A0A077ZQI3_TRITR Loading...

Plastid ribosomal protein L11

AlphaFold DB , UniProt , Accession A0A077ZQI3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 663 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	38	Very low	40.3	Very low	243 Å²	243	148.5 Å²	148.5	100%	1.197	82%	0.822	S	S	*	*				0	114.8	0	-79.9	177.3	174.2	0	0	108	S3	M1-S3 PolarHBondContact O-N 2.9Å; M1-S3 VanDerWaalsContact O-N 3.1Å
2	V	37.7	Very low	40.7	Very low	150 Å²	150	147.8 Å²	147.8	91%	0.909	83%	0.83	S	S	*	*			trans	-74.9	97.7	172	-178.1	0	0	0	0	106.5	S4	V2-S4 PolarHBondContact O-N 3.45Å; V2-S4 VanDerWaalsContact O-N 3.09Å
3	S	42.6	Very low	41.5	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	81%	0.808	S	S	*	*			trans	-72	99.4	174.7	179	0	0	0	0	108.1	M1 V5	M1-S3 PolarHBondContact O-N 2.9Å; M1-S3 VanDerWaalsContact O-N 3.1Å; S3-V5 PolarHBondContact O-N 2.95Å; S3-V5 VanDerWaalsContact O-N 3.13Å
4	S	38.3	Very low	42.6	Very low	95 Å²	95	136.9 Å²	136.9	66%	0.664	79%	0.79	S	S	*	*			trans	-60.5	112.7	171.3	45.9	0	0	0	0	109.2	V2 T6	V2-S4 PolarHBondContact O-N 3.45Å; V2-S4 VanDerWaalsContact O-N 3.09Å; S4-T6 VanDerWaalsContact C-N 3.31Å; S4-T6 PolarHBondContact O-N 2.67Å
5	V	43.4	Very low	44.5	Very low	127 Å²	127	135.7 Å²	135.7	77%	0.77	78%	0.779	S	S	*	*			trans	-66	96.4	169.9	178.3	0	0	0	0	106.7	S3 V7	S3-V5 PolarHBondContact O-N 2.95Å; S3-V5 VanDerWaalsContact O-N 3.13Å; V5-V7 PolarHBondContact O-N 3.33Å
6	T	36.6	Very low	46.8	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	76%	0.758	S	S	*	*			trans	-69.5	102.8	168.1	-60.9	0	0	0	0	105.8	S4 G8	S4-T6 VanDerWaalsContact C-N 3.31Å; S4-T6 PolarHBondContact O-N 2.67Å; T6-G8 VanDerWaalsContact C-N 3.34Å; T6-G8 PolarHBondContact O-N 2.78Å
7	V	40.7	Very low	49	Very low	126 Å²	126	133.6 Å²	133.6	76%	0.764	75%	0.751	S	S	*	*			trans	-58.2	101.7	170.5	179.2	0	0	0	0	106.2	V5 R9	V5-V7 PolarHBondContact O-N 3.33Å; V7-R9 PolarHBondContact O-N 3.28Å
8	G	39.3	Very low	51.3	Low	60 Å²	60	130.1 Å²	130.1	62%	0.619	73%	0.73	S	S	*	*			trans	-53.3	117.9	177.4	0	0	0	0	0	108.3	T6 L10	T6-G8 VanDerWaalsContact C-N 3.34Å; T6-G8 PolarHBondContact O-N 2.78Å; G8-L10 PolarHBondContact O-N 3.24Å
9	R	39.1	Very low	53.3	Low	243 Å²	243	125.8 Å²	125.8	92%	0.917	70%	0.703	S	S	*	*			trans	-48.6	120	168.5	-74.8	179.8	174	177.9	-2.3	107	V7 K11	V7-R9 PolarHBondContact O-N 3.28Å; R9-K11 PolarHBondContact O-N 3.41Å
10	L	41.4	Very low	55.2	Low	170 Å²	170	122.6 Å²	122.6	89%	0.89	69%	0.686	S	S	*	*			trans	-42.6	118.3	168.8	-80.8	145.7	0	0	0	107.2	G8	G8-L10 PolarHBondContact O-N 3.24Å
11	K	46.5	Very low	56.9	Low	192 Å²	192	120 Å²	120	84%	0.835	67%	0.673	S	S	*	*			trans	-48.5	135.2	168.2	-84.5	-178.1	174.5	178.3	0	106.6	R9 G13	R9-K11 PolarHBondContact O-N 3.41Å; K11-G13 PolarHBondContact O-N 3.11Å
12	P	44.5	Very low	59.3	Low	140 Å²	140	114.9 Å²	114.9	91%	0.909	65%	0.646	S	S	*	*			trans	-62.7	91	177	24.7	-30.2	0	0	0	107.5
13	G	50.9	Low	61.7	Low	53 Å²	53	111.9 Å²	111.9	55%	0.546	62%	0.624	S	S	.	*			trans	-93.9	118.8	-172.3	0	0	0	0	0	108.5	K11	K11-G13 PolarHBondContact O-N 3.11Å
14	T	57.9	Low	63.9	Low	91 Å²	91	114.7 Å²	114.7	56%	0.558	63%	0.631	S	S	*	*			trans	38.5	92.3	156.6	-36.6	0	0	0	0	115.2	M16 D42	T14-M16 PolarHBondContact O-N 2.84Å; T14-M16 VanDerWaalsContact O-N 3.09Å; T14-D42 VanDerWaalsContact CA-OD2 3.31Å; T14-D42 WeakPolarHBondContact CA-OD2 3.44Å
15	N	70	Confident	66.3	Low	118 Å²	118	113 Å²	113	63%	0.631	63%	0.63	S	S	*	*			trans	-76.2	100.9	177.9	-82.1	-32	0	0	0	109.6	D42	N15-D42 PolarHBondContact N-OD2 3.16Å
16	M	81.4	Confident	68.4	Low	90 Å²	90	113.6 Å²	113.6	44%	0.443	62%	0.621	S	S	.	*			trans	-73.2	127	165.1	-68.1	-175.9	-62	0	0	109.4	T14 Y39 V40 H41	T14-M16 PolarHBondContact O-N 2.84Å; T14-M16 VanDerWaalsContact O-N 3.09Å; M16-Y39 HydrophobicContact CB-CD1 4.03Å; M16-Y39 HydrophobicContact CB-CG 4.49Å; M16-V40 WeakPolarHBondContact CA-O 3.39Å; M16-H41 WeakPolarHBondContact CG-ND1 3.46Å; M16-H41 PolarHBondContact SD-CE1 3.22Å
17	K	85	Confident	70.9	Confident	147 Å²	147	114.5 Å²	114.5	64%	0.639	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.8	135.5	174.6	-69.3	-176.5	-179.1	176.6	0	110.6	K19 Y39 V40	K17-K19 PolarHBondContact O-N 3.02Å; K17-Y39 CarbonylContact O-C 3.52Å; K17-Y39 VanDerWaalsContact O-CA 3.29Å; K17-Y39 WeakPolarHBondContact O-CA 3.41Å; K17-V40 PolarHBondContact N-O 2.88Å; K17-V40 PolarHBondContact O-N 3.07Å
18	L	89.5	Confident	73.2	Confident	70 Å²	70	114 Å²	114	37%	0.366	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.6	125.7	174	-177	68	0	0	0	109.3	T20 A29 P37 Y39	L18-T20 HydrophobicContact CD2-CG2 4.12Å; L18-T20 HydrophobicContact CG-CG2 4.11Å; L18-T20 PolarHBondContact O-N 3.31Å; L18-A29 HydrophobicContact CD1-CB 4.05Å; L18-A29 HydrophobicContact CD2-CB 4.12Å; L18-A29 HydrophobicContact CG-CB 4.28Å; L18-P37 HydrophobicContact CD1-CB 3.79Å; L18-Y39 HydrophobicContact CB-CD1 4.27Å; L18-Y39 HydrophobicContact CB-CE1 3.88Å; L18-Y39 HydrophobicContact CD1-CD2 4.15Å; L18-Y39 HydrophobicContact CD1-CE1 4.24Å; L18-Y39 HydrophobicContact CD1-CE2 3.67Å
19	K	90.7	Very high	75.6	Confident	48 Å²	48	113.3 Å²	113.3	21%	0.209	59%	0.591	C	S	.	*			trans	-73.5	119.5	174.4	-165	179.1	-177.6	-162.7	0	108.3	K17 E30 V38 V40 E46	K17-K19 PolarHBondContact O-N 3.02Å; K19-E30 HydrophobicContact CB-CB 4.36Å; K19-E30 HydrophobicContact CD-CB 4.25Å; K19-E30 WeakPolarHBondContact CD-OE2 3.33Å; K19-E30 WeakPolarHBondContact CE-OE2 3.41Å; K19-E30 HydrophobicContact CG-CB 4.27Å; K19-E30 VanDerWaalsContact NZ-CD 3.25Å; K19-E30 IonicContact NZ-OE1 2.76Å; K19-E30 PolarHBondContact NZ-OE1 2.8Å; K19-E30 IonicContact NZ-OE2 2.87Å; K19-E30 PolarHBondContact NZ-OE2 3.48Å; K19-E30 PolarHBondContact O-N 3.25Å; K19-V38 HydrophobicContact CB-CB 4.1Å; K19-V38 HydrophobicContact CB-CG1 4.09Å; K19-V38 WeakPolarHBondContact CB-O 3.33Å; K19-V38 HydrophobicContact CD-CB 4.39Å; K19-V38 HydrophobicContact CD-CG1 3.93Å; K19-V38 PolarHBondContact N-O 3.15Å; K19-V40 HydrophobicContact CB-CG2 3.95Å; K19-V40 HydrophobicContact CD-CG2 4.33Å; K19-V40 HydrophobicContact CG-CG2 4.13Å; K19-E46 WeakPolarHBondContact CE-OE1 3.5Å; K19-E46 IonicContact NZ-OE1 3.03Å; K19-E46 PolarHBondContact NZ-OE1 3.08Å; K19-E46 IonicContact NZ-OE2 2.86Å; K19-E46 PolarHBondContact NZ-OE2 3.31Å
20	T	91.1	Very high	78.1	Confident	62 Å²	62	105.3 Å²	105.3	38%	0.38	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.6	148.1	-178.4	60	0	0	0	0	111.8	L18 Y28	L18-T20 HydrophobicContact CD2-CG2 4.12Å; L18-T20 HydrophobicContact CG-CG2 4.11Å; L18-T20 PolarHBondContact O-N 3.31Å; T20-Y28 CarbonylContact C-O 3.47Å; T20-Y28 WeakPolarHBondContact CA-O 3.42Å; T20-Y28 WeakPolarHBondContact CB-O 3.32Å
21	V	90.7	Very high	80.5	Confident	68 Å²	68	102.3 Å²	102.3	41%	0.412	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.8	169.5	65.3	0	0	0	0	108.9	I23 Q27 Y28	V21-I23 HydrophobicContact CG1-CD1 4.27Å; V21-I23 HydrophobicContact CG1-CG1 4.43Å; V21-I23 HydrophobicContact CG2-CG1 4.39Å; V21-Q27 WeakPolarHBondContact O-CA 3.49Å; V21-Y28 PolarHBondContact N-O 3.38Å; V21-Y28 PolarHBondContact O-N 3.38Å
22	E	88.9	Confident	82.5	Confident	135 Å²	135	95.5 Å²	95.5	63%	0.631	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.7	176.9	-168.6	177.3	160.8	0	0	110.3	K26	E22-K26 WeakPolarHBondContact CA-O 2.96Å
23	I	87.2	Confident	84.6	Confident	87 Å²	87	96.4 Å²	96.4	45%	0.446	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121.6	175.6	-55.9	175.1	0	0	0	107.5	V21 G25 K26 Y28	V21-I23 HydrophobicContact CG1-CD1 4.27Å; V21-I23 HydrophobicContact CG1-CG1 4.43Å; V21-I23 HydrophobicContact CG2-CG1 4.39Å; I23-G25 VanDerWaalsContact C-N 3.28Å; I23-G25 PolarHBondContact O-N 2.99Å; I23-K26 PolarHBondContact N-O 3.08Å; I23-K26 PolarHBondContact O-N 3.18Å; I23-Y28 HydrophobicContact CB-CD2 4.04Å; I23-Y28 HydrophobicContact CB-CE2 3.95Å; I23-Y28 HydrophobicContact CD1-CD2 4.4Å; I23-Y28 HydrophobicContact CG1-CD2 4.33Å
24	N	88.8	Confident	86.4	Confident	164 Å²	164	97.5 Å²	97.5	88%	0.877	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	40.4	179.4	-60.8	-28.4	0	0	0	114.1	K26	N24-K26 VanDerWaalsContact C-N 3.28Å; N24-K26 PolarHBondContact O-N 3.5Å
25	G	88.2	Confident	87.9	Confident	61 Å²	61	95.2 Å²	95.2	63%	0.629	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	6.6	179.5	0	0	0	0	0	115.2	I23	I23-G25 VanDerWaalsContact C-N 3.28Å; I23-G25 PolarHBondContact O-N 2.99Å
26	K	87.3	Confident	88.9	Confident	138 Å²	138	91.7 Å²	91.7	60%	0.6	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.5	174	-70.6	-176.9	-179.9	-179.1	0	110.4	E22 I23 N24 Y28	E22-K26 WeakPolarHBondContact CA-O 2.96Å; I23-K26 PolarHBondContact N-O 3.08Å; I23-K26 PolarHBondContact O-N 3.18Å; N24-K26 VanDerWaalsContact C-N 3.28Å; N24-K26 PolarHBondContact O-N 3.5Å; K26-Y28 HydrophobicContact CB-CD2 4.35Å; K26-Y28 HydrophobicContact CB-CE2 3.55Å; K26-Y28 WeakPolarHBondContact O-CD2 3.36Å; K26-Y28 WeakPolarHBondContact O-CE2 3.47Å
27	Q	90.1	Very high	89.4	Confident	142 Å²	142	89.6 Å²	89.6	66%	0.664	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.8	174.6	-67.1	-174.5	0.8	0	0	110.3	V21	V21-Q27 WeakPolarHBondContact O-CA 3.49Å
28	Y	88.9	Confident	89.7	Confident	114 Å²	114	82.9 Å²	82.9	45%	0.447	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141.5	177	-64.7	-90.3	0	0	0	109.1	T20 V21 I23 K26	T20-Y28 CarbonylContact C-O 3.47Å; T20-Y28 WeakPolarHBondContact CA-O 3.42Å; T20-Y28 WeakPolarHBondContact CB-O 3.32Å; V21-Y28 PolarHBondContact N-O 3.38Å; V21-Y28 PolarHBondContact O-N 3.38Å; I23-Y28 HydrophobicContact CB-CD2 4.04Å; I23-Y28 HydrophobicContact CB-CE2 3.95Å; I23-Y28 HydrophobicContact CD1-CD2 4.4Å; I23-Y28 HydrophobicContact CG1-CD2 4.33Å; K26-Y28 HydrophobicContact CB-CD2 4.35Å; K26-Y28 HydrophobicContact CB-CE2 3.55Å; K26-Y28 WeakPolarHBondContact O-CD2 3.36Å; K26-Y28 WeakPolarHBondContact O-CE2 3.47Å
29	A	89.7	Confident	89.8	Confident	46 Å²	46	82.6 Å²	82.6	38%	0.38	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	135.2	172.7	0	0	0	0	0	110.1	L18 P37	L18-A29 HydrophobicContact CD1-CB 4.05Å; L18-A29 HydrophobicContact CD2-CB 4.12Å; L18-A29 HydrophobicContact CG-CB 4.28Å; A29-P37 HydrophobicContact CB-CB 4.41Å
30	E	91	Very high	89.7	Confident	75 Å²	75	82.3 Å²	82.3	35%	0.35	46%	0.464	S	S	.	.			trans	-73.9	135.6	166.3	-164.9	172.8	148.6	0	0	108.6	K19 V38	K19-E30 HydrophobicContact CB-CB 4.36Å; K19-E30 HydrophobicContact CD-CB 4.25Å; K19-E30 WeakPolarHBondContact CD-OE2 3.33Å; K19-E30 WeakPolarHBondContact CE-OE2 3.41Å; K19-E30 HydrophobicContact CG-CB 4.27Å; K19-E30 VanDerWaalsContact NZ-CD 3.25Å; K19-E30 IonicContact NZ-OE1 2.76Å; K19-E30 PolarHBondContact NZ-OE1 2.8Å; K19-E30 IonicContact NZ-OE2 2.87Å; K19-E30 PolarHBondContact NZ-OE2 3.48Å; K19-E30 PolarHBondContact O-N 3.25Å; E30-V38 PolarHBondContact O-N 3.27Å
31	I	91.2	Very high	89.3	Confident	108 Å²	108	81.7 Å²	81.7	55%	0.554	46%	0.457	S	S	*	.	B	Isolated β-bridge	trans	-107.6	143.1	176.6	58.4	174.7	0	0	0	109.6	L36	I31-L36 CarbonylContact C-O 3.55Å; I31-L36 VanDerWaalsContact CA-O 3.25Å; I31-L36 WeakPolarHBondContact CA-O 3.44Å
32	D	89.7	Confident	88.9	Confident	49 Å²	49	83.7 Å²	83.7	26%	0.262	47%	0.466	S	S	.	.			trans	-75.9	-179.1	173.4	71	6.2	0	0	0	111.9	A34 G35 L36 V38 G48	D32-A34 PolarHBondContact O-N 3.26Å; D32-A34 VanDerWaalsContact O-N 3.11Å; D32-A34 VanDerWaalsContact OD1-CA 3.31Å; D32-A34 WeakPolarHBondContact OD1-CA 3.41Å; D32-A34 WeakPolarHBondContact OD1-CB 3.21Å; D32-A34 PolarHBondContact OD1-N 3.28Å; D32-G35 PolarHBondContact O-N 2.8Å; D32-G35 PolarHBondContact OD1-N 2.82Å; D32-L36 PolarHBondContact N-O 2.99Å; D32-L36 PolarHBondContact OD1-N 2.98Å; D32-V38 HydrophobicContact CB-CG2 3.89Å; D32-G48 WeakPolarHBondContact OD2-CA 3.06Å
33	T	88	Confident	88.7	Confident	159 Å²	159	82 Å²	82	98%	0.975	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.1	177.6	51.9	0	0	0	0	114
34	A	88.4	Confident	88.4	Confident	75 Å²	75	80.3 Å²	80.3	62%	0.62	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-2.5	175	0	0	0	0	0	112.7	D32 L36	D32-A34 PolarHBondContact O-N 3.26Å; D32-A34 VanDerWaalsContact O-N 3.11Å; D32-A34 VanDerWaalsContact OD1-CA 3.31Å; D32-A34 WeakPolarHBondContact OD1-CA 3.41Å; D32-A34 WeakPolarHBondContact OD1-CB 3.21Å; D32-A34 PolarHBondContact OD1-N 3.28Å; A34-L36 HydrophobicContact CB-CG 4.35Å
35	G	90	Very high	88.3	Confident	44 Å²	44	79 Å²	79	45%	0.454	45%	0.451	S	S	.	.	S	Bend	trans	82.8	14.7	-178.5	0	0	0	0	0	114.2	D32	D32-G35 PolarHBondContact O-N 2.8Å; D32-G35 PolarHBondContact OD1-N 2.82Å
36	L	91.5	Very high	88.4	Confident	44 Å²	44	81.1 Å²	81.1	23%	0.23	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-91.1	139.2	-179.9	-60.1	177.4	0	0	0	111.1	I31 D32 A34 V38 D50	I31-L36 CarbonylContact C-O 3.55Å; I31-L36 VanDerWaalsContact CA-O 3.25Å; I31-L36 WeakPolarHBondContact CA-O 3.44Å; D32-L36 PolarHBondContact N-O 2.99Å; D32-L36 PolarHBondContact OD1-N 2.98Å; A34-L36 HydrophobicContact CB-CG 4.35Å; L36-V38 PolarHBondContact O-N 3.29Å; L36-D50 HydrophobicContact CD1-CB 3.97Å; L36-D50 HydrophobicContact CD2-CB 4.07Å
37	P	92.1	Very high	88.5	Confident	46 Å²	46	78.8 Å²	78.8	30%	0.299	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-58.7	127.2	173.6	-21.4	32	0	0	0	111.4	L18 A29 Y39 F49	L18-P37 HydrophobicContact CD1-CB 3.79Å; A29-P37 HydrophobicContact CB-CB 4.41Å; P37-Y39 HydrophobicContact CB-CE2 4.29Å; P37-Y39 WeakPolarHBondContact O-CD2 3.47Å; P37-F49 PolarHBondContact O-N 2.92Å
38	V	91.7	Very high	88.4	Confident	6 Å²	6	73 Å²	73	4%	0.036	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.3	-176.9	179.2	0	0	0	0	110.3	K19 E30 D32 L36 E46 I47	K19-V38 HydrophobicContact CB-CB 4.1Å; K19-V38 HydrophobicContact CB-CG1 4.09Å; K19-V38 WeakPolarHBondContact CB-O 3.33Å; K19-V38 HydrophobicContact CD-CB 4.39Å; K19-V38 HydrophobicContact CD-CG1 3.93Å; K19-V38 PolarHBondContact N-O 3.15Å; E30-V38 PolarHBondContact O-N 3.27Å; D32-V38 HydrophobicContact CB-CG2 3.89Å; L36-V38 PolarHBondContact O-N 3.29Å; V38-E46 HydrophobicContact CG1-CB 3.7Å; V38-E46 HydrophobicContact CG1-CG 4.13Å; V38-I47 CarbonylContact C-O 3.58Å; V38-I47 WeakPolarHBondContact CA-O 3.34Å
39	Y	91.4	Very high	88.5	Confident	63 Å²	63	71.3 Å²	71.3	25%	0.247	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138.1	170.2	-74.7	-102.4	0	0	0	110.3	M16 K17 L18 P37 E46 I47 F49	M16-Y39 HydrophobicContact CB-CD1 4.03Å; M16-Y39 HydrophobicContact CB-CG 4.49Å; K17-Y39 CarbonylContact O-C 3.52Å; K17-Y39 VanDerWaalsContact O-CA 3.29Å; K17-Y39 WeakPolarHBondContact O-CA 3.41Å; L18-Y39 HydrophobicContact CB-CD1 4.27Å; L18-Y39 HydrophobicContact CB-CE1 3.88Å; L18-Y39 HydrophobicContact CD1-CD2 4.15Å; L18-Y39 HydrophobicContact CD1-CE1 4.24Å; L18-Y39 HydrophobicContact CD1-CE2 3.67Å; P37-Y39 HydrophobicContact CB-CE2 4.29Å; P37-Y39 WeakPolarHBondContact O-CD2 3.47Å; Y39-E46 WeakPolarHBondContact O-CA 3.09Å; Y39-I47 PolarHBondContact N-O 2.79Å; Y39-I47 PolarHBondContact O-N 3.47Å; Y39-F49 HydrophobicContact CD2-CB 3.43Å; Y39-F49 VanDerWaalsContact CD2-CB 3.43Å; Y39-F49 HydrophobicContact CD2-CG 4.26Å; Y39-F49 HydrophobicContact CE2-CB 3.52Å; Y39-F49 HydrophobicContact CE2-CD1 4.14Å; Y39-F49 HydrophobicContact CE2-CG 4.04Å
40	V	87.8	Confident	88.6	Confident	42 Å²	42	71.8 Å²	71.8	26%	0.255	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122	174.4	-167.5	0	0	0	0	108.4	M16 K17 K19 K45 E46	M16-V40 WeakPolarHBondContact CA-O 3.39Å; K17-V40 PolarHBondContact N-O 2.88Å; K17-V40 PolarHBondContact O-N 3.07Å; K19-V40 HydrophobicContact CB-CG2 3.95Å; K19-V40 HydrophobicContact CD-CG2 4.33Å; K19-V40 HydrophobicContact CG-CG2 4.13Å; V40-K45 WeakPolarHBondContact CA-O 3.35Å; V40-E46 HydrophobicContact CG2-CG 4.29Å
41	H	83.6	Confident	88.4	Confident	50 Å²	50	70.4 Å²	70.4	23%	0.231	41%	0.409	C	S	.	.			trans	-74.8	163.2	170.7	-77.4	-84.7	0	0	0	111.7	M16 D43 G44 K45 I47	M16-H41 WeakPolarHBondContact CG-ND1 3.46Å; M16-H41 PolarHBondContact SD-CE1 3.22Å; H41-D43 WeakPolarHBondContact CB-OD1 3.4Å; H41-D43 PolarHBondContact O-N 2.85Å; H41-D43 VanDerWaalsContact O-N 3.11Å; H41-G44 PolarHBondContact O-N 3.13Å; H41-K45 PolarHBondContact N-O 3.39Å; H41-I47 WeakPolarHBondContact NE2-CG2 3.34Å
42	D	81.5	Confident	88.3	Confident	110 Å²	110	70 Å²	70	59%	0.588	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.5	174.4	-69.3	-40.4	0	0	0	113.2	T14 N15 G44	T14-D42 VanDerWaalsContact CA-OD2 3.31Å; T14-D42 WeakPolarHBondContact CA-OD2 3.44Å; N15-D42 PolarHBondContact N-OD2 3.16Å; D42-G44 VanDerWaalsContact C-N 3.28Å
43	D	83.6	Confident	88.2	Confident	100 Å²	100	73.1 Å²	73.1	54%	0.535	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	6.3	174.9	72.6	-14	0	0	0	113.7	H41 K45	H41-D43 WeakPolarHBondContact CB-OD1 3.4Å; H41-D43 PolarHBondContact O-N 2.85Å; H41-D43 VanDerWaalsContact O-N 3.11Å; D43-K45 VanDerWaalsContact C-N 3.25Å; D43-K45 PolarHBondContact O-N 2.99Å; D43-K45 WeakPolarHBondContact OD1-CB 3.49Å; D43-K45 WeakPolarHBondContact OD1-CG 3.42Å; D43-K45 PolarHBondContact OD1-N 2.89Å; D43-K45 VanDerWaalsContact OD1-N 3.12Å; D43-K45 WeakPolarHBondContact OD2-CD 3.45Å; D43-K45 WeakPolarHBondContact OD2-CE 3.46Å; D43-K45 IonicContact OD2-NZ 2.65Å; D43-K45 PolarHBondContact OD2-NZ 3.02Å
44	G	82.2	Confident	88.3	Confident	51 Å²	51	66.7 Å²	66.7	53%	0.526	39%	0.392	S	S	.	.	S	Bend	trans	78.3	1	-179.1	0	0	0	0	0	114.5	H41 D42	H41-G44 PolarHBondContact O-N 3.13Å; D42-G44 VanDerWaalsContact C-N 3.28Å
45	K	87.1	Confident	88.5	Confident	136 Å²	136	67.2 Å²	67.2	59%	0.591	39%	0.388	S	S	*	.			trans	-72.8	135.9	175.8	-68.9	-171.4	-172	114.6	0	111.2	V40 H41 D43	V40-K45 WeakPolarHBondContact CA-O 3.35Å; H41-K45 PolarHBondContact N-O 3.39Å; D43-K45 VanDerWaalsContact C-N 3.25Å; D43-K45 PolarHBondContact O-N 2.99Å; D43-K45 WeakPolarHBondContact OD1-CB 3.49Å; D43-K45 WeakPolarHBondContact OD1-CG 3.42Å; D43-K45 PolarHBondContact OD1-N 2.89Å; D43-K45 VanDerWaalsContact OD1-N 3.12Å; D43-K45 WeakPolarHBondContact OD2-CD 3.45Å; D43-K45 WeakPolarHBondContact OD2-CE 3.46Å; D43-K45 IonicContact OD2-NZ 2.65Å; D43-K45 PolarHBondContact OD2-NZ 3.02Å
46	E	89.8	Confident	88.5	Confident	106 Å²	106	71.6 Å²	71.6	50%	0.495	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130	176.3	-65.2	-171.9	-173.5	0	0	110.1	K19 V38 Y39 V40	K19-E46 WeakPolarHBondContact CE-OE1 3.5Å; K19-E46 IonicContact NZ-OE1 3.03Å; K19-E46 PolarHBondContact NZ-OE1 3.08Å; K19-E46 IonicContact NZ-OE2 2.86Å; K19-E46 PolarHBondContact NZ-OE2 3.31Å; V38-E46 HydrophobicContact CG1-CB 3.7Å; V38-E46 HydrophobicContact CG1-CG 4.13Å; Y39-E46 WeakPolarHBondContact O-CA 3.09Å; V40-E46 HydrophobicContact CG2-CG 4.29Å
47	I	88.8	Confident	88.6	Confident	89 Å²	89	74.5 Å²	74.5	46%	0.456	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.1	176.4	-166.5	167.2	0	0	0	110.6	V38 Y39 H41	V38-I47 CarbonylContact C-O 3.58Å; V38-I47 WeakPolarHBondContact CA-O 3.34Å; Y39-I47 PolarHBondContact N-O 2.79Å; Y39-I47 PolarHBondContact O-N 3.47Å; H41-I47 WeakPolarHBondContact NE2-CG2 3.34Å
48	G	89.3	Confident	88.6	Confident	19 Å²	19	77 Å²	77	20%	0.196	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.8	168.3	0	0	0	0	0	111.1	D32	D32-G48 WeakPolarHBondContact OD2-CA 3.06Å
49	F	90.3	Very high	88.6	Confident	79 Å²	79	81.2 Å²	81.2	35%	0.346	44%	0.441	S	S	.	.			trans	-95.2	112.9	178.5	-177.9	-107.1	0	0	0	112	P37 Y39 A51 A54	P37-F49 PolarHBondContact O-N 2.92Å; Y39-F49 HydrophobicContact CD2-CB 3.43Å; Y39-F49 VanDerWaalsContact CD2-CB 3.43Å; Y39-F49 HydrophobicContact CD2-CG 4.26Å; Y39-F49 HydrophobicContact CE2-CB 3.52Å; Y39-F49 HydrophobicContact CE2-CD1 4.14Å; Y39-F49 HydrophobicContact CE2-CG 4.04Å; F49-A51 HydrophobicContact CD1-CB 4.03Å; F49-A51 HydrophobicContact CE1-CB 3.62Å; F49-A51 PolarHBondContact O-N 3.07Å; F49-A54 HydrophobicContact CE2-CB 3.86Å; F49-A54 HydrophobicContact CZ-CB 3.65Å
50	D	90.6	Very high	88.7	Confident	57 Å²	57	82.4 Å²	82.4	31%	0.305	45%	0.448	S	S	.	.			trans	-86.6	92.1	172	-171.3	-25.6	0	0	0	110.4	L36 P52 L53 A54	L36-D50 HydrophobicContact CD1-CB 3.97Å; L36-D50 HydrophobicContact CD2-CB 4.07Å; D50-P52 WeakPolarHBondContact OD1-CD 3.47Å; D50-L53 HydrophobicContact CB-CB 3.83Å; D50-L53 PolarHBondContact O-N 3.18Å; D50-L53 WeakPolarHBondContact OD1-CB 3.28Å; D50-L53 PolarHBondContact OD1-N 3.02Å; D50-L53 WeakPolarHBondContact OD2-CB 3.5Å; D50-A54 WeakPolarHBondContact O-CB 3.34Å; D50-A54 PolarHBondContact O-N 2.5Å
51	A	87	Confident	89	Confident	46 Å²	46	84.5 Å²	84.5	38%	0.38	46%	0.458	S	S	.	.	H	α-helix	trans	-60.9	-42.5	178.5	0	0	0	0	0	113.5	F49 A54 T55	F49-A51 HydrophobicContact CD1-CB 4.03Å; F49-A51 HydrophobicContact CE1-CB 3.62Å; F49-A51 PolarHBondContact O-N 3.07Å; A51-A54 PolarHBondContact O-N 3.17Å; A51-T55 WeakPolarHBondContact O-CB 3.34Å; A51-T55 PolarHBondContact O-N 3.04Å; A51-T55 PolarHBondContact O-OG1 3.41Å
52	P	88.9	Confident	89.4	Confident	100 Å²	100	87.3 Å²	87.3	65%	0.649	48%	0.475	S	S	*	.	H	α-helix	trans	-55.5	-49.1	171.3	-27.9	33.6	0	0	0	114.1	D50 T55 K56	D50-P52 WeakPolarHBondContact OD1-CD 3.47Å; P52-T55 PolarHBondContact O-N 3.41Å; P52-K56 PolarHBondContact O-N 3.49Å
53	L	89.6	Confident	89.9	Confident	113 Å²	113	83.7 Å²	83.7	59%	0.592	46%	0.463	S	S	*	.	H	α-helix	trans	-63.3	-44.2	178.7	-172.8	92.4	0	0	0	111.3	D50 T55 K56 K57	D50-L53 HydrophobicContact CB-CB 3.83Å; D50-L53 PolarHBondContact O-N 3.18Å; D50-L53 WeakPolarHBondContact OD1-CB 3.28Å; D50-L53 PolarHBondContact OD1-N 3.02Å; D50-L53 WeakPolarHBondContact OD2-CB 3.5Å; L53-T55 VanDerWaalsContact C-N 3.33Å; L53-T55 PolarHBondContact O-N 3.15Å; L53-K56 WeakPolarHBondContact O-CB 3.26Å; L53-K56 PolarHBondContact O-N 3.33Å; L53-K57 PolarHBondContact O-N 3.41Å
54	A	89.8	Confident	90.3	Very high	25 Å²	25	83.7 Å²	83.7	21%	0.207	46%	0.46	C	S	.	.	H	α-helix	trans	-59.9	-43.8	177.2	0	0	0	0	0	111.6	F49 D50 A51 K56 K57 I58	F49-A54 HydrophobicContact CE2-CB 3.86Å; F49-A54 HydrophobicContact CZ-CB 3.65Å; D50-A54 WeakPolarHBondContact O-CB 3.34Å; D50-A54 PolarHBondContact O-N 2.5Å; A51-A54 PolarHBondContact O-N 3.17Å; A54-K56 PolarHBondContact O-N 2.85Å; A54-K57 PolarHBondContact O-N 3.48Å; A54-I58 VanDerWaalsContact O-CG1 3.28Å; A54-I58 WeakPolarHBondContact O-CG1 3.28Å; A54-I58 PolarHBondContact O-N 3.33Å
55	T	90.8	Very high	90.7	Very high	85 Å²	85	84 Å²	84	52%	0.521	46%	0.458	S	S	.	.	H	α-helix	trans	-63.9	-41.1	177.5	-54.1	0	0	0	0	111.6	A51 P52 L53 K57 I58 T59	A51-T55 WeakPolarHBondContact O-CB 3.34Å; A51-T55 PolarHBondContact O-N 3.04Å; A51-T55 PolarHBondContact O-OG1 3.41Å; P52-T55 PolarHBondContact O-N 3.41Å; L53-T55 VanDerWaalsContact C-N 3.33Å; L53-T55 PolarHBondContact O-N 3.15Å; T55-K57 VanDerWaalsContact C-N 3.35Å; T55-I58 PolarHBondContact O-N 2.81Å; T55-T59 PolarHBondContact O-N 3.38Å; T55-T59 VanDerWaalsContact O-N 3.08Å; T55-T59 PolarHBondContact O-OG1 2.87Å
56	K	92	Very high	91	Very high	136 Å²	136	83.3 Å²	83.3	59%	0.591	45%	0.454	S	S	*	.	H	α-helix	trans	-61	-44.7	173.5	-172.8	-178.8	176	-175.5	0	111	P52 L53 A54 T59 E60	P52-K56 PolarHBondContact O-N 3.49Å; L53-K56 WeakPolarHBondContact O-CB 3.26Å; L53-K56 PolarHBondContact O-N 3.33Å; A54-K56 PolarHBondContact O-N 2.85Å; K56-T59 WeakPolarHBondContact O-CB 3.41Å; K56-T59 PolarHBondContact O-N 3.07Å; K56-E60 WeakPolarHBondContact CE-OE1 3.31Å; K56-E60 WeakPolarHBondContact O-CG 3.35Å; K56-E60 PolarHBondContact O-N 2.99Å
