NZ 3.27Å; S261-K265 WeakPolarHBondContact O-CD 3.27Å; E262-K265 CarbonylContact O-C 3.56Å; E262-K265 WeakPolarHBondContact O-CB 3.41Å; E262-K265 PolarHBondContact O-N 3.35Å; E262-K265 VanDerWaalsContact O-N 3.08Å; E262-K265 VanDerWaalsContact OE1-CD 3.3Å; E262-K265 WeakPolarHBondContact OE1-CD 3.34Å; E262-K265 IonicContact OE1-NZ 3.48Å; K265-I268 PolarHBondContact O-N 2.66Å; K265-R269 VanDerWaalsContact O-CG 3.31Å; K265-R269 WeakPolarHBondContact O-CG 3.28Å; K265-R269 PolarHBondContact O-N 3.08Å
266	D	98.5	Very high	95.2	Very high	54 Å²	54	48.4 Å²	48.4	29%	0.289	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176.1	-174.8	56.6	0	0	0	111.8	E262 I268 R269 K270 H288	E262-D266 WeakPolarHBondContact O-CB 3.25Å; E262-D266 PolarHBondContact O-N 3.33Å; D266-I268 PolarHBondContact O-N 3.41Å; D266-R269 WeakPolarHBondContact O-CB 3.46Å; D266-R269 PolarHBondContact O-N 2.84Å; D266-K270 WeakPolarHBondContact O-CG 3.32Å; D266-K270 PolarHBondContact O-N 3.41Å; D266-K270 VanDerWaalsContact O-N 3.1Å; D266-K270 IonicContact OD1-NZ 3.35Å; D266-K270 WeakPolarHBondContact OD2-CE 3.49Å; D266-K270 IonicContact OD2-NZ 3.87Å; D266-K270 PolarHBondContact OD2-NZ 2.91Å; D266-H288 IonicContact OD2-CE1 2.7Å; D266-H288 PolarHBondContact OD2-CE1 2.99Å; D266-H288 IonicContact OD2-NE2 3.94Å; D266-H288 PolarHBondContact OD2-NE2 2.93Å
267	L	98.6	Very high	95.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-45.7	175.7	-177.4	53.2	0	0	0	111.9	M223 D263 P264 R269 K270 C271 I280 V285 H288 F290 F291	M223-L267 HydrophobicContact CE-CB 4.27Å; M223-L267 HydrophobicContact CE-CD2 4.01Å; M223-L267 HydrophobicContact CE-CG 4.44Å; M223-L267 HydrophobicContact SD-CB 4.46Å; M223-L267 HydrophobicContact SD-CD2 3.74Å; M223-L267 HydrophobicContact SD-CG 4.07Å; D263-L267 PolarHBondContact O-N 3.38Å; P264-L267 PolarHBondContact O-N 3.13Å; L267-R269 VanDerWaalsContact C-N 3.3Å; L267-R269 PolarHBondContact O-N 3.42Å; L267-K270 PolarHBondContact O-N 3.1Å; L267-K270 VanDerWaalsContact O-N 3.12Å; L267-C271 PolarHBondContact O-N 3.24Å; L267-C271 PolarHBondContact O-SG 2.95Å; L267-C271 VanDerWaalsContact O-SG 3.41Å; L267-I280 HydrophobicContact CD1-CD1 4.29Å; L267-V285 HydrophobicContact CD1-CG1 4.12Å; L267-V285 HydrophobicContact CD1-CG2 4.21Å; L267-V285 HydrophobicContact CD2-CG1 4.42Å; L267-H288 HydrophobicContact CD1-CB 4.12Å; L267-F290 HydrophobicContact CD2-CB 4.06Å; L267-F290 HydrophobicContact CD2-CD1 3.69Å; L267-F290 HydrophobicContact CD2-CG 4.18Å; L267-F291 HydrophobicContact CD2-CD2 4.29Å; L267-F291 HydrophobicContact CD2-CE2 3.47Å; L267-F291 VanDerWaalsContact CD2-CE2 3.47Å; L267-F291 HydrophobicContact CD2-CZ 3.89Å
268	I	98.8	Very high	96.2	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-42.8	176.1	-71.5	166.6	0	0	0	110.9	M223 F224 L227 Y250 F252 W257 P264 K265 D266 K270 C271 L272	M223-I268 HydrophobicContact CB-CG1 4.27Å; M223-I268 HydrophobicContact CE-CG1 4.35Å; M223-I268 HydrophobicContact CG-CD1 4.13Å; M223-I268 HydrophobicContact CG-CG1 3.97Å; M223-I268 HydrophobicContact SD-CG1 4.08Å; F224-I268 HydrophobicContact CB-CD1 4.13Å; F224-I268 HydrophobicContact CD2-CD1 4.45Å; F224-I268 HydrophobicContact CD2-CG2 4.15Å; L227-I268 HydrophobicContact CD1-CD1 3.89Å; Y250-I268 HydrophobicContact CE2-CG2 4.19Å; F252-I268 HydrophobicContact CE1-CB 4.35Å; F252-I268 HydrophobicContact CE1-CD1 4.34Å; F252-I268 HydrophobicContact CE1-CG2 3.97Å; F252-I268 HydrophobicContact CZ-CB 4.14Å; F252-I268 HydrophobicContact CZ-CG2 3.84Å; W257-I268 HydrophobicContact CH2-CD1 3.57Å; W257-I268 HydrophobicContact CZ3-CD1 4.11Å; P264-I268 VanDerWaalsContact O-CG1 3.27Å; P264-I268 WeakPolarHBondContact O-CG1 3.11Å; P264-I268 PolarHBondContact O-N 2.77Å; K265-I268 PolarHBondContact O-N 2.66Å; D266-I268 PolarHBondContact O-N 3.41Å; I268-K270 PolarHBondContact O-N 3.21Å; I268-C271 PolarHBondContact O-N 2.86Å; I268-L272 HydrophobicContact CG2-CD1 3.68Å; I268-L272 HydrophobicContact CG2-CG 4.13Å; I268-L272 WeakPolarHBondContact O-CB 3.49Å; I268-L272 PolarHBondContact O-N 2.71Å
269	R	98.7	Very high	96.8	Very high	96 Å²	96	51.6 Å²	51.6	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-57.9	-38.5	176.5	-71.9	174.5	-165.5	111.2	-0.7	112.6	Y250 F252 E262 K265 D266 L267 V273	Y250-R269 WeakPolarHBondContact OH-CA 3.42Å; F252-R269 HydrophobicContact CE2-CG 3.71Å; F252-R269 HydrophobicContact CZ-CG 4.05Å; E262-R269 IonicContact OE2-CZ 2.94Å; E262-R269 IonicContact OE2-NH1 2.72Å; E262-R269 PolarHBondContact OE2-NH1 3.3Å; E262-R269 VanDerWaalsContact OE2-NH1 3.09Å; E262-R269 IonicContact OE2-NH2 3.93Å; E262-R269 PolarHBondContact OE2-NH2 3.18Å; K265-R269 VanDerWaalsContact O-CG 3.31Å; K265-R269 WeakPolarHBondContact O-CG 3.28Å; K265-R269 PolarHBondContact O-N 3.08Å; D266-R269 WeakPolarHBondContact O-CB 3.46Å; D266-R269 PolarHBondContact O-N 2.84Å; L267-R269 VanDerWaalsContact C-N 3.3Å; L267-R269 PolarHBondContact O-N 3.42Å; R269-V273 VanDerWaalsContact O-CG2 3.25Å; R269-V273 WeakPolarHBondContact O-CG2 3.41Å
270	K	98.6	Very high	97.4	Very high	77 Å²	77	45.1 Å²	45.1	34%	0.335	24%	0.235	S	C	.	.	H	α-helix	trans	-75.7	-31.7	179.1	-71.4	172.8	-179.3	162.4	0	113.1	D266 L267 I268 V273 I280 H288	D266-K270 WeakPolarHBondContact O-CG 3.32Å; D266-K270 PolarHBondContact O-N 3.41Å; D266-K270 VanDerWaalsContact O-N 3.1Å; D266-K270 IonicContact OD1-NZ 3.35Å; D266-K270 WeakPolarHBondContact OD2-CE 3.49Å; D266-K270 IonicContact OD2-NZ 3.87Å; D266-K270 PolarHBondContact OD2-NZ 2.91Å; L267-K270 PolarHBondContact O-N 3.1Å; L267-K270 VanDerWaalsContact O-N 3.12Å; I268-K270 PolarHBondContact O-N 3.21Å; K270-V273 WeakPolarHBondContact O-CG2 3.32Å; K270-I280 HydrophobicContact CB-CB 3.99Å; K270-I280 HydrophobicContact CB-CD1 4.18Å; K270-I280 HydrophobicContact CB-CG2 3.93Å; K270-I280 HydrophobicContact CD-CD1 4.17Å; K270-I280 VanDerWaalsContact O-CG2 3.31Å; K270-I280 WeakPolarHBondContact O-CG2 3.5Å; K270-I280 PolarHBondContact O-N 2.87Å; K270-H288 PolarHBondContact NZ-NE2 2.9Å
271	C	98.8	Very high	97.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-75.2	-40.5	173.4	-66.2	0	0	0	0	112.6	I216 L267 I268 V273 R279	I216-C271 HydrophobicContact CG2-CB 4.24Å; L267-C271 PolarHBondContact O-N 3.24Å; L267-C271 PolarHBondContact O-SG 2.95Å; L267-C271 VanDerWaalsContact O-SG 3.41Å; I268-C271 PolarHBondContact O-N 2.86Å; C271-V273 VanDerWaalsContact C-N 3.25Å; C271-V273 PolarHBondContact O-N 2.62Å; C271-R279 WeakPolarHBondContact O-CD 3.22Å; C271-R279 VanDerWaalsContact O-CG 3.29Å; C271-R279 WeakPolarHBondContact O-CG 3.43Å; C271-R279 PolarHBondContact O-NE 3.2Å
272	L	98.7	Very high	97.9	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	24%	0.237	C	C	.	.	S	Bend	trans	-91.4	45.9	-177.1	-59	-175.4	0	0	0	112.3	W217 V221 P232 F233 Y250 I268	W217-L272 HydrophobicContact CD2-CD2 3.85Å; W217-L272 HydrophobicContact CE3-CB 4.44Å; W217-L272 HydrophobicContact CE3-CD2 4.07Å; W217-L272 HydrophobicContact CG-CD2 4.26Å; W217-L272 HydrophobicContact CZ2-CD2 4.39Å; W217-L272 HydrophobicContact CZ3-CB 4.2Å; W217-L272 HydrophobicContact CZ3-CD2 4.43Å; W217-L272 WeakPolarHBondContact O-CD2 3.49Å; V221-L272 HydrophobicContact CG2-CD2 3.89Å; P232-L272 HydrophobicContact CB-CD1 4.32Å; P232-L272 HydrophobicContact CG-CD1 4.28Å; F233-L272 HydrophobicContact CE2-CD1 4.35Å; F233-L272 HydrophobicContact CE2-CD2 4.49Å; F233-L272 HydrophobicContact CZ-CD1 4.37Å; Y250-L272 HydrophobicContact CD1-CB 4.45Å; Y250-L272 HydrophobicContact CD1-CD1 4.08Å; Y250-L272 HydrophobicContact CD2-CD1 4.37Å; Y250-L272 HydrophobicContact CE1-CB 3.62Å; Y250-L272 HydrophobicContact CE1-CD1 3.89Å; Y250-L272 HydrophobicContact CE1-CG 4.43Å; Y250-L272 HydrophobicContact CE2-CD1 4.19Å; Y250-L272 HydrophobicContact CG-CD1 4.33Å; I268-L272 HydrophobicContact CG2-CD1 3.68Å; I268-L272 HydrophobicContact CG2-CG 4.13Å; I268-L272 WeakPolarHBondContact O-CB 3.49Å; I268-L272 PolarHBondContact O-N 2.71Å
273	V	98.6	Very high	97.9	Very high	40 Å²	40	46.6 Å²	46.6	24%	0.242	24%	0.24	C	C	.	.			trans	-90.7	128.2	173.2	178.8	0	0	0	0	109.3	R269 K270 C271 Q278 R279	R269-V273 VanDerWaalsContact O-CG2 3.25Å; R269-V273 WeakPolarHBondContact O-CG2 3.41Å; K270-V273 WeakPolarHBondContact O-CG2 3.32Å; C271-V273 VanDerWaalsContact C-N 3.25Å; C271-V273 PolarHBondContact O-N 2.62Å; V273-Q278 HydrophobicContact CG1-CB 3.9Å; V273-R279 HydrophobicContact CB-CB 4.24Å; V273-R279 HydrophobicContact CB-CG 4.43Å; V273-R279 PolarHBondContact O-NE 3.44Å; V273-R279 PolarHBondContact O-NH2 2.84Å
274	V	97.9	Very high	97.9	Very high	41 Å²	41	48.2 Å²	48.2	25%	0.248	25%	0.246	C	C	.	.	S	Bend	trans	-67.1	-39.1	-174.8	174.8	0	0	0	0	112.5	P196 P276	P196-V274 HydrophobicContact CB-CG1 4.01Å; P196-V274 HydrophobicContact CG-CB 4.48Å; P196-V274 HydrophobicContact CG-CG1 4.2Å; P196-V274 HydrophobicContact CG-CG2 4.37Å; V274-P276 VanDerWaalsContact O-CD 3.3Å; V274-P276 WeakPolarHBondContact O-CD 3.25Å