57	K	92.8	Very high	91.1	Very high	105 Å²	105	83.2 Å²	83.2	46%	0.457	46%	0.457	S	S	.	.	H	α-helix	trans	-65.9	-39.9	180	-169.4	58.4	178.1	175.9	0	113	L53 A54 T55 T59 E60 L61	L53-K57 PolarHBondContact O-N 3.41Å; A54-K57 PolarHBondContact O-N 3.48Å; T55-K57 VanDerWaalsContact C-N 3.35Å; K57-T59 VanDerWaalsContact C-N 3.28Å; K57-T59 PolarHBondContact O-N 3.33Å; K57-E60 WeakPolarHBondContact CD-OE2 3.36Å; K57-E60 IonicContact NZ-OE2 3.12Å; K57-E60 PolarHBondContact NZ-OE2 3.16Å; K57-E60 PolarHBondContact O-N 3.15Å; K57-L61 HydrophobicContact CG-CD1 4.23Å; K57-L61 WeakPolarHBondContact O-CB 3.28Å; K57-L61 WeakPolarHBondContact O-CG 3.49Å; K57-L61 PolarHBondContact O-N 3.03Å
58	I	92.3	Very high	91.2	Very high	99 Å²	99	84.4 Å²	84.4	51%	0.508	46%	0.461	S	S	.	.	H	α-helix	trans	-59.6	-42.9	173.5	-69.3	163.1	0	0	0	110.4	A54 T55 L61 N62	A54-I58 VanDerWaalsContact O-CG1 3.28Å; A54-I58 WeakPolarHBondContact O-CG1 3.28Å; A54-I58 PolarHBondContact O-N 3.33Å; T55-I58 PolarHBondContact O-N 2.81Å; I58-L61 PolarHBondContact O-N 3.11Å; I58-N62 WeakPolarHBondContact O-CB 3.31Å; I58-N62 PolarHBondContact O-N 3.34Å; I58-N62 PolarHBondContact O-ND2 3.19Å
59	T	91.6	Very high	91.4	Very high	94 Å²	94	90.8 Å²	90.8	58%	0.577	48%	0.479	S	S	*	.	H	α-helix	trans	-64.5	-44.1	177.7	-54.2	0	0	0	0	111.6	T55 K56 K57 N62 G63	T55-T59 PolarHBondContact O-N 3.38Å; T55-T59 VanDerWaalsContact O-N 3.08Å; T55-T59 PolarHBondContact O-OG1 2.87Å; K56-T59 WeakPolarHBondContact O-CB 3.41Å; K56-T59 PolarHBondContact O-N 3.07Å; K57-T59 VanDerWaalsContact C-N 3.28Å; K57-T59 PolarHBondContact O-N 3.33Å; T59-N62 PolarHBondContact O-N 3.01Å; T59-G63 PolarHBondContact O-N 3.1Å
60	E	93.3	Very high	91.4	Very high	88 Å²	88	90.8 Å²	90.8	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-58.7	-49	174.7	-72.5	171.6	-170.4	0	0	112	K56 K57 N62 G63 E64	K56-E60 WeakPolarHBondContact CE-OE1 3.31Å; K56-E60 WeakPolarHBondContact O-CG 3.35Å; K56-E60 PolarHBondContact O-N 2.99Å; K57-E60 WeakPolarHBondContact CD-OE2 3.36Å; K57-E60 IonicContact NZ-OE2 3.12Å; K57-E60 PolarHBondContact NZ-OE2 3.16Å; K57-E60 PolarHBondContact O-N 3.15Å; E60-N62 PolarHBondContact O-N 3.25Å; E60-G63 WeakPolarHBondContact O-CA 3.25Å; E60-G63 PolarHBondContact O-N 3.06Å; E60-G63 VanDerWaalsContact O-N 3.13Å; E60-E64 PolarHBondContact O-N 3.05Å
61	L	93.3	Very high	91.6	Very high	87 Å²	87	91.1 Å²	91.1	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-38.8	-179.5	-72.8	171.3	0	0	0	112.4	K57 I58 G63 E64 A65	K57-L61 HydrophobicContact CG-CD1 4.23Å; K57-L61 WeakPolarHBondContact O-CB 3.28Å; K57-L61 WeakPolarHBondContact O-CG 3.49Å; K57-L61 PolarHBondContact O-N 3.03Å; I58-L61 PolarHBondContact O-N 3.11Å; L61-G63 VanDerWaalsContact C-N 3.32Å; L61-E64 PolarHBondContact O-N 3.45Å; L61-A65 WeakPolarHBondContact O-CB 3.36Å; L61-A65 PolarHBondContact O-N 3.03Å
62	N	92.5	Very high	91.9	Very high	109 Å²	109	95 Å²	95	58%	0.583	50%	0.501	S	S	*	.	H	α-helix	trans	-65.3	-37.1	174.2	-75.9	-27.6	0	0	0	111.9	I58 T59 E60 K66	I58-N62 WeakPolarHBondContact O-CB 3.31Å; I58-N62 PolarHBondContact O-N 3.34Å; I58-N62 PolarHBondContact O-ND2 3.19Å; T59-N62 PolarHBondContact O-N 3.01Å; E60-N62 PolarHBondContact O-N 3.25Å; N62-K66 PolarHBondContact O-N 3.38Å; N62-K66 VanDerWaalsContact O-N 3.13Å
63	G	92.3	Very high	92	Very high	33 Å²	33	94.9 Å²	94.9	34%	0.34	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-44.6	172.4	0	0	0	0	0	112.4	T59 E60 L61 K66 N67	T59-G63 PolarHBondContact O-N 3.1Å; E60-G63 WeakPolarHBondContact O-CA 3.25Å; E60-G63 PolarHBondContact O-N 3.06Å; E60-G63 VanDerWaalsContact O-N 3.13Å; L61-G63 VanDerWaalsContact C-N 3.32Å; G63-K66 WeakPolarHBondContact O-CB 3.46Å; G63-K66 PolarHBondContact O-N 2.93Å; G63-N67 PolarHBondContact O-N 3.33Å; G63-N67 VanDerWaalsContact O-N 3.07Å
64	E	91.3	Very high	92.1	Very high	100 Å²	100	91.5 Å²	91.5	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-46.4	177.3	-161	-168.4	147.5	0	0	111.9	E60 L61 K66 N67 H68	E60-E64 PolarHBondContact O-N 3.05Å; L61-E64 PolarHBondContact O-N 3.45Å; E64-K66 VanDerWaalsContact C-N 3.28Å; E64-K66 PolarHBondContact O-N 3.34Å; E64-N67 WeakPolarHBondContact O-CB 3.42Å; E64-N67 PolarHBondContact O-N 3.45Å; E64-H68 PolarHBondContact O-CD2 3.25Å; E64-H68 PolarHBondContact O-N 2.9Å; E64-H68 IonicContact OE1-CD2 2.78Å; E64-H68 IonicContact OE1-CE1 2.75Å; E64-H68 IonicContact OE1-NE2 3.35Å; E64-H68 PolarHBondContact OE1-NE2 3.32Å
65	A	91.4	Very high	92.2	Very high	58 Å²	58	93 Å²	93	48%	0.479	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-37.8	177.1	0	0	0	0	0	112.4	L61 H68 R69	L61-A65 WeakPolarHBondContact O-CB 3.36Å; L61-A65 PolarHBondContact O-N 3.03Å; A65-H68 PolarHBondContact O-N 2.86Å; A65-R69 PolarHBondContact O-N 2.83Å; A65-R69 VanDerWaalsContact O-N 3.07Å
66	K	92.9	Very high	92.2	Very high	121 Å²	121	93.9 Å²	93.9	53%	0.526	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-44.5	172.7	-177.5	-177.5	175.6	-175.4	0	111.3	N62 G63 E64 R69 L70	N62-K66 PolarHBondContact O-N 3.38Å; N62-K66 VanDerWaalsContact O-N 3.13Å; G63-K66 WeakPolarHBondContact O-CB 3.46Å; G63-K66 PolarHBondContact O-N 2.93Å; E64-K66 VanDerWaalsContact C-N 3.28Å; E64-K66 PolarHBondContact O-N 3.34Å; K66-R69 PolarHBondContact O-N 3.14Å; K66-L70 HydrophobicContact CG-CD1 4.26Å; K66-L70 WeakPolarHBondContact O-CG 3.02Å; K66-L70 PolarHBondContact O-N 3.09Å
67	N	91.7	Very high	92.1	Very high	104 Å²	104	94 Å²	94	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-64.4	-41.1	178.4	-69.5	-15.5	0	0	0	112	G63 E64 R69 L70 A71	G63-N67 PolarHBondContact O-N 3.33Å; G63-N67 VanDerWaalsContact O-N 3.07Å; E64-N67 WeakPolarHBondContact O-CB 3.42Å; E64-N67 PolarHBondContact O-N 3.45Å; N67-R69 VanDerWaalsContact C-N 3.32Å; N67-R69 PolarHBondContact O-N 2.84Å; N67-L70 PolarHBondContact O-N 2.66Å; N67-A71 WeakPolarHBondContact O-CB 3.5Å; N67-A71 PolarHBondContact O-N 2.69Å
68	H	92.3	Very high	91.9	Very high	115 Å²	115	95.8 Å²	95.8	53%	0.532	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-40.8	173.7	-74.2	-55.5	0	0	0	112	E64 A65 K72	E64-H68 PolarHBondContact O-CD2 3.25Å; E64-H68 PolarHBondContact O-N 2.9Å; E64-H68 IonicContact OE1-CD2 2.78Å; E64-H68 IonicContact OE1-CE1 2.75Å; E64-H68 IonicContact OE1-NE2 3.35Å; E64-H68 PolarHBondContact OE1-NE2 3.32Å; A65-H68 PolarHBondContact O-N 2.86Å; H68-K72 WeakPolarHBondContact O-CB 3.44Å; H68-K72 PolarHBondContact O-N 3.1Å
69	R	92.3	Very high	91.6	Very high	152 Å²	152	97 Å²	97	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-47.3	175.7	-171	178.8	69.7	-162.6	0.8	112	A65 K66 N67 A71 K72 E73	A65-R69 PolarHBondContact O-N 2.83Å; A65-R69 VanDerWaalsContact O-N 3.07Å; K66-R69 PolarHBondContact O-N 3.14Å; N67-R69 VanDerWaalsContact C-N 3.32Å; N67-R69 PolarHBondContact O-N 2.84Å; R69-A71 PolarHBondContact O-N 3.28Å; R69-K72 PolarHBondContact O-N 3.47Å; R69-E73 WeakPolarHBondContact CG-OE1 3.35Å; R69-E73 IonicContact NE-OE1 3.79Å; R69-E73 WeakPolarHBondContact O-CG 3.47Å; R69-E73 PolarHBondContact O-N 3.2Å
70	L	91.8	Very high	91.2	Very high	80 Å²	80	95.8 Å²	95.8	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-40.7	178.8	-68.4	174.2	0	0	0	112.2	K66 N67 K72 E73 A74	K66-L70 HydrophobicContact CG-CD1 4.26Å; K66-L70 WeakPolarHBondContact O-CG 3.02Å; K66-L70 PolarHBondContact O-N 3.09Å; N67-L70 PolarHBondContact O-N 2.66Å; L70-K72 VanDerWaalsContact C-N 3.33Å; L70-E73 PolarHBondContact O-N 3.01Å; L70-A74 WeakPolarHBondContact O-CB 3.16Å; L70-A74 PolarHBondContact O-N 3.23Å
71	A	92.7	Very high	90.8	Very high	63 Å²	63	99.2 Å²	99.2	52%	0.521	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-38.8	176.3	0	0	0	0	0	111.9	N67 R69 A75	N67-A71 WeakPolarHBondContact O-CB 3.5Å; N67-A71 PolarHBondContact O-N 2.69Å; R69-A71 PolarHBondContact O-N 3.28Å; A71-A75 WeakPolarHBondContact O-CB 3.3Å; A71-A75 PolarHBondContact O-N 3.41Å
72	K	94	Very high	90.4	Very high	129 Å²	129	101 Å²	101	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-63.8	-49.7	174.1	-179	-178.2	169.5	-177	0	111.6	H68 R69 L70 A74 A75 E76	H68-K72 WeakPolarHBondContact O-CB 3.44Å; H68-K72 PolarHBondContact O-N 3.1Å; R69-K72 PolarHBondContact O-N 3.47Å; L70-K72 VanDerWaalsContact C-N 3.33Å; K72-A74 VanDerWaalsContact C-N 3.32Å; K72-A74 PolarHBondContact O-N 3.33Å; K72-A75 PolarHBondContact O-N 3.09Å; K72-A75 VanDerWaalsContact O-N 3.14Å; K72-E76 WeakPolarHBondContact CE-OE1 3.48Å; K72-E76 HydrophobicContact CG-CG 4.47Å; K72-E76 IonicContact NZ-OE1 3.9Å; K72-E76 WeakPolarHBondContact O-CG 3.44Å; K72-E76 PolarHBondContact O-N 3Å
73	E	92.3	Very high	89.8	Confident	97 Å²	97	100 Å²	100	45%	0.453	53%	0.532	S	S	.	.	H	α-helix	trans	-58.3	-43.9	178.1	-73.1	168.9	-174.8	0	0	111.2	R69 L70 A75 E76 E77	R69-E73 WeakPolarHBondContact CG-OE1 3.35Å; R69-E73 IonicContact NE-OE1 3.79Å; R69-E73 WeakPolarHBondContact O-CG 3.47Å; R69-E73 PolarHBondContact O-N 3.2Å; L70-E73 PolarHBondContact O-N 3.01Å; E73-A75 PolarHBondContact O-N 2.74Å; E73-E76 PolarHBondContact O-N 2.89Å; E73-E77 PolarHBondContact O-N 3Å
74	A	91.7	Very high	89.3	Confident	42 Å²	42	103.1 Å²	103.1	35%	0.347	55%	0.554	S	S	.	*	H	α-helix	trans	-66.9	-32.6	176.4	0	0	0	0	0	113.6	L70 K72 K78	L70-A74 WeakPolarHBondContact O-CB 3.16Å; L70-A74 PolarHBondContact O-N 3.23Å; K72-A74 VanDerWaalsContact C-N 3.32Å; K72-A74 PolarHBondContact O-N 3.33Å; A74-K78 WeakPolarHBondContact O-CG 3.47Å; A74-K78 PolarHBondContact O-N 3.35Å
75	A	91.2	Very high	88.9	Confident	57 Å²	57	101.5 Å²	101.5	47%	0.471	55%	0.548	S	S	.	.	H	α-helix	trans	-71.5	-41.8	174.9	0	0	0	0	0	111.5	A71 K72 E73 K78 L79	A71-A75 WeakPolarHBondContact O-CB 3.3Å; A71-A75 PolarHBondContact O-N 3.41Å; K72-A75 PolarHBondContact O-N 3.09Å; K72-A75 VanDerWaalsContact O-N 3.14Å; E73-A75 PolarHBondContact O-N 2.74Å; A75-K78 PolarHBondContact O-N 3.49Å; A75-L79 WeakPolarHBondContact O-CB 3.11Å; A75-L79 PolarHBondContact O-N 2.98Å
76	E	90.9	Very high	88.3	Confident	103 Å²	103	108.4 Å²	108.4	48%	0.481	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-40.3	175.7	-72.9	176.9	167.6	0	0	111.4	K72 E73 L79 A80	K72-E76 WeakPolarHBondContact CE-OE1 3.48Å; K72-E76 HydrophobicContact CG-CG 4.47Å; K72-E76 IonicContact NZ-OE1 3.9Å; K72-E76 WeakPolarHBondContact O-CG 3.44Å; K72-E76 PolarHBondContact O-N 3Å; E73-E76 PolarHBondContact O-N 2.89Å; E76-L79 PolarHBondContact O-N 3.22Å; E76-A80 PolarHBondContact O-N 2.87Å
77	E	89.9	Confident	87.8	Confident	138 Å²	138	105.6 Å²	105.6	65%	0.645	56%	0.562	S	S	*	*	H	α-helix	trans	-63.6	-40.8	174.6	-169.1	-175.2	175.7	0	0	112.5	E73	E73-E77 PolarHBondContact O-N 3Å
78	K	87.7	Confident	87.3	Confident	142 Å²	142	104.4 Å²	104.4	62%	0.617	56%	0.559	S	S	*	*	H	α-helix	trans	-67.1	-40	175	-74.7	174.7	-176.2	176.9	0	112	A74 A75 A80 K81 F82	A74-K78 WeakPolarHBondContact O-CG 3.47Å; A74-K78 PolarHBondContact O-N 3.35Å; A75-K78 PolarHBondContact O-N 3.49Å; K78-A80 VanDerWaalsContact C-N 3.34Å; K78-K81 PolarHBondContact O-N 3.41Å; K78-F82 VanDerWaalsContact O-CD2 3.22Å; K78-F82 WeakPolarHBondContact O-CD2 3.25Å; K78-F82 WeakPolarHBondContact O-CE2 3.43Å
79	L	86.4	Confident	87	Confident	126 Å²	126	106.5 Å²	106.5	66%	0.66	57%	0.567	S	S	*	*	H	α-helix	trans	-65.9	-37.1	179	-169.6	71.4	0	0	0	111.6	A75 E76 K81 F82	A75-L79 WeakPolarHBondContact O-CB 3.11Å; A75-L79 PolarHBondContact O-N 2.98Å; E76-L79 PolarHBondContact O-N 3.22Å; L79-K81 PolarHBondContact O-N 3.28Å; L79-F82 PolarHBondContact O-N 3.24Å
80	A	84.2	Confident	86.4	Confident	67 Å²	67	105.7 Å²	105.7	55%	0.554	57%	0.567	S	S	*	*	H	α-helix	trans	-58	-30.4	178.6	0	0	0	0	0	113.4	E76 K78 F82 A83	E76-A80 PolarHBondContact O-N 2.87Å; K78-A80 VanDerWaalsContact C-N 3.34Å; A80-F82 PolarHBondContact O-N 3.23Å; A80-A83 VanDerWaalsContact O-CB 3.29Å; A80-A83 WeakPolarHBondContact O-CB 3.19Å; A80-A83 PolarHBondContact O-N 2.99Å; A80-A83 VanDerWaalsContact O-N 3.16Å
81	K	84.1	Confident	85.8	Confident	160 Å²	160	103.5 Å²	103.5	70%	0.696	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-23.2	175.7	-63.1	-177.7	-178.1	-179	0	113.2	K78 L79	K78-K81 PolarHBondContact O-N 3.41Å; L79-K81 PolarHBondContact O-N 3.28Å
82	F	84.9	Confident	85.4	Confident	126 Å²	126	105.4 Å²	105.4	55%	0.553	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	2	-180	-57.3	-80.7	0	0	0	112.9	K78 L79 A80 A84 I85	K78-F82 VanDerWaalsContact O-CD2 3.22Å; K78-F82 WeakPolarHBondContact O-CD2 3.25Å; K78-F82 WeakPolarHBondContact O-CE2 3.43Å; L79-F82 PolarHBondContact O-N 3.24Å; A80-F82 PolarHBondContact O-N 3.23Å; F82-A84 PolarHBondContact O-N 3.48Å; F82-A84 VanDerWaalsContact O-N 3.15Å; F82-I85 HydrophobicContact CD1-CD1 4.01Å; F82-I85 PolarHBondContact O-N 2.81Å
83	A	79.8	Confident	84.7	Confident	87 Å²	87	104.6 Å²	104.6	72%	0.719	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-23.6	-176.4	0	0	0	0	0	114	A80 I85	A80-A83 VanDerWaalsContact O-CB 3.29Å; A80-A83 WeakPolarHBondContact O-CB 3.19Å; A80-A83 PolarHBondContact O-N 2.99Å; A80-A83 VanDerWaalsContact O-N 3.16Å; A83-I85 VanDerWaalsContact C-N 3.34Å
84	A	81.9	Confident	84.1	Confident	98 Å²	98	102.2 Å²	102.2	81%	0.81	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-5.9	177.1	0	0	0	0	0	113.9	F82 E86	F82-A84 PolarHBondContact O-N 3.48Å; F82-A84 VanDerWaalsContact O-N 3.15Å; A84-E86 PolarHBondContact O-N 2.79Å
85	I	82.1	Confident	83.6	Confident	67 Å²	67	106 Å²	106	34%	0.344	57%	0.57	S	S	.	*			trans	-94.6	95.7	177.8	-53.1	-177.1	0	0	0	108	F82 A83 D87 P88 A91	F82-I85 HydrophobicContact CD1-CD1 4.01Å; F82-I85 PolarHBondContact O-N 2.81Å; A83-I85 VanDerWaalsContact C-N 3.34Å; I85-D87 PolarHBondContact O-N 2.81Å; I85-P88 HydrophobicContact CG2-CB 4.4Å; I85-P88 HydrophobicContact CG2-CG 4.18Å; I85-A91 HydrophobicContact CG2-CB 3.86Å
86	E	79.1	Confident	83.1	Confident	202 Å²	202	108.8 Å²	108.8	94%	0.944	57%	0.574	S	S	*	*	S	Bend	trans	-60.2	-33.9	179	-70.5	-172.7	163	0	0	112.8	A84	A84-E86 PolarHBondContact O-N 2.79Å
87	D	83.6	Confident	82.4	Confident	63 Å²	63	109.4 Å²	109.4	34%	0.337	58%	0.578	S	S	.	*			trans	-139.2	96.4	178.4	-172.3	-13.2	0	0	0	111.1	I85 K89 K90 A91	I85-D87 PolarHBondContact O-N 2.81Å; D87-K89 PolarHBondContact O-N 3.22Å; D87-K89 WeakPolarHBondContact OD1-CB 3.33Å; D87-K89 PolarHBondContact OD1-N 3.29Å; D87-K90 HydrophobicContact CB-CB 4.17Å; D87-K90 HydrophobicContact CB-CD 4.14Å; D87-K90 HydrophobicContact CB-CG 4.24Å; D87-K90 PolarHBondContact O-N 3.23Å; D87-K90 PolarHBondContact OD1-N 3.08Å; D87-K90 WeakPolarHBondContact OD2-CD 3.35Å; D87-K90 WeakPolarHBondContact OD2-CE 3.48Å; D87-K90 WeakPolarHBondContact OD2-CG 3.45Å; D87-A91 PolarHBondContact O-N 3.43Å
88	P	81.3	Confident	81.8	Confident	79 Å²	79	107.6 Å²	107.6	51%	0.513	57%	0.572	S	S	.	*	H	α-helix	trans	-58	-27.1	178.7	-27.6	35.7	0	0	0	114.5	I85 A91 I92	I85-P88 HydrophobicContact CG2-CB 4.4Å; I85-P88 HydrophobicContact CG2-CG 4.18Å; P88-A91 PolarHBondContact O-N 3.16Å; P88-I92 WeakPolarHBondContact O-CG1 3.45Å; P88-I92 PolarHBondContact O-N 2.91Å
89	K	84.7	Confident	81.1	Confident	158 Å²	158	103.5 Å²	103.5	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-69.1	-45	177.6	-69.1	-177.7	178.2	178.5	0	110.8	D87 A91 I92 E93	D87-K89 PolarHBondContact O-N 3.22Å; D87-K89 WeakPolarHBondContact OD1-CB 3.33Å; D87-K89 PolarHBondContact OD1-N 3.29Å; K89-A91 VanDerWaalsContact C-N 3.28Å; K89-A91 PolarHBondContact O-N 3.5Å; K89-I92 PolarHBondContact O-N 2.94Å; K89-I92 VanDerWaalsContact O-N 3.16Å; K89-E93 WeakPolarHBondContact O-CG 3.34Å; K89-E93 PolarHBondContact O-N 2.8Å
90	K	80	Confident	80.4	Confident	135 Å²	135	103.7 Å²	103.7	59%	0.587	56%	0.557	S	S	*	*	H	α-helix	trans	-62.4	-35.2	175.5	-75.5	-178.2	-176.5	178.3	0	112.8	D87 I92 E93 A94	D87-K90 HydrophobicContact CB-CB 4.17Å; D87-K90 HydrophobicContact CB-CD 4.14Å; D87-K90 HydrophobicContact CB-CG 4.24Å; D87-K90 PolarHBondContact O-N 3.23Å; D87-K90 PolarHBondContact OD1-N 3.08Å; D87-K90 WeakPolarHBondContact OD2-CD 3.35Å; D87-K90 WeakPolarHBondContact OD2-CE 3.48Å; D87-K90 WeakPolarHBondContact OD2-CG 3.45Å; K90-I92 VanDerWaalsContact C-N 3.33Å; K90-I92 PolarHBondContact O-N 3.1Å; K90-E93 PolarHBondContact O-N 2.95Å; K90-A94 WeakPolarHBondContact O-CB 3.5Å; K90-A94 PolarHBondContact O-N 2.86Å
91	A	80.2	Confident	80	Confident	35 Å²	35	104.7 Å²	104.7	29%	0.289	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-40.2	175.2	0	0	0	0	0	111.9	I85 D87 P88 K89 A94 L95	I85-A91 HydrophobicContact CG2-CB 3.86Å; D87-A91 PolarHBondContact O-N 3.43Å; P88-A91 PolarHBondContact O-N 3.16Å; K89-A91 VanDerWaalsContact C-N 3.28Å; K89-A91 PolarHBondContact O-N 3.5Å; A91-A94 PolarHBondContact O-N 3.46Å; A91-L95 WeakPolarHBondContact O-CG 3.21Å; A91-L95 PolarHBondContact O-N 2.93Å; A91-L95 VanDerWaalsContact O-N 3.16Å
92	I	83.3	Confident	79.4	Confident	103 Å²	103	101.2 Å²	101.2	53%	0.528	54%	0.541	S	S	.	.	H	α-helix	trans	-67.4	-44.7	175.7	-65.4	165.9	0	0	0	110.9	P88 K89 K90 A94 L95 E96	P88-I92 WeakPolarHBondContact O-CG1 3.45Å; P88-I92 PolarHBondContact O-N 2.91Å; K89-I92 PolarHBondContact O-N 2.94Å; K89-I92 VanDerWaalsContact O-N 3.16Å; K90-I92 VanDerWaalsContact C-N 3.33Å; K90-I92 PolarHBondContact O-N 3.1Å; I92-A94 VanDerWaalsContact C-N 3.3Å; I92-A94 PolarHBondContact O-N 2.83Å; I92-L95 PolarHBondContact O-N 2.85Å; I92-L95 VanDerWaalsContact O-N 3.16Å; I92-E96 PolarHBondContact O-N 3.05Å
93	E	79.8	Confident	78.4	Confident	112 Å²	112	101.4 Å²	101.4	52%	0.523	54%	0.544	S	S	.	.	H	α-helix	trans	-60.3	-38.6	176.9	-70.9	174.8	-177.8	0	0	112.3	K89 K90 E96 M97	K89-E93 WeakPolarHBondContact O-CG 3.34Å; K89-E93 PolarHBondContact O-N 2.8Å; K90-E93 PolarHBondContact O-N 2.95Å; E93-E96 PolarHBondContact O-N 2.8Å; E93-M97 PolarHBondContact O-N 3.16Å
94	A	78.9	Confident	77.8	Confident	47 Å²	47	104.1 Å²	104.1	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-64.5	-40.9	175	0	0	0	0	0	112.4	K90 A91 I92 M97 L98	K90-A94 WeakPolarHBondContact O-CB 3.5Å; K90-A94 PolarHBondContact O-N 2.86Å; A91-A94 PolarHBondContact O-N 3.46Å; I92-A94 VanDerWaalsContact C-N 3.3Å; I92-A94 PolarHBondContact O-N 2.83Å; A94-M97 PolarHBondContact O-N 2.95Å; A94-L98 WeakPolarHBondContact O-CG 3.49Å; A94-L98 PolarHBondContact O-N 3.44Å; A94-L98 VanDerWaalsContact O-N 3.08Å
95	L	81	Confident	77.2	Confident	121 Å²	121	105.7 Å²	105.7	63%	0.634	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-41	176.4	-71.4	168	0	0	0	112	A91 I92 L98 S99	A91-L95 WeakPolarHBondContact O-CG 3.21Å; A91-L95 PolarHBondContact O-N 2.93Å; A91-L95 VanDerWaalsContact O-N 3.16Å; I92-L95 PolarHBondContact O-N 2.85Å; I92-L95 VanDerWaalsContact O-N 3.16Å; L95-L98 PolarHBondContact O-N 3.06Å; L95-S99 PolarHBondContact O-N 3.08Å; L95-S99 VanDerWaalsContact O-N 3.17Å
96	E	82.3	Confident	76.2	Confident	115 Å²	115	108.6 Å²	108.6	54%	0.537	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-43.8	174.5	-82.4	-169.9	174.5	0	0	112.2	I92 E93 L98 S99 K100	I92-E96 PolarHBondContact O-N 3.05Å; E93-E96 PolarHBondContact O-N 2.8Å; E96-L98 PolarHBondContact O-N 3.5Å; E96-S99 PolarHBondContact O-N 3.45Å; E96-S99 PolarHBondContact O-OG 3.42Å; E96-K100 PolarHBondContact O-N 3.27Å
97	M	75.8	Confident	75.3	Confident	116 Å²	116	104.7 Å²	104.7	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-61.5	-41.5	176.7	-84.8	-171.5	-86	0	0	112.7	E93 A94 S99 K100 I101	E93-M97 PolarHBondContact O-N 3.16Å; A94-M97 PolarHBondContact O-N 2.95Å; M97-S99 VanDerWaalsContact C-N 3.34Å; M97-S99 PolarHBondContact O-N 3.29Å; M97-K100 PolarHBondContact O-N 3.12Å; M97-I101 WeakPolarHBondContact O-CG1 3.42Å; M97-I101 PolarHBondContact O-N 3.39Å
98	L	76.6	Confident	74.6	Confident	101 Å²	101	105.8 Å²	105.8	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-60.5	-43.3	176.2	-75.8	168.3	0	0	0	111.7	A94 L95 E96 K100 I101 D102	A94-L98 WeakPolarHBondContact O-CG 3.49Å; A94-L98 PolarHBondContact O-N 3.44Å; A94-L98 VanDerWaalsContact O-N 3.08Å; L95-L98 PolarHBondContact O-N 3.06Å; E96-L98 PolarHBondContact O-N 3.5Å; L98-K100 VanDerWaalsContact C-N 3.27Å; L98-K100 PolarHBondContact O-N 3.06Å; L98-I101 PolarHBondContact O-N 3.38Å; L98-I101 VanDerWaalsContact O-N 3.14Å; L98-D102 PolarHBondContact O-N 3.07Å; L98-D102 VanDerWaalsContact O-N 3.15Å
99	S	73.9	Confident	73.4	Confident	55 Å²	55	104.2 Å²	104.2	39%	0.385	53%	0.528	S	S	.	.	H	α-helix	trans	-59.6	-35.7	177.2	81	0	0	0	0	113.3	L95 E96 M97 D102 Q103	L95-S99 PolarHBondContact O-N 3.08Å; L95-S99 VanDerWaalsContact O-N 3.17Å; E96-S99 PolarHBondContact O-N 3.45Å; E96-S99 PolarHBondContact O-OG 3.42Å; M97-S99 VanDerWaalsContact C-N 3.34Å; M97-S99 PolarHBondContact O-N 3.29Å; S99-D102 PolarHBondContact O-N 3.14Å; S99-Q103 WeakPolarHBondContact O-CG 3.46Å; S99-Q103 PolarHBondContact O-N 2.88Å; S99-Q103 VanDerWaalsContact O-N 3.13Å
100	K	71.5	Confident	72.6	Confident	131 Å²	131	98.2 Å²	98.2	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-71.8	-34.9	178.9	-71.1	175.3	-178.6	168.8	0	111.8	E96 M97 L98 K104	E96-K100 PolarHBondContact O-N 3.27Å; M97-K100 PolarHBondContact O-N 3.12Å; L98-K100 VanDerWaalsContact C-N 3.27Å; L98-K100 PolarHBondContact O-N 3.06Å; K100-K104 PolarHBondContact O-N 2.88Å
101	I	75.6	Confident	72.1	Confident	87 Å²	87	97.8 Å²	97.8	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-41.5	175.9	-67.7	169.2	0	0	0	110.3	M97 L98 K104 K105	M97-I101 WeakPolarHBondContact O-CG1 3.42Å; M97-I101 PolarHBondContact O-N 3.39Å; L98-I101 PolarHBondContact O-N 3.38Å; L98-I101 VanDerWaalsContact O-N 3.14Å; I101-K104 PolarHBondContact O-N 2.5Å; I101-K105 PolarHBondContact O-N 3.5Å
102	D	71.7	Confident	71.4	Confident	88 Å²	88	99.6 Å²	99.6	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-67.9	-39.4	178.5	-68.1	-27.9	0	0	0	112.1	L98 S99 K104 K105 L106	L98-D102 PolarHBondContact O-N 3.07Å; L98-D102 VanDerWaalsContact O-N 3.15Å; S99-D102 PolarHBondContact O-N 3.14Å; D102-K104 VanDerWaalsContact C-N 3.34Å; D102-K104 PolarHBondContact O-N 2.72Å; D102-K105 PolarHBondContact O-N 2.89Å; D102-L106 WeakPolarHBondContact O-CG 3.45Å; D102-L106 PolarHBondContact O-N 3.14Å; D102-L106 VanDerWaalsContact O-N 3.09Å
103	Q	63.1	Low	70.8	Confident	130 Å²	130	99.4 Å²	99.4	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-60.2	-40.6	173.4	-75.3	177.1	5.6	0	0	112.9	S99 L106 L107	S99-Q103 WeakPolarHBondContact O-CG 3.46Å; S99-Q103 PolarHBondContact O-N 2.88Å; S99-Q103 VanDerWaalsContact O-N 3.13Å; Q103-L106 PolarHBondContact O-N 2.99Å; Q103-L107 PolarHBondContact O-N 2.95Å
104	K	67.3	Low	70.4	Confident	143 Å²	143	100.9 Å²	100.9	62%	0.622	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-43.5	177.2	-174.7	175.5	177.2	176.3	0	111.8	K100 I101 D102 L106 L107 D108	K100-K104 PolarHBondContact O-N 2.88Å; I101-K104 PolarHBondContact O-N 2.5Å; D102-K104 VanDerWaalsContact C-N 3.34Å; D102-K104 PolarHBondContact O-N 2.72Å; K104-L106 VanDerWaalsContact C-N 3.28Å; K104-L106 PolarHBondContact O-N 3.35Å; K104-L107 PolarHBondContact O-N 3.16Å; K104-D108 PolarHBondContact O-N 3.11Å
105	K	69.7	Low	70.2	Confident	132 Å²	132	102.7 Å²	102.7	57%	0.574	53%	0.531	S	S	*	.	H	α-helix	trans	-61.8	-35.7	177	-72.1	177	-178.9	172.4	0	112.5	I101 D102 A109	I101-K105 PolarHBondContact O-N 3.5Å; D102-K105 PolarHBondContact O-N 2.89Å; K105-A109 WeakPolarHBondContact O-CB 3.41Å; K105-A109 PolarHBondContact O-N 2.83Å; K105-A109 VanDerWaalsContact O-N 3.09Å