275	D	97.2	Very high	98	Very high	77 Å²	77	48.2 Å²	48.2	41%	0.412	25%	0.246	S	C	.	.	S	Bend	trans	-78.6	112.5	173.2	-176.2	-15.2	0	0	0	109.4	S277 Q278 R279	D275-S277 PolarHBondContact O-N 2.98Å; D275-S277 WeakPolarHBondContact OD1-CB 3.28Å; D275-S277 PolarHBondContact OD1-N 2.89Å; D275-S277 PolarHBondContact OD1-OG 3.42Å; D275-S277 PolarHBondContact OD2-OG 2.96Å; D275-Q278 HydrophobicContact CB-CB 4.27Å; D275-Q278 HydrophobicContact CB-CG 4.14Å; D275-Q278 PolarHBondContact O-N 3.5Å; D275-Q278 VanDerWaalsContact O-N 3.1Å; D275-R279 PolarHBondContact O-N 2.87Å
276	P	96.9	Very high	97.9	Very high	38 Å²	38	48.9 Å²	48.9	25%	0.247	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-61.5	-26.9	-178.9	25.2	-33.9	0	0	0	112.9	E197 E213 V274 Q278 R279	E197-P276 HydrophobicContact CB-CG 4.47Å; E197-P276 HydrophobicContact CG-CG 4.34Å; E213-P276 HydrophobicContact CB-CB 3.86Å; E213-P276 HydrophobicContact CG-CB 4.09Å; V274-P276 VanDerWaalsContact O-CD 3.3Å; V274-P276 WeakPolarHBondContact O-CD 3.25Å; P276-Q278 VanDerWaalsContact C-N 3.27Å; P276-Q278 PolarHBondContact O-N 3.17Å; P276-R279 WeakPolarHBondContact O-CB 3.3Å; P276-R279 PolarHBondContact O-N 3.44Å
277	S	95.9	Very high	97.8	Very high	85 Å²	85	55.2 Å²	55.2	59%	0.594	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-71.3	-23	178.5	74.1	0	0	0	0	113.4	D275	D275-S277 PolarHBondContact O-N 2.98Å; D275-S277 WeakPolarHBondContact OD1-CB 3.28Å; D275-S277 PolarHBondContact OD1-N 2.89Å; D275-S277 PolarHBondContact OD1-OG 3.42Å; D275-S277 PolarHBondContact OD2-OG 2.96Å
278	Q	97.6	Very high	97.7	Very high	138 Å²	138	55.5 Å²	55.5	65%	0.645	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-99.3	-6.2	177.1	-58.4	-55.7	-62.8	0	0	112.1	V273 D275 P276	V273-Q278 HydrophobicContact CG1-CB 3.9Å; D275-Q278 HydrophobicContact CB-CB 4.27Å; D275-Q278 HydrophobicContact CB-CG 4.14Å; D275-Q278 PolarHBondContact O-N 3.5Å; D275-Q278 VanDerWaalsContact O-N 3.1Å; P276-Q278 VanDerWaalsContact C-N 3.27Å; P276-Q278 PolarHBondContact O-N 3.17Å
279	R	98.4	Very high	97.5	Very high	11 Å²	11	58.6 Å²	58.6	4%	0.042	29%	0.291	C	S	.	.	S	Bend	trans	-71.9	136.6	178.6	-166.7	178.7	-61	146.4	8.1	109.2	E197 E213 I216 C271 V273 D275 P276 T281	E197-R279 IonicContact OE1-CZ 3.9Å; E197-R279 IonicContact OE1-NH1 3.74Å; E197-R279 PolarHBondContact OE1-NH1 3.33Å; E197-R279 IonicContact OE1-NH2 3.86Å; E197-R279 PolarHBondContact OE1-NH2 2.89Å; E197-R279 IonicContact OE2-CZ 3.3Å; E197-R279 IonicContact OE2-NH1 2.86Å; E197-R279 IonicContact OE2-NH2 3.07Å; E197-R279 PolarHBondContact OE2-NH2 2.85Å; E213-R279 PolarHBondContact O-NH1 3.37Å; I216-R279 HydrophobicContact CG2-CG 4.29Å; C271-R279 WeakPolarHBondContact O-CD 3.22Å; C271-R279 VanDerWaalsContact O-CG 3.29Å; C271-R279 WeakPolarHBondContact O-CG 3.43Å; C271-R279 PolarHBondContact O-NE 3.2Å; V273-R279 HydrophobicContact CB-CB 4.24Å; V273-R279 HydrophobicContact CB-CG 4.43Å; V273-R279 PolarHBondContact O-NE 3.44Å; V273-R279 PolarHBondContact O-NH2 2.84Å; D275-R279 PolarHBondContact O-N 2.87Å; P276-R279 WeakPolarHBondContact O-CB 3.3Å; P276-R279 PolarHBondContact O-N 3.44Å; R279-T281 PolarHBondContact O-N 3.23Å
280	I	98.4	Very high	97.4	Very high	19 Å²	19	54 Å²	54	10%	0.097	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-56.3	139.3	179.4	-167.4	172.4	0	0	0	111.1	I216 L267 K270 E284 V285	I216-I280 HydrophobicContact CG2-CG2 4.09Å; I216-I280 WeakPolarHBondContact CG2-O 3.42Å; L267-I280 HydrophobicContact CD1-CD1 4.29Å; K270-I280 HydrophobicContact CB-CB 3.99Å; K270-I280 HydrophobicContact CB-CD1 4.18Å; K270-I280 HydrophobicContact CB-CG2 3.93Å; K270-I280 HydrophobicContact CD-CD1 4.17Å; K270-I280 VanDerWaalsContact O-CG2 3.31Å; K270-I280 WeakPolarHBondContact O-CG2 3.5Å; K270-I280 PolarHBondContact O-N 2.87Å; I280-E284 HydrophobicContact CD1-CB 3.94Å; I280-E284 HydrophobicContact CG1-CB 3.48Å; I280-E284 VanDerWaalsContact CG1-CB 3.48Å; I280-V285 HydrophobicContact CB-CG2 4.3Å; I280-V285 HydrophobicContact CD1-CG2 3.87Å; I280-V285 HydrophobicContact CG1-CG2 3.91Å; I280-V285 HydrophobicContact CG2-CG2 3.5Å; I280-V285 VanDerWaalsContact CG2-CG2 3.5Å
281	T	98	Very high	97.2	Very high	70 Å²	70	50.9 Å²	50.9	43%	0.429	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-82.2	156.4	175.1	65.4	0	0	0	0	111.1	R279 K283 E284 V285	R279-T281 PolarHBondContact O-N 3.23Å; T281-K283 PolarHBondContact O-N 3.32Å; T281-K283 VanDerWaalsContact O-N 3.17Å; T281-E284 WeakPolarHBondContact CB-OE2 3.31Å; T281-E284 PolarHBondContact N-OE2 2.93Å; T281-E284 WeakPolarHBondContact O-CB 3.42Å; T281-E284 PolarHBondContact O-N 2.79Å; T281-E284 VanDerWaalsContact OG1-CG 3.27Å; T281-E284 WeakPolarHBondContact OG1-CG 3.49Å; T281-E284 PolarHBondContact OG1-N 2.76Å; T281-E284 PolarHBondContact OG1-OE2 2.85Å; T281-V285 WeakPolarHBondContact O-CG2 3.25Å; T281-V285 PolarHBondContact O-N 3Å
282	V	97.6	Very high	96.6	Very high	12 Å²	12	55.1 Å²	55.1	7%	0.073	28%	0.283	C	S	.	.	H	α-helix	trans	-56	-35.7	178.4	67.6	0	0	0	0	113.4	F138 V141 E142 I216 E284 V285 L286	F138-V282 HydrophobicContact CB-CG2 4.26Å; F138-V282 HydrophobicContact CD1-CG2 4.15Å; F138-V282 VanDerWaalsContact O-CG2 3.25Å; F138-V282 WeakPolarHBondContact O-CG2 3.22Å; V141-V282 HydrophobicContact CB-CG2 4.41Å; V141-V282 HydrophobicContact CG1-CG2 4.24Å; E142-V282 HydrophobicContact CB-CB 4.49Å; E142-V282 HydrophobicContact CB-CG1 3.95Å; E142-V282 HydrophobicContact CB-CG2 3.75Å; E142-V282 HydrophobicContact CG-CG1 4.07Å; I216-V282 HydrophobicContact CD1-CB 3.79Å; I216-V282 HydrophobicContact CD1-CG2 4.4Å; V282-E284 VanDerWaalsContact C-N 3.34Å; V282-E284 PolarHBondContact O-N 3.49Å; V282-V285 WeakPolarHBondContact O-CB 3.42Å; V282-V285 PolarHBondContact O-N 3.37Å; V282-L286 PolarHBondContact O-N 3.09Å
283	K	96.2	Very high	94.8	Very high	127 Å²	127	61.8 Å²	61.8	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-64.2	-38.5	176.5	-70.1	178.3	179.5	175.6	0	112.2	E142 T281 R287	E142-K283 WeakPolarHBondContact OE1-CG 3.25Å; T281-K283 PolarHBondContact O-N 3.32Å; T281-K283 VanDerWaalsContact O-N 3.17Å; K283-R287 WeakPolarHBondContact O-CG 3.43Å
284	E	97.6	Very high	92.5	Very high	99 Å²	99	65.9 Å²	65.9	46%	0.463	33%	0.332	S	S	.	.	H	α-helix	trans	-75.6	-36.9	176.8	-68.8	164.5	144.9	0	0	111.3	I280 T281 V282 L286 R287 H288	I280-E284 HydrophobicContact CD1-CB 3.94Å; I280-E284 HydrophobicContact CG1-CB 3.48Å; I280-E284 VanDerWaalsContact CG1-CB 3.48Å; T281-E284 WeakPolarHBondContact CB-OE2 3.31Å; T281-E284 PolarHBondContact N-OE2 2.93Å; T281-E284 WeakPolarHBondContact O-CB 3.42Å; T281-E284 PolarHBondContact O-N 2.79Å; T281-E284 VanDerWaalsContact OG1-CG 3.27Å; T281-E284 WeakPolarHBondContact OG1-CG 3.49Å; T281-E284 PolarHBondContact OG1-N 2.76Å; T281-E284 PolarHBondContact OG1-OE2 2.85Å; V282-E284 VanDerWaalsContact C-N 3.34Å; V282-E284 PolarHBondContact O-N 3.49Å; E284-L286 PolarHBondContact O-N 2.95Å; E284-R287 CarbonylContact O-C 3.6Å; E284-R287 PolarHBondContact O-N 2.76Å; E284-R287 VanDerWaalsContact O-N 3.12Å; E284-H288 PolarHBondContact O-N 3.02Å
285	V	97.8	Very high	90	Very high	0 Å²	0	71 Å²	71	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-54.8	-51.3	173.3	169.3	0	0	0	0	110.5	F138 L267 I280 T281 V282 R287 H288 F291	F138-V285 HydrophobicContact CB-CG1 4.29Å; F138-V285 HydrophobicContact CD1-CB 4.35Å; F138-V285 HydrophobicContact CD1-CG1 3.67Å; F138-V285 HydrophobicContact CD2-CG1 3.41Å; F138-V285 VanDerWaalsContact CD2-CG1 3.41Å; F138-V285 HydrophobicContact CE1-CB 4.4Å; F138-V285 HydrophobicContact CE1-CG1 3.71Å; F138-V285 HydrophobicContact CE1-CG2 4.2Å; F138-V285 HydrophobicContact CE2-CG1 3.47Å; F138-V285 VanDerWaalsContact CE2-CG1 3.47Å; F138-V285 HydrophobicContact CG-CG1 3.53Å; F138-V285 HydrophobicContact CZ-CG1 3.61Å; F138-V285 HydrophobicContact CZ-CG2 4.45Å; L267-V285 HydrophobicContact CD1-CG1 4.12Å; L267-V285 HydrophobicContact CD1-CG2 4.21Å; L267-V285 HydrophobicContact CD2-CG1 4.42Å; I280-V285 HydrophobicContact CB-CG2 4.3Å; I280-V285 HydrophobicContact CD1-CG2 3.87Å; I280-V285 HydrophobicContact CG1-CG2 3.91Å; I280-V285 HydrophobicContact CG2-CG2 3.5Å; I280-V285 VanDerWaalsContact CG2-CG2 3.5Å; T281-V285 WeakPolarHBondContact O-CG2 3.25Å; T281-V285 PolarHBondContact O-N 3Å; V282-V285 WeakPolarHBondContact O-CB 3.42Å; V282-V285 PolarHBondContact O-N 3.37Å; V285-R287 PolarHBondContact O-N 2.85Å; V285-R287 VanDerWaalsContact O-N 3.13Å; V285-H288 WeakPolarHBondContact O-CB 3.44Å; V285-H288 PolarHBondContact O-N 3.4Å; V285-F291 HydrophobicContact CG1-CD2 4.44Å; V285-F291 HydrophobicContact CG1-CE2 3.63Å; V285-F291 HydrophobicContact CG1-CZ 4.46Å; V285-F291 WeakPolarHBondContact O-CD2 3.39Å
286	L	96.5	Very high	87.5	Confident	37 Å²	37	76.8 Å²	76.8	19%	0.194	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.2	-178.5	-70.6	171.6	0	0	0	113.6	R135 F138 E139 E142 V282 E284	R135-L286 HydrophobicContact CG-CD2 4.34Å; F138-L286 HydrophobicContact CB-CD2 3.71Å; F138-L286 HydrophobicContact CB-CG 4.18Å; E139-L286 HydrophobicContact CG-CD1 4.23Å; E139-L286 HydrophobicContact CG-CD2 3.9Å; E142-L286 HydrophobicContact CB-CD1 4.2Å; E142-L286 WeakPolarHBondContact OE2-CD1 3.33Å; V282-L286 PolarHBondContact O-N 3.09Å; E284-L286 PolarHBondContact O-N 2.95Å