106	L	61.2	Low	69.6	Low	127 Å²	127	100.8 Å²	100.8	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-68.1	-38.8	176.9	-73	167.8	0	0	0	112.4	D102 Q103 K104 A109 G110	D102-L106 WeakPolarHBondContact O-CG 3.45Å; D102-L106 PolarHBondContact O-N 3.14Å; D102-L106 VanDerWaalsContact O-N 3.09Å; Q103-L106 PolarHBondContact O-N 2.99Å; K104-L106 VanDerWaalsContact C-N 3.28Å; K104-L106 PolarHBondContact O-N 3.35Å; L106-A109 PolarHBondContact O-N 2.86Å; L106-G110 PolarHBondContact O-N 3.28Å; L106-G110 VanDerWaalsContact O-N 3.13Å
107	L	59.5	Low	69	Low	121 Å²	121	98.2 Å²	98.2	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-65.5	-42.9	177.5	-160	81.7	0	0	0	111.6	Q103 K104 A109 G110 Q111	Q103-L107 PolarHBondContact O-N 2.95Å; K104-L107 PolarHBondContact O-N 3.16Å; L107-A109 VanDerWaalsContact C-N 3.34Å; L107-G110 PolarHBondContact O-N 3.48Å; L107-Q111 PolarHBondContact O-N 3.26Å
108	D	69.4	Low	68.9	Low	85 Å²	85	99.1 Å²	99.1	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-37.2	178	-67.8	-19.5	0	0	0	111.3	K104 V112	K104-D108 PolarHBondContact O-N 3.11Å; D108-V112 WeakPolarHBondContact O-CG2 3.42Å; D108-V112 PolarHBondContact O-N 3.05Å
109	A	56.8	Low	69	Low	46 Å²	46	98.3 Å²	98.3	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-42.6	175.1	0	0	0	0	0	112.7	K105 L106 L107 Q111 V112 D113	K105-A109 WeakPolarHBondContact O-CB 3.41Å; K105-A109 PolarHBondContact O-N 2.83Å; K105-A109 VanDerWaalsContact O-N 3.09Å; L106-A109 PolarHBondContact O-N 2.86Å; L107-A109 VanDerWaalsContact C-N 3.34Å; A109-Q111 VanDerWaalsContact C-N 3.32Å; A109-Q111 PolarHBondContact O-N 3.37Å; A109-V112 PolarHBondContact O-N 3.48Å; A109-D113 PolarHBondContact O-N 3.34Å; A109-D113 VanDerWaalsContact O-N 3.12Å
110	G	67.5	Low	69.3	Low	33 Å²	33	98.7 Å²	98.7	34%	0.34	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-32.6	-179.2	0	0	0	0	0	114.4	L106 L107 Q114	L106-G110 PolarHBondContact O-N 3.28Å; L106-G110 VanDerWaalsContact O-N 3.13Å; L107-G110 PolarHBondContact O-N 3.48Å; G110-Q114 PolarHBondContact O-N 3.35Å
111	Q	70	Confident	69.7	Low	125 Å²	125	100 Å²	100	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-70.4	-37.7	174.8	-68.5	-175.7	20	0	0	112.1	L107 A109 D113 Q114 V115	L107-Q111 PolarHBondContact O-N 3.26Å; A109-Q111 VanDerWaalsContact C-N 3.32Å; A109-Q111 PolarHBondContact O-N 3.37Å; Q111-D113 VanDerWaalsContact C-N 3.3Å; Q111-D113 PolarHBondContact O-N 3.06Å; Q111-Q114 PolarHBondContact O-N 3.22Å; Q111-V115 PolarHBondContact O-N 3.08Å
112	V	64	Low	70	Confident	74 Å²	74	100.5 Å²	100.5	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-38.1	176.1	173.9	0	0	0	0	111	D108 A109 V115 K116	D108-V112 WeakPolarHBondContact O-CG2 3.42Å; D108-V112 PolarHBondContact O-N 3.05Å; A109-V112 PolarHBondContact O-N 3.48Å; V112-V115 PolarHBondContact O-N 2.72Å; V112-K116 HydrophobicContact CG1-CD 4.13Å; V112-K116 WeakPolarHBondContact O-CG 3.43Å; V112-K116 PolarHBondContact O-N 3.05Å; V112-K116 VanDerWaalsContact O-N 3.08Å
113	D	71.5	Confident	70.5	Confident	98 Å²	98	102.7 Å²	102.7	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-66.1	-36.5	178.3	-69.2	-24.9	0	0	0	112.8	A109 Q111 K116 A117	A109-D113 PolarHBondContact O-N 3.34Å; A109-D113 VanDerWaalsContact O-N 3.12Å; Q111-D113 VanDerWaalsContact C-N 3.3Å; Q111-D113 PolarHBondContact O-N 3.06Å; D113-K116 PolarHBondContact O-N 3.47Å; D113-A117 WeakPolarHBondContact O-CB 3.48Å; D113-A117 PolarHBondContact O-N 3.36Å
114	Q	71.5	Confident	71.1	Confident	143 Å²	143	100.3 Å²	100.3	67%	0.668	52%	0.518	S	S	*	.	H	α-helix	trans	-63.5	-46.1	175.6	-71.8	-177.1	6.1	0	0	112	G110 Q111 K116 A117 E118	G110-Q114 PolarHBondContact O-N 3.35Å; Q111-Q114 PolarHBondContact O-N 3.22Å; Q114-K116 VanDerWaalsContact C-N 3.33Å; Q114-K116 PolarHBondContact O-N 3.33Å; Q114-A117 PolarHBondContact O-N 3.46Å; Q114-E118 PolarHBondContact O-N 3.21Å; Q114-E118 VanDerWaalsContact O-N 3.1Å
115	V	74	Confident	72	Confident	85 Å²	85	98.6 Å²	98.6	52%	0.515	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-40.9	178	176.8	0	0	0	0	110.9	Q111 V112 E118 I119	Q111-V115 PolarHBondContact O-N 3.08Å; V112-V115 PolarHBondContact O-N 2.72Å; V115-E118 PolarHBondContact O-N 3.13Å; V115-I119 HydrophobicContact CG1-CD1 4Å; V115-I119 VanDerWaalsContact O-CG1 3.3Å; V115-I119 WeakPolarHBondContact O-CG1 3.43Å; V115-I119 PolarHBondContact O-N 3.42Å; V115-I119 VanDerWaalsContact O-N 3.1Å
116	K	69.7	Low	72.6	Confident	81 Å²	81	98.3 Å²	98.3	35%	0.352	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-38.2	176.7	-74.1	178.4	176.7	-176.6	0	112.8	V112 D113 Q114 I119 T120	V112-K116 HydrophobicContact CG1-CD 4.13Å; V112-K116 WeakPolarHBondContact O-CG 3.43Å; V112-K116 PolarHBondContact O-N 3.05Å; V112-K116 VanDerWaalsContact O-N 3.08Å; D113-K116 PolarHBondContact O-N 3.47Å; Q114-K116 VanDerWaalsContact C-N 3.33Å; Q114-K116 PolarHBondContact O-N 3.33Å; K116-I119 PolarHBondContact O-N 3.45Å; K116-T120 WeakPolarHBondContact O-CB 3.42Å; K116-T120 PolarHBondContact O-N 3.2Å; K116-T120 PolarHBondContact O-OG1 3.48Å
117	A	69.5	Low	73.5	Confident	61 Å²	61	96.3 Å²	96.3	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-42.5	176.9	0	0	0	0	0	111.8	D113 Q114 T120 K121	D113-A117 WeakPolarHBondContact O-CB 3.48Å; D113-A117 PolarHBondContact O-N 3.36Å; Q114-A117 PolarHBondContact O-N 3.46Å; A117-T120 PolarHBondContact O-N 3.49Å; A117-K121 WeakPolarHBondContact O-CB 3.34Å; A117-K121 PolarHBondContact O-N 3.43Å
118	E	74	Confident	74.7	Confident	136 Å²	136	93.9 Å²	93.9	64%	0.636	49%	0.491	S	S	*	.	H	α-helix	trans	-63.2	-43.1	175.2	-72.5	-170.5	160.4	0	0	112.3	Q114 V115 T120 K121 N122	Q114-E118 PolarHBondContact O-N 3.21Å; Q114-E118 VanDerWaalsContact O-N 3.1Å; V115-E118 PolarHBondContact O-N 3.13Å; E118-T120 PolarHBondContact O-N 3.11Å; E118-K121 PolarHBondContact O-N 3.34Å; E118-N122 PolarHBondContact O-N 3.28Å; E118-N122 PolarHBondContact O-ND2 2.89Å
119	I	78.4	Confident	75.6	Confident	84 Å²	84	95 Å²	95	43%	0.431	49%	0.493	S	S	.	.	H	α-helix	trans	-60.3	-47	175.5	-69.1	168.9	0	0	0	110.7	V115 K116 K121 N122 F123	V115-I119 HydrophobicContact CG1-CD1 4Å; V115-I119 VanDerWaalsContact O-CG1 3.3Å; V115-I119 WeakPolarHBondContact O-CG1 3.43Å; V115-I119 PolarHBondContact O-N 3.42Å; V115-I119 VanDerWaalsContact O-N 3.1Å; K116-I119 PolarHBondContact O-N 3.45Å; I119-K121 PolarHBondContact O-N 3.43Å; I119-N122 PolarHBondContact O-N 3.01Å; I119-F123 HydrophobicContact CG2-CD2 3.61Å; I119-F123 HydrophobicContact CG2-CE2 3.48Å; I119-F123 VanDerWaalsContact CG2-CE2 3.48Å; I119-F123 VanDerWaalsContact O-CD2 3.24Å; I119-F123 WeakPolarHBondContact O-CD2 3.45Å; I119-F123 PolarHBondContact O-N 3.33Å; I119-F123 VanDerWaalsContact O-N 3.11Å
120	T	79.2	Confident	77.1	Confident	63 Å²	63	98.5 Å²	98.5	39%	0.387	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-41.6	-178.3	-55	0	0	0	0	111.7	K116 A117 E118 N122 F123 Q124 P295	K116-T120 WeakPolarHBondContact O-CB 3.42Å; K116-T120 PolarHBondContact O-N 3.2Å; K116-T120 PolarHBondContact O-OG1 3.48Å; A117-T120 PolarHBondContact O-N 3.49Å; E118-T120 PolarHBondContact O-N 3.11Å; T120-N122 VanDerWaalsContact C-N 3.35Å; T120-N122 PolarHBondContact O-N 3.12Å; T120-F123 PolarHBondContact O-N 2.84Å; T120-Q124 PolarHBondContact O-N 3.45Å; T120-P295 HydrophobicContact CG2-CG 4.32Å
121	K	81.2	Confident	78.1	Confident	157 Å²	157	102.4 Å²	102.4	68%	0.683	51%	0.509	S	S	*	.	H	α-helix	trans	-61.5	-42.1	177.8	-173.8	179.7	177.3	-176.8	0	112.1	A117 E118 I119 Q124 Q125	A117-K121 WeakPolarHBondContact O-CB 3.34Å; A117-K121 PolarHBondContact O-N 3.43Å; E118-K121 PolarHBondContact O-N 3.34Å; I119-K121 PolarHBondContact O-N 3.43Å; K121-Q124 PolarHBondContact O-N 3Å; K121-Q125 PolarHBondContact O-N 3.44Å
122	N	81.5	Confident	78.9	Confident	98 Å²	98	103 Å²	103	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-40.5	178.1	-71.9	-26.9	0	0	0	112.2	E118 I119 T120 Q125 Q126	E118-N122 PolarHBondContact O-N 3.28Å; E118-N122 PolarHBondContact O-ND2 2.89Å; I119-N122 PolarHBondContact O-N 3.01Å; T120-N122 VanDerWaalsContact C-N 3.35Å; T120-N122 PolarHBondContact O-N 3.12Å; N122-Q125 PolarHBondContact O-N 3.04Å; N122-Q126 PolarHBondContact O-N 2.78Å
123	F	81	Confident	80	Confident	134 Å²	134	106.6 Å²	106.6	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-66.4	-40.2	176.6	-82.8	-66.3	0	0	0	112.7	I119 T120 Q125 Q126 L127	I119-F123 HydrophobicContact CG2-CD2 3.61Å; I119-F123 HydrophobicContact CG2-CE2 3.48Å; I119-F123 VanDerWaalsContact CG2-CE2 3.48Å; I119-F123 VanDerWaalsContact O-CD2 3.24Å; I119-F123 WeakPolarHBondContact O-CD2 3.45Å; I119-F123 PolarHBondContact O-N 3.33Å; I119-F123 VanDerWaalsContact O-N 3.11Å; T120-F123 PolarHBondContact O-N 2.84Å; F123-Q125 VanDerWaalsContact C-N 3.33Å; F123-Q125 PolarHBondContact O-N 3Å; F123-Q126 PolarHBondContact O-N 3.04Å; F123-L127 WeakPolarHBondContact O-CB 3.11Å; F123-L127 PolarHBondContact O-N 3.43Å
124	Q	76.3	Confident	80.5	Confident	80 Å²	80	104.9 Å²	104.9	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-42.1	178	-174.6	57.9	42.7	0	0	111.6	T120 K121 Q126 L127 D128	T120-Q124 PolarHBondContact O-N 3.45Å; K121-Q124 PolarHBondContact O-N 3Å; Q124-Q126 PolarHBondContact O-N 3.45Å; Q124-L127 PolarHBondContact O-N 3.07Å; Q124-D128 PolarHBondContact NE2-OD1 3.2Å; Q124-D128 PolarHBondContact NE2-OD2 2.6Å; Q124-D128 VanDerWaalsContact NE2-OD2 3.12Å; Q124-D128 PolarHBondContact O-N 3.36Å
125	Q	85.6	Confident	81	Confident	107 Å²	107	104.4 Å²	104.4	50%	0.5	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-46.1	176.9	-175.8	178.4	-13.5	0	0	112.1	K121 N122 F123 L127 D128 E129	K121-Q125 PolarHBondContact O-N 3.44Å; N122-Q125 PolarHBondContact O-N 3.04Å; F123-Q125 VanDerWaalsContact C-N 3.33Å; F123-Q125 PolarHBondContact O-N 3Å; Q125-L127 VanDerWaalsContact C-N 3.27Å; Q125-L127 PolarHBondContact O-N 3.2Å; Q125-D128 PolarHBondContact O-N 3.18Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.49Å; Q125-E129 PolarHBondContact NE2-OE1 3.43Å; Q125-E129 WeakPolarHBondContact O-CG 3.19Å; Q125-E129 PolarHBondContact O-N 3.22Å
126	Q	82.9	Confident	81.4	Confident	126 Å²	126	105.8 Å²	105.8	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-62	-37.2	177.1	-71.1	-176.6	1.7	0	0	112.2	N122 F123 Q124 E130	N122-Q126 PolarHBondContact O-N 2.78Å; F123-Q126 PolarHBondContact O-N 3.04Å; Q124-Q126 PolarHBondContact O-N 3.45Å; Q126-E130 WeakPolarHBondContact O-CB 3.45Å; Q126-E130 PolarHBondContact O-N 3.1Å
127	L	79.8	Confident	82	Confident	86 Å²	86	106.3 Å²	106.3	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-70	-37	-178.7	-156.8	146.5	0	0	0	111.9	F123 Q124 Q125 K131	F123-L127 WeakPolarHBondContact O-CB 3.11Å; F123-L127 PolarHBondContact O-N 3.43Å; Q124-L127 PolarHBondContact O-N 3.07Å; Q125-L127 VanDerWaalsContact C-N 3.27Å; Q125-L127 PolarHBondContact O-N 3.2Å; L127-K131 HydrophobicContact CD2-CD 3.96Å; L127-K131 HydrophobicContact CD2-CG 4.46Å; L127-K131 WeakPolarHBondContact O-CG 3.45Å; L127-K131 PolarHBondContact O-N 3.1Å; L127-K131 VanDerWaalsContact O-N 3.08Å
128	D	84.5	Confident	82.5	Confident	70 Å²	70	109.4 Å²	109.4	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-71.2	-39.7	176	-69.1	-27.7	0	0	0	112.1	Q124 Q125 E130 K131 Q132	Q124-D128 PolarHBondContact NE2-OD1 3.2Å; Q124-D128 PolarHBondContact NE2-OD2 2.6Å; Q124-D128 VanDerWaalsContact NE2-OD2 3.12Å; Q124-D128 PolarHBondContact O-N 3.36Å; Q125-D128 PolarHBondContact O-N 3.18Å; D128-E130 PolarHBondContact O-N 3.37Å; D128-K131 PolarHBondContact O-N 2.69Å; D128-Q132 WeakPolarHBondContact O-CG 3.49Å; D128-Q132 PolarHBondContact O-N 3.37Å; D128-Q132 VanDerWaalsContact O-N 3.12Å
129	E	87.8	Confident	82.8	Confident	107 Å²	107	109.8 Å²	109.8	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-43	173.7	-73.5	174.4	-166.7	0	0	111.5	Q125 Q132 R133	Q125-E129 WeakPolarHBondContact CG-OE1 3.49Å; Q125-E129 PolarHBondContact NE2-OE1 3.43Å; Q125-E129 WeakPolarHBondContact O-CG 3.19Å; Q125-E129 PolarHBondContact O-N 3.22Å; E129-Q132 PolarHBondContact O-N 3.03Å; E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 PolarHBondContact O-N 3.09Å; E129-R133 VanDerWaalsContact O-N 3.08Å
130	E	88.3	Confident	82.9	Confident	121 Å²	121	111 Å²	111	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-71.5	-36.1	-179.2	-159.7	64.7	-172.2	0	0	112.5	Q126 D128 R133 S134	Q126-E130 WeakPolarHBondContact O-CB 3.45Å; Q126-E130 PolarHBondContact O-N 3.1Å; D128-E130 PolarHBondContact O-N 3.37Å; E130-R133 WeakPolarHBondContact O-CB 3.35Å; E130-R133 PolarHBondContact O-N 3.26Å; E130-S134 PolarHBondContact O-N 3.28Å
131	K	88.7	Confident	83	Confident	115 Å²	115	112.5 Å²	112.5	50%	0.5	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-45.5	172.8	-82.1	175.9	177.2	168.4	0	112.3	L127 D128 R133 S134 Q135	L127-K131 HydrophobicContact CD2-CD 3.96Å; L127-K131 HydrophobicContact CD2-CG 4.46Å; L127-K131 WeakPolarHBondContact O-CG 3.45Å; L127-K131 PolarHBondContact O-N 3.1Å; L127-K131 VanDerWaalsContact O-N 3.08Å; D128-K131 PolarHBondContact O-N 2.69Å; K131-R133 VanDerWaalsContact C-N 3.26Å; K131-R133 PolarHBondContact O-N 2.76Å; K131-S134 PolarHBondContact O-N 3Å; K131-Q135 WeakPolarHBondContact O-CG 3.48Å; K131-Q135 PolarHBondContact O-N 3.02Å
132	Q	87.8	Confident	82.9	Confident	137 Å²	137	108.8 Å²	108.8	64%	0.64	51%	0.514	S	S	*	.	H	α-helix	trans	-61.7	-39.1	176.5	-72.2	-179.8	6.2	0	0	111.2	D128 E129 M136	D128-Q132 WeakPolarHBondContact O-CG 3.49Å; D128-Q132 PolarHBondContact O-N 3.37Å; D128-Q132 VanDerWaalsContact O-N 3.12Å; E129-Q132 PolarHBondContact O-N 3.03Å; Q132-M136 WeakPolarHBondContact O-CB 3.31Å; Q132-M136 PolarHBondContact O-N 3.42Å; Q132-M136 VanDerWaalsContact O-N 3.1Å
133	R	86.7	Confident	82.8	Confident	150 Å²	150	108.2 Å²	108.2	57%	0.566	51%	0.511	S	S	*	.	H	α-helix	trans	-63.9	-45.5	175.7	-159.9	173.2	-170.5	168	2.7	111.9	E129 E130 K131 Q135 M136 L137	E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 PolarHBondContact O-N 3.09Å; E129-R133 VanDerWaalsContact O-N 3.08Å; E130-R133 WeakPolarHBondContact O-CB 3.35Å; E130-R133 PolarHBondContact O-N 3.26Å; K131-R133 VanDerWaalsContact C-N 3.26Å; K131-R133 PolarHBondContact O-N 2.76Å; R133-Q135 PolarHBondContact O-N 2.96Å; R133-M136 PolarHBondContact O-N 3.44Å; R133-L137 HydrophobicContact CG-CD1 3.99Å; R133-L137 WeakPolarHBondContact O-CD1 3.33Å; R133-L137 PolarHBondContact O-N 2.92Å
134	S	81.3	Confident	82.9	Confident	61 Å²	61	105.9 Å²	105.9	43%	0.427	51%	0.511	S	S	.	.	H	α-helix	trans	-58.8	-47.9	177	-165.4	0	0	0	0	112.1	E130 K131 M136 L137 E138	E130-S134 PolarHBondContact O-N 3.28Å; K131-S134 PolarHBondContact O-N 3Å; S134-M136 VanDerWaalsContact C-N 3.32Å; S134-M136 PolarHBondContact O-N 3.36Å; S134-L137 PolarHBondContact O-N 2.84Å; S134-E138 WeakPolarHBondContact O-CG 3.46Å; S134-E138 PolarHBondContact O-N 3.2Å
135	Q	81.9	Confident	83.3	Confident	134 Å²	134	104.7 Å²	104.7	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-62.6	-38.6	178.7	-71	178.2	-5.6	0	0	112.5	K131 R133 K139	K131-Q135 WeakPolarHBondContact O-CG 3.48Å; K131-Q135 PolarHBondContact O-N 3.02Å; R133-Q135 PolarHBondContact O-N 2.96Å; Q135-K139 PolarHBondContact O-N 3.47Å; Q135-K139 VanDerWaalsContact O-N 3.16Å
136	M	83.3	Confident	83.3	Confident	113 Å²	113	99.7 Å²	99.7	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-67.9	-40.3	176.8	-170.5	169	64	0	0	111.8	Q132 R133 S134 Q140	Q132-M136 WeakPolarHBondContact O-CB 3.31Å; Q132-M136 PolarHBondContact O-N 3.42Å; Q132-M136 VanDerWaalsContact O-N 3.1Å; R133-M136 PolarHBondContact O-N 3.44Å; S134-M136 VanDerWaalsContact C-N 3.32Å; S134-M136 PolarHBondContact O-N 3.36Å; M136-Q140 WeakPolarHBondContact O-CG 3.19Å; M136-Q140 PolarHBondContact O-N 3.37Å; M136-Q140 VanDerWaalsContact O-N 3.1Å
137	L	82.5	Confident	83.5	Confident	92 Å²	92	94.5 Å²	94.5	48%	0.482	46%	0.463	S	S	.	.	H	α-helix	trans	-66.4	-42.9	175.9	-96.1	71.5	0	0	0	112	R133 S134 K139 Q140 L141	R133-L137 HydrophobicContact CG-CD1 3.99Å; R133-L137 WeakPolarHBondContact O-CD1 3.33Å; R133-L137 PolarHBondContact O-N 2.92Å; S134-L137 PolarHBondContact O-N 2.84Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 2.94Å; L137-Q140 PolarHBondContact O-N 2.89Å; L137-L141 WeakPolarHBondContact O-CB 3.06Å; L137-L141 PolarHBondContact O-N 3.35Å
138	E	79.3	Confident	83.8	Confident	126 Å²	126	92.5 Å²	92.5	59%	0.589	46%	0.464	S	S	*	.	H	α-helix	trans	-58.8	-44	176.5	-79.7	176.2	-169.6	0	0	111.7	S134 L141 Y142	S134-E138 WeakPolarHBondContact O-CG 3.46Å; S134-E138 PolarHBondContact O-N 3.2Å; E138-L141 WeakPolarHBondContact O-CB 3.27Å; E138-L141 PolarHBondContact O-N 3.49Å; E138-Y142 WeakPolarHBondContact O-CB 3.29Å; E138-Y142 PolarHBondContact O-N 3.21Å
139	K	80.3	Confident	84	Confident	145 Å²	145	90.8 Å²	90.8	63%	0.63	46%	0.457	S	S	*	.	H	α-helix	trans	-63.2	-44.4	176.4	-172.1	178.8	178.7	-178.1	0	112.1	Q135 L137 L141 Y142 D143	Q135-K139 PolarHBondContact O-N 3.47Å; Q135-K139 VanDerWaalsContact O-N 3.16Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 2.94Å; K139-L141 VanDerWaalsContact C-N 3.31Å; K139-L141 PolarHBondContact O-N 3.38Å; K139-Y142 WeakPolarHBondContact O-CB 3.35Å; K139-Y142 PolarHBondContact O-N 3.41Å; K139-D143 PolarHBondContact O-N 2.79Å
140	Q	81.7	Confident	84.2	Confident	109 Å²	109	85.8 Å²	85.8	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-64	-36.9	176.7	-74.3	178.7	-19.4	0	0	112.6	M136 L137 S144	M136-Q140 WeakPolarHBondContact O-CG 3.19Å; M136-Q140 PolarHBondContact O-N 3.37Å; M136-Q140 VanDerWaalsContact O-N 3.1Å; L137-Q140 PolarHBondContact O-N 2.89Å; Q140-S144 WeakPolarHBondContact O-CB 3.42Å; Q140-S144 PolarHBondContact O-N 3.46Å; Q140-S144 PolarHBondContact O-OG 3.33Å
141	L	80.3	Confident	84.2	Confident	94 Å²	94	84 Å²	84	49%	0.492	44%	0.44	S	S	.	.	H	α-helix	trans	-65.7	-45	176.1	-169	99.7	0	0	0	110.9	L137 E138 K139 S144 M145	L137-L141 WeakPolarHBondContact O-CB 3.06Å; L137-L141 PolarHBondContact O-N 3.35Å; E138-L141 WeakPolarHBondContact O-CB 3.27Å; E138-L141 PolarHBondContact O-N 3.49Å; K139-L141 VanDerWaalsContact C-N 3.31Å; K139-L141 PolarHBondContact O-N 3.38Å; L141-S144 PolarHBondContact O-N 2.88Å; L141-M145 HydrophobicContact CD2-CE 3.34Å; L141-M145 HydrophobicContact CD2-SD 4.28Å; L141-M145 HydrophobicContact CG-CE 3.64Å; L141-M145 HydrophobicContact CG-CG 4.44Å; L141-M145 HydrophobicContact CG-SD 4.2Å; L141-M145 WeakPolarHBondContact O-CB 3.33Å; L141-M145 WeakPolarHBondContact O-CG 3.4Å; L141-M145 PolarHBondContact O-N 2.78Å
142	Y	79.3	Confident	84.2	Confident	80 Å²	80	81.6 Å²	81.6	31%	0.314	45%	0.448	S	S	.	.	H	α-helix	trans	-56.9	-51.3	175.6	-179.8	-91.8	0	0	0	111.4	E138 K139 S144 I146 G172 F175 V177	E138-Y142 WeakPolarHBondContact O-CB 3.29Å; E138-Y142 PolarHBondContact O-N 3.21Å; K139-Y142 WeakPolarHBondContact O-CB 3.35Å; K139-Y142 PolarHBondContact O-N 3.41Å; Y142-S144 VanDerWaalsContact C-N 3.31Å; Y142-S144 PolarHBondContact O-N 3.2Å; Y142-I146 HydrophobicContact CD1-CD1 4.16Å; Y142-I146 HydrophobicContact CD2-CD1 3.61Å; Y142-I146 HydrophobicContact CE1-CD1 3.75Å; Y142-I146 HydrophobicContact CE2-CD1 3.12Å; Y142-I146 HydrophobicContact CG-CD1 4.09Å; Y142-I146 WeakPolarHBondContact O-CB 3.41Å; Y142-I146 PolarHBondContact O-N 3.47Å; Y142-I146 VanDerWaalsContact O-N 3.14Å; Y142-I146 WeakPolarHBondContact OH-CD1 3.34Å; Y142-G172 PolarHBondContact OH-O 3.36Å; Y142-F175 WeakPolarHBondContact CE2-O 3.41Å; Y142-F175 PolarHBondContact OH-O 2.78Å; Y142-V177 HydrophobicContact CD2-CG2 4.08Å
143	D	79.2	Confident	84.4	Confident	86 Å²	86	75.5 Å²	75.5	46%	0.46	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-39.5	179.6	-69.6	-21.7	0	0	0	111.8	K139 G147	K139-D143 PolarHBondContact O-N 2.79Å; D143-G147 WeakPolarHBondContact O-CA 3.24Å; D143-G147 PolarHBondContact O-N 2.77Å
144	S	83.1	Confident	84.5	Confident	85 Å²	85	75.2 Å²	75.2	59%	0.594	42%	0.423	S	S	*	.	H	α-helix	trans	-73.6	-44.6	-178.4	-59.7	0	0	0	0	113.1	Q140 L141 Y142 G148	Q140-S144 WeakPolarHBondContact O-CB 3.42Å; Q140-S144 PolarHBondContact O-N 3.46Å; Q140-S144 PolarHBondContact O-OG 3.33Å; L141-S144 PolarHBondContact O-N 2.88Å; Y142-S144 VanDerWaalsContact C-N 3.31Å; Y142-S144 PolarHBondContact O-N 3.2Å; S144-G148 PolarHBondContact O-N 3.44Å
145	M	85.5	Confident	84.9	Confident	55 Å²	55	73.3 Å²	73.3	27%	0.271	41%	0.407	S	S	.	.	H	α-helix	trans	-71	-46.5	-176.7	-71.2	-165.4	-57.6	0	0	111.6	L141 S149 V177 I182	L141-M145 HydrophobicContact CD2-CE 3.34Å; L141-M145 HydrophobicContact CD2-SD 4.28Å; L141-M145 HydrophobicContact CG-CE 3.64Å; L141-M145 HydrophobicContact CG-CG 4.44Å; L141-M145 HydrophobicContact CG-SD 4.2Å; L141-M145 WeakPolarHBondContact O-CB 3.33Å; L141-M145 WeakPolarHBondContact O-CG 3.4Å; L141-M145 PolarHBondContact O-N 2.78Å; M145-S149 PolarHBondContact O-N 3.06Å; M145-S149 PolarHBondContact O-OG 3.08Å; M145-V177 HydrophobicContact CE-CB 3.9Å; M145-V177 HydrophobicContact CE-CG1 3.29Å; M145-V177 HydrophobicContact CE-CG2 3.3Å; M145-I182 HydrophobicContact CB-CD1 4.38Å
146	I	85.5	Confident	85.4	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-69.6	-46.7	179.4	-66.7	171.5	0	0	0	109.8	Y142 G148 S149 F150 Q168 F175 I182	Y142-I146 HydrophobicContact CD1-CD1 4.16Å; Y142-I146 HydrophobicContact CD2-CD1 3.61Å; Y142-I146 HydrophobicContact CE1-CD1 3.75Å; Y142-I146 HydrophobicContact CE2-CD1 3.12Å; Y142-I146 HydrophobicContact CG-CD1 4.09Å; Y142-I146 WeakPolarHBondContact O-CB 3.41Å; Y142-I146 PolarHBondContact O-N 3.47Å; Y142-I146 VanDerWaalsContact O-N 3.14Å; Y142-I146 WeakPolarHBondContact OH-CD1 3.34Å; I146-G148 VanDerWaalsContact C-N 3.3Å; I146-G148 PolarHBondContact O-N 3.05Å; I146-S149 PolarHBondContact O-N 3.27Å; I146-S149 VanDerWaalsContact O-N 3.15Å; I146-F150 HydrophobicContact CG2-CD2 3.73Å; I146-F150 HydrophobicContact CG2-CE2 3.7Å; I146-F150 WeakPolarHBondContact O-CD2 3.41Å; I146-F150 PolarHBondContact O-N 3.12Å; I146-Q168 HydrophobicContact CG2-CG 4.49Å; I146-F175 HydrophobicContact CD1-CB 3.96Å; I146-F175 WeakPolarHBondContact CD1-O 3.43Å; I146-F175 HydrophobicContact CG1-CB 4.25Å; I146-I182 HydrophobicContact CG1-CD1 4.46Å
147	G	86.3	Confident	85.6	Confident	17 Å²	17	65.1 Å²	65.1	18%	0.175	38%	0.378	C	S	.	.	H	α-helix	trans	-57.2	-42.4	176.5	0	0	0	0	0	112.8	D143 F150 A151	D143-G147 WeakPolarHBondContact O-CA 3.24Å; D143-G147 PolarHBondContact O-N 2.77Å; G147-F150 PolarHBondContact O-N 2.82Å; G147-A151 WeakPolarHBondContact O-CB 3.29Å; G147-A151 PolarHBondContact O-N 2.95Å
148	G	86.5	Confident	85.9	Confident	44 Å²	44	65.1 Å²	65.1	45%	0.454	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-42.2	175.5	0	0	0	0	0	113.4	S144 I146 A151 G152	S144-G148 PolarHBondContact O-N 3.44Å; I146-G148 VanDerWaalsContact C-N 3.3Å; I146-G148 PolarHBondContact O-N 3.05Å; G148-A151 PolarHBondContact O-N 2.65Å; G148-G152 PolarHBondContact O-N 2.76Å
149	S	89.3	Confident	86.5	Confident	34 Å²	34	65 Å²	65	24%	0.238	38%	0.376	C	S	.	.	H	α-helix	trans	-66.6	-39.5	177.2	-64.3	0	0	0	0	113	M145 I146 G152 S153 I182 F204	M145-S149 PolarHBondContact O-N 3.06Å; M145-S149 PolarHBondContact O-OG 3.08Å; I146-S149 PolarHBondContact O-N 3.27Å; I146-S149 VanDerWaalsContact O-N 3.15Å; S149-G152 PolarHBondContact O-N 3.01Å; S149-S153 WeakPolarHBondContact O-CB 3.27Å; S149-S153 PolarHBondContact O-N 3.28Å; S149-S153 VanDerWaalsContact O-N 3.08Å; S149-I182 WeakPolarHBondContact OG-CD1 3.31Å; S149-F204 VanDerWaalsContact O-CE1 3.28Å; S149-F204 WeakPolarHBondContact O-CE1 3.25Å
150	F	91.8	Very high	87	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	35%	0.347	C	S	.	.	H	α-helix	trans	-65.3	-40.8	173.5	-86.3	-90.2	0	0	0	112.1	I146 G147 I156 L167 Q168 F171 F175 F204 L208	I146-F150 HydrophobicContact CG2-CD2 3.73Å; I146-F150 HydrophobicContact CG2-CE2 3.7Å; I146-F150 WeakPolarHBondContact O-CD2 3.41Å; I146-F150 PolarHBondContact O-N 3.12Å; G147-F150 PolarHBondContact O-N 2.82Å; F150-I156 HydrophobicContact CB-CD1 4.35Å; F150-I156 HydrophobicContact CD1-CD1 3.61Å; F150-I156 HydrophobicContact CE1-CD1 4.32Å; F150-I156 HydrophobicContact CG-CD1 4.33Å; F150-I156 WeakPolarHBondContact O-CD1 3.37Å; F150-L167 HydrophobicContact CD1-CB 4.46Å; F150-L167 HydrophobicContact CD1-CD2 4.35Å; F150-L167 HydrophobicContact CE1-CB 4.38Å; F150-L167 HydrophobicContact CE1-CD2 4.15Å; F150-L167 HydrophobicContact CE1-CG 4.12Å; F150-Q168 HydrophobicContact CB-CB 4.19Å; F150-Q168 HydrophobicContact CB-CG 4.46Å; F150-Q168 HydrophobicContact CD1-CB 3.79Å; F150-Q168 HydrophobicContact CD1-CG 4.45Å; F150-Q168 HydrophobicContact CD2-CB 4.02Å; F150-Q168 HydrophobicContact CD2-CG 3.77Å; F150-Q168 HydrophobicContact CE1-CB 4.17Å; F150-Q168 HydrophobicContact CE2-CB 4.38Å; F150-Q168 HydrophobicContact CE2-CG 4.11Å; F150-Q168 HydrophobicContact CG-CB 3.73Å; F150-Q168 HydrophobicContact CG-CG 3.98Å; F150-Q168 HydrophobicContact CZ-CB 4.45Å; F150-F171 HydrophobicContact CE1-CB 4.36Å; F150-F171 HydrophobicContact CZ-CB 4.11Å; F150-F175 AromaticContact CE2-CD2 3.83Å; F150-F175 HydrophobicContact CE2-CD2 3.83Å; F150-F175 AromaticContact CE2-CE2 3.91Å; F150-F175 HydrophobicContact CE2-CE2 3.91Å; F150-F175 AromaticContact CZ-CD2 3.93Å; F150-F175 HydrophobicContact CZ-CD2 3.93Å; F150-F175 AromaticContact CZ-CE2 3.62Å; F150-F175 HydrophobicContact CZ-CE2 3.62Å; F150-F204 HydrophobicContact CB-CZ 4.41Å; F150-F204 HydrophobicContact CD1-CZ 4.15Å; F150-F204 AromaticContact CD2-CE2 3.83Å; F150-F204 HydrophobicContact CD2-CE2 3.83Å; F150-F204 AromaticContact CD2-CZ 3.47Å; F150-F204 HydrophobicContact CD2-CZ 3.47Å; F150-F204 VanDerWaalsContact CD2-CZ 3.47Å; F150-F204 HydrophobicContact CE1-CZ 4.25Å; F150-F204 AromaticContact CE2-CE2 3.7Å; F150-F204 HydrophobicContact CE2-CE2 3.7Å; F150-F204 AromaticContact CE2-CZ 3.6Å; F150-F204 HydrophobicContact CE2-CZ 3.6Å; F150-F204 AromaticContact CG-CZ 3.76Å; F150-F204 HydrophobicContact CG-CZ 3.76Å; F150-F204 HydrophobicContact CZ-CE2 4.34Å; F150-F204 AromaticContact CZ-CZ 3.99Å; F150-F204 HydrophobicContact CZ-CZ 3.99Å; F150-L208 HydrophobicContact CE1-CD1 4.08Å; F150-L208 HydrophobicContact CE1-CD2 4.42Å; F150-L208 HydrophobicContact CZ-CD1 4.29Å
151	A	88.5	Confident	87.3	Confident	84 Å²	84	56.1 Å²	56.1	69%	0.694	35%	0.347	S	S	*	.	H	α-helix	trans	-68.5	-34	178.7	0	0	0	0	0	113.2	G147 G148	G147-A151 WeakPolarHBondContact O-CB 3.29Å; G147-A151 PolarHBondContact O-N 2.95Å; G148-A151 PolarHBondContact O-N 2.65Å
152	G	87.3	Confident	87.7	Confident	65 Å²	65	54 Å²	54	67%	0.67	34%	0.336	S	S	*	.	H	α-helix	trans	-95.6	-0.9	-176.7	0	0	0	0	0	116	G148 S149 K154	G148-G152 PolarHBondContact O-N 2.76Å; S149-G152 PolarHBondContact O-N 3.01Å; G152-K154 PolarHBondContact O-N 2.74Å
153	S	91.9	Very high	88.2	Confident	8 Å²	8	54.4 Å²	54.4	6%	0.056	35%	0.348	C	S	.	.			trans	-65.6	124.9	-175.3	172.4	0	0	0	0	112.7	S149 Y155 I156 A157 D205	S149-S153 WeakPolarHBondContact O-CB 3.27Å; S149-S153 PolarHBondContact O-N 3.28Å; S149-S153 VanDerWaalsContact O-N 3.08Å; S153-Y155 PolarHBondContact OG-N 2.92Å; S153-I156 PolarHBondContact O-N 2.79Å; S153-I156 WeakPolarHBondContact OG-CG1 3.16Å; S153-I156 PolarHBondContact OG-N 2.96Å; S153-I156 VanDerWaalsContact OG-N 3.07Å; S153-A157 PolarHBondContact O-N 2.84Å; S153-D205 WeakPolarHBondContact CB-OD1 3.3Å; S153-D205 PolarHBondContact OG-OD1 3.07Å
154	K	89.4	Confident	88.7	Confident	144 Å²	144	51.7 Å²	51.7	63%	0.626	34%	0.338	S	S	*	.	H	α-helix	trans	-71.8	-36.2	175	-171	177.5	179.6	-175	0	110.9	G152 I156 A157 D158 D205	G152-K154 PolarHBondContact O-N 2.74Å; K154-I156 PolarHBondContact O-N 3.26Å; K154-A157 PolarHBondContact O-N 3.17Å; K154-D158 WeakPolarHBondContact CE-OD2 3.48Å; K154-D158 WeakPolarHBondContact O-CB 3.31Å; K154-D158 PolarHBondContact O-N 2.75Å; K154-D205 PolarHBondContact N-OD2 2.85Å
155	Y	90.5	Very high	88.9	Confident	22 Å²	22	53.4 Å²	53.4	9%	0.086	34%	0.34	C	S	.	.	H	α-helix	trans	-58.4	-45.4	174.1	178.5	-101.3	0	0	0	112	S153 D158 K159 I160 D205 L208 E209 V212	S153-Y155 PolarHBondContact OG-N 2.92Å; Y155-D158 PolarHBondContact O-N 3.1Å; Y155-K159 HydrophobicContact CD2-CB 4.2Å; Y155-K159 HydrophobicContact CD2-CG 4.05Å; Y155-K159 HydrophobicContact CE2-CB 3.98Å; Y155-K159 HydrophobicContact CE2-CG 4.02Å; Y155-K159 WeakPolarHBondContact O-CB 3.44Å; Y155-K159 PolarHBondContact O-N 3.34Å; Y155-I160 HydrophobicContact CD1-CD1 4.46Å; Y155-I160 HydrophobicContact CD1-CG1 4.19Å; Y155-I160 HydrophobicContact CE1-CD1 3.75Å; Y155-I160 HydrophobicContact CE1-CG1 3.98Å; Y155-D205 PolarHBondContact N-OD2 2.72Å; Y155-L208 HydrophobicContact CD1-CD2 4.02Å; Y155-L208 HydrophobicContact CD1-CG 4.15Å; Y155-L208 HydrophobicContact CE1-CG 4.33Å; Y155-E209 HydrophobicContact CD2-CB 4.06Å; Y155-E209 HydrophobicContact CD2-CG 4.33Å; Y155-E209 HydrophobicContact CE1-CB 4.2Å; Y155-E209 HydrophobicContact CE2-CB 3.63Å; Y155-E209 HydrophobicContact CE2-CG 3.57Å; Y155-V212 HydrophobicContact CE1-CB 4.36Å; Y155-V212 HydrophobicContact CE1-CG2 4.3Å; Y155-V212 WeakPolarHBondContact OH-CG1 3.44Å
156	I	91.4	Very high	89.1	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.072	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-49.7	175.6	-65	175.5	0	0	0	110.6	F150 S153 K154 D158 I160 A164 L167 L208	F150-I156 HydrophobicContact CB-CD1 4.35Å; F150-I156 HydrophobicContact CD1-CD1 3.61Å; F150-I156 HydrophobicContact CE1-CD1 4.32Å; F150-I156 HydrophobicContact CG-CD1 4.33Å; F150-I156 WeakPolarHBondContact O-CD1 3.37Å; S153-I156 PolarHBondContact O-N 2.79Å; S153-I156 WeakPolarHBondContact OG-CG1 3.16Å; S153-I156 PolarHBondContact OG-N 2.96Å; S153-I156 VanDerWaalsContact OG-N 3.07Å; K154-I156 PolarHBondContact O-N 3.26Å; I156-D158 VanDerWaalsContact C-N 3.31Å; I156-D158 PolarHBondContact O-N 3.42Å; I156-I160 HydrophobicContact CB-CG1 4.42Å; I156-I160 HydrophobicContact CG1-CG1 4.29Å; I156-I160 HydrophobicContact CG2-CB 4.2Å; I156-I160 WeakPolarHBondContact O-CB 3.46Å; I156-I160 PolarHBondContact O-N 3.28Å; I156-I160 VanDerWaalsContact O-N 3.15Å; I156-A164 HydrophobicContact CG2-CB 4.21Å; I156-L167 HydrophobicContact CD1-CD2 3.54Å; I156-L167 HydrophobicContact CG1-CD2 3.57Å; I156-L208 HydrophobicContact CD1-CD2 3.6Å; I156-L208 HydrophobicContact CG1-CD2 3.48Å; I156-L208 VanDerWaalsContact CG1-CD2 3.48Å
157	A	87.9	Confident	89.4	Confident	61 Å²	61	55.6 Å²	55.6	50%	0.504	35%	0.352	S	S	.	.	H	α-helix	trans	-58.8	-40.7	-178.7	0	0	0	0	0	112.8	S153 K154 K223	S153-A157 PolarHBondContact O-N 2.84Å; K154-A157 PolarHBondContact O-N 3.17Å; A157-K223 PolarHBondContact O-NZ 3.32Å
158	D	89	Confident	89.5	Confident	92 Å²	92	57.4 Å²	57.4	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-88.1	-40.1	-173.1	-70.6	-18.2	0	0	0	112.8	K154 Y155 I156 K223	K154-D158 WeakPolarHBondContact CE-OD2 3.48Å; K154-D158 WeakPolarHBondContact O-CB 3.31Å; K154-D158 PolarHBondContact O-N 2.75Å; Y155-D158 PolarHBondContact O-N 3.1Å; I156-D158 VanDerWaalsContact C-N 3.31Å; I156-D158 PolarHBondContact O-N 3.42Å; D158-K223 WeakPolarHBondContact O-CD 3.42Å; D158-K223 PolarHBondContact O-NZ 3.36Å
159	K	91.5	Very high	89.7	Confident	123 Å²	123	58.2 Å²	58.2	54%	0.535	36%	0.359	S	S	.	.	H	α-helix	trans	-114.5	-19.8	-165.6	-58.3	-61.5	-174.9	176.1	0	115.4	Y155 L222 K223	Y155-K159 HydrophobicContact CD2-CB 4.2Å; Y155-K159 HydrophobicContact CD2-CG 4.05Å; Y155-K159 HydrophobicContact CE2-CB 3.98Å; Y155-K159 HydrophobicContact CE2-CG 4.02Å; Y155-K159 WeakPolarHBondContact O-CB 3.44Å; Y155-K159 PolarHBondContact O-N 3.34Å; K159-L222 WeakPolarHBondContact O-CA 3.44Å; K159-K223 PolarHBondContact O-N 2.8Å
160	I	91.7	Very high	89.7	Confident	7 Å²	7	66 Å²	66	4%	0.036	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-96.8	130.7	-175.1	-58.2	-61.1	0	0	0	111.3	Y155 I156 I162 L167 V212 I221 L222 K223	Y155-I160 HydrophobicContact CD1-CD1 4.46Å; Y155-I160 HydrophobicContact CD1-CG1 4.19Å; Y155-I160 HydrophobicContact CE1-CD1 3.75Å; Y155-I160 HydrophobicContact CE1-CG1 3.98Å; I156-I160 HydrophobicContact CB-CG1 4.42Å; I156-I160 HydrophobicContact CG1-CG1 4.29Å; I156-I160 HydrophobicContact CG2-CB 4.2Å; I156-I160 WeakPolarHBondContact O-CB 3.46Å; I156-I160 PolarHBondContact O-N 3.28Å; I156-I160 VanDerWaalsContact O-N 3.15Å; I160-I162 HydrophobicContact CG2-CG1 3.64Å; I160-I162 WeakPolarHBondContact CG2-O 3.49Å; I160-L167 HydrophobicContact CG1-CD2 4.18Å; I160-L167 HydrophobicContact CG2-CD1 4.2Å; I160-L167 HydrophobicContact CG2-CD2 4.1Å; I160-V212 HydrophobicContact CD1-CG1 4.01Å; I160-V212 HydrophobicContact CD1-CG2 4.22Å; I160-I221 CarbonylContact C-O 3.54Å; I160-I221 WeakPolarHBondContact CA-O 3.18Å; I160-L222 HydrophobicContact CD1-CD2 4Å; I160-K223 WeakPolarHBondContact O-CE 3.42Å
161	A	88.4	Confident	89.7	Confident	61 Å²	61	67 Å²	67	50%	0.504	39%	0.387	S	S	.	.			trans	-85.3	-23.6	-179.4	0	0	0	0	0	113.3	I221 K223	A161-I221 PolarHBondContact N-O 3.22Å; A161-K223 HydrophobicContact CB-CG 3.97Å
162	I	88.3	Confident	89.7	Confident	50 Å²	50	63.2 Å²	63.2	26%	0.256	36%	0.357	S	S	.	.	S	Bend	trans	-92	151.4	-179.8	61.4	165.2	0	0	0	112.3	I160 L167 I221	I160-I162 HydrophobicContact CG2-CG1 3.64Å; I160-I162 WeakPolarHBondContact CG2-O 3.49Å; I162-L167 HydrophobicContact CD1-CB 4.21Å; I162-L167 HydrophobicContact CD1-CD1 3.7Å; I162-L167 HydrophobicContact CG1-CB 4.47Å; I162-L167 HydrophobicContact CG1-CD1 4.08Å; I162-I221 HydrophobicContact CD1-CB 4.43Å; I162-I221 HydrophobicContact CD1-CG2 3.83Å; I162-I221 HydrophobicContact CG1-CB 4.44Å; I162-I221 HydrophobicContact CG1-CG2 4.29Å
163	P	89.5	Confident	89.7	Confident	87 Å²	87	67.9 Å²	67.9	57%	0.565	36%	0.361	S	S	*	.			trans	-57.2	146.6	175.2	-25.6	33.7	0	0	0	113.8	D165 L166 L167	P163-D165 VanDerWaalsContact C-N 3.3Å; P163-D165 PolarHBondContact O-N 2.97Å; P163-L166 HydrophobicContact CG-CD1 4.48Å; P163-L166 PolarHBondContact O-N 3.33Å; P163-L167 PolarHBondContact O-N 3.36Å; P163-L167 VanDerWaalsContact O-N 3.16Å
164	A	88.4	Confident	89.7	Confident	30 Å²	30	68.5 Å²	68.5	25%	0.248	37%	0.367	C	S	.	.	H	α-helix	trans	-57.8	-36.4	-176.5	0	0	0	0	0	113.9	I156 L167 Q168	I156-A164 HydrophobicContact CG2-CB 4.21Å; A164-L167 WeakPolarHBondContact O-CB 3.23Å; A164-L167 PolarHBondContact O-N 3.01Å; A164-Q168 WeakPolarHBondContact O-CB 3.34Å; A164-Q168 PolarHBondContact O-N 2.96Å
165	D	88.9	Confident	89.8	Confident	120 Å²	120	61.7 Å²	61.7	64%	0.642	34%	0.337	S	S	*	.	H	α-helix	trans	-62.7	-47.3	177.6	175.6	22.9	0	0	0	112.3	P163 L167 Q168 A169	P163-D165 VanDerWaalsContact C-N 3.3Å; P163-D165 PolarHBondContact O-N 2.97Å; D165-L167 VanDerWaalsContact C-N 3.26Å; D165-L167 PolarHBondContact O-N 3.46Å; D165-Q168 WeakPolarHBondContact O-CB 3.12Å; D165-Q168 PolarHBondContact O-N 3.36Å; D165-Q168 VanDerWaalsContact O-N 3.16Å; D165-A169 PolarHBondContact O-N 3.15Å
166	L	89.8	Confident	89.7	Confident	104 Å²	104	65.5 Å²	65.5	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-35.4	175.6	-72.5	175.9	0	0	0	111.9	P163 R170	P163-L166 HydrophobicContact CG-CD1 4.48Å; P163-L166 PolarHBondContact O-N 3.33Å; L166-R170 PolarHBondContact O-N 2.87Å
167	L	90.9	Very high	89.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-67.9	-42.9	175	-162.4	75.5	0	0	0	111.1	F150 I156 I160 I162 P163 A164 D165 A169 R170 F171 L208	F150-L167 HydrophobicContact CD1-CB 4.46Å; F150-L167 HydrophobicContact CD1-CD2 4.35Å; F150-L167 HydrophobicContact CE1-CB 4.38Å; F150-L167 HydrophobicContact CE1-CD2 4.15Å; F150-L167 HydrophobicContact CE1-CG 4.12Å; I156-L167 HydrophobicContact CD1-CD2 3.54Å; I156-L167 HydrophobicContact CG1-CD2 3.57Å; I160-L167 HydrophobicContact CG1-CD2 4.18Å; I160-L167 HydrophobicContact CG2-CD1 4.2Å; I160-L167 HydrophobicContact CG2-CD2 4.1Å; I162-L167 HydrophobicContact CD1-CB 4.21Å; I162-L167 HydrophobicContact CD1-CD1 3.7Å; I162-L167 HydrophobicContact CG1-CB 4.47Å; I162-L167 HydrophobicContact CG1-CD1 4.08Å; P163-L167 PolarHBondContact O-N 3.36Å; P163-L167 VanDerWaalsContact O-N 3.16Å; A164-L167 WeakPolarHBondContact O-CB 3.23Å; A164-L167 PolarHBondContact O-N 3.01Å; D165-L167 VanDerWaalsContact C-N 3.26Å; D165-L167 PolarHBondContact O-N 3.46Å; L167-A169 PolarHBondContact O-N 3.08Å; L167-R170 PolarHBondContact O-N 3.22Å; L167-F171 HydrophobicContact CD1-CD2 3.48Å; L167-F171 VanDerWaalsContact CD1-CD2 3.48Å; L167-F171 HydrophobicContact CD1-CE2 3.54Å; L167-F171 HydrophobicContact CG-CD2 3.84Å; L167-F171 HydrophobicContact CG-CE2 4.4Å; L167-F171 PolarHBondContact O-N 3.27Å; L167-L208 HydrophobicContact CD2-CD1 4.28Å; L167-L208 HydrophobicContact CD2-CD2 4Å
168	Q	89.4	Confident	88.9	Confident	54 Å²	54	66.5 Å²	66.5	25%	0.252	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-41.3	175.6	-175.1	-178.4	-5.2	0	0	111.4	I146 F150 A164 D165 R170 G172	I146-Q168 HydrophobicContact CG2-CG 4.49Å; F150-Q168 HydrophobicContact CB-CB 4.19Å; F150-Q168 HydrophobicContact CB-CG 4.46Å; F150-Q168 HydrophobicContact CD1-CB 3.79Å; F150-Q168 HydrophobicContact CD1-CG 4.45Å; F150-Q168 HydrophobicContact CD2-CB 4.02Å; F150-Q168 HydrophobicContact CD2-CG 3.77Å; F150-Q168 HydrophobicContact CE1-CB 4.17Å; F150-Q168 HydrophobicContact CE2-CB 4.38Å; F150-Q168 HydrophobicContact CE2-CG 4.11Å; F150-Q168 HydrophobicContact CG-CB 3.73Å; F150-Q168 HydrophobicContact CG-CG 3.98Å; F150-Q168 HydrophobicContact CZ-CB 4.45Å; A164-Q168 WeakPolarHBondContact O-CB 3.34Å; A164-Q168 PolarHBondContact O-N 2.96Å; D165-Q168 WeakPolarHBondContact O-CB 3.12Å; D165-Q168 PolarHBondContact O-N 3.36Å; D165-Q168 VanDerWaalsContact O-N 3.16Å; Q168-R170 PolarHBondContact O-N 3.41Å; Q168-G172 WeakPolarHBondContact O-CA 3.43Å; Q168-G172 PolarHBondContact O-N 3.43Å
169	A	89.4	Confident	88.3	Confident	62 Å²	62	71.7 Å²	71.7	51%	0.512	37%	0.373	S	S	.	.	H	α-helix	trans	-61.2	-29.9	177.3	0	0	0	0	0	112.9	D165 L167	D165-A169 PolarHBondContact O-N 3.15Å; L167-A169 PolarHBondContact O-N 3.08Å
170	R	89.2	Confident	87.5	Confident	198 Å²	198	68.8 Å²	68.8	75%	0.747	38%	0.378	S	S	*	.	H	α-helix	trans	-91.3	-46.4	179	-76.1	-56.8	-168.2	-179.2	-0.7	114.3	L166 L167 Q168	L166-R170 PolarHBondContact O-N 2.87Å; L167-R170 PolarHBondContact O-N 3.22Å; Q168-R170 PolarHBondContact O-N 3.41Å
171	F	91.8	Very high	87	Confident	20 Å²	20	77.8 Å²	77.8	9%	0.088	41%	0.411	C	S	.	.	H	α-helix	trans	-100	-16.1	-173.8	-66.7	-82.7	0	0	0	113	F150 L167 Q173 A174 F175 L208 L211 V212 Y215 I221	F150-F171 HydrophobicContact CE1-CB 4.36Å; F150-F171 HydrophobicContact CZ-CB 4.11Å; L167-F171 HydrophobicContact CD1-CD2 3.48Å; L167-F171 VanDerWaalsContact CD1-CD2 3.48Å; L167-F171 HydrophobicContact CD1-CE2 3.54Å; L167-F171 HydrophobicContact CG-CD2 3.84Å; L167-F171 HydrophobicContact CG-CE2 4.4Å; L167-F171 PolarHBondContact O-N 3.27Å; F171-Q173 PolarHBondContact O-N 3.17Å; F171-A174 VanDerWaalsContact O-CB 3.25Å; F171-A174 WeakPolarHBondContact O-CB 3.37Å; F171-A174 PolarHBondContact O-N 3.43Å; F171-F175 HydrophobicContact CB-CE2 4.47Å; F171-F175 WeakPolarHBondContact O-CD2 3.43Å; F171-F175 WeakPolarHBondContact O-CE2 3.18Å; F171-L208 HydrophobicContact CB-CD1 4.07Å; F171-L208 HydrophobicContact CG-CD1 4.34Å; F171-L211 HydrophobicContact CD1-CB 3.9Å; F171-L211 HydrophobicContact CE1-CB 4.14Å; F171-V212 HydrophobicContact CE1-CG2 4.41Å; F171-V212 HydrophobicContact CE2-CG2 4.34Å; F171-V212 HydrophobicContact CZ-CG2 4.14Å; F171-Y215 HydrophobicContact CE1-CG 4.49Å; F171-Y215 HydrophobicContact CZ-CD1 4.27Å; F171-Y215 HydrophobicContact CZ-CD2 4.2Å; F171-Y215 AromaticContact CZ-CG 3.94Å; F171-Y215 HydrophobicContact CZ-CG 3.94Å; F171-I221 HydrophobicContact CE2-CD1 4.14Å; F171-I221 HydrophobicContact CZ-CD1 4Å
172	G	89.1	Confident	87	Confident	6 Å²	6	76.6 Å²	76.6	6%	0.062	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-58.3	-32.5	-178.8	0	0	0	0	0	113.8	Y142 Q168 A174 F175	Y142-G172 PolarHBondContact OH-O 3.36Å; Q168-G172 WeakPolarHBondContact O-CA 3.43Å; Q168-G172 PolarHBondContact O-N 3.43Å; G172-A174 PolarHBondContact O-N 3.46Å; G172-F175 PolarHBondContact O-N 3.12Å
173	Q	87.7	Confident	87	Confident	163 Å²	163	74.4 Å²	74.4	76%	0.762	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-64.8	-21.7	176.9	-61.8	-176.1	5.8	0	0	113.5	F171 F175	F171-Q173 PolarHBondContact O-N 3.17Å; Q173-F175 PolarHBondContact O-N 3.46Å
174	A	90.8	Very high	87.2	Confident	21 Å²	21	70.5 Å²	70.5	17%	0.174	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-75.2	-13.8	175.2	0	0	0	0	0	112.4	F171 G172 A184 Y185 L211	F171-A174 VanDerWaalsContact O-CB 3.25Å; F171-A174 WeakPolarHBondContact O-CB 3.37Å; F171-A174 PolarHBondContact O-N 3.43Å; G172-A174 PolarHBondContact O-N 3.46Å; A174-A184 CarbonylContact O-C 3.57Å; A174-A184 WeakPolarHBondContact O-CA 3.21Å; A174-Y185 WeakPolarHBondContact CB-O 3.4Å; A174-Y185 PolarHBondContact O-N 2.81Å; A174-L211 HydrophobicContact CB-CD1 3.64Å; A174-L211 HydrophobicContact CB-CD2 4.34Å
175	F	92.1	Very high	87.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.6	-177	-63.4	-86.1	0	0	0	111.3	Y142 I146 F150 F171 G172 Q173 I182 V183 A184 F204 A207 L208 L211	Y142-F175 WeakPolarHBondContact CE2-O 3.41Å; Y142-F175 PolarHBondContact OH-O 2.78Å; I146-F175 HydrophobicContact CD1-CB 3.96Å; I146-F175 WeakPolarHBondContact CD1-O 3.43Å; I146-F175 HydrophobicContact CG1-CB 4.25Å; F150-F175 AromaticContact CE2-CD2 3.83Å; F150-F175 HydrophobicContact CE2-CD2 3.83Å; F150-F175 AromaticContact CE2-CE2 3.91Å; F150-F175 HydrophobicContact CE2-CE2 3.91Å; F150-F175 AromaticContact CZ-CD2 3.93Å; F150-F175 HydrophobicContact CZ-CD2 3.93Å; F150-F175 AromaticContact CZ-CE2 3.62Å; F150-F175 HydrophobicContact CZ-CE2 3.62Å; F171-F175 HydrophobicContact CB-CE2 4.47Å; F171-F175 WeakPolarHBondContact O-CD2 3.43Å; F171-F175 WeakPolarHBondContact O-CE2 3.18Å; G172-F175 PolarHBondContact O-N 3.12Å; Q173-F175 PolarHBondContact O-N 3.46Å; F175-I182 HydrophobicContact CB-CG2 3.95Å; F175-I182 HydrophobicContact CD1-CG2 3.48Å; F175-I182 VanDerWaalsContact CD1-CG2 3.48Å; F175-I182 HydrophobicContact CE1-CG2 4.39Å; F175-I182 HydrophobicContact CG-CG2 4.11Å; F175-V183 WeakPolarHBondContact CA-O 3.32Å; F175-A184 HydrophobicContact CD1-CB 3.68Å; F175-A184 HydrophobicContact CE1-CB 3.55Å; F175-A184 HydrophobicContact CZ-CB 4.29Å; F175-F204 AromaticContact CD1-CD2 3.98Å; F175-F204 HydrophobicContact CD1-CD2 3.98Å; F175-F204 HydrophobicContact CD1-CE2 4.02Å; F175-F204 HydrophobicContact CD2-CE2 4.41Å; F175-F204 AromaticContact CE1-CD2 3.63Å; F175-F204 HydrophobicContact CE1-CD2 3.63Å; F175-F204 AromaticContact CE1-CE2 3.71Å; F175-F204 HydrophobicContact CE1-CE2 3.71Å; F175-F204 HydrophobicContact CE2-CE2 4.18Å; F175-F204 HydrophobicContact CG-CE2 4.33Å; F175-F204 HydrophobicContact CZ-CD2 4.14Å; F175-F204 AromaticContact CZ-CE2 3.81Å; F175-F204 HydrophobicContact CZ-CE2 3.81Å; F175-F204 HydrophobicContact CZ-CZ 4.4Å; F175-A207 HydrophobicContact CE1-CB 4.14Å; F175-L208 HydrophobicContact CE2-CD1 4.28Å; F175-L208 HydrophobicContact CZ-CB 4.16Å; F175-L208 HydrophobicContact CZ-CD1 4.24Å; F175-L211 HydrophobicContact CE2-CD1 3.93Å; F175-L211 HydrophobicContact CZ-CD1 3.92Å
176	K	88.7	Confident	87.4	Confident	102 Å²	102	67 Å²	67	44%	0.443	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.1	175	-62.6	-175.1	-175.1	172.6	0	110.3	I182 V183 Y185	K176-I182 CarbonylContact O-C 3.55Å; K176-I182 WeakPolarHBondContact O-CA 3.23Å; K176-V183 PolarHBondContact N-O 3.36Å; K176-V183 PolarHBondContact O-N 2.77Å; K176-Y185 HydrophobicContact CB-CE2 4.14Å; K176-Y185 HydrophobicContact CD-CD2 4.11Å; K176-Y185 HydrophobicContact CD-CE2 3.77Å; K176-Y185 HydrophobicContact CG-CD2 4.23Å; K176-Y185 HydrophobicContact CG-CE2 4.12Å
177	V	82.4	Confident	87.2	Confident	45 Å²	45	67.5 Å²	67.5	27%	0.273	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	112.6	172.5	-179	0	0	0	0	107.5	Y142 M145 R181	Y142-V177 HydrophobicContact CD2-CG2 4.08Å; M145-V177 HydrophobicContact CE-CB 3.9Å; M145-V177 HydrophobicContact CE-CG1 3.29Å; M145-V177 HydrophobicContact CE-CG2 3.3Å; V177-R181 WeakPolarHBondContact CA-O 3.34Å
178	E	80.7	Confident	87.1	Confident	52 Å²	52	72.2 Å²	72.2	24%	0.243	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.7	175.5	-66.6	177.9	-172.1	0	0	108.2	G180 R181 V183 Y185 K191	E178-G180 PolarHBondContact O-N 3.22Å; E178-G180 VanDerWaalsContact O-N 3.08Å; E178-R181 PolarHBondContact N-O 2.78Å; E178-R181 PolarHBondContact O-N 2.88Å; E178-R181 VanDerWaalsContact O-O 3.07Å; E178-V183 HydrophobicContact CB-CG2 3.88Å; E178-V183 HydrophobicContact CG-CG2 4.48Å; E178-Y185 WeakPolarHBondContact OE1-CE2 3.45Å; E178-Y185 PolarHBondContact OE1-OH 2.91Å; E178-Y185 PolarHBondContact OE2-OH 3.03Å; E178-Y185 VanDerWaalsContact OE2-OH 3.14Å; E178-K191 IonicContact OE2-NZ 3.36Å; E178-K191 PolarHBondContact OE2-NZ 2.88Å
179	E	75.5	Confident	86.9	Confident	201 Å²	201	72 Å²	72	94%	0.939	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	34	179	-56.1	-179.1	169.8	0	0	113.6	R181	E179-R181 VanDerWaalsContact C-N 3.27Å; E179-R181 PolarHBondContact O-N 3.39Å
180	G	74.4	Confident	87	Confident	62 Å²	62	73.5 Å²	73.5	64%	0.639	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	10.2	-179.2	0	0	0	0	0	115	E178	E178-G180 PolarHBondContact O-N 3.22Å; E178-G180 VanDerWaalsContact O-N 3.08Å
181	R	81.7	Confident	87.2	Confident	195 Å²	195	67.7 Å²	67.7	74%	0.736	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.9	176.6	-61.6	-176.1	-176.9	177.7	2.7	111	V177 E178 E179	V177-R181 WeakPolarHBondContact CA-O 3.34Å; E178-R181 PolarHBondContact N-O 2.78Å; E178-R181 PolarHBondContact O-N 2.88Å; E178-R181 VanDerWaalsContact O-O 3.07Å; E179-R181 VanDerWaalsContact C-N 3.27Å; E179-R181 PolarHBondContact O-N 3.39Å
182	I	87.5	Confident	87.2	Confident	36 Å²	36	67.1 Å²	67.1	19%	0.185	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.6	174.8	-63.8	171	0	0	0	108.6	M145 I146 S149 F175 K176 F204	M145-I182 HydrophobicContact CB-CD1 4.38Å; I146-I182 HydrophobicContact CG1-CD1 4.46Å; S149-I182 WeakPolarHBondContact OG-CD1 3.31Å; F175-I182 HydrophobicContact CB-CG2 3.95Å; F175-I182 HydrophobicContact CD1-CG2 3.48Å; F175-I182 VanDerWaalsContact CD1-CG2 3.48Å; F175-I182 HydrophobicContact CE1-CG2 4.39Å; F175-I182 HydrophobicContact CG-CG2 4.11Å; K176-I182 CarbonylContact O-C 3.55Å; K176-I182 WeakPolarHBondContact O-CA 3.23Å; I182-F204 HydrophobicContact CG2-CD2 4.13Å