287	R	96.3	Very high	84.9	Confident	186 Å²	186	84.2 Å²	84.2	70%	0.702	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-3	173.8	-64.1	173.1	-172.6	175.7	2.1	113.4	K283 E284 V285	K283-R287 WeakPolarHBondContact O-CG 3.43Å; E284-R287 CarbonylContact O-C 3.6Å; E284-R287 PolarHBondContact O-N 2.76Å; E284-R287 VanDerWaalsContact O-N 3.12Å; V285-R287 PolarHBondContact O-N 2.85Å; V285-R287 VanDerWaalsContact O-N 3.13Å
288	H	97.5	Very high	82.3	Confident	6 Å²	6	88.6 Å²	88.6	3%	0.028	41%	0.413	C	S	.	.	S	Bend	trans	-64	143.8	-176.8	-164.6	-96.2	0	0	0	111.7	D263 D266 L267 K270 E284 V285 F290 F291 N292	D263-H288 PolarHBondContact O-CE1 3Å; D266-H288 IonicContact OD2-CE1 2.7Å; D266-H288 PolarHBondContact OD2-CE1 2.99Å; D266-H288 IonicContact OD2-NE2 3.94Å; D266-H288 PolarHBondContact OD2-NE2 2.93Å; L267-H288 HydrophobicContact CD1-CB 4.12Å; K270-H288 PolarHBondContact NZ-NE2 2.9Å; E284-H288 PolarHBondContact O-N 3.02Å; V285-H288 WeakPolarHBondContact O-CB 3.44Å; V285-H288 PolarHBondContact O-N 3.4Å; H288-F290 WeakPolarHBondContact ND1-CB 3.24Å; H288-F290 PolarHBondContact ND1-N 2.79Å; H288-F290 PolarHBondContact O-N 3.37Å; H288-F291 HydrophobicContact CB-CD2 4.4Å; H288-F291 PolarHBondContact O-N 2.91Å; H288-N292 PolarHBondContact O-N 3.2Å
289	P	95.3	Very high	80.2	Confident	65 Å²	65	87.1 Å²	87.1	42%	0.422	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-29.2	175.9	-30.6	36.6	0	0	0	115	F291 N292	P289-F291 VanDerWaalsContact C-N 3.27Å; P289-F291 PolarHBondContact O-N 2.85Å; P289-N292 WeakPolarHBondContact O-CB 3.45Å; P289-N292 PolarHBondContact O-N 3.3Å
290	F	95.6	Very high	78.2	Confident	0 Å²	0	97.8 Å²	97.8	0%	0	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-38.1	174.2	-178.9	-111.9	0	0	0	113	R131 M223 D263 P264 L267 H288	R131-F290 HydrophobicContact CB-CE1 3.9Å; R131-F290 HydrophobicContact CB-CE2 4.28Å; R131-F290 HydrophobicContact CB-CZ 3.66Å; R131-F290 WeakPolarHBondContact CD-O 3.35Å; R131-F290 HydrophobicContact CG-CD1 4.47Å; R131-F290 HydrophobicContact CG-CE1 4.13Å; R131-F290 HydrophobicContact CG-CZ 4.26Å; R131-F290 WeakPolarHBondContact CG-O 3.11Å; R131-F290 PolarHBondContact NE-O 2.94Å; M223-F290 HydrophobicContact CE-CD1 3.73Å; M223-F290 HydrophobicContact CE-CD2 4.26Å; M223-F290 HydrophobicContact CE-CE1 3.43Å; M223-F290 VanDerWaalsContact CE-CE1 3.43Å; M223-F290 HydrophobicContact CE-CE2 4.03Å; M223-F290 HydrophobicContact CE-CG 4.13Å; M223-F290 HydrophobicContact CE-CZ 3.6Å; M223-F290 HydrophobicContact SD-CE1 4.28Å; D263-F290 HydrophobicContact CB-CB 4.26Å; D263-F290 HydrophobicContact CB-CD2 4.32Å; P264-F290 HydrophobicContact CB-CD2 3.86Å; P264-F290 HydrophobicContact CB-CE2 3.67Å; P264-F290 HydrophobicContact CB-CZ 4.35Å; P264-F290 HydrophobicContact CG-CD2 4.32Å; P264-F290 HydrophobicContact CG-CE2 4.17Å; L267-F290 HydrophobicContact CD2-CB 4.06Å; L267-F290 HydrophobicContact CD2-CD1 3.69Å; L267-F290 HydrophobicContact CD2-CG 4.18Å; H288-F290 WeakPolarHBondContact ND1-CB 3.24Å; H288-F290 PolarHBondContact ND1-N 2.79Å; H288-F290 PolarHBondContact O-N 3.37Å
291	F	94.4	Very high	76.9	Confident	11 Å²	11	104.7 Å²	104.7	5%	0.048	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-16.1	179.5	-62.7	-64.5	0	0	0	114.3	R131 M134 R135 F138 L267 V285 H288 P289 Q293	R131-F291 HydrophobicContact CG-CD1 3.91Å; R131-F291 HydrophobicContact CG-CE1 4.4Å; R131-F291 WeakPolarHBondContact O-CE1 3.41Å; M134-F291 HydrophobicContact CB-CE1 3.95Å; M134-F291 HydrophobicContact CB-CZ 3.93Å; R135-F291 HydrophobicContact CB-CD1 3.68Å; R135-F291 HydrophobicContact CB-CE1 3.75Å; R135-F291 HydrophobicContact CG-CD1 4.32Å; F138-F291 AromaticContact CD2-CE2 3.95Å; F138-F291 HydrophobicContact CD2-CE2 3.95Å; F138-F291 AromaticContact CD2-CZ 3.6Å; F138-F291 HydrophobicContact CD2-CZ 3.6Å; F138-F291 HydrophobicContact CE2-CE2 4.24Å; F138-F291 AromaticContact CE2-CZ 3.92Å; F138-F291 HydrophobicContact CE2-CZ 3.92Å; L267-F291 HydrophobicContact CD2-CD2 4.29Å; L267-F291 HydrophobicContact CD2-CE2 3.47Å; L267-F291 VanDerWaalsContact CD2-CE2 3.47Å; L267-F291 HydrophobicContact CD2-CZ 3.89Å; V285-F291 HydrophobicContact CG1-CD2 4.44Å; V285-F291 HydrophobicContact CG1-CE2 3.63Å; V285-F291 HydrophobicContact CG1-CZ 4.46Å; V285-F291 WeakPolarHBondContact O-CD2 3.39Å; H288-F291 HydrophobicContact CB-CD2 4.4Å; H288-F291 PolarHBondContact O-N 2.91Å; P289-F291 VanDerWaalsContact C-N 3.27Å; P289-F291 PolarHBondContact O-N 2.85Å; F291-Q293 PolarHBondContact O-N 3.12Å
292	N	85.7	Confident	75.9	Confident	90 Å²	90	104.9 Å²	104.9	48%	0.481	49%	0.486	S	S	.	.	S	Bend	trans	-52.9	120.4	165.4	-69.7	-18.7	0	0	0	106	H288 P289 M294	H288-N292 PolarHBondContact O-N 3.2Å; P289-N292 WeakPolarHBondContact O-CB 3.45Å; P289-N292 PolarHBondContact O-N 3.3Å; N292-M294 VanDerWaalsContact C-N 3.34Å; N292-M294 PolarHBondContact O-N 3.26Å
293	Q	62.4	Low	75.2	Confident	145 Å²	145	106.9 Å²	106.9	68%	0.678	50%	0.504	S	S	*	.			trans	-50.4	114.6	169.3	-82.9	-179.2	-5.1	0	0	104.6	F291 L295	F291-Q293 PolarHBondContact O-N 3.12Å; Q293-L295 PolarHBondContact O-N 2.99Å
294	M	49.8	Very low	74.5	Confident	127 Å²	127	109.6 Å²	109.6	63%	0.626	51%	0.511	S	S	*	.			trans	-53.3	92.7	137.3	-74.8	-174.6	77.2	0	0	103	N292 R296	N292-M294 VanDerWaalsContact C-N 3.34Å; N292-M294 PolarHBondContact O-N 3.26Å; M294-R296 HydrophobicContact CB-CG 4.33Å; M294-R296 HydrophobicContact CE-CG 3.88Å; M294-R296 PolarHBondContact O-N 3.34Å
295	L	45.3	Very low	73.6	Confident	147 Å²	147	111.7 Å²	111.7	77%	0.77	52%	0.518	S	S	*	.				-43.7	77.2	118.2	-63	173.7	0	0	0	104.2	Q293 K297	Q293-L295 PolarHBondContact O-N 2.99Å; L295-K297 PolarHBondContact O-N 3.39Å
296	R	45.1	Very low	73	Confident	199 Å²	199	118.2 Å²	118.2	75%	0.751	55%	0.547	S	S	*	.			trans	-48.3	104	139.3	-88	-171.2	163.9	-173.1	-3	98.7	M294 Q298	M294-R296 HydrophobicContact CB-CG 4.33Å; M294-R296 HydrophobicContact CE-CG 3.88Å; M294-R296 PolarHBondContact O-N 3.34Å; R296-Q298 PolarHBondContact O-N 3.15Å
297	K	41.5	Very low	72.6	Confident	194 Å²	194	123 Å²	123	84%	0.843	57%	0.566	S	S	*	*			trans	-35.8	105.8	146.7	-79.2	177.8	175.8	174.3	0	100.8	L295 S299	L295-K297 PolarHBondContact O-N 3.39Å; K297-S299 WeakPolarHBondContact O-CA 3.49Å; K297-S299 PolarHBondContact O-N 3.09Å
298	Q	42	Very low	72.2	Confident	178 Å²	178	118.7 Å²	118.7	83%	0.832	55%	0.554	S	S	*	*			trans	-44.3	111.4	169.4	-81.4	-180	-12.1	0	0	101	R296 R300	R296-Q298 PolarHBondContact O-N 3.15Å; Q298-R300 PolarHBondContact O-N 3.49Å
299	S	52.5	Low	71.8	Confident	107 Å²	107	124.7 Å²	124.7	75%	0.748	58%	0.58	S	S	*	*			trans	-59.9	109.4	-174.7	73.6	0	0	0	0	101.5	K297 F301	K297-S299 WeakPolarHBondContact O-CA 3.49Å; K297-S299 PolarHBondContact O-N 3.09Å; S299-F301 PolarHBondContact O-N 3.43Å
300	R	56.7	Low	71.5	Confident	234 Å²	234	123.6 Å²	123.6	88%	0.883	58%	0.576	S	S	*	*			trans	-47.3	122.4	-172.1	-85.4	179.4	91.9	176.8	8.4	104.2	Q298 N302	Q298-R300 PolarHBondContact O-N 3.49Å; R300-N302 VanDerWaalsContact C-N 3.33Å; R300-N302 WeakPolarHBondContact O-CA 3.47Å; R300-N302 PolarHBondContact O-N 3.31Å
301	F	71.1	Confident	71.4	Confident	164 Å²	164	126.6 Å²	126.6	72%	0.719	59%	0.592	S	S	*	*			trans	-45.6	105.6	-173.7	168.2	-100.4	0	0	0	107.8	S299 A303 K306	S299-F301 PolarHBondContact O-N 3.43Å; F301-A303 VanDerWaalsContact C-N 3.28Å; F301-A303 HydrophobicContact CD1-CB 4.05Å; F301-A303 HydrophobicContact CE1-CB 3.53Å; F301-A303 HydrophobicContact CZ-CB 4.32Å; F301-A303 PolarHBondContact O-N 3.48Å; F301-K306 HydrophobicContact CE2-CB 4.41Å; F301-K306 HydrophobicContact CE2-CG 4.11Å
302	N	78.1	Confident	71.3	Confident	74 Å²	74	131.6 Å²	131.6	40%	0.396	62%	0.618	S	S	.	*			trans	-90.8	83.7	-173.3	-171.4	-42.4	0	0	0	105.5	R300 R304 K305 K306	R300-N302 VanDerWaalsContact C-N 3.33Å; R300-N302 WeakPolarHBondContact O-CA 3.47Å; R300-N302 PolarHBondContact O-N 3.31Å; N302-R304 PolarHBondContact O-N 3.25Å; N302-R304 VanDerWaalsContact O-N 3.11Å; N302-R304 WeakPolarHBondContact OD1-CB 3.37Å; N302-R304 PolarHBondContact OD1-N 2.86Å; N302-K305 HydrophobicContact CB-CB 4.14Å; N302-K305 HydrophobicContact CB-CG 4.43Å; N302-K305 PolarHBondContact O-N 3.01Å; N302-K305 PolarHBondContact OD1-N 3.19Å; N302-K306 PolarHBondContact O-N 3.16Å
303	A	82.3	Confident	71.7	Confident	54 Å²	54	130.1 Å²	130.1	45%	0.446	61%	0.612	S	S	.	*	H	α-helix	trans	-48.1	-40.2	-179.4	0	0	0	0	0	110.7	F301 K306 F307	F301-A303 VanDerWaalsContact C-N 3.28Å; F301-A303 HydrophobicContact CD1-CB 4.05Å; F301-A303 HydrophobicContact CE1-CB 3.53Å; F301-A303 HydrophobicContact CZ-CB 4.32Å; F301-A303 PolarHBondContact O-N 3.48Å; A303-K306 PolarHBondContact O-N 2.86Å; A303-F307 WeakPolarHBondContact O-CB 3.3Å; A303-F307 PolarHBondContact O-N 3.39Å
304	R	80.6	Confident	73.2	Confident	185 Å²	185	127.9 Å²	127.9	70%	0.698	60%	0.604	S	S	*	*	H	α-helix	trans	-63.7	-49.8	178.3	-172.5	176.6	-178.4	167.8	1.8	112.9	N302 F307 Q308	N302-R304 PolarHBondContact O-N 3.25Å; N302-R304 VanDerWaalsContact O-N 3.11Å; N302-R304 WeakPolarHBondContact OD1-CB 3.37Å; N302-R304 PolarHBondContact OD1-N 2.86Å; R304-F307 PolarHBondContact O-N 2.93Å; R304-Q308 WeakPolarHBondContact O-CB 3.18Å; R304-Q308 VanDerWaalsContact O-CG 3.23Å; R304-Q308 WeakPolarHBondContact O-CG 3.31Å; R304-Q308 PolarHBondContact O-N 3.31Å
305	K	79.1	Confident	75.2	Confident	142 Å²	142	128.8 Å²	128.8	62%	0.617	60%	0.601	S	S	*	*	H	α-helix	trans	-64.1	-41	177.7	-77.8	-171.1	175.7	-174	0	111.8	N302 Q308 F309	N302-K305 HydrophobicContact CB-CB 4.14Å; N302-K305 HydrophobicContact CB-CG 4.43Å; N302-K305 PolarHBondContact O-N 3.01Å; N302-K305 PolarHBondContact OD1-N 3.19Å; K305-Q308 PolarHBondContact O-N 3.3Å; K305-F309 WeakPolarHBondContact O-CB 3.42Å; K305-F309 PolarHBondContact O-N 3.4Å
306	K	84.9	Confident	77.3	Confident	137 Å²	137	124 Å²	124	60%	0.596	58%	0.583	S	S	*	*	H	α-helix	trans	-67.4	-40.4	177.5	-73.2	-68.8	-173.7	177.9	0	112	F301 N302 A303 F309 A310	F301-K306 HydrophobicContact CE2-CB 4.41Å; F301-K306 HydrophobicContact CE2-CG 4.11Å; N302-K306 PolarHBondContact O-N 3.16Å; A303-K306 PolarHBondContact O-N 2.86Å; K306-F309 PolarHBondContact O-N 3.16Å; K306-A310 WeakPolarHBondContact O-CB 3.33Å; K306-A310 PolarHBondContact O-N 2.82Å
307	F	88.1	Confident	79.4	Confident	139 Å²	139	118.2 Å²	118.2	61%	0.61	57%	0.566	S	S	*	*	H	α-helix	trans	-65.5	-42	174.5	-173.7	-111.9	0	0	0	112	A303 R304 F309 A310 I311	A303-F307 WeakPolarHBondContact O-CB 3.3Å; A303-F307 PolarHBondContact O-N 3.39Å; R304-F307 PolarHBondContact O-N 2.93Å; F307-F309 VanDerWaalsContact C-N 3.34Å; F307-F309 PolarHBondContact O-N 3.24Å; F307-A310 PolarHBondContact O-N 3.16Å; F307-I311 HydrophobicContact CD1-CD1 3.71Å; F307-I311 HydrophobicContact CE1-CD1 3.46Å; F307-I311 VanDerWaalsContact CE1-CD1 3.46Å; F307-I311 HydrophobicContact CE1-CG1 4.33Å; F307-I311 HydrophobicContact CG-CD1 4.44Å; F307-I311 HydrophobicContact CZ-CD1 3.98Å; F307-I311 HydrophobicContact CZ-CG1 4.44Å; F307-I311 WeakPolarHBondContact O-CG1 3.23Å; F307-I311 PolarHBondContact O-N 3.29Å
308	Q	88.3	Confident	81.7	Confident	94 Å²	94	112.8 Å²	112.8	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-60.3	-42.8	173.5	-76.6	172	-21.5	0	0	112.1	R304 K305 I311 L312	R304-Q308 WeakPolarHBondContact O-CB 3.18Å; R304-Q308 VanDerWaalsContact O-CG 3.23Å; R304-Q308 WeakPolarHBondContact O-CG 3.31Å; R304-Q308 PolarHBondContact O-N 3.31Å; K305-Q308 PolarHBondContact O-N 3.3Å; Q308-I311 PolarHBondContact O-N 3.37Å; Q308-L312 PolarHBondContact O-N 3.33Å
309	F	88.3	Confident	83.6	Confident	133 Å²	133	112.2 Å²	112.2	58%	0.583	54%	0.535	S	S	*	.	H	α-helix	trans	-65.1	-42.3	175.4	-173	-102.9	0	0	0	111.9	K305 K306 F307 I311 L312 V313	K305-F309 WeakPolarHBondContact O-CB 3.42Å; K305-F309 PolarHBondContact O-N 3.4Å; K306-F309 PolarHBondContact O-N 3.16Å; F307-F309 VanDerWaalsContact C-N 3.34Å; F307-F309 PolarHBondContact O-N 3.24Å; F309-I311 VanDerWaalsContact C-N 3.34Å; F309-I311 PolarHBondContact O-N 2.94Å; F309-L312 WeakPolarHBondContact O-CB 3.31Å; F309-L312 PolarHBondContact O-N 2.95Å; F309-L312 VanDerWaalsContact O-N 3.13Å; F309-V313 HydrophobicContact CD1-CG2 4.06Å; F309-V313 HydrophobicContact CE1-CG2 3.72Å; F309-V313 HydrophobicContact CZ-CG2 3.99Å; F309-V313 WeakPolarHBondContact O-CG2 3.43Å; F309-V313 PolarHBondContact O-N 2.94Å
310	A	90.8	Very high	85	Confident	41 Å²	41	112.7 Å²	112.7	34%	0.339	53%	0.528	S	S	.	.	H	α-helix	trans	-60.4	-42	174.8	0	0	0	0	0	112	K306 F307 L312 V313 I314	K306-A310 WeakPolarHBondContact O-CB 3.33Å; K306-A310 PolarHBondContact O-N 2.82Å; F307-A310 PolarHBondContact O-N 3.16Å; A310-L312 VanDerWaalsContact C-N 3.34Å; A310-L312 PolarHBondContact O-N 3.16Å; A310-V313 PolarHBondContact O-N 3.2Å; A310-I314 WeakPolarHBondContact O-CB 3.38Å; A310-I314 VanDerWaalsContact O-CG1 3.26Å; A310-I314 WeakPolarHBondContact O-CG1 3.47Å; A310-I314 PolarHBondContact O-N 2.96Å
311	I	93.1	Very high	86.2	Confident	64 Å²	64	110.6 Å²	110.6	33%	0.328	52%	0.52	S	S	.	.	H	α-helix	trans	-59.9	-44.8	172.9	-69.9	166.2	0	0	0	110.8	F307 Q308 F309 I314 R315	F307-I311 HydrophobicContact CD1-CD1 3.71Å; F307-I311 HydrophobicContact CE1-CD1 3.46Å; F307-I311 VanDerWaalsContact CE1-CD1 3.46Å; F307-I311 HydrophobicContact CE1-CG1 4.33Å; F307-I311 HydrophobicContact CG-CD1 4.44Å; F307-I311 HydrophobicContact CZ-CD1 3.98Å; F307-I311 HydrophobicContact CZ-CG1 4.44Å; F307-I311 WeakPolarHBondContact O-CG1 3.23Å; F307-I311 PolarHBondContact O-N 3.29Å; Q308-I311 PolarHBondContact O-N 3.37Å; F309-I311 VanDerWaalsContact C-N 3.34Å; F309-I311 PolarHBondContact O-N 2.94Å; I311-I314 PolarHBondContact O-N 3.08Å; I311-R315 HydrophobicContact CG2-CG 4.26Å; I311-R315 WeakPolarHBondContact O-CB 3.46Å; I311-R315 VanDerWaalsContact O-CG 3.25Å; I311-R315 WeakPolarHBondContact O-CG 3.37Å; I311-R315 PolarHBondContact O-N 3.24Å
312	L	92.1	Very high	86.5	Confident	115 Å²	115	110.6 Å²	110.6	60%	0.602	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-46.6	177.6	-90.9	158	0	0	0	111.9	Q308 F309 A310 R315 A316	Q308-L312 PolarHBondContact O-N 3.33Å; F309-L312 WeakPolarHBondContact O-CB 3.31Å; F309-L312 PolarHBondContact O-N 2.95Å; F309-L312 VanDerWaalsContact O-N 3.13Å; A310-L312 VanDerWaalsContact C-N 3.34Å; A310-L312 PolarHBondContact O-N 3.16Å; L312-R315 PolarHBondContact O-N 2.88Å; L312-A316 WeakPolarHBondContact O-CB 3.46Å; L312-A316 PolarHBondContact O-N 3.48Å
313	V	93.2	Very high	86.2	Confident	59 Å²	59	112.7 Å²	112.7	36%	0.358	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-46.6	177	171.7	0	0	0	0	110.9	F309 A310 R315 A316 I317	F309-V313 HydrophobicContact CD1-CG2 4.06Å; F309-V313 HydrophobicContact CE1-CG2 3.72Å; F309-V313 HydrophobicContact CZ-CG2 3.99Å; F309-V313 WeakPolarHBondContact O-CG2 3.43Å; F309-V313 PolarHBondContact O-N 2.94Å; A310-V313 PolarHBondContact O-N 3.2Å; V313-R315 PolarHBondContact O-N 3.13Å; V313-A316 PolarHBondContact O-N 2.87Å; V313-I317 HydrophobicContact CG1-CD1 3.79Å; V313-I317 HydrophobicContact CG1-CG1 4.46Å; V313-I317 VanDerWaalsContact O-CG1 3.32Å; V313-I317 WeakPolarHBondContact O-CG1 3.37Å; V313-I317 PolarHBondContact O-N 3.37Å
314	I	94.2	Very high	85.5	Confident	98 Å²	98	119.9 Å²	119.9	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-61.2	-44.6	177	-69.5	168.4	0	0	0	110.7	A310 I311 A316 I317 I318	A310-I314 WeakPolarHBondContact O-CB 3.38Å; A310-I314 VanDerWaalsContact O-CG1 3.26Å; A310-I314 WeakPolarHBondContact O-CG1 3.47Å; A310-I314 PolarHBondContact O-N 2.96Å; I311-I314 PolarHBondContact O-N 3.08Å; I314-A316 VanDerWaalsContact C-N 3.33Å; I314-A316 PolarHBondContact O-N 3.12Å; I314-I317 PolarHBondContact O-N 3.2Å; I314-I318 HydrophobicContact CG2-CD1 3.71Å; I314-I318 HydrophobicContact CG2-CG1 4.35Å; I314-I318 WeakPolarHBondContact O-CB 3.41Å; I314-I318 VanDerWaalsContact O-CG1 3.26Å; I314-I318 WeakPolarHBondContact O-CG1 3.48Å; I314-I318 PolarHBondContact O-N 2.81Å
315	R	91	Very high	84.9	Confident	147 Å²	147	118.1 Å²	118.1	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-63.1	-38.6	177.1	-72.5	176.2	98.7	165	7.9	112	I311 L312 V313 R319	I311-R315 HydrophobicContact CG2-CG 4.26Å; I311-R315 WeakPolarHBondContact O-CB 3.46Å; I311-R315 VanDerWaalsContact O-CG 3.25Å; I311-R315 WeakPolarHBondContact O-CG 3.37Å; I311-R315 PolarHBondContact O-N 3.24Å; L312-R315 PolarHBondContact O-N 2.88Å; V313-R315 PolarHBondContact O-N 3.13Å; R315-R319 WeakPolarHBondContact O-CB 3.31Å; R315-R319 WeakPolarHBondContact O-CG 3.34Å; R315-R319 PolarHBondContact O-N 3.49Å
316	A	89.5	Confident	84.2	Confident	47 Å²	47	115.7 Å²	115.7	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-47.2	175.4	0	0	0	0	0	111.3	L312 V313 I314 I318 R319 I320	L312-A316 WeakPolarHBondContact O-CB 3.46Å; L312-A316 PolarHBondContact O-N 3.48Å; V313-A316 PolarHBondContact O-N 2.87Å; I314-A316 VanDerWaalsContact C-N 3.33Å; I314-A316 PolarHBondContact O-N 3.12Å; A316-I318 PolarHBondContact O-N 3.45Å; A316-R319 WeakPolarHBondContact O-CB 3.22Å; A316-R319 PolarHBondContact O-N 3Å; A316-R319 VanDerWaalsContact O-N 3.17Å; A316-I320 VanDerWaalsContact O-CG1 3.32Å; A316-I320 WeakPolarHBondContact O-CG1 3.38Å; A316-I320 PolarHBondContact O-N 3.33Å
317	I	91.2	Very high	83	Confident	77 Å²	77	113.5 Å²	113.5	40%	0.395	54%	0.544	S	S	.	.	H	α-helix	trans	-61.3	-43.4	176.9	-68.5	168.9	0	0	0	111.1	V313 I314 R319 I320 R321	V313-I317 HydrophobicContact CG1-CD1 3.79Å; V313-I317 HydrophobicContact CG1-CG1 4.46Å; V313-I317 VanDerWaalsContact O-CG1 3.32Å; V313-I317 WeakPolarHBondContact O-CG1 3.37Å; V313-I317 PolarHBondContact O-N 3.37Å; I314-I317 PolarHBondContact O-N 3.2Å; I317-R319 VanDerWaalsContact C-N 3.34Å; I317-R319 PolarHBondContact O-N 3.15Å; I317-I320 PolarHBondContact O-N 2.84Å; I317-R321 HydrophobicContact CG2-CG 4.38Å; I317-R321 WeakPolarHBondContact O-CB 3.5Å; I317-R321 WeakPolarHBondContact O-CG 3.45Å; I317-R321 PolarHBondContact O-N 2.92Å