183	V	90.1	Very high	87.3	Confident	5 Å²	5	73 Å²	73	3%	0.03	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.1	177.9	-178.3	0	0	0	0	108.7	F175 K176 E178 Y185 K191 L201	F175-V183 WeakPolarHBondContact CA-O 3.32Å; K176-V183 PolarHBondContact N-O 3.36Å; K176-V183 PolarHBondContact O-N 2.77Å; E178-V183 HydrophobicContact CB-CG2 3.88Å; E178-V183 HydrophobicContact CG-CG2 4.48Å; V183-Y185 HydrophobicContact CB-CE2 4.43Å; V183-Y185 HydrophobicContact CG1-CE2 3.96Å; V183-K191 HydrophobicContact CG1-CD 3.97Å; V183-K191 HydrophobicContact CG1-CG 4.15Å; V183-L201 HydrophobicContact CG1-CD1 4.22Å; V183-L201 HydrophobicContact CG1-CD2 4.37Å; V183-L201 HydrophobicContact CG2-CD1 3.82Å
184	A	92	Very high	87.4	Confident	4 Å²	4	66 Å²	66	3%	0.033	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.9	179.1	0	0	0	0	0	111.7	A174 F175 I192 A207	A174-A184 CarbonylContact O-C 3.57Å; A174-A184 WeakPolarHBondContact O-CA 3.21Å; F175-A184 HydrophobicContact CD1-CB 3.68Å; F175-A184 HydrophobicContact CE1-CB 3.55Å; F175-A184 HydrophobicContact CZ-CB 4.29Å; A184-I192 HydrophobicContact CB-CB 4.41Å; A184-I192 HydrophobicContact CB-CD1 3.91Å; A184-I192 HydrophobicContact CB-CG1 4.46Å; A184-I192 PolarHBondContact O-N 2.92Å; A184-A207 HydrophobicContact CB-CB 3.47Å; A184-A207 VanDerWaalsContact CB-CB 3.47Å
185	Y	93	Very high	87.2	Confident	38 Å²	38	71.8 Å²	71.8	15%	0.149	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-120.1	137.4	-179.9	-72.1	-88.8	0	0	0	110.7	A174 K176 E178 V183 G189 N190 K191	A174-Y185 WeakPolarHBondContact CB-O 3.4Å; A174-Y185 PolarHBondContact O-N 2.81Å; K176-Y185 HydrophobicContact CB-CE2 4.14Å; K176-Y185 HydrophobicContact CD-CD2 4.11Å; K176-Y185 HydrophobicContact CD-CE2 3.77Å; K176-Y185 HydrophobicContact CG-CD2 4.23Å; K176-Y185 HydrophobicContact CG-CE2 4.12Å; E178-Y185 WeakPolarHBondContact OE1-CE2 3.45Å; E178-Y185 PolarHBondContact OE1-OH 2.91Å; E178-Y185 PolarHBondContact OE2-OH 3.03Å; E178-Y185 VanDerWaalsContact OE2-OH 3.14Å; V183-Y185 HydrophobicContact CB-CE2 4.43Å; V183-Y185 HydrophobicContact CG1-CE2 3.96Å; Y185-G189 WeakPolarHBondContact CD1-O 3.45Å; Y185-N190 CarbonylContact C-O 3.59Å; Y185-N190 VanDerWaalsContact CA-O 3.29Å; Y185-N190 WeakPolarHBondContact CA-O 3.28Å; Y185-K191 HydrophobicContact CD1-CG 4.3Å; Y185-K191 HydrophobicContact CE1-CG 3.64Å; Y185-K191 WeakPolarHBondContact OH-CE 3.41Å
186	D	90.4	Very high	86.8	Confident	39 Å²	39	75.9 Å²	75.9	21%	0.209	42%	0.417	C	S	.	.			trans	-73.6	175.2	171.3	73.6	14	0	0	0	111.8	S188 G189 N190 I192 F210	D186-S188 PolarHBondContact O-N 2.95Å; D186-S188 VanDerWaalsContact O-N 3.11Å; D186-S188 VanDerWaalsContact OD1-CA 3.27Å; D186-S188 WeakPolarHBondContact OD1-CA 3.42Å; D186-S188 WeakPolarHBondContact OD1-CB 3.33Å; D186-S188 PolarHBondContact OD1-N 3.36Å; D186-G189 PolarHBondContact O-N 2.83Å; D186-G189 PolarHBondContact OD1-N 2.84Å; D186-N190 PolarHBondContact N-O 3.19Å; D186-N190 PolarHBondContact OD1-N 3.22Å; D186-N190 PolarHBondContact OD2-ND2 3.23Å; D186-I192 HydrophobicContact CB-CG1 4.31Å; D186-F210 HydrophobicContact CB-CE1 4.26Å
187	A	85.3	Confident	86.8	Confident	114 Å²	114	75.9 Å²	75.9	94%	0.942	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.3	178.8	0	0	0	0	0	114.1
188	S	87.4	Confident	86.8	Confident	100 Å²	100	79.6 Å²	79.6	70%	0.699	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.1	176.4	-51	0	0	0	0	112.3	D186	D186-S188 PolarHBondContact O-N 2.95Å; D186-S188 VanDerWaalsContact O-N 3.11Å; D186-S188 VanDerWaalsContact OD1-CA 3.27Å; D186-S188 WeakPolarHBondContact OD1-CA 3.42Å; D186-S188 WeakPolarHBondContact OD1-CB 3.33Å; D186-S188 PolarHBondContact OD1-N 3.36Å
189	G	86.3	Confident	87	Confident	48 Å²	48	80.2 Å²	80.2	50%	0.495	46%	0.462	S	S	.	.	S	Bend	trans	84.1	15.1	-177.4	0	0	0	0	0	114.4	Y185 D186	Y185-G189 WeakPolarHBondContact CD1-O 3.45Å; D186-G189 PolarHBondContact O-N 2.83Å; D186-G189 PolarHBondContact OD1-N 2.84Å
190	N	91	Very high	87.7	Confident	94 Å²	94	75.3 Å²	75.3	50%	0.503	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-88.8	146.1	175.1	-53.5	-57.3	0	0	0	111.2	Y185 D186	Y185-N190 CarbonylContact C-O 3.59Å; Y185-N190 VanDerWaalsContact CA-O 3.29Å; Y185-N190 WeakPolarHBondContact CA-O 3.28Å; D186-N190 PolarHBondContact N-O 3.19Å; D186-N190 PolarHBondContact OD1-N 3.22Å; D186-N190 PolarHBondContact OD2-ND2 3.23Å
191	K	93.3	Very high	88.4	Confident	76 Å²	76	75.6 Å²	75.6	33%	0.33	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-65.7	136.7	173.6	-61.2	-168	-171.5	-153.9	0	110.4	E178 V183 Y185 Y193 L201	E178-K191 IonicContact OE2-NZ 3.36Å; E178-K191 PolarHBondContact OE2-NZ 2.88Å; V183-K191 HydrophobicContact CG1-CD 3.97Å; V183-K191 HydrophobicContact CG1-CG 4.15Å; Y185-K191 HydrophobicContact CD1-CG 4.3Å; Y185-K191 HydrophobicContact CE1-CG 3.64Å; Y185-K191 WeakPolarHBondContact OH-CE 3.41Å; K191-Y193 HydrophobicContact CB-CE2 3.92Å; K191-Y193 WeakPolarHBondContact O-CD2 3.38Å; K191-Y193 WeakPolarHBondContact O-CE2 3.02Å; K191-L201 HydrophobicContact CB-CD2 3.82Å; K191-L201 HydrophobicContact CD-CD2 3.81Å; K191-L201 HydrophobicContact CG-CD2 4.4Å
192	I	91.1	Very high	88.7	Confident	9 Å²	9	66.6 Å²	66.6	5%	0.046	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-85	121.3	176.1	-58.3	171	0	0	0	108.8	A184 D186 A202 A207 F210 L211	A184-I192 HydrophobicContact CB-CB 4.41Å; A184-I192 HydrophobicContact CB-CD1 3.91Å; A184-I192 HydrophobicContact CB-CG1 4.46Å; A184-I192 PolarHBondContact O-N 2.92Å; D186-I192 HydrophobicContact CB-CG1 4.31Å; I192-A202 HydrophobicContact CB-CB 4.46Å; I192-A202 HydrophobicContact CG2-CB 3.86Å; I192-A202 WeakPolarHBondContact O-CB 3.39Å; I192-A202 PolarHBondContact O-N 3.3Å; I192-A207 HydrophobicContact CG2-CB 4.4Å; I192-F210 HydrophobicContact CD1-CD1 3.7Å; I192-F210 HydrophobicContact CD1-CE1 4.31Å; I192-F210 HydrophobicContact CG1-CD1 3.97Å; I192-F210 HydrophobicContact CG1-CE1 4.22Å; I192-F210 HydrophobicContact CG2-CB 3.98Å; I192-F210 HydrophobicContact CG2-CD1 3.9Å; I192-F210 HydrophobicContact CG2-CG 3.88Å; I192-L211 HydrophobicContact CD1-CD1 4.17Å; I192-L211 HydrophobicContact CD1-CD2 3.64Å; I192-L211 HydrophobicContact CD1-CG 3.62Å
193	Y	91.2	Very high	88.9	Confident	130 Å²	130	71.8 Å²	71.8	51%	0.51	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-100.8	153.1	179.6	-67.5	-89.5	0	0	0	111.5	K191 R195 E200 L201	K191-Y193 HydrophobicContact CB-CE2 3.92Å; K191-Y193 WeakPolarHBondContact O-CD2 3.38Å; K191-Y193 WeakPolarHBondContact O-CE2 3.02Å; Y193-R195 PolarHBondContact O-N 3.37Å; Y193-E200 CarbonylContact C-O 3.59Å; Y193-E200 WeakPolarHBondContact CA-O 3.41Å; Y193-E200 WeakPolarHBondContact CD1-O 3.32Å; Y193-L201 HydrophobicContact CD1-CD2 4.07Å; Y193-L201 HydrophobicContact CE1-CD2 3.75Å
194	S	90.7	Very high	89	Confident	14 Å²	14	72.9 Å²	72.9	10%	0.098	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-64.3	129.9	178.6	-176.2	0	0	0	0	110.7	A196 K197 E200 E206	S194-A196 PolarHBondContact OG-N 2.82Å; S194-K197 CarbonylContact O-C 3.42Å; S194-K197 PolarHBondContact OG-N 2.95Å; S194-K197 VanDerWaalsContact OG-N 3.09Å; S194-E200 PolarHBondContact N-O 3.39Å; S194-E206 WeakPolarHBondContact CA-OE1 3.5Å; S194-E206 VanDerWaalsContact CA-OE2 3.3Å; S194-E206 WeakPolarHBondContact CA-OE2 3.35Å; S194-E206 WeakPolarHBondContact CB-OE2 3.5Å; S194-E206 VanDerWaalsContact OG-CD 3.26Å; S194-E206 PolarHBondContact OG-OE1 3.28Å; S194-E206 VanDerWaalsContact OG-OE1 3.1Å; S194-E206 PolarHBondContact OG-OE2 2.98Å
195	R	85.7	Confident	89	Confident	144 Å²	144	75 Å²	75	54%	0.543	43%	0.432	S	S	.	.	S	Bend	trans	-71.8	-35.3	169.9	-64.4	180	174	172.7	1.3	110.7	Y193 E206 E213	Y193-R195 PolarHBondContact O-N 3.37Å; R195-E206 WeakPolarHBondContact CA-OE1 3.34Å; R195-E206 WeakPolarHBondContact CB-OE1 3.45Å; R195-E206 PolarHBondContact N-OE1 3.48Å; R195-E213 IonicContact CZ-OE2 2.79Å; R195-E213 VanDerWaalsContact CZ-OE2 3.27Å; R195-E213 IonicContact NH1-OE1 3.48Å; R195-E213 IonicContact NH1-OE2 3.55Å; R195-E213 PolarHBondContact NH1-OE2 3.31Å; R195-E213 IonicContact NH2-OE2 3.28Å; R195-E213 PolarHBondContact NH2-OE2 3.3Å
196	A	85.5	Confident	88.9	Confident	85 Å²	85	75 Å²	75	70%	0.702	43%	0.434	S	S	*	.	S	Bend	trans	-75.5	-31.6	179.2	0	0	0	0	0	112.7	S194 E206	S194-A196 PolarHBondContact OG-N 2.82Å; A196-E206 PolarHBondContact N-OE1 3.04Å
197	K	87.4	Confident	89	Confident	102 Å²	102	73.2 Å²	73.2	44%	0.443	42%	0.424	S	S	.	.	S	Bend	trans	-127.3	89.6	179.9	-65.1	-174.2	-179.2	-173.1	0	111.2	S194 G199 E200	S194-K197 CarbonylContact O-C 3.42Å; S194-K197 PolarHBondContact OG-N 2.95Å; S194-K197 VanDerWaalsContact OG-N 3.09Å; K197-G199 PolarHBondContact O-N 3.22Å; K197-G199 VanDerWaalsContact O-N 3.16Å; K197-E200 HydrophobicContact CB-CB 4.08Å; K197-E200 HydrophobicContact CB-CG 4.31Å; K197-E200 HydrophobicContact CD-CG 4.31Å; K197-E200 WeakPolarHBondContact CD-OE2 3.39Å; K197-E200 IonicContact NZ-OE1 3.86Å; K197-E200 PolarHBondContact NZ-OE1 3.12Å; K197-E200 IonicContact NZ-OE2 3.25Å; K197-E200 PolarHBondContact NZ-OE2 3.21Å; K197-E200 PolarHBondContact O-N 3.33Å
198	P	83	Confident	89.4	Confident	123 Å²	123	67.8 Å²	67.8	80%	0.799	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	122.9	178.4	-25.8	34.4	0	0	0	111.7
199	G	85.2	Confident	89.6	Confident	66 Å²	66	66.5 Å²	66.5	68%	0.68	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.7	-17.1	179.4	0	0	0	0	0	115.5	K197	K197-G199 PolarHBondContact O-N 3.22Å; K197-G199 VanDerWaalsContact O-N 3.16Å
200	E	89	Confident	89.8	Confident	98 Å²	98	66.9 Å²	66.9	46%	0.458	35%	0.35	S	S	.	.	S	Bend	trans	-84.2	145.5	169.3	-72.7	-171.2	-163.7	0	0	110.5	Y193 S194 K197	Y193-E200 CarbonylContact C-O 3.59Å; Y193-E200 WeakPolarHBondContact CA-O 3.41Å; Y193-E200 WeakPolarHBondContact CD1-O 3.32Å; S194-E200 PolarHBondContact N-O 3.39Å; K197-E200 HydrophobicContact CB-CB 4.08Å; K197-E200 HydrophobicContact CB-CG 4.31Å; K197-E200 HydrophobicContact CD-CG 4.31Å; K197-E200 WeakPolarHBondContact CD-OE2 3.39Å; K197-E200 IonicContact NZ-OE1 3.86Å; K197-E200 PolarHBondContact NZ-OE1 3.12Å; K197-E200 IonicContact NZ-OE2 3.25Å; K197-E200 PolarHBondContact NZ-OE2 3.21Å; K197-E200 PolarHBondContact O-N 3.33Å
201	L	89.3	Confident	89.9	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.356	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-62.4	139.8	170.2	-67.9	172.4	0	0	0	109.6	V183 K191 Y193 Q203	V183-L201 HydrophobicContact CG1-CD1 4.22Å; V183-L201 HydrophobicContact CG1-CD2 4.37Å; V183-L201 HydrophobicContact CG2-CD1 3.82Å; K191-L201 HydrophobicContact CB-CD2 3.82Å; K191-L201 HydrophobicContact CD-CD2 3.81Å; K191-L201 HydrophobicContact CG-CD2 4.4Å; Y193-L201 HydrophobicContact CD1-CD2 4.07Å; Y193-L201 HydrophobicContact CE1-CD2 3.75Å; L201-Q203 PolarHBondContact O-N 2.93Å
202	A	89.2	Confident	89.8	Confident	6 Å²	6	59.8 Å²	59.8	5%	0.05	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.6	138.2	179.1	0	0	0	0	0	110.4	I192 E206 A207	I192-A202 HydrophobicContact CB-CB 4.46Å; I192-A202 HydrophobicContact CG2-CB 3.86Å; I192-A202 WeakPolarHBondContact O-CB 3.39Å; I192-A202 PolarHBondContact O-N 3.3Å; A202-E206 HydrophobicContact CB-CB 4.28Å; A202-E206 HydrophobicContact CB-CG 4.16Å; A202-A207 HydrophobicContact CB-CB 3.86Å
203	Q	91	Very high	89.7	Confident	144 Å²	144	62.4 Å²	62.4	67%	0.673	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-65.5	160.8	169.7	-65.6	-171.1	-5.9	0	0	109.9	L201 D205 E206 A207	L201-Q203 PolarHBondContact O-N 2.93Å; Q203-D205 VanDerWaalsContact C-N 3.31Å; Q203-D205 PolarHBondContact O-N 2.75Å; Q203-E206 PolarHBondContact O-N 3.49Å; Q203-E206 VanDerWaalsContact O-N 3.09Å; Q203-A207 WeakPolarHBondContact O-CB 3.48Å; Q203-A207 PolarHBondContact O-N 3.36Å
204	F	91.3	Very high	89.6	Confident	28 Å²	28	61 Å²	61	12%	0.123	33%	0.329	C	S	.	.	H	α-helix	trans	-47.8	-49.3	-176.2	179.4	-92.7	0	0	0	113.6	S149 F150 F175 I182 A207 L208	S149-F204 VanDerWaalsContact O-CE1 3.28Å; S149-F204 WeakPolarHBondContact O-CE1 3.25Å; F150-F204 HydrophobicContact CB-CZ 4.41Å; F150-F204 HydrophobicContact CD1-CZ 4.15Å; F150-F204 AromaticContact CD2-CE2 3.83Å; F150-F204 HydrophobicContact CD2-CE2 3.83Å; F150-F204 AromaticContact CD2-CZ 3.47Å; F150-F204 HydrophobicContact CD2-CZ 3.47Å; F150-F204 VanDerWaalsContact CD2-CZ 3.47Å; F150-F204 HydrophobicContact CE1-CZ 4.25Å; F150-F204 AromaticContact CE2-CE2 3.7Å; F150-F204 HydrophobicContact CE2-CE2 3.7Å; F150-F204 AromaticContact CE2-CZ 3.6Å; F150-F204 HydrophobicContact CE2-CZ 3.6Å; F150-F204 AromaticContact CG-CZ 3.76Å; F150-F204 HydrophobicContact CG-CZ 3.76Å; F150-F204 HydrophobicContact CZ-CE2 4.34Å; F150-F204 AromaticContact CZ-CZ 3.99Å; F150-F204 HydrophobicContact CZ-CZ 3.99Å; F175-F204 AromaticContact CD1-CD2 3.98Å; F175-F204 HydrophobicContact CD1-CD2 3.98Å; F175-F204 HydrophobicContact CD1-CE2 4.02Å; F175-F204 HydrophobicContact CD2-CE2 4.41Å; F175-F204 AromaticContact CE1-CD2 3.63Å; F175-F204 HydrophobicContact CE1-CD2 3.63Å; F175-F204 AromaticContact CE1-CE2 3.71Å; F175-F204 HydrophobicContact CE1-CE2 3.71Å; F175-F204 HydrophobicContact CE2-CE2 4.18Å; F175-F204 HydrophobicContact CG-CE2 4.33Å; F175-F204 HydrophobicContact CZ-CD2 4.14Å; F175-F204 AromaticContact CZ-CE2 3.81Å; F175-F204 HydrophobicContact CZ-CE2 3.81Å; F175-F204 HydrophobicContact CZ-CZ 4.4Å; I182-F204 HydrophobicContact CG2-CD2 4.13Å; F204-A207 PolarHBondContact O-N 3.31Å; F204-L208 HydrophobicContact CE1-CD2 4.04Å; F204-L208 HydrophobicContact CZ-CD2 4.34Å; F204-L208 VanDerWaalsContact O-CB 3.26Å; F204-L208 WeakPolarHBondContact O-CB 3.42Å; F204-L208 PolarHBondContact O-N 3.42Å
205	D	92.6	Very high	89.6	Confident	49 Å²	49	64 Å²	64	26%	0.262	34%	0.339	S	S	.	.	H	α-helix	trans	-67.3	-41.3	-178.8	-81.3	-5	0	0	0	112.8	S153 K154 Y155 Q203 L208 E209	S153-D205 WeakPolarHBondContact CB-OD1 3.3Å; S153-D205 PolarHBondContact OG-OD1 3.07Å; K154-D205 PolarHBondContact N-OD2 2.85Å; Y155-D205 PolarHBondContact N-OD2 2.72Å; Q203-D205 VanDerWaalsContact C-N 3.31Å; Q203-D205 PolarHBondContact O-N 2.75Å; D205-L208 PolarHBondContact O-N 2.97Å; D205-E209 WeakPolarHBondContact O-CB 3.44Å; D205-E209 PolarHBondContact O-N 3.01Å
206	E	91.7	Very high	89.8	Confident	39 Å²	39	63.1 Å²	63.1	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-68.7	-39	178.5	-178.3	176.3	-153.2	0	0	111.6	S194 R195 A196 A202 Q203 E209 F210	S194-E206 WeakPolarHBondContact CA-OE1 3.5Å; S194-E206 VanDerWaalsContact CA-OE2 3.3Å; S194-E206 WeakPolarHBondContact CA-OE2 3.35Å; S194-E206 WeakPolarHBondContact CB-OE2 3.5Å; S194-E206 VanDerWaalsContact OG-CD 3.26Å; S194-E206 PolarHBondContact OG-OE1 3.28Å; S194-E206 VanDerWaalsContact OG-OE1 3.1Å; S194-E206 PolarHBondContact OG-OE2 2.98Å; R195-E206 WeakPolarHBondContact CA-OE1 3.34Å; R195-E206 WeakPolarHBondContact CB-OE1 3.45Å; R195-E206 PolarHBondContact N-OE1 3.48Å; A196-E206 PolarHBondContact N-OE1 3.04Å; A202-E206 HydrophobicContact CB-CB 4.28Å; A202-E206 HydrophobicContact CB-CG 4.16Å; Q203-E206 PolarHBondContact O-N 3.49Å; Q203-E206 VanDerWaalsContact O-N 3.09Å; E206-E209 PolarHBondContact O-N 3.4Å; E206-F210 WeakPolarHBondContact O-CB 3.42Å; E206-F210 PolarHBondContact O-N 2.84Å
207	A	91.9	Very high	89.9	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-65.4	-43.7	174.2	0	0	0	0	0	111.7	F175 A184 I192 A202 Q203 F204 F210 L211	F175-A207 HydrophobicContact CE1-CB 4.14Å; A184-A207 HydrophobicContact CB-CB 3.47Å; A184-A207 VanDerWaalsContact CB-CB 3.47Å; I192-A207 HydrophobicContact CG2-CB 4.4Å; A202-A207 HydrophobicContact CB-CB 3.86Å; Q203-A207 WeakPolarHBondContact O-CB 3.48Å; Q203-A207 PolarHBondContact O-N 3.36Å; F204-A207 PolarHBondContact O-N 3.31Å; A207-F210 PolarHBondContact O-N 3.36Å; A207-L211 WeakPolarHBondContact O-CG 3.36Å; A207-L211 PolarHBondContact O-N 2.83Å
208	L	93.1	Very high	90	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-42	176.4	-176.6	63.1	0	0	0	111.2	F150 Y155 I156 L167 F171 F175 F204 D205 F210 L211 V212	F150-L208 HydrophobicContact CE1-CD1 4.08Å; F150-L208 HydrophobicContact CE1-CD2 4.42Å; F150-L208 HydrophobicContact CZ-CD1 4.29Å; Y155-L208 HydrophobicContact CD1-CD2 4.02Å; Y155-L208 HydrophobicContact CD1-CG 4.15Å; Y155-L208 HydrophobicContact CE1-CG 4.33Å; I156-L208 HydrophobicContact CD1-CD2 3.6Å; I156-L208 HydrophobicContact CG1-CD2 3.48Å; I156-L208 VanDerWaalsContact CG1-CD2 3.48Å; L167-L208 HydrophobicContact CD2-CD1 4.28Å; L167-L208 HydrophobicContact CD2-CD2 4Å; F171-L208 HydrophobicContact CB-CD1 4.07Å; F171-L208 HydrophobicContact CG-CD1 4.34Å; F175-L208 HydrophobicContact CE2-CD1 4.28Å; F175-L208 HydrophobicContact CZ-CB 4.16Å; F175-L208 HydrophobicContact CZ-CD1 4.24Å; F204-L208 HydrophobicContact CE1-CD2 4.04Å; F204-L208 HydrophobicContact CZ-CD2 4.34Å; F204-L208 VanDerWaalsContact O-CB 3.26Å; F204-L208 WeakPolarHBondContact O-CB 3.42Å; F204-L208 PolarHBondContact O-N 3.42Å; D205-L208 PolarHBondContact O-N 2.97Å; L208-F210 VanDerWaalsContact C-N 3.35Å; L208-F210 PolarHBondContact O-N 3.25Å; L208-L211 PolarHBondContact O-N 3.08Å; L208-V212 HydrophobicContact CD1-CG2 4.23Å; L208-V212 HydrophobicContact CG-CG2 4.37Å; L208-V212 WeakPolarHBondContact O-CB 3.23Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.46Å; L208-V212 PolarHBondContact O-N 3.13Å
209	E	91.9	Very high	90.2	Very high	72 Å²	72	63.4 Å²	63.4	34%	0.336	33%	0.332	S	S	.	.	H	α-helix	trans	-58.5	-46.4	174	-180	168.4	-149	0	0	111.2	Y155 D205 E206 L211 V212 E213	Y155-E209 HydrophobicContact CD2-CB 4.06Å; Y155-E209 HydrophobicContact CD2-CG 4.33Å; Y155-E209 HydrophobicContact CE1-CB 4.2Å; Y155-E209 HydrophobicContact CE2-CB 3.63Å; Y155-E209 HydrophobicContact CE2-CG 3.57Å; D205-E209 WeakPolarHBondContact O-CB 3.44Å; D205-E209 PolarHBondContact O-N 3.01Å; E206-E209 PolarHBondContact O-N 3.4Å; E209-L211 VanDerWaalsContact C-N 3.34Å; E209-L211 PolarHBondContact O-N 3.38Å; E209-V212 PolarHBondContact O-N 3.37Å; E209-E213 HydrophobicContact CG-CG 4.27Å; E209-E213 WeakPolarHBondContact O-CB 3.21Å; E209-E213 VanDerWaalsContact O-CG 3.31Å; E209-E213 WeakPolarHBondContact O-CG 3.22Å; E209-E213 PolarHBondContact O-N 3.13Å
210	F	91.8	Very high	90.3	Very high	57 Å²	57	69.2 Å²	69.2	25%	0.25	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-43.6	175.4	-177.4	-88.9	0	0	0	112.7	D186 I192 E206 A207 L208 N214	D186-F210 HydrophobicContact CB-CE1 4.26Å; I192-F210 HydrophobicContact CD1-CD1 3.7Å; I192-F210 HydrophobicContact CD1-CE1 4.31Å; I192-F210 HydrophobicContact CG1-CD1 3.97Å; I192-F210 HydrophobicContact CG1-CE1 4.22Å; I192-F210 HydrophobicContact CG2-CB 3.98Å; I192-F210 HydrophobicContact CG2-CD1 3.9Å; I192-F210 HydrophobicContact CG2-CG 3.88Å; E206-F210 WeakPolarHBondContact O-CB 3.42Å; E206-F210 PolarHBondContact O-N 2.84Å; A207-F210 PolarHBondContact O-N 3.36Å; L208-F210 VanDerWaalsContact C-N 3.35Å; L208-F210 PolarHBondContact O-N 3.25Å; F210-N214 WeakPolarHBondContact CD1-ND2 3.38Å; F210-N214 WeakPolarHBondContact CE1-ND2 3.21Å; F210-N214 WeakPolarHBondContact CZ-ND2 3.36Å; F210-N214 WeakPolarHBondContact O-CB 3.3Å; F210-N214 PolarHBondContact O-N 3.04Å; F210-N214 PolarHBondContact O-ND2 3.38Å
211	L	91.8	Very high	90.3	Very high	20 Å²	20	65.2 Å²	65.2	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-41.3	178.1	-72.8	171.5	0	0	0	112.1	F171 A174 F175 I192 A207 L208 E209 Y215	F171-L211 HydrophobicContact CD1-CB 3.9Å; F171-L211 HydrophobicContact CE1-CB 4.14Å; A174-L211 HydrophobicContact CB-CD1 3.64Å; A174-L211 HydrophobicContact CB-CD2 4.34Å; F175-L211 HydrophobicContact CE2-CD1 3.93Å; F175-L211 HydrophobicContact CZ-CD1 3.92Å; I192-L211 HydrophobicContact CD1-CD1 4.17Å; I192-L211 HydrophobicContact CD1-CD2 3.64Å; I192-L211 HydrophobicContact CD1-CG 3.62Å; A207-L211 WeakPolarHBondContact O-CG 3.36Å; A207-L211 PolarHBondContact O-N 2.83Å; L208-L211 PolarHBondContact O-N 3.08Å; E209-L211 VanDerWaalsContact C-N 3.34Å; E209-L211 PolarHBondContact O-N 3.38Å; L211-Y215 PolarHBondContact O-N 3.43Å
212	V	91.2	Very high	90.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-70.2	-42.3	179	165.2	0	0	0	0	111.3	Y155 I160 F171 L208 E209 N214 Y215 K218 I221 L222	Y155-V212 HydrophobicContact CE1-CB 4.36Å; Y155-V212 HydrophobicContact CE1-CG2 4.3Å; Y155-V212 WeakPolarHBondContact OH-CG1 3.44Å; I160-V212 HydrophobicContact CD1-CG1 4.01Å; I160-V212 HydrophobicContact CD1-CG2 4.22Å; F171-V212 HydrophobicContact CE1-CG2 4.41Å; F171-V212 HydrophobicContact CE2-CG2 4.34Å; F171-V212 HydrophobicContact CZ-CG2 4.14Å; L208-V212 HydrophobicContact CD1-CG2 4.23Å; L208-V212 HydrophobicContact CG-CG2 4.37Å; L208-V212 WeakPolarHBondContact O-CB 3.23Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.46Å; L208-V212 PolarHBondContact O-N 3.13Å; E209-V212 PolarHBondContact O-N 3.37Å; V212-N214 VanDerWaalsContact C-N 3.26Å; V212-N214 PolarHBondContact O-N 2.83Å; V212-Y215 VanDerWaalsContact O-CB 3.31Å; V212-Y215 WeakPolarHBondContact O-CB 3.27Å; V212-Y215 PolarHBondContact O-N 2.87Å; V212-Y215 VanDerWaalsContact O-N 3.07Å; V212-K218 VanDerWaalsContact O-CB 3.25Å; V212-K218 WeakPolarHBondContact O-CB 3.43Å; V212-I221 HydrophobicContact CB-CD1 4.24Å; V212-I221 HydrophobicContact CG1-CD1 3.64Å; V212-I221 HydrophobicContact CG1-CG1 4.19Å; V212-I221 HydrophobicContact CG2-CD1 4.06Å; V212-L222 HydrophobicContact CG1-CD2 3.75Å; V212-L222 HydrophobicContact CG1-CG 4.12Å
213	E	89.3	Confident	90.1	Very high	65 Å²	65	68.9 Å²	68.9	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-31.6	178	-79	-171.4	156	0	0	113.4	R195 E209 K218	R195-E213 IonicContact CZ-OE2 2.79Å; R195-E213 VanDerWaalsContact CZ-OE2 3.27Å; R195-E213 IonicContact NH1-OE1 3.48Å; R195-E213 IonicContact NH1-OE2 3.55Å; R195-E213 PolarHBondContact NH1-OE2 3.31Å; R195-E213 IonicContact NH2-OE2 3.28Å; R195-E213 PolarHBondContact NH2-OE2 3.3Å; E209-E213 HydrophobicContact CG-CG 4.27Å; E209-E213 WeakPolarHBondContact O-CB 3.21Å; E209-E213 VanDerWaalsContact O-CG 3.31Å; E209-E213 WeakPolarHBondContact O-CG 3.22Å; E209-E213 PolarHBondContact O-N 3.13Å; E213-K218 VanDerWaalsContact O-CD 3.28Å; E213-K218 WeakPolarHBondContact O-CD 3.5Å; E213-K218 PolarHBondContact O-NZ 3.39Å
214	N	89.7	Confident	89.3	Confident	101 Å²	101	66.2 Å²	66.2	54%	0.54	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.3	176.6	-71.9	-40.6	0	0	0	113.2	F210 V212 P216	F210-N214 WeakPolarHBondContact CD1-ND2 3.38Å; F210-N214 WeakPolarHBondContact CE1-ND2 3.21Å; F210-N214 WeakPolarHBondContact CZ-ND2 3.36Å; F210-N214 WeakPolarHBondContact O-CB 3.3Å; F210-N214 PolarHBondContact O-N 3.04Å; F210-N214 PolarHBondContact O-ND2 3.38Å; V212-N214 VanDerWaalsContact C-N 3.26Å; V212-N214 PolarHBondContact O-N 2.83Å; N214-P216 WeakPolarHBondContact O-CD 2.96Å
215	Y	90.8	Very high	87.8	Confident	77 Å²	77	71.2 Å²	71.2	30%	0.302	37%	0.372	S	S	.	.			trans	-74.3	126.9	178.9	-172	-122.4	0	0	0	110.7	F171 L211 V212 Q217 K218 I221	F171-Y215 HydrophobicContact CE1-CG 4.49Å; F171-Y215 HydrophobicContact CZ-CD1 4.27Å; F171-Y215 HydrophobicContact CZ-CD2 4.2Å; F171-Y215 AromaticContact CZ-CG 3.94Å; F171-Y215 HydrophobicContact CZ-CG 3.94Å; L211-Y215 PolarHBondContact O-N 3.43Å; V212-Y215 VanDerWaalsContact O-CB 3.31Å; V212-Y215 WeakPolarHBondContact O-CB 3.27Å; V212-Y215 PolarHBondContact O-N 2.87Å; V212-Y215 VanDerWaalsContact O-N 3.07Å; Y215-Q217 HydrophobicContact CD1-CB 4.03Å; Y215-Q217 HydrophobicContact CE1-CB 3.57Å; Y215-Q217 PolarHBondContact O-N 2.99Å; Y215-K218 WeakPolarHBondContact O-CB 3.48Å; Y215-K218 PolarHBondContact O-N 3.27Å; Y215-I221 HydrophobicContact CD1-CD1 3.69Å; Y215-I221 HydrophobicContact CD1-CG1 4.45Å; Y215-I221 HydrophobicContact CE1-CD1 4.45Å; Y215-I221 HydrophobicContact CG-CD1 4.38Å