318	I	88.3	Confident	81.8	Confident	80 Å²	80	115.6 Å²	115.6	41%	0.41	56%	0.555	S	S	.	*	H	α-helix	trans	-62	-43.7	175.9	-69.6	169.3	0	0	0	110.4	I314 A316 R321 R322	I314-I318 HydrophobicContact CG2-CD1 3.71Å; I314-I318 HydrophobicContact CG2-CG1 4.35Å; I314-I318 WeakPolarHBondContact O-CB 3.41Å; I314-I318 VanDerWaalsContact O-CG1 3.26Å; I314-I318 WeakPolarHBondContact O-CG1 3.48Å; I314-I318 PolarHBondContact O-N 2.81Å; A316-I318 PolarHBondContact O-N 3.45Å; I318-R321 PolarHBondContact O-N 3.21Å; I318-R322 HydrophobicContact CG2-CG 4.36Å; I318-R322 VanDerWaalsContact O-CB 3.27Å; I318-R322 WeakPolarHBondContact O-CB 3.43Å; I318-R322 VanDerWaalsContact O-CG 3.28Å; I318-R322 WeakPolarHBondContact O-CG 3.47Å; I318-R322 PolarHBondContact O-N 3.16Å
319	R	82.8	Confident	80.8	Confident	165 Å²	165	117.1 Å²	117.1	62%	0.623	57%	0.574	S	S	*	*	H	α-helix	trans	-61.8	-45.1	176.1	-83.5	179.5	169	118.1	-5.7	112.2	R315 A316 I317 R322 L323	R315-R319 WeakPolarHBondContact O-CB 3.31Å; R315-R319 WeakPolarHBondContact O-CG 3.34Å; R315-R319 PolarHBondContact O-N 3.49Å; A316-R319 WeakPolarHBondContact O-CB 3.22Å; A316-R319 PolarHBondContact O-N 3Å; A316-R319 VanDerWaalsContact O-N 3.17Å; I317-R319 VanDerWaalsContact C-N 3.34Å; I317-R319 PolarHBondContact O-N 3.15Å; R319-R322 CarbonylContact O-C 3.59Å; R319-R322 PolarHBondContact O-N 2.9Å; R319-L323 PolarHBondContact O-N 3.25Å
320	I	82.3	Confident	79.8	Confident	118 Å²	118	115 Å²	115	61%	0.605	57%	0.568	S	S	*	*	H	α-helix	trans	-64.2	-43.3	177.3	-67.7	165.6	0	0	0	111	A316 I317 R322 L323	A316-I320 VanDerWaalsContact O-CG1 3.32Å; A316-I320 WeakPolarHBondContact O-CG1 3.38Å; A316-I320 PolarHBondContact O-N 3.33Å; I317-I320 PolarHBondContact O-N 2.84Å; I320-R322 VanDerWaalsContact C-N 3.28Å; I320-R322 PolarHBondContact O-N 3.39Å; I320-L323 WeakPolarHBondContact O-CB 3.42Å; I320-L323 PolarHBondContact O-N 3.17Å
321	R	81.3	Confident	79	Confident	189 Å²	189	118.4 Å²	118.4	71%	0.713	58%	0.577	S	S	*	*	H	α-helix	trans	-66.5	-30.8	176.3	-74.8	-177.8	175.8	-177.1	-0.2	112.9	I317 I318	I317-R321 HydrophobicContact CG2-CG 4.38Å; I317-R321 WeakPolarHBondContact O-CB 3.5Å; I317-R321 WeakPolarHBondContact O-CG 3.45Å; I317-R321 PolarHBondContact O-N 2.92Å; I318-R321 PolarHBondContact O-N 3.21Å
322	R	77.8	Confident	78	Confident	164 Å²	164	119.9 Å²	119.9	62%	0.619	59%	0.589	S	S	*	*	H	α-helix	trans	-89	-2.8	176.4	-68.8	-175.3	-179.7	-148.4	1.2	113.3	I318 R319 I320 R324 F325 T326	I318-R322 HydrophobicContact CG2-CG 4.36Å; I318-R322 VanDerWaalsContact O-CB 3.27Å; I318-R322 WeakPolarHBondContact O-CB 3.43Å; I318-R322 VanDerWaalsContact O-CG 3.28Å; I318-R322 WeakPolarHBondContact O-CG 3.47Å; I318-R322 PolarHBondContact O-N 3.16Å; R319-R322 CarbonylContact O-C 3.59Å; R319-R322 PolarHBondContact O-N 2.9Å; I320-R322 VanDerWaalsContact C-N 3.28Å; I320-R322 PolarHBondContact O-N 3.39Å; R322-R324 PolarHBondContact O-N 3.32Å; R322-R324 VanDerWaalsContact O-N 3.16Å; R322-F325 CarbonylContact O-C 3.51Å; R322-F325 WeakPolarHBondContact O-CA 3.42Å; R322-F325 PolarHBondContact O-N 2.92Å; R322-T326 PolarHBondContact O-N 3.05Å; R322-T326 PolarHBondContact O-OG1 3.32Å
323	L	71.3	Confident	77.3	Confident	119 Å²	119	121.3 Å²	121.3	62%	0.623	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-33.5	-179	-144	98.6	0	0	0	111.6	R319 I320 F325 T326	R319-L323 PolarHBondContact O-N 3.25Å; I320-L323 WeakPolarHBondContact O-CB 3.42Å; I320-L323 PolarHBondContact O-N 3.17Å; L323-F325 VanDerWaalsContact C-N 3.27Å; L323-F325 PolarHBondContact O-N 3.08Å; L323-T326 VanDerWaalsContact C-OG1 3.29Å; L323-T326 WeakPolarHBondContact CA-OG1 3.24Å; L323-T326 PolarHBondContact O-OG1 2.98Å
324	R	66.8	Low	76.2	Confident	204 Å²	204	122 Å²	122	77%	0.77	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-16	174.7	69.9	-178.8	-178.2	167.3	2.3	115.2	R322	R322-R324 PolarHBondContact O-N 3.32Å; R322-R324 VanDerWaalsContact O-N 3.16Å
325	F	69.6	Low	75.4	Confident	148 Å²	148	118 Å²	118	65%	0.649	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-14.6	-179.9	-59.9	-65.1	0	0	0	112.6	R322 L323 A327	R322-F325 CarbonylContact O-C 3.51Å; R322-F325 WeakPolarHBondContact O-CA 3.42Å; R322-F325 PolarHBondContact O-N 2.92Å; L323-F325 VanDerWaalsContact C-N 3.27Å; L323-F325 PolarHBondContact O-N 3.08Å; F325-A327 PolarHBondContact O-N 3.32Å
326	T	63	Low	74.7	Confident	92 Å²	92	117.5 Å²	117.5	56%	0.564	58%	0.58	S	S	*	*	S	Bend	trans	-72.6	112.7	165.4	31.4	0	0	0	0	108.3	R322 L323 E328	R322-T326 PolarHBondContact O-N 3.05Å; R322-T326 PolarHBondContact O-OG1 3.32Å; L323-T326 VanDerWaalsContact C-OG1 3.29Å; L323-T326 WeakPolarHBondContact CA-OG1 3.24Å; L323-T326 PolarHBondContact O-OG1 2.98Å; T326-E328 PolarHBondContact O-N 2.99Å
327	A	60.4	Low	74.2	Confident	90 Å²	90	126.2 Å²	126.2	74%	0.744	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-55.3	136.6	168.6	0	0	0	0	0	109	F325	F325-A327 PolarHBondContact O-N 3.32Å
328	E	63.4	Low	73.5	Confident	183 Å²	183	125.9 Å²	125.9	86%	0.855	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-52.3	129	167.9	-75.9	178.3	165	0	0	108.2	T326 L330	T326-E328 PolarHBondContact O-N 2.99Å; E328-L330 PolarHBondContact O-N 3.13Å; E328-L330 VanDerWaalsContact O-N 3.08Å
329	P	66.1	Low	72.8	Confident	127 Å²	127	124.1 Å²	124.1	83%	0.825	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-56.7	119.8	175.7	-19.7	29.3	0	0	0	109	H331	P329-H331 PolarHBondContact O-N 3.08Å; P329-H331 VanDerWaalsContact O-N 3.13Å
330	L	66.9	Low	72.4	Confident	88 Å²	88	118.4 Å²	118.4	46%	0.461	57%	0.574	S	S	.	*			trans	-66.6	112.2	171.8	-171.1	97.4	0	0	0	107.5	E328 V332 A335 V342 L345	E328-L330 PolarHBondContact O-N 3.13Å; E328-L330 VanDerWaalsContact O-N 3.08Å; L330-V332 PolarHBondContact O-N 2.99Å; L330-A335 HydrophobicContact CD1-CB 4.4Å; L330-A335 HydrophobicContact CD2-CB 3.67Å; L330-A335 HydrophobicContact CG-CB 4.02Å; L330-V342 HydrophobicContact CD1-CB 4.42Å; L330-V342 HydrophobicContact CD1-CG1 3.63Å; L330-V342 HydrophobicContact CD1-CG2 4.15Å; L330-L345 HydrophobicContact CD1-CD1 4.08Å; L330-L345 HydrophobicContact CD1-CG 4.37Å
331	H	74	Confident	71.9	Confident	112 Å²	112	120.8 Å²	120.8	52%	0.519	58%	0.576	S	S	.	*			trans	-68.9	103.4	174.2	-150.4	-83.4	0	0	0	108.1	P329 E333 E334 A335	P329-H331 PolarHBondContact O-N 3.08Å; P329-H331 VanDerWaalsContact O-N 3.13Å; H331-E333 IonicContact CE1-OE2 2.66Å; H331-E333 PolarHBondContact CE1-OE2 3.1Å; H331-E333 VanDerWaalsContact CE1-OE2 3.26Å; H331-E333 IonicContact ND1-OE2 3.78Å; H331-E333 PolarHBondContact O-N 3.03Å; H331-E334 HydrophobicContact CB-CB 4.02Å; H331-E334 PolarHBondContact O-N 3.31Å; H331-A335 PolarHBondContact O-N 3.44Å
332	V	73.6	Confident	71.6	Confident	96 Å²	96	113.5 Å²	113.5	58%	0.582	55%	0.552	S	S	*	*	H	α-helix	trans	-55.8	-40.5	-171.7	176.7	0	0	0	0	111.2	L330 E334 A335 I336	L330-V332 PolarHBondContact O-N 2.99Å; V332-E334 VanDerWaalsContact C-N 3.32Å; V332-E334 PolarHBondContact O-N 3.32Å; V332-A335 PolarHBondContact O-N 3.36Å; V332-I336 HydrophobicContact CG1-CD1 3.79Å; V332-I336 HydrophobicContact CG1-CG1 4.42Å; V332-I336 VanDerWaalsContact O-CG1 3.25Å; V332-I336 WeakPolarHBondContact O-CG1 3.37Å; V332-I336 PolarHBondContact O-N 3.29Å
333	E	76.8	Confident	71.3	Confident	144 Å²	144	112.6 Å²	112.6	67%	0.673	55%	0.553	S	S	*	*	H	α-helix	trans	-62.3	-37.6	177.2	-65.1	167.3	179.8	0	0	112.7	H331 R337	H331-E333 IonicContact CE1-OE2 2.66Å; H331-E333 PolarHBondContact CE1-OE2 3.1Å; H331-E333 VanDerWaalsContact CE1-OE2 3.26Å; H331-E333 IonicContact ND1-OE2 3.78Å; H331-E333 PolarHBondContact O-N 3.03Å; E333-R337 WeakPolarHBondContact O-CB 3.25Å; E333-R337 PolarHBondContact O-N 3.5Å; E333-R337 VanDerWaalsContact O-N 3.07Å
334	E	70.8	Confident	71.5	Confident	75 Å²	75	112 Å²	112	35%	0.35	55%	0.554	S	S	.	*	H	α-helix	trans	-76.8	-36.7	179.1	-164.4	169.8	-166.3	0	0	111.2	H331 V332 I336 R337 D338 R341	H331-E334 HydrophobicContact CB-CB 4.02Å; H331-E334 PolarHBondContact O-N 3.31Å; V332-E334 VanDerWaalsContact C-N 3.32Å; V332-E334 PolarHBondContact O-N 3.32Å; E334-I336 VanDerWaalsContact C-N 3.31Å; E334-I336 PolarHBondContact O-N 3.25Å; E334-R337 PolarHBondContact O-N 3.18Å; E334-D338 CarbonylContact O-C 3.55Å; E334-D338 PolarHBondContact O-N 3.42Å; E334-R341 WeakPolarHBondContact OE1-CD 3.5Å; E334-R341 IonicContact OE1-CZ 3.62Å; E334-R341 IonicContact OE1-NE 3.88Å; E334-R341 IonicContact OE1-NH1 3.77Å; E334-R341 PolarHBondContact OE1-NH1 3.26Å
335	A	75.8	Confident	72.1	Confident	14 Å²	14	104.8 Å²	104.8	12%	0.116	53%	0.53	C	S	.	.	H	α-helix	trans	-64.8	-32.9	173.2	0	0	0	0	0	112.9	L330 H331 V332 P339 L345	L330-A335 HydrophobicContact CD1-CB 4.4Å; L330-A335 HydrophobicContact CD2-CB 3.67Å; L330-A335 HydrophobicContact CG-CB 4.02Å; H331-A335 PolarHBondContact O-N 3.44Å; V332-A335 PolarHBondContact O-N 3.36Å; A335-P339 WeakPolarHBondContact O-CA 3.42Å; A335-P339 VanDerWaalsContact O-CB 3.32Å; A335-P339 WeakPolarHBondContact O-CB 3.49Å; A335-P339 WeakPolarHBondContact O-CD 3.44Å; A335-L345 HydrophobicContact CB-CD1 3.75Å