216	P	89	Confident	85.6	Confident	124 Å²	124	72 Å²	72	81%	0.805	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.6	-177.5	-29.5	36.2	0	0	0	115.1	N214	N214-P216 WeakPolarHBondContact O-CD 2.96Å
217	Q	88.6	Confident	83.1	Confident	110 Å²	110	77.3 Å²	77.3	51%	0.514	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	30.6	179.8	-65	177.9	0.6	0	0	112.1	Y215 D219 Y220	Y215-Q217 HydrophobicContact CD1-CB 4.03Å; Y215-Q217 HydrophobicContact CE1-CB 3.57Å; Y215-Q217 PolarHBondContact O-N 2.99Å; Q217-D219 PolarHBondContact O-N 2.84Å; Q217-D219 VanDerWaalsContact O-N 3.15Å; Q217-Y220 HydrophobicContact CB-CD2 3.91Å; Q217-Y220 HydrophobicContact CG-CD2 4.41Å; Q217-Y220 WeakPolarHBondContact O-CB 3.48Å; Q217-Y220 PolarHBondContact O-N 3.23Å
218	K	88.1	Confident	80.3	Confident	77 Å²	77	85.9 Å²	85.9	34%	0.335	47%	0.466	S	S	.	.	H	α-helix	trans	-54.1	-34.7	-177.1	68.1	-175	174	-172.2	0	114.4	V212 E213 Y215 Y220 I221 L222	V212-K218 VanDerWaalsContact O-CB 3.25Å; V212-K218 WeakPolarHBondContact O-CB 3.43Å; E213-K218 VanDerWaalsContact O-CD 3.28Å; E213-K218 WeakPolarHBondContact O-CD 3.5Å; E213-K218 PolarHBondContact O-NZ 3.39Å; Y215-K218 WeakPolarHBondContact O-CB 3.48Å; Y215-K218 PolarHBondContact O-N 3.27Å; K218-Y220 PolarHBondContact O-N 3.37Å; K218-Y220 VanDerWaalsContact O-N 3.13Å; K218-I221 HydrophobicContact CB-CG1 4.46Å; K218-I221 WeakPolarHBondContact O-CG1 3.32Å; K218-I221 PolarHBondContact O-N 2.85Å; K218-L222 HydrophobicContact CB-CD1 4.08Å; K218-L222 HydrophobicContact CD-CD1 4.44Å; K218-L222 HydrophobicContact CG-CD1 4.25Å; K218-L222 WeakPolarHBondContact O-CB 3.5Å; K218-L222 WeakPolarHBondContact O-CG 3.38Å; K218-L222 PolarHBondContact O-N 3.34Å
219	D	86.8	Confident	77.4	Confident	129 Å²	129	89.2 Å²	89.2	69%	0.69	50%	0.5	S	S	*	.	H	α-helix	trans	-63.5	-21.3	-179.3	-60	-30.3	0	0	0	112.9	Q217	Q217-D219 PolarHBondContact O-N 2.84Å; Q217-D219 VanDerWaalsContact O-N 3.15Å
220	Y	88	Confident	74.4	Confident	188 Å²	188	90 Å²	90	74%	0.737	53%	0.528	S	S	*	.	H	α-helix	trans	-86.7	-18.3	175.6	-65	-83.6	0	0	0	113.5	Q217 K218	Q217-Y220 HydrophobicContact CB-CD2 3.91Å; Q217-Y220 HydrophobicContact CG-CD2 4.41Å; Q217-Y220 WeakPolarHBondContact O-CB 3.48Å; Q217-Y220 PolarHBondContact O-N 3.23Å; K218-Y220 PolarHBondContact O-N 3.37Å; K218-Y220 VanDerWaalsContact O-N 3.13Å
221	I	89	Confident	71.5	Confident	14 Å²	14	91 Å²	91	7%	0.072	55%	0.554	C	S	.	*	H	α-helix	trans	-103.2	-22.9	179.6	57.1	174.6	0	0	0	112.3	I160 A161 I162 F171 V212 Y215 K218	I160-I221 CarbonylContact C-O 3.54Å; I160-I221 WeakPolarHBondContact CA-O 3.18Å; A161-I221 PolarHBondContact N-O 3.22Å; I162-I221 HydrophobicContact CD1-CB 4.43Å; I162-I221 HydrophobicContact CD1-CG2 3.83Å; I162-I221 HydrophobicContact CG1-CB 4.44Å; I162-I221 HydrophobicContact CG1-CG2 4.29Å; F171-I221 HydrophobicContact CE2-CD1 4.14Å; F171-I221 HydrophobicContact CZ-CD1 4Å; V212-I221 HydrophobicContact CB-CD1 4.24Å; V212-I221 HydrophobicContact CG1-CD1 3.64Å; V212-I221 HydrophobicContact CG1-CG1 4.19Å; V212-I221 HydrophobicContact CG2-CD1 4.06Å; Y215-I221 HydrophobicContact CD1-CD1 3.69Å; Y215-I221 HydrophobicContact CD1-CG1 4.45Å; Y215-I221 HydrophobicContact CE1-CD1 4.45Å; Y215-I221 HydrophobicContact CG-CD1 4.38Å; K218-I221 HydrophobicContact CB-CG1 4.46Å; K218-I221 WeakPolarHBondContact O-CG1 3.32Å; K218-I221 PolarHBondContact O-N 2.85Å
222	L	89	Confident	68.3	Low	49 Å²	49	95.7 Å²	95.7	26%	0.257	59%	0.589	S	S	.	*	B	Isolated β-bridge	trans	-84.9	142.7	176.7	-67	170.6	0	0	0	111.2	K159 I160 V212 K218	K159-L222 WeakPolarHBondContact O-CA 3.44Å; I160-L222 HydrophobicContact CD1-CD2 4Å; V212-L222 HydrophobicContact CG1-CD2 3.75Å; V212-L222 HydrophobicContact CG1-CG 4.12Å; K218-L222 HydrophobicContact CB-CD1 4.08Å; K218-L222 HydrophobicContact CD-CD1 4.44Å; K218-L222 HydrophobicContact CG-CD1 4.25Å; K218-L222 WeakPolarHBondContact O-CB 3.5Å; K218-L222 WeakPolarHBondContact O-CG 3.38Å; K218-L222 PolarHBondContact O-N 3.34Å
223	K	86.2	Confident	65.5	Low	103 Å²	103	107.2 Å²	107.2	45%	0.448	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-67.4	134.8	169.9	-62.5	-177.7	-165.2	170.1	0	109.3	A157 D158 K159 I160 A161 S225	A157-K223 PolarHBondContact O-NZ 3.32Å; D158-K223 WeakPolarHBondContact O-CD 3.42Å; D158-K223 PolarHBondContact O-NZ 3.36Å; K159-K223 PolarHBondContact O-N 2.8Å; I160-K223 WeakPolarHBondContact O-CE 3.42Å; A161-K223 HydrophobicContact CB-CG 3.97Å; K223-S225 PolarHBondContact O-N 3.1Å
224	A	74.1	Confident	62.9	Low	87 Å²	87	109.6 Å²	109.6	72%	0.719	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-56.1	133.7	176.5	0	0	0	0	0	111.4	G226	A224-G226 PolarHBondContact O-N 2.84Å
225	S	60	Low	60.1	Low	134 Å²	134	110.9 Å²	110.9	94%	0.937	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	83.8	-178.8	63.1	0	0	0	0	111.3	K223	K223-S225 PolarHBondContact O-N 3.1Å
226	G	46.6	Very low	57.1	Low	64 Å²	64	114.9 Å²	114.9	66%	0.66	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	151.7	2.8	166	0	0	0	0	0	119.6	A224	A224-G226 PolarHBondContact O-N 2.84Å
227	N	37.2	Very low	54.2	Low	152 Å²	152	115.8 Å²	115.8	81%	0.813	68%	0.68	S	S	*	*			trans	-126	109.3	-175.6	-72.9	79	0	0	0	113
228	N	34.7	Very low	51.4	Low	180 Å²	180	116.5 Å²	116.5	96%	0.963	69%	0.687	S	S	*	*			trans	-74	122.9	166.4	-143.1	24.7	0	0	0	108.4
229	G	31.4	Very low	48.7	Very low	70 Å²	70	121.2 Å²	121.2	72%	0.722	71%	0.714	S	S	*	*			trans	152.5	106.2	177.2	0	0	0	0	0	109.1
230	G	30	Very low	46.1	Very low	89 Å²	89	117.8 Å²	117.8	92%	0.918	71%	0.709	S	S	*	*				85.8	92.5	55.3	0	0	0	0	0	107.7
231	G	29.1	Very low	43.6	Very low	78 Å²	78	117 Å²	117	80%	0.804	71%	0.712	S	S	*	*			trans	163.2	86.6	177.9	0	0	0	0	0	115.1
232	S	26.2	Very low	41.1	Very low	118 Å²	118	126.5 Å²	126.5	83%	0.825	75%	0.753	S	S	*	*			trans	-53.7	148.3	165.4	10	0	0	0	0	113.7
233	R	31.2	Very low	38.8	Very low	243 Å²	243	129.9 Å²	129.9	92%	0.917	78%	0.776	S	S	*	*			trans	-157.5	118.1	140.4	-122.4	173.3	156.1	145.6	-4.4	112.8
234	P	35.7	Very low	37.8	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	78%	0.781	S	S	*	*			trans	-93.1	136.3	172.4	35	-27.8	0	0	0	110.5
235	T	29.7	Very low	37.1	Very low	129 Å²	129	134.1 Å²	134.1	79%	0.791	78%	0.781	S	S	*	*			trans	-161.3	101.6	164.4	30.6	0	0	0	0	105.3
236	Q	28.4	Very low	37.1	Very low	161 Å²	161	137.5 Å²	137.5	75%	0.752	77%	0.773	S	S	*	*				72	128.2	70.7	-158.3	-172.1	-21.4	0	0	113.3
237	H	27.5	Very low	38.1	Very low	143 Å²	143	138.8 Å²	138.8	66%	0.662	77%	0.772	S	S	*	*			trans	82.7	112.9	168.5	-81.2	-72.7	0	0	0	117.4
238	D	30.1	Very low	39.5	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	75%	0.751	S	S	*	*				80.6	94.2	63.4	-176.5	27.4	0	0	0	111.5
239	I	32.8	Very low	40.9	Very low	176 Å²	176	131.3 Å²	131.3	90%	0.903	73%	0.733	S	S	*	*			trans	-136.6	95.1	157.8	-55.5	-179.3	0	0	0	107.7
240	G	31.2	Very low	42.5	Very low	57 Å²	57	133.2 Å²	133.2	59%	0.588	73%	0.726	S	S	*	*				101.3	17.1	125.4	0	0	0	0	0	118.6	K242	G240-K242 PolarHBondContact O-N 3.49Å
241	Q	35.9	Very low	43.9	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	71%	0.713	S	S	*	*			trans	-73.3	95.2	167	-75.5	-174.3	-10.2	0	0	109.9	T243	Q241-T243 HydrophobicContact CB-CG2 4.36Å; Q241-T243 PolarHBondContact O-N 2.88Å
242	K	36.9	Very low	45	Very low	212 Å²	212	133.9 Å²	133.9	92%	0.922	70%	0.7	S	S	*	*			trans	-62.5	86	165.3	-71.8	-175.3	179.2	-179.9	0	108.9	G240	G240-K242 PolarHBondContact O-N 3.49Å
243	T	40.2	Very low	45.8	Very low	120 Å²	120	134.3 Å²	134.3	74%	0.736	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-82.4	116.9	171.6	52.7	0	0	0	0	108.2	Q241	Q241-T243 HydrophobicContact CB-CG2 4.36Å; Q241-T243 PolarHBondContact O-N 2.88Å
244	M	65.9	Low	46.5	Very low	112 Å²	112	129 Å²	129	55%	0.552	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-89.9	138.3	169.2	68.5	-168.3	-68	0	0	109.5	A248 F249 L252	M244-A248 HydrophobicContact CE-CB 4.17Å; M244-F249 HydrophobicContact CE-CB 4.46Å; M244-L252 HydrophobicContact CE-CD1 4.24Å
245	K	58.2	Low	46.5	Very low	167 Å²	167	127.7 Å²	127.7	73%	0.726	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-65.1	141.6	179.2	-67.1	-174.8	178.4	-179.3	0	109.7	S247 A248 F249	K245-S247 PolarHBondContact O-N 3.26Å; K245-S247 VanDerWaalsContact O-N 3.11Å; K245-A248 WeakPolarHBondContact O-CA 3.25Å; K245-A248 WeakPolarHBondContact O-CB 3.45Å; K245-A248 PolarHBondContact O-N 3.18Å; K245-F249 PolarHBondContact O-N 3.44Å
246	R	60.6	Low	46.7	Very low	206 Å²	206	125.5 Å²	125.5	78%	0.777	68%	0.682	S	S	*	*	H	α-helix	trans	-52.5	-35.8	-176.6	-165.9	165.7	-179.7	164.8	-0.6	113.5	A248 F249 D250	R246-A248 VanDerWaalsContact C-N 3.28Å; R246-A248 PolarHBondContact O-N 2.88Å; R246-F249 CarbonylContact O-C 3.56Å; R246-F249 WeakPolarHBondContact O-CA 3.22Å; R246-F249 WeakPolarHBondContact O-CB 3.43Å; R246-F249 PolarHBondContact O-N 3.36Å; R246-D250 VanDerWaalsContact O-CG 3.24Å; R246-D250 PolarHBondContact O-N 3.08Å
247	S	66.6	Low	47	Very low	90 Å²	90	121.3 Å²	121.3	63%	0.629	67%	0.67	S	S	*	*	H	α-helix	trans	-63.2	-29.8	173.9	59.8	0	0	0	0	114.3	K245 A251	K245-S247 PolarHBondContact O-N 3.26Å; K245-S247 VanDerWaalsContact O-N 3.11Å; S247-A251 VanDerWaalsContact O-CB 3.32Å; S247-A251 WeakPolarHBondContact O-CB 3.43Å; S247-A251 PolarHBondContact O-N 3.29Å
248	A	67.5	Low	47.1	Very low	46 Å²	46	117.2 Å²	117.2	38%	0.38	67%	0.666	S	S	.	*	H	α-helix	trans	-80.7	-22.4	173.6	0	0	0	0	0	112.1	M244 K245 R246	M244-A248 HydrophobicContact CE-CB 4.17Å; K245-A248 WeakPolarHBondContact O-CA 3.25Å; K245-A248 WeakPolarHBondContact O-CB 3.45Å; K245-A248 PolarHBondContact O-N 3.18Å; R246-A248 VanDerWaalsContact C-N 3.28Å; R246-A248 PolarHBondContact O-N 2.88Å
249	F	64	Low	47.2	Very low	130 Å²	130	122.9 Å²	122.9	57%	0.57	68%	0.679	S	S	*	*	H	α-helix	trans	-76.8	-44	171.2	-177.4	-95.5	0	0	0	110.8	M244 K245 R246 A251 L252	M244-F249 HydrophobicContact CE-CB 4.46Å; K245-F249 PolarHBondContact O-N 3.44Å; R246-F249 CarbonylContact O-C 3.56Å; R246-F249 WeakPolarHBondContact O-CA 3.22Å; R246-F249 WeakPolarHBondContact O-CB 3.43Å; R246-F249 PolarHBondContact O-N 3.36Å; F249-A251 PolarHBondContact O-N 3.15Å; F249-L252 HydrophobicContact CD2-CD1 4.4Å; F249-L252 WeakPolarHBondContact O-CB 3.32Å; F249-L252 PolarHBondContact O-N 3.46Å; F249-L252 VanDerWaalsContact O-N 3.08Å
250	D	64.8	Low	47.1	Very low	110 Å²	110	122.1 Å²	122.1	59%	0.588	67%	0.671	S	S	*	*	H	α-helix	trans	-69.8	-20.3	178.5	-60.3	-27	0	0	0	112.5	R246 L252	R246-D250 VanDerWaalsContact O-CG 3.24Å; R246-D250 PolarHBondContact O-N 3.08Å; D250-L252 VanDerWaalsContact C-N 3.3Å
251	A	60.1	Low	47.2	Very low	77 Å²	77	124.8 Å²	124.8	64%	0.636	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-2.3	173.1	0	0	0	0	0	113.7	S247 F249 D253	S247-A251 VanDerWaalsContact O-CB 3.32Å; S247-A251 WeakPolarHBondContact O-CB 3.43Å; S247-A251 PolarHBondContact O-N 3.29Å; F249-A251 PolarHBondContact O-N 3.15Å; A251-D253 VanDerWaalsContact C-N 3.26Å; A251-D253 PolarHBondContact O-N 3.21Å
252	L	50.6	Low	47.2	Very low	103 Å²	103	121.4 Å²	121.4	54%	0.539	66%	0.662	S	S	.	*			trans	-75.4	88.1	165.1	-67.8	168.3	0	0	0	107.5	M244 F249 D250 V254	M244-L252 HydrophobicContact CE-CD1 4.24Å; F249-L252 HydrophobicContact CD2-CD1 4.4Å; F249-L252 WeakPolarHBondContact O-CB 3.32Å; F249-L252 PolarHBondContact O-N 3.46Å; F249-L252 VanDerWaalsContact O-N 3.08Å; D250-L252 VanDerWaalsContact C-N 3.3Å; L252-V254 PolarHBondContact O-N 3.03Å; L252-V254 VanDerWaalsContact O-N 3.11Å
253	D	44.2	Very low	47.1	Very low	128 Å²	128	116.5 Å²	116.5	68%	0.684	66%	0.655	S	S	*	*			trans	-68.6	104	174.8	-164.2	-5.2	0	0	0	109.5	A251 A255	A251-D253 VanDerWaalsContact C-N 3.26Å; A251-D253 PolarHBondContact O-N 3.21Å; D253-A255 PolarHBondContact O-N 2.78Å; D253-A255 PolarHBondContact OD1-N 2.9Å
254	V	45.7	Very low	46.9	Very low	130 Å²	130	114 Å²	114	79%	0.788	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	4.2	-176.5	174.9	0	0	0	0	112.1	L252	L252-V254 PolarHBondContact O-N 3.03Å; L252-V254 VanDerWaalsContact O-N 3.11Å
255	A	35.3	Very low	45.5	Very low	87 Å²	87	113 Å²	113	72%	0.719	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-0.1	-168.5	0	0	0	0	0	117.2	D253	D253-A255 PolarHBondContact O-N 2.78Å; D253-A255 PolarHBondContact OD1-N 2.9Å
256	A	34.1	Very low	44.7	Very low	84 Å²	84	110.8 Å²	110.8	69%	0.694	65%	0.645	S	S	*	*	S	Bend	trans	-133.5	4.8	-175.5	0	0	0	0	0	117.1
257	S	35.1	Very low	44	Very low	72 Å²	72	105.8 Å²	105.8	50%	0.503	64%	0.642	S	S	.	*	S	Bend	trans	-110.4	1.6	-178.2	41.7	0	0	0	0	114.9
258	G	30.4	Very low	42.9	Very low	57 Å²	57	105.3 Å²	105.3	59%	0.588	64%	0.638	S	S	*	*	S	Bend	trans	-80.6	-21.2	-176.5	0	0	0	0	0	116.2
259	W	30.3	Very low	41.8	Very low	245 Å²	245	106.4 Å²	106.4	93%	0.928	64%	0.638	S	S	*	*	S	Bend	trans	-121.9	-19.1	-169.1	-68.5	64	0	0	0	114.6
260	E	31.8	Very low	40.7	Very low	160 Å²	160	106.2 Å²	106.2	75%	0.748	64%	0.642	S	S	*	*	S	Bend	trans	-89.4	-14.3	172.2	-78.4	-167	156.2	0	0	114.2	V262 S263	E260-V262 PolarHBondContact O-N 2.76Å; E260-V262 VanDerWaalsContact O-N 3.16Å; E260-S263 PolarHBondContact O-N 2.84Å; E260-S263 PolarHBondContact O-OG 3.1Å
261	L	32.9	Very low	39.5	Very low	113 Å²	113	107.8 Å²	107.8	59%	0.592	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-7.1	174.8	-111.1	149.8	0	0	0	113.3	L265	L261-L265 WeakPolarHBondContact O-CD1 3.48Å; L261-L265 VanDerWaalsContact O-CG 3.31Å; L261-L265 WeakPolarHBondContact O-CG 3.25Å
262	V	36.1	Very low	38.5	Very low	100 Å²	100	109.2 Å²	109.2	61%	0.606	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-16.9	-178.3	-176	0	0	0	0	113	E260	E260-V262 PolarHBondContact O-N 2.76Å; E260-V262 VanDerWaalsContact O-N 3.16Å
263	S	35.8	Very low	37.8	Very low	109 Å²	109	110.8 Å²	110.8	76%	0.762	64%	0.644	S	S	*	*	S	Bend	trans	-89	-10.1	179.4	60.3	0	0	0	0	114.6	E260	E260-S263 PolarHBondContact O-N 2.84Å; E260-S263 PolarHBondContact O-OG 3.1Å
264	G	35.6	Very low	37.8	Very low	67 Å²	67	108 Å²	108	69%	0.691	63%	0.632	S	S	*	*	S	Bend	trans	-107.9	0.4	-178.3	0	0	0	0	0	115.3	D266	G264-D266 PolarHBondContact O-N 3.13Å; G264-D266 VanDerWaalsContact O-N 3.14Å
265	L	36.3	Very low	37.5	Very low	93 Å²	93	106.4 Å²	106.4	49%	0.487	62%	0.618	S	S	.	*			trans	-85.5	96	-175.3	-73.8	169.2	0	0	0	110.4	L261 L269	L261-L265 WeakPolarHBondContact O-CD1 3.48Å; L261-L265 VanDerWaalsContact O-CG 3.31Å; L261-L265 WeakPolarHBondContact O-CG 3.25Å; L265-L269 HydrophobicContact CB-CB 4.49Å; L265-L269 HydrophobicContact CB-CD1 3.93Å; L265-L269 HydrophobicContact CD1-CD1 3.63Å; L265-L269 HydrophobicContact CD2-CD1 3.24Å; L265-L269 HydrophobicContact CD2-CG 4.37Å; L265-L269 HydrophobicContact CG-CD1 3.73Å
266	D	41.1	Very low	37.8	Very low	120 Å²	120	106 Å²	106	64%	0.642	61%	0.607	S	S	*	*			trans	-35.5	145.9	166.3	-171.8	8.5	0	0	0	112.6	G264 S268 L269	G264-D266 PolarHBondContact O-N 3.13Å; G264-D266 VanDerWaalsContact O-N 3.14Å; D266-S268 PolarHBondContact O-N 2.96Å; D266-L269 PolarHBondContact O-N 2.78Å; D266-L269 VanDerWaalsContact O-N 3.13Å
267	S	45.5	Very low	37.9	Very low	100 Å²	100	107 Å²	107	70%	0.699	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	0.9	-164.7	71.8	0	0	0	0	115.6
268	S	44.6	Very low	38.3	Very low	80 Å²	80	108.5 Å²	108.5	56%	0.559	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-20	171.9	60.1	0	0	0	0	113.5	D266	D266-S268 PolarHBondContact O-N 2.96Å
269	L	43.9	Very low	38.6	Very low	70 Å²	70	112.4 Å²	112.4	37%	0.366	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.3	-1.9	176.9	-70.6	-169	0	0	0	115.5	L265 D266 H271 L272 F273	L265-L269 HydrophobicContact CB-CB 4.49Å; L265-L269 HydrophobicContact CB-CD1 3.93Å; L265-L269 HydrophobicContact CD1-CD1 3.63Å; L265-L269 HydrophobicContact CD2-CD1 3.24Å; L265-L269 HydrophobicContact CD2-CG 4.37Å; L265-L269 HydrophobicContact CG-CD1 3.73Å; D266-L269 PolarHBondContact O-N 2.78Å; D266-L269 VanDerWaalsContact O-N 3.13Å; L269-H271 PolarHBondContact O-N 2.97Å; L269-L272 HydrophobicContact CD2-CB 4.33Å; L269-L272 HydrophobicContact CD2-CD2 4.48Å; L269-L272 PolarHBondContact O-N 3.01Å; L269-F273 PolarHBondContact O-N 2.84Å
270	L	41.2	Very low	38.8	Very low	126 Å²	126	107.6 Å²	107.6	66%	0.66	59%	0.585	S	S	*	*	H	α-helix	trans	-60.4	-25	170.2	-167	63.3	0	0	0	112	T274	L270-T274 PolarHBondContact O-N 3.17Å; L270-T274 PolarHBondContact O-OG1 3.41Å
271	H	40	Very low	39	Very low	143 Å²	143	106 Å²	106	66%	0.662	58%	0.578	S	S	*	*	H	α-helix	trans	-77.2	-24.7	175.1	-76.1	86	0	0	0	113.9	L269 T274 I275	L269-H271 PolarHBondContact O-N 2.97Å; H271-T274 PolarHBondContact O-OG1 2.85Å; H271-T274 VanDerWaalsContact O-OG1 3.07Å; H271-I275 WeakPolarHBondContact O-CD1 3.22Å; H271-I275 VanDerWaalsContact O-CG1 3.31Å; H271-I275 WeakPolarHBondContact O-CG1 3.34Å; H271-I275 PolarHBondContact O-N 2.72Å
272	L	38.5	Very low	39.1	Very low	106 Å²	106	108.9 Å²	108.9	56%	0.555	58%	0.582	S	S	*	*	H	α-helix	trans	-85.5	-31.8	178.3	-142.1	75.2	0	0	0	111.5	L269 I275 T276	L269-L272 HydrophobicContact CD2-CB 4.33Å; L269-L272 HydrophobicContact CD2-CD2 4.48Å; L269-L272 PolarHBondContact O-N 3.01Å; L272-I275 PolarHBondContact O-N 2.95Å; L272-T276 PolarHBondContact O-N 3.45Å; L272-T276 PolarHBondContact O-OG1 3.09Å
273	F	35.8	Very low	39	Very low	137 Å²	137	109.8 Å²	109.8	60%	0.601	58%	0.583	S	S	*	*	H	α-helix	trans	-65.4	-40.7	174.1	-129.8	-88.6	0	0	0	111.6	L269 T276 Q277	L269-F273 PolarHBondContact O-N 2.84Å; F273-T276 PolarHBondContact O-N 3.22Å; F273-Q277 WeakPolarHBondContact O-CB 3.3Å; F273-Q277 PolarHBondContact O-N 2.83Å
274	T	43.5	Very low	38.8	Very low	68 Å²	68	110.9 Å²	110.9	42%	0.417	58%	0.579	S	S	.	*	H	α-helix	trans	-66.9	-40.2	175.3	47	0	0	0	0	112.5	L270 H271 T276 Q277 I278	L270-T274 PolarHBondContact O-N 3.17Å; L270-T274 PolarHBondContact O-OG1 3.41Å; H271-T274 PolarHBondContact O-OG1 2.85Å; H271-T274 VanDerWaalsContact O-OG1 3.07Å; T274-T276 VanDerWaalsContact C-N 3.32Å; T274-T276 PolarHBondContact O-N 3.34Å; T274-Q277 PolarHBondContact O-N 3.43Å; T274-I278 WeakPolarHBondContact O-CB 3.48Å; T274-I278 WeakPolarHBondContact O-CD1 3.16Å; T274-I278 WeakPolarHBondContact O-CG1 3.47Å; T274-I278 PolarHBondContact O-N 3.06Å
275	I	41	Very low	38.5	Very low	97 Å²	97	114.3 Å²	114.3	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-62.6	-40.8	174.4	-68.3	168.5	0	0	0	110.8	H271 L272 I278 F279	H271-I275 WeakPolarHBondContact O-CD1 3.22Å; H271-I275 VanDerWaalsContact O-CG1 3.31Å; H271-I275 WeakPolarHBondContact O-CG1 3.34Å; H271-I275 PolarHBondContact O-N 2.72Å; L272-I275 PolarHBondContact O-N 2.95Å; I275-I278 PolarHBondContact O-N 3.29Å; I275-F279 WeakPolarHBondContact O-CB 3.48Å; I275-F279 PolarHBondContact O-N 2.98Å
276	T	39.9	Very low	38.4	Very low	80 Å²	80	112.8 Å²	112.8	49%	0.491	58%	0.579	S	S	.	*	H	α-helix	trans	-71.6	-34.7	179.4	-46.9	0	0	0	0	112.1	L272 F273 T274 F279 K280	L272-T276 PolarHBondContact O-N 3.45Å; L272-T276 PolarHBondContact O-OG1 3.09Å; F273-T276 PolarHBondContact O-N 3.22Å; T274-T276 VanDerWaalsContact C-N 3.32Å; T274-T276 PolarHBondContact O-N 3.34Å; T276-F279 PolarHBondContact O-N 3.37Å; T276-K280 WeakPolarHBondContact O-CB 3.43Å; T276-K280 PolarHBondContact O-N 3.13Å
277	Q	37.9	Very low	38.2	Very low	104 Å²	104	109 Å²	109	49%	0.486	57%	0.569	S	S	.	*	H	α-helix	trans	-66.5	-45	173.7	-147.1	103.7	-2.2	0	0	110.9	F273 T274 F279 K280 E281	F273-Q277 WeakPolarHBondContact O-CB 3.3Å; F273-Q277 PolarHBondContact O-N 2.83Å; T274-Q277 PolarHBondContact O-N 3.43Å; Q277-F279 VanDerWaalsContact C-N 3.31Å; Q277-F279 PolarHBondContact O-N 2.87Å; Q277-K280 PolarHBondContact O-N 2.63Å; Q277-E281 PolarHBondContact O-N 3.09Å
278	I	43.3	Very low	38	Very low	104 Å²	104	108.7 Å²	108.7	53%	0.533	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-40.5	173.2	-67.8	164.4	0	0	0	109.7	T274 I275 K280 E281 Y282	T274-I278 WeakPolarHBondContact O-CB 3.48Å; T274-I278 WeakPolarHBondContact O-CD1 3.16Å; T274-I278 WeakPolarHBondContact O-CG1 3.47Å; T274-I278 PolarHBondContact O-N 3.06Å; I275-I278 PolarHBondContact O-N 3.29Å; I278-K280 PolarHBondContact O-N 2.52Å; I278-E281 PolarHBondContact O-N 2.98Å; I278-Y282 WeakPolarHBondContact O-CB 3.49Å; I278-Y282 PolarHBondContact O-N 3.24Å
279	F	36	Very low	38.8	Very low	138 Å²	138	107.2 Å²	107.2	61%	0.605	55%	0.547	S	S	*	.	H	α-helix	trans	-66.2	-36.6	176.2	-127.4	-94.6	0	0	0	111.9	I275 T276 Q277 L283	I275-F279 WeakPolarHBondContact O-CB 3.48Å; I275-F279 PolarHBondContact O-N 2.98Å; T276-F279 PolarHBondContact O-N 3.37Å; Q277-F279 VanDerWaalsContact C-N 3.31Å; Q277-F279 PolarHBondContact O-N 2.87Å; F279-L283 VanDerWaalsContact O-CB 3.23Å; F279-L283 WeakPolarHBondContact O-CB 3.49Å; F279-L283 PolarHBondContact O-N 3.36Å
280	K	35.1	Very low	39.7	Very low	144 Å²	144	104 Å²	104	63%	0.626	53%	0.53	S	S	*	.	H	α-helix	trans	-68.6	-44.6	173.6	-99.9	-177.7	175	179.4	0	112.2	T276 Q277 I278 Y282 L283 I284	T276-K280 WeakPolarHBondContact O-CB 3.43Å; T276-K280 PolarHBondContact O-N 3.13Å; Q277-K280 PolarHBondContact O-N 2.63Å; I278-K280 PolarHBondContact O-N 2.52Å; K280-Y282 VanDerWaalsContact C-N 3.29Å; K280-Y282 PolarHBondContact O-N 2.72Å; K280-L283 PolarHBondContact O-N 2.93Å; K280-I284 WeakPolarHBondContact O-CB 3.27Å; K280-I284 WeakPolarHBondContact O-CD1 3.48Å; K280-I284 WeakPolarHBondContact O-CG1 3.37Å; K280-I284 PolarHBondContact O-N 2.9Å
281	E	35.1	Very low	40.4	Very low	128 Å²	128	101.1 Å²	101.1	60%	0.598	52%	0.518	S	S	*	.	H	α-helix	trans	-63.8	-37.4	175	-75.2	177.5	175	0	0	111	Q277 I278 M285	Q277-E281 PolarHBondContact O-N 3.09Å; I278-E281 PolarHBondContact O-N 2.98Å; E281-M285 WeakPolarHBondContact O-CB 3.07Å; E281-M285 WeakPolarHBondContact O-CG 3.38Å; E281-M285 PolarHBondContact O-N 2.9Å
282	Y	35.6	Very low	41.4	Very low	172 Å²	172	97.2 Å²	97.2	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-72.3	-38.1	176.1	-157.4	-92.7	0	0	0	112.6	I278 K280 M285 A286	I278-Y282 WeakPolarHBondContact O-CB 3.49Å; I278-Y282 PolarHBondContact O-N 3.24Å; K280-Y282 VanDerWaalsContact C-N 3.29Å; K280-Y282 PolarHBondContact O-N 2.72Å; Y282-M285 PolarHBondContact O-N 2.84Å; Y282-A286 WeakPolarHBondContact O-CB 3.48Å; Y282-A286 PolarHBondContact O-N 3.47Å
283	L	32.9	Very low	43	Very low	119 Å²	119	93.3 Å²	93.3	62%	0.623	50%	0.496	S	S	*	.	H	α-helix	trans	-71.1	-34.8	177.1	-147.6	88.6	0	0	0	111.7	F279 K280 A286 G287	F279-L283 VanDerWaalsContact O-CB 3.23Å; F279-L283 WeakPolarHBondContact O-CB 3.49Å; F279-L283 PolarHBondContact O-N 3.36Å; K280-L283 PolarHBondContact O-N 2.93Å; L283-A286 PolarHBondContact O-N 2.71Å; L283-G287 PolarHBondContact O-N 3.21Å
284	I	31.3	Very low	44.8	Very low	133 Å²	133	89.3 Å²	89.3	68%	0.682	48%	0.48	S	S	*	.	H	α-helix	trans	-70.6	-34.3	174.2	-65.2	165.5	0	0	0	110.5	K280 G287	K280-I284 WeakPolarHBondContact O-CB 3.27Å; K280-I284 WeakPolarHBondContact O-CD1 3.48Å; K280-I284 WeakPolarHBondContact O-CG1 3.37Å; K280-I284 PolarHBondContact O-N 2.9Å; I284-G287 PolarHBondContact O-N 2.94Å
285	M	30.6	Very low	46.1	Very low	138 Å²	138	88.5 Å²	88.5	68%	0.68	48%	0.476	S	S	*	.	H	α-helix	trans	-78	-19.1	174.4	-72.2	-70.2	-71.6	0	0	114.1	E281 Y282 G287	E281-M285 WeakPolarHBondContact O-CB 3.07Å; E281-M285 WeakPolarHBondContact O-CG 3.38Å; E281-M285 PolarHBondContact O-N 2.9Å; Y282-M285 PolarHBondContact O-N 2.84Å; M285-G287 VanDerWaalsContact C-N 3.35Å