336	I	77.4	Confident	72.5	Confident	135 Å²	135	101.8 Å²	101.8	69%	0.692	52%	0.515	S	S	*	.	H	α-helix	trans	-72.9	-42.6	173.8	-69.4	166.2	0	0	0	110.7	V332 E334	V332-I336 HydrophobicContact CG1-CD1 3.79Å; V332-I336 HydrophobicContact CG1-CG1 4.42Å; V332-I336 VanDerWaalsContact O-CG1 3.25Å; V332-I336 WeakPolarHBondContact O-CG1 3.37Å; V332-I336 PolarHBondContact O-N 3.29Å; E334-I336 VanDerWaalsContact C-N 3.31Å; E334-I336 PolarHBondContact O-N 3.25Å
337	R	78.3	Confident	72.9	Confident	230 Å²	230	104.4 Å²	104.4	87%	0.868	52%	0.518	S	S	*	.	H	α-helix	trans	-73.7	-43.2	-175.4	-169.3	179.7	-174.4	-173.7	2.5	113.3	E333 E334	E333-R337 WeakPolarHBondContact O-CB 3.25Å; E333-R337 PolarHBondContact O-N 3.5Å; E333-R337 VanDerWaalsContact O-N 3.07Å; E334-R337 PolarHBondContact O-N 3.18Å
338	D	76.1	Confident	73.9	Confident	71 Å²	71	104.3 Å²	104.3	38%	0.38	51%	0.508	S	S	.	.			trans	-147.1	81.4	178.9	-175.5	-0	0	0	0	110.9	E334 Y340 R341	E334-D338 CarbonylContact O-C 3.55Å; E334-D338 PolarHBondContact O-N 3.42Å; D338-Y340 PolarHBondContact O-N 2.94Å; D338-Y340 VanDerWaalsContact O-N 3.13Å; D338-Y340 WeakPolarHBondContact OD1-CB 3.43Å; D338-Y340 PolarHBondContact OD1-N 3.33Å; D338-Y340 VanDerWaalsContact OD1-N 3.16Å; D338-R341 HydrophobicContact CB-CB 4.29Å; D338-R341 WeakPolarHBondContact O-CB 3.36Å; D338-R341 PolarHBondContact O-N 2.96Å; D338-R341 PolarHBondContact OD1-N 3.21Å
339	P	75.3	Confident	74.5	Confident	43 Å²	43	97.6 Å²	97.6	28%	0.279	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.1	180	24.1	-33	0	0	0	113	A335 R341 L345 I349	A335-P339 WeakPolarHBondContact O-CA 3.42Å; A335-P339 VanDerWaalsContact O-CB 3.32Å; A335-P339 WeakPolarHBondContact O-CB 3.49Å; A335-P339 WeakPolarHBondContact O-CD 3.44Å; P339-R341 VanDerWaalsContact C-N 3.3Å; P339-L345 HydrophobicContact CB-CD1 4.26Å; P339-L345 WeakPolarHBondContact O-CB 3.2Å; P339-I349 HydrophobicContact CB-CD1 3.84Å; P339-I349 HydrophobicContact CG-CD1 4.31Å
340	Y	74.3	Confident	74.8	Confident	45 Å²	45	93.2 Å²	93.2	18%	0.176	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-18	177	-78.5	-84.2	0	0	0	112.7	D338 V342 R346 I349 R369	D338-Y340 PolarHBondContact O-N 2.94Å; D338-Y340 VanDerWaalsContact O-N 3.13Å; D338-Y340 WeakPolarHBondContact OD1-CB 3.43Å; D338-Y340 PolarHBondContact OD1-N 3.33Å; D338-Y340 VanDerWaalsContact OD1-N 3.16Å; Y340-V342 VanDerWaalsContact C-N 3.33Å; Y340-R346 HydrophobicContact CD1-CG 4.04Å; Y340-R346 PolarHBondContact O-NE 3.4Å; Y340-R346 PolarHBondContact O-NH2 2.94Å; Y340-I349 HydrophobicContact CE1-CG2 3.99Å; Y340-I349 HydrophobicContact CE2-CG2 4.33Å; Y340-I349 WeakPolarHBondContact OH-CG2 3.32Å; Y340-R369 HydrophobicContact CE1-CB 4.18Å
341	R	71.7	Confident	75	Confident	167 Å²	167	90.3 Å²	90.3	63%	0.63	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-34.7	175	-155.7	172.5	-177.7	-170.7	6.5	111.8	E334 D338 P339 K343 R346	E334-R341 WeakPolarHBondContact OE1-CD 3.5Å; E334-R341 IonicContact OE1-CZ 3.62Å; E334-R341 IonicContact OE1-NE 3.88Å; E334-R341 IonicContact OE1-NH1 3.77Å; E334-R341 PolarHBondContact OE1-NH1 3.26Å; D338-R341 HydrophobicContact CB-CB 4.29Å; D338-R341 WeakPolarHBondContact O-CB 3.36Å; D338-R341 PolarHBondContact O-N 2.96Å; D338-R341 PolarHBondContact OD1-N 3.21Å; P339-R341 VanDerWaalsContact C-N 3.3Å; R341-K343 PolarHBondContact O-N 3.23Å; R341-R346 PolarHBondContact O-NH2 3.38Å; R341-R346 VanDerWaalsContact O-NH2 3.13Å
342	V	74.3	Confident	75.1	Confident	36 Å²	36	88.2 Å²	88.2	22%	0.218	44%	0.436	C	S	.	.	S	Bend	trans	-78.1	115.9	177.3	-176.3	0	0	0	0	110.7	L330 Y340 V344 L345 R346	L330-V342 HydrophobicContact CD1-CB 4.42Å; L330-V342 HydrophobicContact CD1-CG1 3.63Å; L330-V342 HydrophobicContact CD1-CG2 4.15Å; Y340-V342 VanDerWaalsContact C-N 3.33Å; V342-V344 VanDerWaalsContact C-N 3.26Å; V342-V344 HydrophobicContact CG1-CB 4.5Å; V342-V344 PolarHBondContact O-N 3.28Å; V342-L345 HydrophobicContact CB-CB 4.15Å; V342-L345 HydrophobicContact CB-CD1 4.02Å; V342-L345 HydrophobicContact CB-CG 4.13Å; V342-L345 HydrophobicContact CG1-CB 4.36Å; V342-L345 HydrophobicContact CG1-CD1 4.27Å; V342-L345 HydrophobicContact CG1-CG 4.03Å; V342-L345 HydrophobicContact CG2-CD1 4.24Å; V342-L345 PolarHBondContact O-N 3.25Å; V342-R346 WeakPolarHBondContact O-CB 3.24Å; V342-R346 PolarHBondContact O-N 3.45Å
343	K	72.3	Confident	74.6	Confident	146 Å²	146	84.7 Å²	84.7	64%	0.635	42%	0.417	S	S	*	.	H	α-helix	trans	-56.6	-36.2	-175.8	-172.1	178.6	-178.7	178.9	0	113.6	R341 K347	R341-K343 PolarHBondContact O-N 3.23Å; K343-K347 PolarHBondContact O-N 3.27Å
344	V	75.4	Confident	73.9	Confident	106 Å²	106	81.3 Å²	81.3	64%	0.642	40%	0.4	S	S	*	.	H	α-helix	trans	-71.5	-48.8	-179.6	-179.9	0	0	0	0	111	V342 R346 K347 V348	V342-V344 VanDerWaalsContact C-N 3.26Å; V342-V344 HydrophobicContact CG1-CB 4.5Å; V342-V344 PolarHBondContact O-N 3.28Å; V344-R346 PolarHBondContact O-N 3.36Å; V344-K347 PolarHBondContact O-N 2.92Å; V344-V348 PolarHBondContact O-N 3.27Å
345	L	78.4	Confident	73.8	Confident	52 Å²	52	88 Å²	88	27%	0.272	42%	0.422	S	S	.	.	H	α-helix	trans	-63	-43.2	177.7	-65.8	179.4	0	0	0	111.5	L330 A335 P339 V342 K347 V348 I349	L330-L345 HydrophobicContact CD1-CD1 4.08Å; L330-L345 HydrophobicContact CD1-CG 4.37Å; A335-L345 HydrophobicContact CB-CD1 3.75Å; P339-L345 HydrophobicContact CB-CD1 4.26Å; P339-L345 WeakPolarHBondContact O-CB 3.2Å; V342-L345 HydrophobicContact CB-CB 4.15Å; V342-L345 HydrophobicContact CB-CD1 4.02Å; V342-L345 HydrophobicContact CB-CG 4.13Å; V342-L345 HydrophobicContact CG1-CB 4.36Å; V342-L345 HydrophobicContact CG1-CD1 4.27Å; V342-L345 HydrophobicContact CG1-CG 4.03Å; V342-L345 HydrophobicContact CG2-CD1 4.24Å; V342-L345 PolarHBondContact O-N 3.25Å; L345-K347 VanDerWaalsContact C-N 3.32Å; L345-K347 PolarHBondContact O-N 2.89Å; L345-V348 PolarHBondContact O-N 3.46Å; L345-V348 VanDerWaalsContact O-N 3.1Å; L345-I349 HydrophobicContact CB-CD1 4.35Å; L345-I349 WeakPolarHBondContact O-CD1 3.41Å; L345-I349 VanDerWaalsContact O-CG1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.4Å; L345-I349 PolarHBondContact O-N 2.88Å
346	R	77.8	Confident	73.4	Confident	86 Å²	86	92.3 Å²	92.3	33%	0.325	45%	0.447	S	S	.	.	H	α-helix	trans	-50.7	-48.7	174.5	-176.7	-173.7	-46.5	140	7.9	112.7	Y340 R341 V342 V344 V348 I349 D350	Y340-R346 HydrophobicContact CD1-CG 4.04Å; Y340-R346 PolarHBondContact O-NE 3.4Å; Y340-R346 PolarHBondContact O-NH2 2.94Å; R341-R346 PolarHBondContact O-NH2 3.38Å; R341-R346 VanDerWaalsContact O-NH2 3.13Å; V342-R346 WeakPolarHBondContact O-CB 3.24Å; V342-R346 PolarHBondContact O-N 3.45Å; V344-R346 PolarHBondContact O-N 3.36Å; R346-V348 VanDerWaalsContact C-N 3.33Å; R346-V348 PolarHBondContact O-N 2.88Å; R346-I349 PolarHBondContact O-N 2.95Å; R346-D350 WeakPolarHBondContact O-CB 3.37Å; R346-D350 VanDerWaalsContact O-CG 3.26Å; R346-D350 PolarHBondContact O-N 2.7Å
347	K	72.7	Confident	72.9	Confident	146 Å²	146	91.8 Å²	91.8	64%	0.635	44%	0.437	S	S	*	.	H	α-helix	trans	-62.6	-40	-179.8	-77.6	-175.9	174.6	-169.8	0	112.4	K343 V344 L345 G351	K343-K347 PolarHBondContact O-N 3.27Å; V344-K347 PolarHBondContact O-N 2.92Å; L345-K347 VanDerWaalsContact C-N 3.32Å; L345-K347 PolarHBondContact O-N 2.89Å; K347-G351 PolarHBondContact O-N 3.41Å
348	V	79.6	Confident	71.7	Confident	89 Å²	89	83.6 Å²	83.6	54%	0.539	42%	0.424	S	S	.	.	H	α-helix	trans	-67	-47.3	178.2	176	0	0	0	0	110.1	V344 L345 R346 G351 C352	V344-V348 PolarHBondContact O-N 3.27Å; L345-V348 PolarHBondContact O-N 3.46Å; L345-V348 VanDerWaalsContact O-N 3.1Å; R346-V348 VanDerWaalsContact C-N 3.33Å; R346-V348 PolarHBondContact O-N 2.88Å; V348-G351 PolarHBondContact O-N 3.37Å; V348-C352 PolarHBondContact O-N 3.16Å; V348-C352 PolarHBondContact O-SG 3.32Å; V348-C352 VanDerWaalsContact O-SG 3.38Å
349	I	77.3	Confident	70.9	Confident	41 Å²	41	85.8 Å²	85.8	21%	0.21	43%	0.432	C	S	.	.	H	α-helix	trans	-61.4	-48.5	179.7	-65	163.5	0	0	0	110.8	P339 Y340 L345 R346 G351 C352 A353	P339-I349 HydrophobicContact CB-CD1 3.84Å; P339-I349 HydrophobicContact CG-CD1 4.31Å; Y340-I349 HydrophobicContact CE1-CG2 3.99Å; Y340-I349 HydrophobicContact CE2-CG2 4.33Å; Y340-I349 WeakPolarHBondContact OH-CG2 3.32Å; L345-I349 HydrophobicContact CB-CD1 4.35Å; L345-I349 WeakPolarHBondContact O-CD1 3.41Å; L345-I349 VanDerWaalsContact O-CG1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.4Å; L345-I349 PolarHBondContact O-N 2.88Å; R346-I349 PolarHBondContact O-N 2.95Å; I349-G351 VanDerWaalsContact C-N 3.31Å; I349-G351 PolarHBondContact O-N 3.31Å; I349-C352 PolarHBondContact O-N 3.13Å; I349-A353 WeakPolarHBondContact O-CB 3.43Å; I349-A353 PolarHBondContact O-N 3.06Å
350	D	72.1	Confident	70.1	Confident	35 Å²	35	91.5 Å²	91.5	19%	0.187	45%	0.448	C	S	.	.	H	α-helix	trans	-62.1	-39.5	177.9	-71.4	-17.6	0	0	0	111.4	R346 A353 F354 W360	R346-D350 WeakPolarHBondContact O-CB 3.37Å; R346-D350 VanDerWaalsContact O-CG 3.26Å; R346-D350 PolarHBondContact O-N 2.7Å; D350-A353 PolarHBondContact O-N 2.78Å; D350-F354 WeakPolarHBondContact O-CB 3.38Å; D350-F354 PolarHBondContact O-N 3.07Å; D350-W360 HydrophobicContact CB-CZ3 4.47Å
351	G	71.9	Confident	69.2	Low	27 Å²	27	91.4 Å²	91.4	28%	0.278	45%	0.452	S	S	.	.	H	α-helix	trans	-65	-40.9	176.3	0	0	0	0	0	113.2	K347 V348 I349 R355	K347-G351 PolarHBondContact O-N 3.41Å; V348-G351 PolarHBondContact O-N 3.37Å; I349-G351 VanDerWaalsContact C-N 3.31Å; I349-G351 PolarHBondContact O-N 3.31Å; G351-R355 WeakPolarHBondContact O-CG 3.19Å; G351-R355 PolarHBondContact O-N 3.47Å
352	C	74.8	Confident	68.2	Low	68 Å²	68	92.1 Å²	92.1	46%	0.459	46%	0.459	S	S	.	.	H	α-helix	trans	-67	-45.1	174.4	-70.7	0	0	0	0	111.6	V348 I349 F354 R355 V356	V348-C352 PolarHBondContact O-N 3.16Å; V348-C352 PolarHBondContact O-SG 3.32Å; V348-C352 VanDerWaalsContact O-SG 3.38Å; I349-C352 PolarHBondContact O-N 3.13Å; C352-F354 PolarHBondContact O-N 3.13Å; C352-R355 PolarHBondContact O-N 2.69Å; C352-V356 WeakPolarHBondContact O-CG2 3.42Å; C352-V356 PolarHBondContact O-N 2.89Å
353	A	63.9	Low	66.7	Low	22 Å²	22	99.3 Å²	99.3	18%	0.182	49%	0.488	C	S	.	.	H	α-helix	trans	-60.4	-44.2	177.8	0	0	0	0	0	111.8	I349 D350 R355 V356 Y357	I349-A353 WeakPolarHBondContact O-CB 3.43Å; I349-A353 PolarHBondContact O-N 3.06Å; D350-A353 PolarHBondContact O-N 2.78Å; A353-R355 VanDerWaalsContact C-N 3.31Å; A353-R355 PolarHBondContact O-N 3.18Å; A353-V356 PolarHBondContact O-N 2.86Å; A353-V356 VanDerWaalsContact O-N 3.14Å; A353-Y357 HydrophobicContact CB-CD2 4.37Å; A353-Y357 WeakPolarHBondContact O-CD2 3.38Å; A353-Y357 PolarHBondContact O-N 3.14Å
354	F	62.6	Low	65.6	Low	73 Å²	73	94.6 Å²	94.6	32%	0.32	48%	0.481	S	S	.	.	H	α-helix	trans	-60	-40.3	177.1	-175	-93.2	0	0	0	112.5	D350 C352 V356 G358 H359 W360	D350-F354 WeakPolarHBondContact O-CB 3.38Å; D350-F354 PolarHBondContact O-N 3.07Å; C352-F354 PolarHBondContact O-N 3.13Å; F354-V356 VanDerWaalsContact C-N 3.26Å; F354-V356 PolarHBondContact O-N 2.94Å; F354-G358 WeakPolarHBondContact O-CA 3.47Å; F354-G358 PolarHBondContact O-N 2.95Å; F354-H359 VanDerWaalsContact CD2-C 3.48Å; F354-W360 HydrophobicContact CB-CE3 4.27Å; F354-W360 HydrophobicContact CB-CH2 4.24Å; F354-W360 HydrophobicContact CB-CZ3 4.07Å; F354-W360 HydrophobicContact CD1-CZ2 4.41Å; F354-W360 AromaticContact CD2-CD1 3.87Å; F354-W360 AromaticContact CD2-CD2 3.47Å; F354-W360 HydrophobicContact CD2-CD2 3.47Å; F354-W360 VanDerWaalsContact CD2-CD2 3.47Å; F354-W360 AromaticContact CD2-CE2 3.46Å; F354-W360 VanDerWaalsContact CD2-CE2 3.46Å; F354-W360 AromaticContact CD2-CE3 3.93Å; F354-W360 HydrophobicContact CD2-CE3 3.93Å; F354-W360 AromaticContact CD2-CG 3.75Å; F354-W360 HydrophobicContact CD2-CG 3.75Å; F354-W360 HydrophobicContact CD2-CH2 4.34Å; F354-W360 AromaticContact CD2-CZ2 3.93Å; F354-W360 HydrophobicContact CD2-CZ2 3.93Å; F354-W360 HydrophobicContact CD2-CZ3 4.34Å; F354-W360 AromaticContact CD2-NE1 3.7Å; F354-W360 AromaticContact CE2-CD1 3.49Å; F354-W360 VanDerWaalsContact CE2-CD1 3.49Å; F354-W360 AromaticContact CE2-CD2 3.9Å; F354-W360 HydrophobicContact CE2-CD2 3.9Å; F354-W360 AromaticContact CE2-CE2 3.58Å; F354-W360 AromaticContact CE2-CG 3.86Å; F354-W360 HydrophobicContact CE2-CG 3.86Å; F354-W360 HydrophobicContact CE2-CZ2 4.21Å; F354-W360 AromaticContact CE2-NE1 3.3Å; F354-W360 VanDerWaalsContact CE2-NE1 3.3Å; F354-W360 HydrophobicContact CG-CD2 4.23Å; F354-W360 HydrophobicContact CG-CE3 4.35Å; F354-W360 HydrophobicContact CG-CH2 4.18Å; F354-W360 HydrophobicContact CG-CZ2 4.05Å; F354-W360 HydrophobicContact CG-CZ3 4.33Å; F354-W360 AromaticContact CZ-NE1 3.93Å
355	R	68.6	Low	64.2	Low	215 Å²	215	100 Å²	100	81%	0.811	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-32	177.1	-73.5	179.5	-169.3	178.7	3.3	113.1	G351 C352 A353	G351-R355 WeakPolarHBondContact O-CG 3.19Å; G351-R355 PolarHBondContact O-N 3.47Å; C352-R355 PolarHBondContact O-N 2.69Å; A353-R355 VanDerWaalsContact C-N 3.31Å; A353-R355 PolarHBondContact O-N 3.18Å
356	V	67.2	Low	62.9	Low	106 Å²	106	101.2 Å²	101.2	64%	0.642	53%	0.525	S	S	*	.	H	α-helix	trans	-82.7	-43.6	-179.2	176.1	0	0	0	0	111.3	C352 A353 F354	C352-V356 WeakPolarHBondContact O-CG2 3.42Å; C352-V356 PolarHBondContact O-N 2.89Å; A353-V356 PolarHBondContact O-N 2.86Å; A353-V356 VanDerWaalsContact O-N 3.14Å; F354-V356 VanDerWaalsContact C-N 3.26Å; F354-V356 PolarHBondContact O-N 2.94Å
357	Y	65.3	Low	61.7	Low	123 Å²	123	104.3 Å²	104.3	48%	0.482	54%	0.543	S	S	.	.	H	α-helix	trans	-103.4	-9.7	-169.3	-59.1	-70.3	0	0	0	114.7	A353 H359 L372	A353-Y357 HydrophobicContact CB-CD2 4.37Å; A353-Y357 WeakPolarHBondContact O-CD2 3.38Å; A353-Y357 PolarHBondContact O-N 3.14Å; Y357-H359 PolarHBondContact O-N 2.92Å; Y357-H359 PolarHBondContact O-ND1 3.37Å; Y357-L372 HydrophobicContact CD2-CD2 4.27Å; Y357-L372 HydrophobicContact CE1-CD2 4.19Å; Y357-L372 HydrophobicContact CE2-CD2 3.63Å
358	G	54.9	Low	60.7	Low	58 Å²	58	103 Å²	103	60%	0.598	54%	0.543	S	S	*	.	S	Bend	trans	71.8	4.7	174.4	0	0	0	0	0	115.9	F354	F354-G358 WeakPolarHBondContact O-CA 3.47Å; F354-G358 PolarHBondContact O-N 2.95Å
359	H	58.1	Low	59.5	Low	117 Å²	117	101.8 Å²	101.8	54%	0.542	53%	0.529	S	S	.	.	S	Bend	trans	-145.5	156.4	177.6	63.7	-79.9	0	0	0	112	F354 Y357	F354-H359 VanDerWaalsContact CD2-C 3.48Å; Y357-H359 PolarHBondContact O-N 2.92Å; Y357-H359 PolarHBondContact O-ND1 3.37Å
360	W	58.5	Low	58.2	Low	164 Å²	164	102 Å²	102	62%	0.621	54%	0.537	S	S	*	.			trans	-84	131.6	-179.7	-66.2	104.9	0	0	0	111.8	D350 F354 K362	D350-W360 HydrophobicContact CB-CZ3 4.47Å; F354-W360 HydrophobicContact CB-CE3 4.27Å; F354-W360 HydrophobicContact CB-CH2 4.24Å; F354-W360 HydrophobicContact CB-CZ3 4.07Å; F354-W360 HydrophobicContact CD1-CZ2 4.41Å; F354-W360 AromaticContact CD2-CD1 3.87Å; F354-W360 AromaticContact CD2-CD2 3.47Å; F354-W360 HydrophobicContact CD2-CD2 3.47Å; F354-W360 VanDerWaalsContact CD2-CD2 3.47Å; F354-W360 AromaticContact CD2-CE2 3.46Å; F354-W360 VanDerWaalsContact CD2-CE2 3.46Å; F354-W360 AromaticContact CD2-CE3 3.93Å; F354-W360 HydrophobicContact CD2-CE3 3.93Å; F354-W360 AromaticContact CD2-CG 3.75Å; F354-W360 HydrophobicContact CD2-CG 3.75Å; F354-W360 HydrophobicContact CD2-CH2 4.34Å; F354-W360 AromaticContact CD2-CZ2 3.93Å; F354-W360 HydrophobicContact CD2-CZ2 3.93Å; F354-W360 HydrophobicContact CD2-CZ3 4.34Å; F354-W360 AromaticContact CD2-NE1 3.7Å; F354-W360 AromaticContact CE2-CD1 3.49Å; F354-W360 VanDerWaalsContact CE2-CD1 3.49Å; F354-W360 AromaticContact CE2-CD2 3.9Å; F354-W360 HydrophobicContact CE2-CD2 3.9Å; F354-W360 AromaticContact CE2-CE2 3.58Å; F354-W360 AromaticContact CE2-CG 3.86Å; F354-W360 HydrophobicContact CE2-CG 3.86Å; F354-W360 HydrophobicContact CE2-CZ2 4.21Å; F354-W360 AromaticContact CE2-NE1 3.3Å; F354-W360 VanDerWaalsContact CE2-NE1 3.3Å; F354-W360 HydrophobicContact CG-CD2 4.23Å; F354-W360 HydrophobicContact CG-CE3 4.35Å; F354-W360 HydrophobicContact CG-CH2 4.18Å; F354-W360 HydrophobicContact CG-CZ2 4.05Å; F354-W360 HydrophobicContact CG-CZ3 4.33Å; F354-W360 AromaticContact CZ-NE1 3.93Å; W360-K362 PolarHBondContact O-N 3.49Å; W360-K362 VanDerWaalsContact O-N 3.15Å
361	V	55.3	Low	57.3	Low	43 Å²	43	103 Å²	103	26%	0.261	55%	0.55	S	S	.	.			trans	-76.5	100.9	172.6	-172.9	0	0	0	0	109.2	R369 L372	V361-R369 HydrophobicContact CG1-CG 4.03Å; V361-R369 PolarHBondContact O-NE 2.83Å; V361-R369 PolarHBondContact O-NH2 3.15Å; V361-L372 HydrophobicContact CG2-CD1 3.88Å
362	K	51.4	Low	56.3	Low	181 Å²	181	105.2 Å²	105.2	79%	0.787	56%	0.555	S	S	*	*			trans	-72.6	144.6	178.8	-77.3	-173.3	177.7	178.8	0	111.2	W360 G364	W360-K362 PolarHBondContact O-N 3.49Å; W360-K362 VanDerWaalsContact O-N 3.15Å; K362-G364 PolarHBondContact O-N 3.4Å
363	K	42.4	Very low	55.3	Low	187 Å²	187	108.6 Å²	108.6	81%	0.813	56%	0.562	S	S	*	*			trans	-84.6	102.6	175.7	-156.5	-173.1	-175.6	-165.6	0	107.8
364	G	48.7	Very low	54.6	Low	48 Å²	48	112.3 Å²	112.3	50%	0.495	58%	0.576	S	S	.	*			trans	-130.3	154.1	170.9	0	0	0	0	0	109.8	K362 G366 Q367	K362-G364 PolarHBondContact O-N 3.4Å; G364-G366 PolarHBondContact O-N 3.04Å; G364-Q367 PolarHBondContact O-N 3.41Å; G364-Q367 VanDerWaalsContact O-N 3.13Å
365	E	47.5	Very low	53.8	Low	218 Å²	218	116.7 Å²	116.7	100%	1.019	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-11.7	-166.8	-67.8	-175.4	155.4	0	0	115.8
366	G	50	Low	52.9	Low	79 Å²	79	111.4 Å²	111.4	81%	0.814	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-5	179.5	0	0	0	0	0	116.9	G364	G364-G366 PolarHBondContact O-N 3.04Å
367	Q	53	Low	51.9	Low	150 Å²	150	112.1 Å²	112.1	70%	0.701	60%	0.601	S	S	*	*			trans	-127.6	108.4	-176.2	-79.2	-178.5	-12	0	0	112.3	G364	G364-Q367 PolarHBondContact O-N 3.41Å; G364-Q367 VanDerWaalsContact O-N 3.13Å