286	A	32.9	Very low	47.7	Very low	61 Å²	61	85.3 Å²	85.3	50%	0.504	46%	0.461	S	S	.	.	H	α-helix	trans	-83.9	-11.4	170.2	0	0	0	0	0	112.7	Y282 L283 N288	Y282-A286 WeakPolarHBondContact O-CB 3.48Å; Y282-A286 PolarHBondContact O-N 3.47Å; L283-A286 PolarHBondContact O-N 2.71Å; A286-N288 PolarHBondContact O-N 2.96Å
287	G	38.3	Very low	49.4	Very low	42 Å²	42	81.5 Å²	81.5	43%	0.433	44%	0.438	S	S	.	.	S	Bend	trans	-64	101.7	162.8	0	0	0	0	0	108.5	L283 I284 M285 T289	L283-G287 PolarHBondContact O-N 3.21Å; I284-G287 PolarHBondContact O-N 2.94Å; M285-G287 VanDerWaalsContact C-N 3.35Å; G287-T289 PolarHBondContact O-N 2.85Å
288	N	41.6	Very low	51.1	Low	93 Å²	93	81.3 Å²	81.3	50%	0.497	43%	0.434	S	S	.	.			trans	-18.9	117.7	176.3	-77	13.7	0	0	0	113.2	A286 L290 T291 G292 D616	A286-N288 PolarHBondContact O-N 2.96Å; N288-L290 PolarHBondContact O-N 2.88Å; N288-L290 VanDerWaalsContact O-N 3.07Å; N288-T291 VanDerWaalsContact CB-OG1 3.31Å; N288-T291 WeakPolarHBondContact CB-OG1 3.41Å; N288-T291 WeakPolarHBondContact O-CA 3.44Å; N288-T291 WeakPolarHBondContact O-CB 3.49Å; N288-T291 PolarHBondContact O-N 2.86Å; N288-G292 PolarHBondContact O-N 3Å; N288-D616 WeakPolarHBondContact CB-OD2 3.39Å
289	T	59.9	Low	52.4	Low	49 Å²	49	78.5 Å²	78.5	30%	0.301	42%	0.421	S	S	.	.	H	α-helix	trans	-55.8	-29.5	-175.4	18.1	0	0	0	0	113.6	G287 D616 L633 R635	G287-T289 PolarHBondContact O-N 2.85Å; T289-D616 PolarHBondContact N-OD2 2.83Å; T289-L633 WeakPolarHBondContact OG1-CD2 3.44Å; T289-R635 PolarHBondContact OG1-NH2 2.87Å
290	L	62.4	Low	53.8	Low	2 Å²	2	72 Å²	72	1%	0.01	39%	0.392	C	S	.	.	H	α-helix	trans	-72.3	-30.3	172.4	-65.6	175.8	0	0	0	112.5	N288 G292 L293 I294 D616 M618 I631 L633 Y642	N288-L290 PolarHBondContact O-N 2.88Å; N288-L290 VanDerWaalsContact O-N 3.07Å; L290-G292 VanDerWaalsContact C-N 3.28Å; L290-G292 PolarHBondContact O-N 2.96Å; L290-L293 CarbonylContact O-C 3.49Å; L290-L293 WeakPolarHBondContact O-CA 3.16Å; L290-L293 PolarHBondContact O-N 2.75Å; L290-I294 WeakPolarHBondContact O-CG1 3.42Å; L290-I294 PolarHBondContact O-N 2.89Å; L290-D616 WeakPolarHBondContact CB-OD2 3.43Å; L290-D616 HydrophobicContact CD1-CB 3.72Å; L290-D616 HydrophobicContact CG-CB 3.87Å; L290-D616 WeakPolarHBondContact CG-OD2 3.24Å; L290-D616 PolarHBondContact N-OD2 3.33Å; L290-M618 HydrophobicContact CD1-CB 3.93Å; L290-I631 HydrophobicContact CD1-CG2 4.49Å; L290-I631 HydrophobicContact CD2-CG2 4.07Å; L290-L633 HydrophobicContact CD1-CB 4.41Å; L290-L633 HydrophobicContact CD2-CB 4.23Å; L290-L633 HydrophobicContact CG-CB 4.29Å; L290-Y642 HydrophobicContact CD2-CD1 4.3Å; L290-Y642 HydrophobicContact CD2-CE1 4.3Å
291	T	56.2	Low	55.2	Low	65 Å²	65	65.3 Å²	65.3	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-59.8	-39.2	176.7	-58.5	0	0	0	0	111.4	N288 L293 I294	N288-T291 VanDerWaalsContact CB-OG1 3.31Å; N288-T291 WeakPolarHBondContact CB-OG1 3.41Å; N288-T291 WeakPolarHBondContact O-CA 3.44Å; N288-T291 WeakPolarHBondContact O-CB 3.49Å; N288-T291 PolarHBondContact O-N 2.86Å; T291-L293 VanDerWaalsContact C-N 3.26Å; T291-L293 PolarHBondContact O-N 2.9Å; T291-I294 HydrophobicContact CG2-CD1 4.06Å; T291-I294 WeakPolarHBondContact O-CB 3.32Å; T291-I294 PolarHBondContact O-N 3.43Å
292	G	62.3	Low	56.4	Low	61 Å²	61	65.1 Å²	65.1	63%	0.629	37%	0.367	S	S	*	.	H	α-helix	trans	-67.7	-22.9	173	0	0	0	0	0	114.4	N288 L290	N288-G292 PolarHBondContact O-N 3Å; L290-G292 VanDerWaalsContact C-N 3.28Å; L290-G292 PolarHBondContact O-N 2.96Å
293	L	72.2	Confident	57.5	Low	24 Å²	24	60.5 Å²	60.5	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-97.8	-2.6	178.3	-63.9	177.7	0	0	0	113.5	L290 T291 P295 T296 I297 L392 Y642	L290-L293 CarbonylContact O-C 3.49Å; L290-L293 WeakPolarHBondContact O-CA 3.16Å; L290-L293 PolarHBondContact O-N 2.75Å; T291-L293 VanDerWaalsContact C-N 3.26Å; T291-L293 PolarHBondContact O-N 2.9Å; L293-P295 VanDerWaalsContact C-N 3.34Å; L293-T296 CarbonylContact O-C 3.6Å; L293-T296 WeakPolarHBondContact O-CA 3.46Å; L293-T296 VanDerWaalsContact O-CB 3.29Å; L293-T296 WeakPolarHBondContact O-CB 3.12Å; L293-T296 PolarHBondContact O-N 2.96Å; L293-I297 HydrophobicContact CB-CD1 4.12Å; L293-I297 HydrophobicContact CB-CG1 4.49Å; L293-I297 WeakPolarHBondContact O-CG1 3.5Å; L293-I297 PolarHBondContact O-N 3.2Å; L293-L392 HydrophobicContact CD1-CD2 4.29Å; L293-L392 HydrophobicContact CD2-CD2 4.35Å; L293-Y642 HydrophobicContact CD1-CE1 3.65Å
294	I	73.3	Confident	58.7	Low	53 Å²	53	55.6 Å²	55.6	27%	0.272	33%	0.332	S	S	.	.	H	α-helix	trans	-48.5	-50.7	176.5	-77.1	174	0	0	0	111.4	L290 T291 T296 I297 Y298 M618	L290-I294 WeakPolarHBondContact O-CG1 3.42Å; L290-I294 PolarHBondContact O-N 2.89Å; T291-I294 HydrophobicContact CG2-CD1 4.06Å; T291-I294 WeakPolarHBondContact O-CB 3.32Å; T291-I294 PolarHBondContact O-N 3.43Å; I294-T296 VanDerWaalsContact C-N 3.28Å; I294-T296 PolarHBondContact O-N 3.2Å; I294-I297 PolarHBondContact O-N 2.87Å; I294-Y298 HydrophobicContact CG2-CD2 3.68Å; I294-Y298 HydrophobicContact CG2-CE2 3.83Å; I294-Y298 WeakPolarHBondContact O-CD2 3.29Å; I294-Y298 PolarHBondContact O-N 2.83Å; I294-M618 HydrophobicContact CD1-CE 4.3Å; I294-M618 HydrophobicContact CD1-SD 4.49Å; I294-M618 HydrophobicContact CG1-CE 3.94Å; I294-M618 HydrophobicContact CG1-SD 3.92Å
295	P	71.4	Confident	59.3	Low	52 Å²	52	53.9 Å²	53.9	34%	0.338	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-38	179.6	-23.4	34.9	0	0	0	112.6	T120 L293 T299	T120-P295 HydrophobicContact CG2-CG 4.32Å; L293-P295 VanDerWaalsContact C-N 3.34Å; P295-T299 WeakPolarHBondContact O-CB 3.44Å; P295-T299 PolarHBondContact O-N 2.87Å; P295-T299 PolarHBondContact O-OG1 2.58Å
296	T	73.5	Confident	60.7	Low	29 Å²	29	49.7 Å²	49.7	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-43.8	177.4	-51	0	0	0	0	111.2	L293 I294 A300 A393	L293-T296 CarbonylContact O-C 3.6Å; L293-T296 WeakPolarHBondContact O-CA 3.46Å; L293-T296 VanDerWaalsContact O-CB 3.29Å; L293-T296 WeakPolarHBondContact O-CB 3.12Å; L293-T296 PolarHBondContact O-N 2.96Å; I294-T296 VanDerWaalsContact C-N 3.28Å; I294-T296 PolarHBondContact O-N 3.2Å; T296-A300 VanDerWaalsContact O-CB 3.24Å; T296-A300 WeakPolarHBondContact O-CB 3.18Å; T296-A300 PolarHBondContact O-N 2.77Å; T296-A393 HydrophobicContact CG2-CB 3.53Å
297	I	75.5	Confident	62.2	Low	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67.6	-45.5	-179.3	-68.2	163	0	0	0	111.1	L293 I294 A300 L301 F400 V620 I631	L293-I297 HydrophobicContact CB-CD1 4.12Å; L293-I297 HydrophobicContact CB-CG1 4.49Å; L293-I297 WeakPolarHBondContact O-CG1 3.5Å; L293-I297 PolarHBondContact O-N 3.2Å; I294-I297 PolarHBondContact O-N 2.87Å; I297-A300 WeakPolarHBondContact O-CB 3.31Å; I297-A300 PolarHBondContact O-N 3.43Å; I297-L301 WeakPolarHBondContact O-CB 3.36Å; I297-L301 PolarHBondContact O-N 3.26Å; I297-F400 HydrophobicContact CG2-CE2 4.4Å; I297-F400 HydrophobicContact CG2-CZ 4.14Å; I297-V620 HydrophobicContact CG2-CG1 4.34Å; I297-V620 HydrophobicContact CG2-CG2 3.92Å; I297-I631 HydrophobicContact CB-CD1 4.45Å; I297-I631 HydrophobicContact CD1-CD1 3.87Å; I297-I631 HydrophobicContact CG1-CD1 4.18Å; I297-I631 HydrophobicContact CG2-CD1 3.43Å; I297-I631 VanDerWaalsContact CG2-CD1 3.43Å
298	Y	73.5	Confident	63.7	Low	101 Å²	101	52.1 Å²	52.1	40%	0.396	30%	0.298	S	S	.	.	H	α-helix	trans	-71.6	-37.1	177.6	-79.5	-78.2	0	0	0	112.5	I294 A300 L301 D302 M618 V620	I294-Y298 HydrophobicContact CG2-CD2 3.68Å; I294-Y298 HydrophobicContact CG2-CE2 3.83Å; I294-Y298 WeakPolarHBondContact O-CD2 3.29Å; I294-Y298 PolarHBondContact O-N 2.83Å; Y298-A300 VanDerWaalsContact C-N 3.29Å; Y298-A300 PolarHBondContact O-N 2.87Å; Y298-L301 HydrophobicContact CD1-CD2 4.25Å; Y298-L301 WeakPolarHBondContact O-CB 3.38Å; Y298-L301 PolarHBondContact O-N 3.44Å; Y298-D302 WeakPolarHBondContact O-CB 3.25Å; Y298-D302 PolarHBondContact O-N 2.73Å; Y298-M618 HydrophobicContact CE2-CE 3.79Å; Y298-V620 HydrophobicContact CE1-CG1 4Å
299	T	72	Confident	65.4	Low	45 Å²	45	49.3 Å²	49.3	28%	0.276	28%	0.284	S	S	.	.	H	α-helix	trans	-65.5	-36	172.7	-58.4	0	0	0	0	111	P295 V303	P295-T299 WeakPolarHBondContact O-CB 3.44Å; P295-T299 PolarHBondContact O-N 2.87Å; P295-T299 PolarHBondContact O-OG1 2.58Å; T299-V303 HydrophobicContact CG2-CG2 4.1Å; T299-V303 WeakPolarHBondContact O-CB 3.35Å; T299-V303 VanDerWaalsContact O-CG2 3.27Å; T299-V303 WeakPolarHBondContact O-CG2 3.04Å; T299-V303 PolarHBondContact O-N 2.98Å
300	A	64	Low	66.7	Low	0 Å²	0	47 Å²	47	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.9	-53.9	170	0	0	0	0	0	110	T296 I297 Y298 D302 V303 V304 A393 F396 K397	T296-A300 VanDerWaalsContact O-CB 3.24Å; T296-A300 WeakPolarHBondContact O-CB 3.18Å; T296-A300 PolarHBondContact O-N 2.77Å; I297-A300 WeakPolarHBondContact O-CB 3.31Å; I297-A300 PolarHBondContact O-N 3.43Å; Y298-A300 VanDerWaalsContact C-N 3.29Å; Y298-A300 PolarHBondContact O-N 2.87Å; A300-D302 VanDerWaalsContact C-N 3.29Å; A300-D302 PolarHBondContact O-N 3.31Å; A300-V303 PolarHBondContact O-N 2.87Å; A300-V304 WeakPolarHBondContact O-CG2 3.36Å; A300-V304 PolarHBondContact O-N 3.2Å; A300-V304 VanDerWaalsContact O-N 3.11Å; A300-A393 HydrophobicContact CB-CB 4.49Å; A300-A393 WeakPolarHBondContact CB-O 3.35Å; A300-F396 HydrophobicContact CB-CB 4.04Å; A300-K397 HydrophobicContact CB-CG 3.58Å; A300-K397 WeakPolarHBondContact O-CG 3.35Å
301	L	64.7	Low	68	Low	4 Å²	4	47 Å²	47	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-55.2	-39.6	-178.3	-164.5	70.1	0	0	0	114.1	I297 Y298 R306 F400 V620 D622	I297-L301 WeakPolarHBondContact O-CB 3.36Å; I297-L301 PolarHBondContact O-N 3.26Å; Y298-L301 HydrophobicContact CD1-CD2 4.25Å; Y298-L301 WeakPolarHBondContact O-CB 3.38Å; Y298-L301 PolarHBondContact O-N 3.44Å; L301-R306 PolarHBondContact O-NH2 2.7Å; L301-F400 HydrophobicContact CD1-CD1 4.23Å; L301-F400 HydrophobicContact CD1-CD2 3.99Å; L301-F400 HydrophobicContact CD1-CE1 4.41Å; L301-F400 HydrophobicContact CD1-CE2 4.19Å; L301-F400 HydrophobicContact CD1-CG 4.03Å; L301-F400 HydrophobicContact CD1-CZ 4.39Å; L301-V620 HydrophobicContact CD2-CG1 3.87Å; L301-D622 HydrophobicContact CD1-CB 4.16Å; L301-D622 HydrophobicContact CD2-CB 4.44Å
302	D	61.4	Low	69.7	Low	124 Å²	124	43.9 Å²	43.9	66%	0.663	25%	0.25	S	S	*	.	H	α-helix	trans	-76.7	-41.2	-179.3	-172.3	38.8	0	0	0	112.9	Y298 A300 V304	Y298-D302 WeakPolarHBondContact O-CB 3.25Å; Y298-D302 PolarHBondContact O-N 2.73Å; A300-D302 VanDerWaalsContact C-N 3.29Å; A300-D302 PolarHBondContact O-N 3.31Å; D302-V304 VanDerWaalsContact C-N 3.3Å; D302-V304 PolarHBondContact O-N 3.2Å
303	V	58.8	Low	70.9	Confident	75 Å²	75	42.8 Å²	42.8	46%	0.455	23%	0.232	S	C	.	.	H	α-helix	trans	-87.3	3.7	-176.8	-174.8	0	0	0	0	112.3	T299 A300 S305 K397	T299-V303 HydrophobicContact CG2-CG2 4.1Å; T299-V303 WeakPolarHBondContact O-CB 3.35Å; T299-V303 VanDerWaalsContact O-CG2 3.27Å; T299-V303 WeakPolarHBondContact O-CG2 3.04Å; T299-V303 PolarHBondContact O-N 2.98Å; A300-V303 PolarHBondContact O-N 2.87Å; V303-S305 PolarHBondContact O-N 3.11Å; V303-K397 HydrophobicContact CB-CD 4.48Å
304	V	56.8	Low	71.8	Confident	17 Å²	17	41.7 Å²	41.7	10%	0.103	23%	0.226	C	C	.	.			trans	-62.7	112.8	175.7	-168.7	0	0	0	0	108.5	A300 D302 R306 K397 R401	A300-V304 WeakPolarHBondContact O-CG2 3.36Å; A300-V304 PolarHBondContact O-N 3.2Å; A300-V304 VanDerWaalsContact O-N 3.11Å; D302-V304 VanDerWaalsContact C-N 3.3Å; D302-V304 PolarHBondContact O-N 3.2Å; V304-R306 HydrophobicContact CB-CG 3.66Å; V304-R306 HydrophobicContact CG1-CB 4.42Å; V304-R306 HydrophobicContact CG1-CG 3.43Å; V304-R306 VanDerWaalsContact CG1-CG 3.43Å; V304-R306 PolarHBondContact O-N 3.01Å; V304-K397 HydrophobicContact CB-CB 4.49Å; V304-K397 HydrophobicContact CG1-CB 4.42Å; V304-K397 HydrophobicContact CG2-CB 3.81Å; V304-K397 HydrophobicContact CG2-CG 4Å; V304-R401 HydrophobicContact CG1-CB 3.98Å
305	S	45	Very low	72.6	Confident	97 Å²	97	39.4 Å²	39.4	68%	0.678	22%	0.215	S	C	*	.			trans	-62.5	79.7	155.6	-62.1	0	0	0	0	107.6	V303 R401	V303-S305 PolarHBondContact O-N 3.11Å; S305-R401 PolarHBondContact O-NH1 2.93Å
306	R	58.3	Low	73.4	Confident	50 Å²	50	37.5 Å²	37.5	19%	0.189	20%	0.204	C	C	.	.			trans	-70.2	144.3	175	-61.9	178.5	-168.1	178.2	3.4	106.9	L301 V304 V309 D622	L301-R306 PolarHBondContact O-NH2 2.7Å; V304-R306 HydrophobicContact CB-CG 3.66Å; V304-R306 HydrophobicContact CG1-CB 4.42Å; V304-R306 HydrophobicContact CG1-CG 3.43Å; V304-R306 VanDerWaalsContact CG1-CG 3.43Å; V304-R306 PolarHBondContact O-N 3.01Å; R306-V309 HydrophobicContact CB-CG2 4.35Å; R306-D622 IonicContact CZ-OD1 3.38Å; R306-D622 VanDerWaalsContact CZ-OD1 3.26Å; R306-D622 IonicContact CZ-OD2 3.96Å; R306-D622 IonicContact NH1-OD1 3.62Å; R306-D622 PolarHBondContact NH1-OD1 3.29Å; R306-D622 IonicContact NH1-OD2 2.73Å; R306-D622 PolarHBondContact NH1-OD2 2.92Å; R306-D622 VanDerWaalsContact NH2-CG 3.33Å; R306-D622 IonicContact NH2-OD1 2.88Å; R306-D622 PolarHBondContact NH2-OD1 3.46Å; R306-D622 IonicContact NH2-OD2 2.94Å
307	E	64.6	Low	74	Confident	81 Å²	81	40.7 Å²	40.7	38%	0.379	22%	0.215	S	C	.	.			trans	-56.9	157.4	155.3	-88.6	158.1	-144.2	0	0	108.7	V309 R401 N405 A504	E307-V309 VanDerWaalsContact O-CG2 3.26Å; E307-V309 WeakPolarHBondContact O-CG2 3.1Å; E307-V309 PolarHBondContact O-N 3.16Å; E307-R401 IonicContact OE1-CZ 3.87Å; E307-R401 IonicContact OE1-NE 2.9Å; E307-R401 IonicContact OE1-NH2 2.69Å; E307-R401 PolarHBondContact OE1-NH2 3.05Å; E307-N405 VanDerWaalsContact CD-ND2 3.26Å; E307-N405 PolarHBondContact OE2-ND2 3.43Å; E307-A504 HydrophobicContact CB-CB 4.21Å
308	Q	70.6	Confident	74.1	Confident	73 Å²	73	42.2 Å²	42.2	34%	0.341	22%	0.223	S	C	.	.			trans	-62.7	111.7	-176.7	-173.4	178.8	68.1	0	0	110	S502 S503 A504	Q308-S502 VanDerWaalsContact CG-O 3.26Å; Q308-S502 WeakPolarHBondContact CG-O 3.35Å; Q308-S502 PolarHBondContact NE2-OG 3.3Å; Q308-S502 PolarHBondContact OE1-OG 2.98Å; Q308-S503 VanDerWaalsContact O-CA 3.32Å; Q308-S503 WeakPolarHBondContact O-CA 3.46Å; Q308-A504 PolarHBondContact O-N 2.86Å
309	V	77.7	Confident	73.6	Confident	34 Å²	34	41.7 Å²	41.7	21%	0.206	24%	0.239	C	C	.	.			trans	-99.8	115.3	-178.6	-177.2	0	0	0	0	108.5	R306 E307 I312 E408	R306-V309 HydrophobicContact CB-CG2 4.35Å; E307-V309 VanDerWaalsContact O-CG2 3.26Å; E307-V309 WeakPolarHBondContact O-CG2 3.1Å; E307-V309 PolarHBondContact O-N 3.16Å; V309-I312 HydrophobicContact CG1-CB 4.11Å; V309-I312 HydrophobicContact CG1-CD1 3.75Å; V309-I312 HydrophobicContact CG1-CG1 4.28Å; V309-E408 HydrophobicContact CB-CG 4.25Å; V309-E408 VanDerWaalsContact CG1-CD 3.48Å; V309-E408 HydrophobicContact CG1-CG 3.68Å; V309-E408 WeakPolarHBondContact CG1-OE1 3.37Å; V309-E408 HydrophobicContact CG2-CG 4.32Å
310	G	86.2	Confident	73.2	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.			trans	-132.4	-26.4	-174.9	0	0	0	0	0	114.6	A314 E408 S502	G310-A314 VanDerWaalsContact O-CB 3.3Å; G310-A314 WeakPolarHBondContact O-CB 3.47Å; G310-E408 PolarHBondContact N-OE1 3.22Å; G310-E408 PolarHBondContact N-OE2 3.03Å; G310-S502 VanDerWaalsContact CA-O 3.23Å; G310-S502 WeakPolarHBondContact CA-O 3.4Å; G310-S502 PolarHBondContact N-O 3.17Å
311	F	90.8	Very high	73.2	Confident	1 Å²	1	47 Å²	47	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-75.6	-45.1	179.7	-78.1	-74	0	0	0	112.6	A314 V315 E408 L411 V459 S503 V506 M591 F593	F311-A314 WeakPolarHBondContact O-CB 3.45Å; F311-A314 PolarHBondContact O-N 3.29Å; F311-V315 WeakPolarHBondContact O-CG1 3.37Å; F311-V315 WeakPolarHBondContact O-CG2 3.04Å; F311-V315 PolarHBondContact O-N 2.78Å; F311-E408 WeakPolarHBondContact CA-OE1 3Å; F311-E408 PolarHBondContact N-OE1 2.79Å; F311-E408 PolarHBondContact N-OE2 3.35Å; F311-L411 HydrophobicContact CB-CB 3.63Å; F311-L411 HydrophobicContact CB-CD1 3.74Å; F311-L411 HydrophobicContact CB-CG 4.31Å; F311-L411 HydrophobicContact CD1-CB 4.42Å; F311-L411 HydrophobicContact CG-CB 4.03Å; F311-V459 HydrophobicContact CD1-CB 4.01Å; F311-V459 HydrophobicContact CD1-CG1 3.94Å; F311-V459 HydrophobicContact CD1-CG2 3.74Å; F311-V459 HydrophobicContact CD2-CG1 3.81Å; F311-V459 HydrophobicContact CE1-CB 3.63Å; F311-V459 HydrophobicContact CE1-CG1 3.73Å; F311-V459 HydrophobicContact CE1-CG2 3.82Å; F311-V459 HydrophobicContact CE2-CB 4.39Å; F311-V459 HydrophobicContact CE2-CG1 3.59Å; F311-V459 HydrophobicContact CG-CG1 3.97Å; F311-V459 HydrophobicContact CG-CG2 4.33Å; F311-V459 HydrophobicContact CZ-CB 3.84Å; F311-V459 HydrophobicContact CZ-CG1 3.55Å; F311-V459 HydrophobicContact CZ-CG2 4.48Å; F311-S503 WeakPolarHBondContact CD2-OG 3.03Å; F311-V506 HydrophobicContact CE2-CG2 3.84Å; F311-V506 HydrophobicContact CZ-CG2 4.07Å; F311-M591 HydrophobicContact CE1-CB 4.13Å; F311-M591 HydrophobicContact CE1-CE 4.31Å; F311-M591 HydrophobicContact CE1-CG 4.19Å; F311-M591 HydrophobicContact CE1-SD 3.43Å; F311-M591 WeakPolarHBondContact CE1-SD 3.44Å; F311-M591 HydrophobicContact CZ-CB 4.5Å; F311-M591 HydrophobicContact CZ-CG 4.27Å; F311-M591 HydrophobicContact CZ-SD 3.65Å; F311-F593 HydrophobicContact CD1-CE1 4.47Å; F311-F593 HydrophobicContact CD1-CZ 4.45Å; F311-F593 HydrophobicContact CE1-CE1 4.3Å
312	I	90.6	Very high	73.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-53.6	-48	-177.4	-68.1	163.8	0	0	0	112.5	V309 A314 V407 E408 L411 L600 S625 I627	V309-I312 HydrophobicContact CG1-CB 4.11Å; V309-I312 HydrophobicContact CG1-CD1 3.75Å; V309-I312 HydrophobicContact CG1-CG1 4.28Å; I312-A314 VanDerWaalsContact C-N 3.34Å; I312-V407 HydrophobicContact CD1-CB 4.05Å; I312-V407 HydrophobicContact CD1-CG1 3.81Å; I312-V407 HydrophobicContact CG1-CB 4.47Å; I312-V407 HydrophobicContact CG1-CG1 3.73Å; I312-E408 WeakPolarHBondContact CB-OE1 3.38Å; I312-E408 HydrophobicContact CD1-CG 3.89Å; I312-E408 HydrophobicContact CG1-CG 4.26Å; I312-E408 WeakPolarHBondContact CG1-OE1 2.95Å; I312-E408 PolarHBondContact N-OE1 3.45Å; I312-L411 HydrophobicContact CB-CD1 4.4Å; I312-L411 HydrophobicContact CG1-CD1 3.74Å; I312-L600 HydrophobicContact CG1-CD2 4.35Å; I312-L600 HydrophobicContact CG2-CD2 4Å; I312-S625 WeakPolarHBondContact CG2-O 3Å; I312-I627 HydrophobicContact CD1-CD1 3.71Å; I312-I627 HydrophobicContact CG1-CD1 4.19Å; I312-I627 HydrophobicContact CG2-CD1 3.81Å; I312-I627 HydrophobicContact CG2-CG1 3.97Å
313	P	88.8	Confident	73.1	Confident	39 Å²	39	51.1 Å²	51.1	25%	0.253	29%	0.294	S	S	.	.	H	α-helix	trans	-74.4	-22.4	175.7	28.9	-35.8	0	0	0	113.7	R595	P313-R595 PolarHBondContact O-NH2 3.1Å
314	A	90	Very high	73.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-77.8	-36.2	-177.6	0	0	0	0	0	112.6	G310 F311 I312 Q457 V459 F593 R595	G310-A314 VanDerWaalsContact O-CB 3.3Å; G310-A314 WeakPolarHBondContact O-CB 3.47Å; F311-A314 WeakPolarHBondContact O-CB 3.45Å; F311-A314 PolarHBondContact O-N 3.29Å; I312-A314 VanDerWaalsContact C-N 3.34Å; A314-Q457 HydrophobicContact CB-CB 4.2Å; A314-Q457 HydrophobicContact CB-CG 4.37Å; A314-Q457 WeakPolarHBondContact O-CG 3.34Å; A314-V459 HydrophobicContact CB-CG2 3.83Å; A314-F593 HydrophobicContact CB-CE2 4.15Å; A314-F593 HydrophobicContact CB-CZ 3.82Å; A314-R595 WeakPolarHBondContact O-CG 3.4Å; A314-R595 PolarHBondContact O-NE 3.07Å
315	V	91.1	Very high	74	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.036	29%	0.289	C	S	.	.	S	Bend	trans	-83.3	157.8	-175.6	-58.9	0	0	0	0	113.6	F311 L411 F593 F598 L600	F311-V315 WeakPolarHBondContact O-CG1 3.37Å; F311-V315 WeakPolarHBondContact O-CG2 3.04Å; F311-V315 PolarHBondContact O-N 2.78Å; V315-L411 HydrophobicContact CG1-CD2 4.13Å; V315-L411 HydrophobicContact CG2-CD1 4Å; V315-L411 HydrophobicContact CG2-CD2 3.96Å; V315-F593 HydrophobicContact CG1-CE2 4.04Å; V315-F593 HydrophobicContact CG1-CZ 4.14Å; V315-F598 HydrophobicContact CB-CB 4.34Å; V315-F598 HydrophobicContact CG1-CB 3.76Å; V315-L600 HydrophobicContact CG2-CB 3.71Å
316	A	88.4	Confident	75.5	Confident	12 Å²	12	49.5 Å²	49.5	10%	0.099	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	146.7	172.4	0	0	0	0	0	111.2	R595 F598 L599 L600	A316-R595 HydrophobicContact CB-CG 4.19Å; A316-R595 WeakPolarHBondContact CB-O 3.35Å; A316-R595 PolarHBondContact N-O 3.49Å; A316-F598 PolarHBondContact N-O 3.39Å; A316-L599 HydrophobicContact CB-CD1 3.8Å; A316-L600 PolarHBondContact O-N 2.88Å
317	K	84.8	Confident	76.2	Confident	96 Å²	96	51.8 Å²	51.8	42%	0.417	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.3	173.9	-69.4	-176.4	-179.2	177.6	0	110.9	A319 L600 S625 G626	K317-A319 PolarHBondContact O-N 2.86Å; K317-L600 WeakPolarHBondContact CA-O 2.87Å; K317-S625 PolarHBondContact NZ-O 2.9Å; K317-G626 VanDerWaalsContact NZ-CA 3.27Å; K317-G626 PolarHBondContact NZ-O 3.06Å
318	N	77.2	Confident	76.3	Confident	32 Å²	32	52.8 Å²	52.8	17%	0.171	30%	0.298	C	S	.	.			trans	-83.3	107.1	175.8	-169.9	-5.6	0	0	0	111.2	K320 A321 L599 L600 A601	N318-K320 PolarHBondContact O-N 3.01Å; N318-K320 WeakPolarHBondContact OD1-CB 3.36Å; N318-K320 PolarHBondContact OD1-N 2.78Å; N318-A321 HydrophobicContact CB-CB 4.43Å; N318-A321 VanDerWaalsContact O-CB 3.25Å; N318-A321 WeakPolarHBondContact O-CB 3.23Å; N318-A321 PolarHBondContact O-N 2.83Å; N318-L599 HydrophobicContact CB-CD1 4.01Å; N318-L599 HydrophobicContact CB-CD2 3.96Å; N318-L599 HydrophobicContact CB-CG 4.05Å; N318-L600 PolarHBondContact N-O 2.94Å; N318-A601 HydrophobicContact CB-CB 4.03Å
319	A	64.5	Low	75.9	Confident	89 Å²	89	51.6 Å²	51.6	74%	0.736	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-66	-19.6	175.4	0	0	0	0	0	113.9	K317 A321	K317-A319 PolarHBondContact O-N 2.86Å; A319-A321 VanDerWaalsContact C-N 3.3Å
320	K	63.5	Low	75.2	Confident	157 Å²	157	51.8 Å²	51.8	68%	0.683	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-85.1	-0.6	177.1	-62.6	-172.7	178.4	-177.6	0	113.5	N318 D322 A323	N318-K320 PolarHBondContact O-N 3.01Å; N318-K320 WeakPolarHBondContact OD1-CB 3.36Å; N318-K320 PolarHBondContact OD1-N 2.78Å; K320-D322 PolarHBondContact O-N 3.13Å; K320-A323 PolarHBondContact O-N 2.78Å
321	A	62.7	Low	74.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-59.4	-29.9	-177.9	0	0	0	0	0	112.9	N318 A319 A323 A324 I364 A601 R603	N318-A321 HydrophobicContact CB-CB 4.43Å; N318-A321 VanDerWaalsContact O-CB 3.25Å; N318-A321 WeakPolarHBondContact O-CB 3.23Å; N318-A321 PolarHBondContact O-N 2.83Å; A319-A321 VanDerWaalsContact C-N 3.3Å; A321-A323 PolarHBondContact O-N 2.82Å; A321-A324 PolarHBondContact O-N 2.75Å; A321-A324 VanDerWaalsContact O-N 3.12Å; A321-I364 HydrophobicContact CB-CD1 4.44Å; A321-A601 HydrophobicContact CB-CB 3.81Å; A321-R603 WeakPolarHBondContact O-CD 3.46Å
322	D	63.9	Low	72.8	Confident	120 Å²	120	57.4 Å²	57.4	64%	0.642	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-59.6	-29.7	-177.8	-65.8	-30.9	0	0	0	113.5	K320 R603	K320-D322 PolarHBondContact O-N 3.13Å; D322-R603 WeakPolarHBondContact OD1-CB 3.47Å
323	A	60.9	Low	71.3	Confident	93 Å²	93	62.2 Å²	62.2	77%	0.769	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-89.9	-6.6	-179.3	0	0	0	0	0	114.3	K320 A321	K320-A323 PolarHBondContact O-N 2.78Å; A321-A323 PolarHBondContact O-N 2.82Å
324	A	64.1	Low	70.2	Confident	5 Å²	5	62.6 Å²	62.6	4%	0.041	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-88.5	124.7	-173.6	0	0	0	0	0	112.1	A321 V330 I364 R603	A321-A324 PolarHBondContact O-N 2.75Å; A321-A324 VanDerWaalsContact O-N 3.12Å; A324-V330 HydrophobicContact CB-CG2 3.48Å; A324-V330 VanDerWaalsContact CB-CG2 3.48Å; A324-I364 HydrophobicContact CB-CG1 4.16Å; A324-R603 VanDerWaalsContact O-CZ 3.3Å; A324-R603 PolarHBondContact O-NE 3.45Å; A324-R603 PolarHBondContact O-NH2 3.16Å