368	N	51.7	Low	51	Low	120 Å²	120	114.2 Å²	114.2	64%	0.642	61%	0.608	S	S	*	*			trans	-80.8	131.4	172.8	-171.6	-6.2	0	0	0	109.7	A370 A371	N368-A370 PolarHBondContact O-N 3.16Å; N368-A370 VanDerWaalsContact O-N 3.08Å; N368-A370 PolarHBondContact OD1-N 3.4Å; N368-A371 WeakPolarHBondContact O-CB 3.2Å; N368-A371 PolarHBondContact O-N 2.92Å
369	R	53.6	Low	50.9	Low	63 Å²	63	117 Å²	117	24%	0.238	61%	0.614	C	S	.	*	G	3₁₀ helix	trans	-59.4	-20.4	178.1	-71.4	-177.8	167.7	133.8	-3.1	113.2	Y340 V361 A371	Y340-R369 HydrophobicContact CE1-CB 4.18Å; V361-R369 HydrophobicContact CG1-CG 4.03Å; V361-R369 PolarHBondContact O-NE 2.83Å; V361-R369 PolarHBondContact O-NH2 3.15Å; R369-A371 PolarHBondContact O-N 3.08Å
370	A	50.4	Low	50.6	Low	46 Å²	46	118.5 Å²	118.5	38%	0.38	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-67.7	-17.7	172.1	0	0	0	0	0	114.3	N368 L372 F373	N368-A370 PolarHBondContact O-N 3.16Å; N368-A370 VanDerWaalsContact O-N 3.08Å; N368-A370 PolarHBondContact OD1-N 3.4Å; A370-L372 PolarHBondContact O-N 3.27Å; A370-L372 VanDerWaalsContact O-N 3.16Å; A370-F373 PolarHBondContact O-N 2.88Å
371	A	53.5	Low	50.4	Low	56 Å²	56	116.9 Å²	116.9	46%	0.463	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-64.7	-18.8	-178.3	0	0	0	0	0	113.7	N368 R369 F373	N368-A371 WeakPolarHBondContact O-CB 3.2Å; N368-A371 PolarHBondContact O-N 2.92Å; R369-A371 PolarHBondContact O-N 3.08Å; A371-F373 PolarHBondContact O-N 3.13Å
372	L	51.7	Low	50.2	Low	73 Å²	73	120.5 Å²	120.5	38%	0.382	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-72.6	-13.7	174.3	-95.2	147.4	0	0	0	113.7	Y357 V361 A370	Y357-L372 HydrophobicContact CD2-CD2 4.27Å; Y357-L372 HydrophobicContact CE1-CD2 4.19Å; Y357-L372 HydrophobicContact CE2-CD2 3.63Å; V361-L372 HydrophobicContact CG2-CD1 3.88Å; A370-L372 PolarHBondContact O-N 3.27Å; A370-L372 VanDerWaalsContact O-N 3.16Å
373	F	52.2	Low	50.4	Low	138 Å²	138	114.2 Å²	114.2	61%	0.605	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-113.4	10.1	-178.4	-58.6	-78.4	0	0	0	112.9	A370 A371 N375	A370-F373 PolarHBondContact O-N 2.88Å; A371-F373 PolarHBondContact O-N 3.13Å; F373-N375 PolarHBondContact O-N 2.87Å; F373-N375 VanDerWaalsContact O-N 3.13Å
374	E	49.8	Very low	51	Low	101 Å²	101	110.4 Å²	110.4	47%	0.472	61%	0.607	S	S	.	*			trans	-69.9	103.9	166.3	-73.1	-179	-171.4	0	0	108.3	T376 R378	E374-T376 PolarHBondContact O-N 3.13Å; E374-R378 IonicContact OE2-NE 3.36Å; E374-R378 IonicContact OE2-NH2 3.9Å
375	N	46.5	Very low	51.4	Low	165 Å²	165	115.7 Å²	115.7	88%	0.882	61%	0.613	S	S	*	*	S	Bend	trans	-70.6	27.9	179.7	-83.9	-35.8	0	0	0	114.3	F373	F373-N375 PolarHBondContact O-N 2.87Å; F373-N375 VanDerWaalsContact O-N 3.13Å
376	T	49.7	Very low	52.3	Low	103 Å²	103	109.2 Å²	109.2	63%	0.632	59%	0.585	S	S	*	*	S	Bend	trans	-130.7	114.9	172.2	30.1	0	0	0	0	108.6	E374 R378	E374-T376 PolarHBondContact O-N 3.13Å; T376-R378 PolarHBondContact O-N 3.05Å; T376-R378 VanDerWaalsContact O-N 3.16Å
377	P	45.3	Very low	52.9	Low	122 Å²	122	110.5 Å²	110.5	79%	0.792	57%	0.573	S	S	*	*			trans	-59.5	122.4	173.6	21.7	-28.5	0	0	0	108.8	T379	P377-T379 PolarHBondContact O-N 3.16Å
378	R	46.4	Very low	53.1	Low	166 Å²	166	109.2 Å²	109.2	63%	0.626	57%	0.571	S	S	*	*			trans	-64.4	111.3	170	-75.8	-169.4	-178.6	-164.9	0.5	108.1	E374 T376 E380 L381	E374-R378 IonicContact OE2-NE 3.36Å; E374-R378 IonicContact OE2-NH2 3.9Å; T376-R378 PolarHBondContact O-N 3.05Å; T376-R378 VanDerWaalsContact O-N 3.16Å; R378-E380 PolarHBondContact O-N 2.91Å; R378-L381 PolarHBondContact O-N 3.17Å; R378-L381 VanDerWaalsContact O-N 3.14Å
379	T	52.3	Low	53.3	Low	118 Å²	118	109.4 Å²	109.4	72%	0.724	57%	0.572	S	S	*	*	H	α-helix	trans	-53.5	-24.3	-176.1	-9.2	0	0	0	0	113.4	P377 H382 A383	P377-T379 PolarHBondContact O-N 3.16Å; T379-H382 PolarHBondContact O-N 3.44Å; T379-A383 PolarHBondContact O-N 3.16Å; T379-A383 VanDerWaalsContact O-N 3.15Å
380	E	53.6	Low	53.4	Low	148 Å²	148	110.4 Å²	110.4	69%	0.692	59%	0.588	S	S	*	*	H	α-helix	trans	-66.5	-35.8	179.9	-68.5	177.7	167.9	0	0	113.5	R378 A383 L384	R378-E380 PolarHBondContact O-N 2.91Å; E380-A383 PolarHBondContact O-N 3.15Å; E380-L384 PolarHBondContact O-N 2.97Å; E380-L384 VanDerWaalsContact O-N 3.08Å
381	L	52.7	Low	53.2	Low	130 Å²	130	122.3 Å²	122.3	68%	0.681	62%	0.623	S	S	*	*	H	α-helix	trans	-73.6	-32.6	178.4	-98.1	153.3	0	0	0	112.1	R378 Y385	R378-L381 PolarHBondContact O-N 3.17Å; R378-L381 VanDerWaalsContact O-N 3.14Å; L381-Y385 WeakPolarHBondContact O-CB 3.47Å; L381-Y385 PolarHBondContact O-N 3.15Å
382	H	51.2	Low	53.1	Low	119 Å²	119	125.7 Å²	125.7	55%	0.551	63%	0.631	S	S	*	*	H	α-helix	trans	-66.2	-42.6	172.8	-176.3	-92.6	0	0	0	111.2	T379 Y385 I386	T379-H382 PolarHBondContact O-N 3.44Å; H382-Y385 PolarHBondContact O-N 3.42Å; H382-I386 VanDerWaalsContact CE1-CD1 3.45Å; H382-I386 WeakPolarHBondContact CE1-CD1 3.32Å; H382-I386 WeakPolarHBondContact O-CB 3.46Å; H382-I386 VanDerWaalsContact O-CG1 3.25Å; H382-I386 WeakPolarHBondContact O-CG1 3.45Å; H382-I386 PolarHBondContact O-N 3.19Å
383	A	55.4	Low	53.2	Low	49 Å²	49	128.4 Å²	128.4	41%	0.405	64%	0.644	S	S	.	*	H	α-helix	trans	-64.1	-39.8	176.4	0	0	0	0	0	112.6	T379 E380 N387	T379-A383 PolarHBondContact O-N 3.16Å; T379-A383 VanDerWaalsContact O-N 3.15Å; E380-A383 PolarHBondContact O-N 3.15Å; A383-N387 VanDerWaalsContact O-CB 3.25Å; A383-N387 WeakPolarHBondContact O-CB 3.25Å; A383-N387 VanDerWaalsContact O-CG 3.31Å; A383-N387 PolarHBondContact O-N 2.68Å; A383-N387 PolarHBondContact O-ND2 3.31Å
384	L	55.1	Low	53.3	Low	106 Å²	106	127.9 Å²	127.9	56%	0.555	65%	0.646	S	S	*	*	H	α-helix	trans	-66.4	-38.8	174	-92.5	153.6	0	0	0	112.8	E380 N388	E380-L384 PolarHBondContact O-N 2.97Å; E380-L384 VanDerWaalsContact O-N 3.08Å; L384-N388 WeakPolarHBondContact O-CB 3.25Å; L384-N388 PolarHBondContact O-N 3.44Å; L384-N388 VanDerWaalsContact O-N 3.15Å; L384-N388 PolarHBondContact O-ND2 3.25Å; L384-N388 VanDerWaalsContact O-ND2 3.16Å
385	Y	58.6	Low	53.5	Low	160 Å²	160	129.5 Å²	129.5	63%	0.627	66%	0.657	S	S	*	*	H	α-helix	trans	-70.6	-43.5	178.7	-165.7	-101.4	0	0	0	112	L381 H382 N388 L389	L381-Y385 WeakPolarHBondContact O-CB 3.47Å; L381-Y385 PolarHBondContact O-N 3.15Å; H382-Y385 PolarHBondContact O-N 3.42Å; Y385-N388 PolarHBondContact O-N 3.14Å; Y385-L389 HydrophobicContact CD1-CD1 3.61Å; Y385-L389 HydrophobicContact CE1-CD1 3.35Å; Y385-L389 HydrophobicContact CG-CD1 4.44Å; Y385-L389 PolarHBondContact O-N 3.01Å; Y385-L389 VanDerWaalsContact O-N 3.17Å
386	I	65.2	Low	53.9	Low	81 Å²	81	127.3 Å²	127.3	42%	0.415	64%	0.643	S	S	.	*	H	α-helix	trans	-65.8	-42.3	175.8	-64.2	-123.3	0	0	0	110.9	H382 N388 L389 S390	H382-I386 VanDerWaalsContact CE1-CD1 3.45Å; H382-I386 WeakPolarHBondContact CE1-CD1 3.32Å; H382-I386 WeakPolarHBondContact O-CB 3.46Å; H382-I386 VanDerWaalsContact O-CG1 3.25Å; H382-I386 WeakPolarHBondContact O-CG1 3.45Å; H382-I386 PolarHBondContact O-N 3.19Å; I386-N388 VanDerWaalsContact C-N 3.32Å; I386-N388 PolarHBondContact O-N 3.48Å; I386-L389 PolarHBondContact O-N 2.99Å; I386-S390 PolarHBondContact O-N 3.39Å; I386-S390 PolarHBondContact O-OG 3.32Å
387	N	62.3	Low	54.2	Low	107 Å²	107	128.9 Å²	128.9	57%	0.572	64%	0.643	S	S	*	*	H	α-helix	trans	-66.6	-30.9	179.3	-80.6	-23.7	0	0	0	113.4	A383 S390	A383-N387 VanDerWaalsContact O-CB 3.25Å; A383-N387 WeakPolarHBondContact O-CB 3.25Å; A383-N387 VanDerWaalsContact O-CG 3.31Å; A383-N387 PolarHBondContact O-N 2.68Å; A383-N387 PolarHBondContact O-ND2 3.31Å; N387-S390 PolarHBondContact O-N 3.08Å
388	N	57.6	Low	54.8	Low	123 Å²	123	129.4 Å²	129.4	66%	0.658	63%	0.633	S	S	*	*	H	α-helix	trans	-80.9	-19.5	175.7	-78.4	-34.8	0	0	0	113.9	L384 Y385 I386 S390	L384-N388 WeakPolarHBondContact O-CB 3.25Å; L384-N388 PolarHBondContact O-N 3.44Å; L384-N388 VanDerWaalsContact O-N 3.15Å; L384-N388 PolarHBondContact O-ND2 3.25Å; L384-N388 VanDerWaalsContact O-ND2 3.16Å; Y385-N388 PolarHBondContact O-N 3.14Å; I386-N388 VanDerWaalsContact C-N 3.32Å; I386-N388 PolarHBondContact O-N 3.48Å; N388-S390 VanDerWaalsContact C-N 3.32Å
389	L	55.6	Low	55.5	Low	124 Å²	124	126.5 Å²	126.5	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-83.3	-12.9	170.2	-81	159.6	0	0	0	112.7	Y385 I386	Y385-L389 HydrophobicContact CD1-CD1 3.61Å; Y385-L389 HydrophobicContact CE1-CD1 3.35Å; Y385-L389 HydrophobicContact CG-CD1 4.44Å; Y385-L389 PolarHBondContact O-N 3.01Å; Y385-L389 VanDerWaalsContact O-N 3.17Å; I386-L389 PolarHBondContact O-N 2.99Å
390	S	56.6	Low	55.7	Low	83 Å²	83	127.3 Å²	127.3	58%	0.58	63%	0.626	S	S	*	*			trans	-100.1	13.2	-178.1	-46.8	0	0	0	0	113.9	I386 N387 N388	I386-S390 PolarHBondContact O-N 3.39Å; I386-S390 PolarHBondContact O-OG 3.32Å; N387-S390 PolarHBondContact O-N 3.08Å; N388-S390 VanDerWaalsContact C-N 3.32Å
391	R	44.9	Very low	55.9	Low	297 Å²	297	125.4 Å²	125.4	100%	1.121	62%	0.62	S	S	*	*			trans	-133.3	0	174.5	-88.6	-169.8	175.9	-172.2	-0.2	112.2

Retrieved 391 of 391 residues in 553.7 ms (Link to these results)

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