325	A	70.8	Confident	68.9	Low	50 Å²	50	66 Å²	66	41%	0.413	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-65.5	157.4	166.5	0	0	0	0	0	110.7	D327 Q328	A325-D327 PolarHBondContact O-N 2.83Å; A325-Q328 HydrophobicContact CB-CB 4.03Å; A325-Q328 WeakPolarHBondContact O-CB 3.48Å; A325-Q328 PolarHBondContact O-N 3.07Å
326	K	75.6	Confident	67.7	Low	101 Å²	101	68.4 Å²	68.4	44%	0.439	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-58.7	138.9	171.9	-169.8	-165.2	167.6	-171.5	0	108.6	Q328 I364 T365	K326-Q328 PolarHBondContact O-N 3.21Å; K326-I364 WeakPolarHBondContact CG-O 3.26Å; K326-T365 WeakPolarHBondContact CE-O 3.32Å
327	D	72.9	Confident	66.6	Low	98 Å²	98	76.2 Å²	76.2	52%	0.524	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	-1.8	-178.8	-53.8	-52	0	0	0	115.3	A325 I364	A325-D327 PolarHBondContact O-N 2.83Å; D327-I364 PolarHBondContact N-O 3.39Å
328	Q	67.6	Low	65.8	Low	101 Å²	101	75.5 Å²	75.5	47%	0.472	46%	0.458	S	S	.	.			trans	-74.5	128.4	171.9	-171.3	-178.8	1.6	0	0	110	A325 K326 V330	A325-Q328 HydrophobicContact CB-CB 4.03Å; A325-Q328 WeakPolarHBondContact O-CB 3.48Å; A325-Q328 PolarHBondContact O-N 3.07Å; K326-Q328 PolarHBondContact O-N 3.21Å; Q328-V330 PolarHBondContact O-N 3.03Å
329	T	62.9	Low	65.5	Low	48 Å²	48	83.8 Å²	83.8	29%	0.294	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	114.3	171	-51.6	0	0	0	0	110.7	T331 D361 K363	T329-T331 HydrophobicContact CG2-CG2 3.5Å; T329-T331 VanDerWaalsContact CG2-CG2 3.5Å; T329-D361 HydrophobicContact CG2-CB 3.65Å; T329-D361 WeakPolarHBondContact CG2-OD1 3.32Å; T329-D361 VanDerWaalsContact CG2-OD2 3.31Å; T329-D361 WeakPolarHBondContact CG2-OD2 3.4Å; T329-K363 HydrophobicContact CG2-CG 4.47Å; T329-K363 WeakPolarHBondContact OG1-CE 3.13Å; T329-K363 PolarHBondContact OG1-NZ 2.92Å
330	V	61.6	Low	66.3	Low	38 Å²	38	86.3 Å²	86.3	23%	0.23	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	108.7	157.5	-177.7	0	0	0	0	106.8	A324 Q328 V362	A324-V330 HydrophobicContact CB-CG2 3.48Å; A324-V330 VanDerWaalsContact CB-CG2 3.48Å; Q328-V330 PolarHBondContact O-N 3.03Å; V330-V362 WeakPolarHBondContact CB-O 3.46Å; V330-V362 PolarHBondContact N-O 3.42Å; V330-V362 PolarHBondContact O-N 3.27Å
331	T	64.3	Low	66.9	Low	79 Å²	79	84.3 Å²	84.3	49%	0.485	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.9	177.4	49.3	0	0	0	0	110.4	T329 T359 V360	T329-T331 HydrophobicContact CG2-CG2 3.5Å; T329-T331 VanDerWaalsContact CG2-CG2 3.5Å; T331-T359 HydrophobicContact CG2-CG2 4.44Å; T331-V360 WeakPolarHBondContact CA-O 3.37Å
332	A	63.4	Low	67.7	Low	41 Å²	41	91.5 Å²	91.5	34%	0.339	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.3	163.2	0	0	0	0	0	108.7	T359 V360	A332-T359 WeakPolarHBondContact O-CA 3.42Å; A332-V360 PolarHBondContact N-O 3.35Å; A332-V360 PolarHBondContact O-N 3.38Å
333	P	58.5	Low	68.6	Low	101 Å²	101	93.8 Å²	93.8	66%	0.656	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	134	174.1	28.3	-32.6	0	0	0	109.8	I357	P333-I357 HydrophobicContact CB-CG2 3.8Å
334	V	65.7	Low	69.4	Low	47 Å²	47	94.6 Å²	94.6	29%	0.285	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.1	171.5	-179.9	0	0	0	0	107.2	G358 V360	V334-G358 PolarHBondContact N-O 2.98Å; V334-G358 PolarHBondContact O-N 3.4Å; V334-V360 HydrophobicContact CG2-CB 4.44Å; V334-V360 HydrophobicContact CG2-CG2 3.63Å
335	A	61.6	Low	69.9	Low	70 Å²	70	100.3 Å²	100.3	58%	0.579	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-68.8	134.1	173.3	0	0	0	0	0	109.4
336	P	66.2	Low	70.5	Confident	57 Å²	57	100.6 Å²	100.6	37%	0.37	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-67.2	165.1	173.3	30.7	-35.2	0	0	0	110.9	A338 Q355	P336-A338 PolarHBondContact O-N 2.99Å; P336-Q355 HydrophobicContact CG-CB 4.1Å; P336-Q355 HydrophobicContact CG-CG 4.31Å
337	E	65.4	Low	70.8	Confident	176 Å²	176	102.8 Å²	102.8	82%	0.822	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-57.7	135.7	170.4	-69	179.9	-179.9	0	0	110.7	K339	E337-K339 PolarHBondContact O-N 2.98Å
338	A	69.3	Low	71.2	Confident	81 Å²	81	102.5 Å²	102.5	67%	0.669	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-72	125	178	0	0	0	0	0	110.1	P336	P336-A338 PolarHBondContact O-N 2.99Å
339	K	71.1	Confident	71.8	Confident	207 Å²	207	101.9 Å²	101.9	90%	0.9	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-85.4	131.2	169.4	-64.7	-175.6	180	-177.1	0	109.4	E337	E337-K339 PolarHBondContact O-N 2.98Å
340	T	79.5	Confident	72.6	Confident	142 Å²	142	103.3 Å²	103.3	87%	0.871	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-92.6	141.1	171.2	56	0	0	0	0	109.7
341	E	77.2	Confident	73.4	Confident	115 Å²	115	108.8 Å²	108.8	54%	0.537	66%	0.661	S	S	.	*			trans	-123.6	149.9	173.1	62.1	-174.9	-177.7	0	0	110.4	T352	E341-T352 VanDerWaalsContact CD-OG1 3.27Å; E341-T352 PolarHBondContact OE1-OG1 2.96Å; E341-T352 VanDerWaalsContact OE2-CB 3.27Å; E341-T352 WeakPolarHBondContact OE2-CB 3.31Å; E341-T352 VanDerWaalsContact OE2-CG2 3.29Å; E341-T352 WeakPolarHBondContact OE2-CG2 3.38Å; E341-T352 PolarHBondContact OE2-OG1 3.01Å
342	D	80.2	Confident	74.2	Confident	152 Å²	152	108.4 Å²	108.4	81%	0.813	66%	0.659	S	S	*	*			trans	-69.9	135.9	176.8	-70.8	-28.8	0	0	0	110.4	V344	D342-V344 PolarHBondContact O-N 3.12Å
343	I	81.9	Confident	74.6	Confident	168 Å²	168	109.7 Å²	109.7	86%	0.862	68%	0.676	S	S	*	*			trans	-73.8	102.1	178.4	-58.9	173.4	0	0	0	108.8
344	V	78.1	Confident	75.5	Confident	110 Å²	110	112 Å²	112	67%	0.667	68%	0.683	S	S	*	*			trans	-100.7	118.4	172.9	-176.8	0	0	0	0	109.9	D342 G346	D342-V344 PolarHBondContact O-N 3.12Å; V344-G346 PolarHBondContact O-N 3.18Å
345	P	74.4	Confident	75.6	Confident	125 Å²	125	114.9 Å²	114.9	81%	0.812	69%	0.693	S	S	*	*			trans	-62.2	130.1	177.3	-24.1	34.4	0	0	0	112.9
346	G	82.6	Confident	76	Confident	55 Å²	55	118.4 Å²	118.4	57%	0.567	70%	0.702	S	S	*	*			trans	-153.4	167.5	177.6	0	0	0	0	0	112.3	V344 S348	V344-G346 PolarHBondContact O-N 3.18Å; G346-S348 PolarHBondContact O-N 3.25Å
347	P	83.1	Confident	76	Confident	147 Å²	147	119.5 Å²	119.5	96%	0.955	71%	0.705	S	S	*	*	S	Bend	trans	-67.9	-21	-178.2	27	-34.3	0	0	0	113.8
348	S	81.4	Confident	75.9	Confident	93 Å²	93	112.7 Å²	112.7	65%	0.65	68%	0.681	S	S	*	*	S	Bend	trans	-132.8	149.3	173.3	56.5	0	0	0	0	109.4	G346	G346-S348 PolarHBondContact O-N 3.25Å
349	A	78.4	Confident	75.7	Confident	88 Å²	88	112.8 Å²	112.8	73%	0.727	67%	0.673	S	S	*	*			trans	-58	141.7	170.4	0	0	0	0	0	109.9	N351	A349-N351 PolarHBondContact O-N 3.38Å
350	P	79.7	Confident	75.4	Confident	77 Å²	77	104 Å²	104	50%	0.5	64%	0.637	S	S	.	*			trans	-53.8	137	168.5	-23.4	33.8	0	0	0	110.4	T352	P350-T352 HydrophobicContact CB-CG2 3.83Å; P350-T352 PolarHBondContact O-N 2.73Å
351	N	80.3	Confident	74.9	Confident	154 Å²	154	100.4 Å²	100.4	82%	0.824	61%	0.613	S	S	*	*	S	Bend	trans	-82.5	74	172.7	-174.7	58	0	0	0	109.1	A349	A349-N351 PolarHBondContact O-N 3.38Å
352	T	79.5	Confident	74.7	Confident	70 Å²	70	95.3 Å²	95.3	43%	0.429	59%	0.589	S	S	.	*			trans	-128.8	168.4	-174.9	52.6	0	0	0	0	109.2	E341 P350	E341-T352 VanDerWaalsContact CD-OG1 3.27Å; E341-T352 PolarHBondContact OE1-OG1 2.96Å; E341-T352 VanDerWaalsContact OE2-CB 3.27Å; E341-T352 WeakPolarHBondContact OE2-CB 3.31Å; E341-T352 VanDerWaalsContact OE2-CG2 3.29Å; E341-T352 WeakPolarHBondContact OE2-CG2 3.38Å; E341-T352 PolarHBondContact OE2-OG1 3.01Å; P350-T352 HydrophobicContact CB-CG2 3.83Å; P350-T352 PolarHBondContact O-N 2.73Å
353	G	73.3	Confident	74.8	Confident	68 Å²	68	91.7 Å²	91.7	70%	0.701	57%	0.566	S	S	*	*			trans	98.8	6.3	-179.6	0	0	0	0	0	115.6	Q355	G353-Q355 PolarHBondContact O-N 3.18Å; G353-Q355 VanDerWaalsContact O-N 3.09Å
354	D	76.1	Confident	74.8	Confident	151 Å²	151	83.8 Å²	83.8	81%	0.807	53%	0.526	S	S	*	.			trans	-57.8	115.2	169.3	-71.7	-37.2	0	0	0	110.1
355	Q	68.5	Low	75.2	Confident	106 Å²	106	81.6 Å²	81.6	50%	0.495	51%	0.513	S	S	.	.			trans	-105.9	120.3	173	-67.5	-172.3	-6.5	0	0	109.5	P336 G353 I357	P336-Q355 HydrophobicContact CG-CB 4.1Å; P336-Q355 HydrophobicContact CG-CG 4.31Å; G353-Q355 PolarHBondContact O-N 3.18Å; G353-Q355 VanDerWaalsContact O-N 3.09Å; Q355-I357 HydrophobicContact CB-CD1 3.99Å; Q355-I357 PolarHBondContact O-N 3.09Å
356	N	68.7	Low	76	Confident	144 Å²	144	78.1 Å²	78.1	77%	0.77	49%	0.485	S	S	*	.			trans	-76.2	103.9	162.3	-173.7	51.5	0	0	0	108.3	G358	N356-G358 PolarHBondContact O-N 3.35Å; N356-G358 VanDerWaalsContact O-N 3.15Å
357	I	67.7	Low	76.3	Confident	81 Å²	81	77.8 Å²	77.8	42%	0.415	47%	0.474	S	S	.	.			trans	-73.4	106.4	175.2	-52.9	-58	0	0	0	108.1	P333 Q355	P333-I357 HydrophobicContact CB-CG2 3.8Å; Q355-I357 HydrophobicContact CB-CD1 3.99Å; Q355-I357 PolarHBondContact O-N 3.09Å
358	G	63.7	Low	76.8	Confident	32 Å²	32	75 Å²	75	33%	0.33	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	154.4	173	0	0	0	0	0	111.1	V334 N356	V334-G358 PolarHBondContact N-O 2.98Å; V334-G358 PolarHBondContact O-N 3.4Å; N356-G358 PolarHBondContact O-N 3.35Å; N356-G358 VanDerWaalsContact O-N 3.15Å
359	T	63.5	Low	77.3	Confident	83 Å²	83	73.7 Å²	73.7	51%	0.509	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.2	171	54.9	0	0	0	0	110	T331 A332	T331-T359 HydrophobicContact CG2-CG2 4.44Å; A332-T359 WeakPolarHBondContact O-CA 3.42Å
360	V	65.6	Low	78	Confident	24 Å²	24	70.1 Å²	70.1	15%	0.145	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124.5	165.6	173.7	0	0	0	0	108.5	T331 A332 V334 V362 V653	T331-V360 WeakPolarHBondContact CA-O 3.37Å; A332-V360 PolarHBondContact N-O 3.35Å; A332-V360 PolarHBondContact O-N 3.38Å; V334-V360 HydrophobicContact CG2-CB 4.44Å; V334-V360 HydrophobicContact CG2-CG2 3.63Å; V360-V362 HydrophobicContact CG1-CG2 4.4Å; V360-V653 HydrophobicContact CB-CG1 4.34Å; V360-V653 HydrophobicContact CG1-CB 4.29Å; V360-V653 HydrophobicContact CG1-CG1 4.18Å; V360-V653 HydrophobicContact CG1-CG2 4.14Å; V360-V653 HydrophobicContact CG2-CG1 4.11Å
361	D	69.7	Low	78.6	Confident	66 Å²	66	70.3 Å²	70.3	35%	0.353	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.6	173.9	-80.3	17.7	0	0	0	110	T329 K363 S651	T329-D361 HydrophobicContact CG2-CB 3.65Å; T329-D361 WeakPolarHBondContact CG2-OD1 3.32Å; T329-D361 VanDerWaalsContact CG2-OD2 3.31Å; T329-D361 WeakPolarHBondContact CG2-OD2 3.4Å; D361-K363 WeakPolarHBondContact OD2-CE 3.23Å; D361-K363 IonicContact OD2-NZ 2.82Å; D361-K363 PolarHBondContact OD2-NZ 3.11Å; D361-S651 PolarHBondContact O-OG 2.73Å
362	V	72.9	Confident	79	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.042	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.5	166.7	-174.4	0	0	0	0	107.1	V330 V360 L599 A601	V330-V362 WeakPolarHBondContact CB-O 3.46Å; V330-V362 PolarHBondContact N-O 3.42Å; V330-V362 PolarHBondContact O-N 3.27Å; V360-V362 HydrophobicContact CG1-CG2 4.4Å; V362-L599 HydrophobicContact CB-CD2 4.36Å; V362-L599 HydrophobicContact CG1-CD2 3.9Å; V362-L599 HydrophobicContact CG2-CD2 3.56Å; V362-A601 HydrophobicContact CG1-CB 3.84Å
363	K	80.7	Confident	79.4	Confident	76 Å²	76	65.2 Å²	65.2	33%	0.33	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.1	179.4	-60.3	-175.6	-157.4	-151.2	0	109.5	T329 D361 T365 G649	T329-K363 HydrophobicContact CG2-CG 4.47Å; T329-K363 WeakPolarHBondContact OG1-CE 3.13Å; T329-K363 PolarHBondContact OG1-NZ 2.92Å; D361-K363 WeakPolarHBondContact OD2-CE 3.23Å; D361-K363 IonicContact OD2-NZ 2.82Å; D361-K363 PolarHBondContact OD2-NZ 3.11Å; K363-T365 HydrophobicContact CB-CG2 4.07Å; K363-T365 PolarHBondContact O-N 2.99Å; K363-T365 VanDerWaalsContact O-N 3.17Å; K363-G649 WeakPolarHBondContact O-CA 3.29Å
364	I	83.7	Confident	80.1	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-74.9	98.1	160.9	-61.6	-64.6	0	0	0	107	A321 A324 K326 D327 A601 A647	A321-I364 HydrophobicContact CB-CD1 4.44Å; A324-I364 HydrophobicContact CB-CG1 4.16Å; K326-I364 WeakPolarHBondContact CG-O 3.26Å; D327-I364 PolarHBondContact N-O 3.39Å; I364-A601 HydrophobicContact CD1-CB 3.66Å; I364-A601 WeakPolarHBondContact CD1-O 3.38Å; I364-A647 HydrophobicContact CG2-CB 3.92Å
365	T	85.5	Confident	80.7	Confident	65 Å²	65	58 Å²	58	40%	0.399	31%	0.312	S	S	.	.			trans	-85.3	-25.9	-174	53.8	0	0	0	0	112.7	K326 K363 W648	K326-T365 WeakPolarHBondContact CE-O 3.32Å; K363-T365 HydrophobicContact CB-CG2 4.07Å; K363-T365 PolarHBondContact O-N 2.99Å; K363-T365 VanDerWaalsContact O-N 3.17Å; T365-W648 PolarHBondContact N-O 3.11Å; T365-W648 VanDerWaalsContact N-O 3.14Å
366	K	90.3	Very high	81.3	Confident	51 Å²	51	55 Å²	55	22%	0.222	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.2	-177.5	-66.3	-177.4	-176.9	178.1	0	110.6	E406 D410 A647 W648	K366-E406 WeakPolarHBondContact CD-OE1 3.48Å; K366-E406 WeakPolarHBondContact CE-OE1 3.13Å; K366-E406 IonicContact NZ-OE1 3.68Å; K366-E406 PolarHBondContact NZ-OE1 3.02Å; K366-D410 WeakPolarHBondContact CD-OD2 3.25Å; K366-D410 VanDerWaalsContact CE-OD2 3.25Å; K366-D410 WeakPolarHBondContact CE-OD2 3.35Å; K366-D410 IonicContact NZ-OD1 2.7Å; K366-D410 PolarHBondContact NZ-OD1 2.66Å; K366-D410 IonicContact NZ-OD2 2.8Å; K366-D410 PolarHBondContact NZ-OD2 2.87Å; K366-A647 CarbonylContact O-C 3.6Å; K366-A647 VanDerWaalsContact O-CA 3.24Å; K366-A647 WeakPolarHBondContact O-CA 3.45Å; K366-W648 HydrophobicContact CB-CD2 4.04Å; K366-W648 HydrophobicContact CB-CE3 4.26Å; K366-W648 HydrophobicContact CB-CH2 4.27Å; K366-W648 HydrophobicContact CB-CZ2 3.98Å; K366-W648 HydrophobicContact CB-CZ3 4.39Å; K366-W648 HydrophobicContact CD-CH2 4.32Å; K366-W648 HydrophobicContact CD-CZ2 3.51Å; K366-W648 HydrophobicContact CG-CZ2 4.4Å; K366-W648 PolarHBondContact N-O 2.88Å; K366-W648 PolarHBondContact O-N 3.4Å; K366-W648 VanDerWaalsContact O-O 3.1Å
367	S	90.4	Very high	82	Confident	48 Å²	48	54.8 Å²	54.8	34%	0.336	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	113.3	164.5	-177.4	0	0	0	0	105.7
368	K	93.3	Very high	82.7	Confident	89 Å²	89	54.9 Å²	54.9	39%	0.387	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.2	-172.6	-69.2	-166.5	171.8	-172.6	0	111.1	L403 E406 G645 L646 W648	K368-L403 HydrophobicContact CB-CD2 4.12Å; K368-E406 VanDerWaalsContact CD-OE2 3.26Å; K368-E406 WeakPolarHBondContact CD-OE2 3.44Å; K368-E406 WeakPolarHBondContact CE-OE1 3.24Å; K368-E406 IonicContact NZ-OE1 3.74Å; K368-E406 PolarHBondContact NZ-OE1 3.16Å; K368-E406 IonicContact NZ-OE2 3.62Å; K368-E406 PolarHBondContact NZ-OE2 2.93Å; K368-G645 WeakPolarHBondContact O-CA 3.31Å; K368-L646 PolarHBondContact N-O 2.9Å; K368-L646 PolarHBondContact O-N 2.99Å; K368-L646 VanDerWaalsContact O-O 3.05Å; K368-W648 HydrophobicContact CB-CH2 4.04Å; K368-W648 HydrophobicContact CB-CZ3 3.93Å; K368-W648 HydrophobicContact CD-CH2 3.9Å; K368-W648 HydrophobicContact CG-CH2 4.13Å; K368-W648 HydrophobicContact CG-CZ3 4.34Å
369	M	92.8	Very high	83.6	Confident	65 Å²	65	56.7 Å²	56.7	32%	0.32	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.7	173.7	63.6	81.1	81	0	0	110.5	P371 E643 V644	M369-P371 HydrophobicContact CE-CB 3.82Å; M369-P371 HydrophobicContact SD-CB 4Å; M369-P371 VanDerWaalsContact SD-CD 3.58Å; M369-P371 HydrophobicContact SD-CG 4.06Å; M369-E643 HydrophobicContact CE-CB 3.62Å; M369-E643 HydrophobicContact CE-CG 3.28Å; M369-E643 WeakPolarHBondContact CE-OE2 3.38Å; M369-V644 CarbonylContact C-O 3.52Å; M369-V644 WeakPolarHBondContact CA-O 3.43Å
370	A	91.9	Very high	84.3	Confident	14 Å²	14	58.7 Å²	58.7	12%	0.116	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.8	169.5	0	0	0	0	0	108.3	A399 L403 V644	A370-A399 HydrophobicContact CB-CB 3.59Å; A370-L403 HydrophobicContact CB-CG 4.5Å; A370-V644 HydrophobicContact CB-CB 4.47Å; A370-V644 PolarHBondContact N-O 2.93Å; A370-V644 PolarHBondContact O-N 2.87Å
371	P	92.2	Very high	84.9	Confident	80 Å²	80	61.8 Å²	61.8	52%	0.519	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	143.7	-177.8	29.8	-30.5	0	0	0	112	M369	M369-P371 HydrophobicContact CE-CB 3.82Å; M369-P371 HydrophobicContact SD-CB 4Å; M369-P371 VanDerWaalsContact SD-CD 3.58Å; M369-P371 HydrophobicContact SD-CG 4.06Å
372	V	88.5	Confident	85.3	Confident	8 Å²	8	61.1 Å²	61.1	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.2	166.2	-179.8	0	0	0	0	108.1	L392 Q395 R641 Y642	V372-L392 HydrophobicContact CG1-CD1 3.82Å; V372-Q395 HydrophobicContact CG1-CB 3.8Å; V372-Q395 HydrophobicContact CG1-CG 4.33Å; V372-Q395 HydrophobicContact CG2-CB 3.92Å; V372-R641 CarbonylContact O-C 3.4Å; V372-Y642 PolarHBondContact N-O 3.32Å; V372-Y642 PolarHBondContact O-N 2.81Å; V372-Y642 VanDerWaalsContact O-O 3.14Å
373	K	89	Confident	85.1	Confident	109 Å²	109	62 Å²	62	47%	0.474	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.9	-173.9	-167	-179.9	71.9	151.8	0	111.3	V640 R641	K373-V640 WeakPolarHBondContact CA-O 3.41Å; K373-R641 HydrophobicContact CG-CB 4.4Å
374	W	87.9	Confident	84.2	Confident	19 Å²	19	65.2 Å²	65.2	7%	0.072	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.7	178	-73.1	97.1	0	0	0	111.4	E378 Q379 L382 Y388 I391 Q395 Q639 V640	W374-E378 WeakPolarHBondContact CA-OE2 3.48Å; W374-E378 HydrophobicContact CE3-CB 3.72Å; W374-E378 HydrophobicContact CZ3-CB 3.95Å; W374-Q379 HydrophobicContact CB-CG 4.38Å; W374-Q379 HydrophobicContact CE3-CG 4.49Å; W374-L382 HydrophobicContact CE3-CD1 4.47Å; W374-L382 HydrophobicContact CH2-CD1 3.37Å; W374-L382 HydrophobicContact CZ3-CD1 3.33Å; W374-Y388 HydrophobicContact CB-CE2 4.13Å; W374-Y388 AromaticContact CD1-CE2 3.87Å; W374-Y388 HydrophobicContact CD2-CD2 4.02Å; W374-Y388 AromaticContact CD2-CE2 3.38Å; W374-Y388 HydrophobicContact CD2-CE2 3.38Å; W374-Y388 AromaticContact CE2-CE2 3.6Å; W374-Y388 AromaticContact CE3-CD2 4Å; W374-Y388 HydrophobicContact CE3-CD2 4Å; W374-Y388 AromaticContact CE3-CE2 3.74Å; W374-Y388 HydrophobicContact CE3-CE2 3.74Å; W374-Y388 AromaticContact CG-CE2 3.53Å; W374-Y388 HydrophobicContact CG-CE2 3.53Å; W374-Y388 HydrophobicContact CH2-CD2 4.23Å; W374-Y388 HydrophobicContact CH2-CE2 4.49Å; W374-Y388 HydrophobicContact CZ2-CD2 4.21Å; W374-Y388 HydrophobicContact CZ2-CE2 4.17Å; W374-Y388 HydrophobicContact CZ3-CD2 4.11Å; W374-Y388 HydrophobicContact CZ3-CE2 4.29Å; W374-Y388 AromaticContact NE1-CE2 3.9Å; W374-I391 HydrophobicContact CH2-CB 4.39Å; W374-I391 HydrophobicContact CH2-CG2 3.92Å; W374-I391 HydrophobicContact CZ2-CB 4.2Å; W374-I391 HydrophobicContact CZ2-CG2 3.66Å; W374-Q395 VanDerWaalsContact CE2-OE1 3.27Å; W374-Q395 VanDerWaalsContact CZ2-OE1 3.31Å; W374-Q639 CarbonylContact O-C 3.49Å; W374-Q639 VanDerWaalsContact O-CA 3.24Å; W374-Q639 WeakPolarHBondContact O-CA 3.43Å; W374-Q639 WeakPolarHBondContact O-CB 3.46Å; W374-V640 PolarHBondContact N-O 3.12Å; W374-V640 PolarHBondContact O-N 3.24Å
375	N	87.2	Confident	83.3	Confident	50 Å²	50	69.3 Å²	69.3	27%	0.267	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	164.4	167.5	74.6	51.2	0	0	0	111.6	E377 E378 Q379 R638 Q639	N375-E377 VanDerWaalsContact C-N 3.31Å; N375-E377 PolarHBondContact O-N 3.34Å; N375-E377 WeakPolarHBondContact OD1-CA 3.1Å; N375-E377 WeakPolarHBondContact OD1-CB 3.12Å; N375-E377 PolarHBondContact OD1-N 2.89Å; N375-E378 PolarHBondContact N-OE2 3.43Å; N375-E378 WeakPolarHBondContact ND2-CG 3.17Å; N375-E378 PolarHBondContact ND2-OE1 3.46Å; N375-E378 PolarHBondContact ND2-OE2 3.2Å; N375-E378 PolarHBondContact O-N 3.36Å; N375-E378 WeakPolarHBondContact OD1-CG 3.47Å; N375-E378 PolarHBondContact OD1-N 3.05Å; N375-Q379 WeakPolarHBondContact O-CG 3.31Å; N375-Q379 PolarHBondContact O-N 3.1Å; N375-Q379 VanDerWaalsContact O-N 3.15Å; N375-R638 WeakPolarHBondContact CA-O 3.24Å; N375-Q639 HydrophobicContact CB-CB 4.1Å
376	G	81.7	Confident	82.4	Confident	41 Å²	41	67.9 Å²	67.9	42%	0.423	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-31.8	-177.6	0	0	0	0	0	114.6	L380 R638	G376-L380 WeakPolarHBondContact O-CB 3.26Å; G376-L380 PolarHBondContact O-N 2.97Å; G376-R638 PolarHBondContact N-O 3.35Å
377	E	83.4	Confident	81.7	Confident	141 Å²	141	68 Å²	68	66%	0.659	41%	0.405	S	S	*	.	H	α-helix	trans	-72.1	-38	178.4	-65.4	-63.9	147.7	0	0	111.5	N375 L380 A381	N375-E377 VanDerWaalsContact C-N 3.31Å; N375-E377 PolarHBondContact O-N 3.34Å; N375-E377 WeakPolarHBondContact OD1-CA 3.1Å; N375-E377 WeakPolarHBondContact OD1-CB 3.12Å; N375-E377 PolarHBondContact OD1-N 2.89Å; E377-L380 PolarHBondContact O-N 3.48Å; E377-A381 VanDerWaalsContact O-CB 3.26Å; E377-A381 WeakPolarHBondContact O-CB 3.45Å; E377-A381 PolarHBondContact O-N 3.39Å
378	E	83.7	Confident	81.1	Confident	83 Å²	83	67.4 Å²	67.4	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-41.8	174.1	-71.6	165.3	163.5	0	0	111.3	W374 N375 A381 L382	W374-E378 WeakPolarHBondContact CA-OE2 3.48Å; W374-E378 HydrophobicContact CE3-CB 3.72Å; W374-E378 HydrophobicContact CZ3-CB 3.95Å; N375-E378 PolarHBondContact N-OE2 3.43Å; N375-E378 WeakPolarHBondContact ND2-CG 3.17Å; N375-E378 PolarHBondContact ND2-OE1 3.46Å; N375-E378 PolarHBondContact ND2-OE2 3.2Å; N375-E378 PolarHBondContact O-N 3.36Å; N375-E378 WeakPolarHBondContact OD1-CG 3.47Å; N375-E378 PolarHBondContact OD1-N 3.05Å; E378-A381 PolarHBondContact O-N 3.24Å; E378-L382 WeakPolarHBondContact O-CG 3.34Å; E378-L382 PolarHBondContact O-N 3.49Å
379	Q	81.2	Confident	80.4	Confident	69 Å²	69	66.8 Å²	66.8	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-44.2	174.5	-71.1	-177.8	1.8	0	0	111.4	W374 N375 L382 Y388	W374-Q379 HydrophobicContact CB-CG 4.38Å; W374-Q379 HydrophobicContact CE3-CG 4.49Å; N375-Q379 WeakPolarHBondContact O-CG 3.31Å; N375-Q379 PolarHBondContact O-N 3.1Å; N375-Q379 VanDerWaalsContact O-N 3.15Å; Q379-L382 PolarHBondContact O-N 3.45Å; Q379-Y388 HydrophobicContact CG-CD2 3.85Å; Q379-Y388 HydrophobicContact CG-CE2 3.55Å; Q379-Y388 PolarHBondContact NE2-OH 3.47Å; Q379-Y388 VanDerWaalsContact NE2-OH 3.14Å
380	L	78.7	Confident	79.9	Confident	126 Å²	126	67.7 Å²	67.7	66%	0.66	41%	0.405	S	S	*	.	H	α-helix	trans	-65.3	-41	178.4	-176.6	61.9	0	0	0	111.8	G376 E377 L382 G383	G376-L380 WeakPolarHBondContact O-CB 3.26Å; G376-L380 PolarHBondContact O-N 2.97Å; E377-L380 PolarHBondContact O-N 3.48Å; L380-L382 VanDerWaalsContact C-N 3.27Å; L380-L382 PolarHBondContact O-N 2.92Å; L380-G383 PolarHBondContact O-N 3.14Å; L380-G383 VanDerWaalsContact O-N 3.07Å
381	A	79	Confident	79.4	Confident	89 Å²	89	69.8 Å²	69.8	74%	0.736	41%	0.414	S	S	*	.	H	α-helix	trans	-63.4	-30.8	-179.2	0	0	0	0	0	113.3	E377 E378 G383	E377-A381 VanDerWaalsContact O-CB 3.26Å; E377-A381 WeakPolarHBondContact O-CB 3.45Å; E377-A381 PolarHBondContact O-N 3.39Å; E378-A381 PolarHBondContact O-N 3.24Å; A381-G383 VanDerWaalsContact C-N 3.31Å
382	L	78.2	Confident	79.1	Confident	51 Å²	51	66 Å²	66	27%	0.267	39%	0.389	S	S	.	.	H	α-helix	trans	-77.2	-17.9	175.9	-69.7	171.9	0	0	0	113.4	W374 E378 Q379 L380 T387 Y388 I391	W374-L382 HydrophobicContact CE3-CD1 4.47Å; W374-L382 HydrophobicContact CH2-CD1 3.37Å; W374-L382 HydrophobicContact CZ3-CD1 3.33Å; E378-L382 WeakPolarHBondContact O-CG 3.34Å; E378-L382 PolarHBondContact O-N 3.49Å; Q379-L382 PolarHBondContact O-N 3.45Å; L380-L382 VanDerWaalsContact C-N 3.27Å; L380-L382 PolarHBondContact O-N 2.92Å; L382-T387 HydrophobicContact CD2-CG2 4.29Å; L382-Y388 HydrophobicContact CD1-CD2 4.28Å; L382-I391 HydrophobicContact CD1-CD1 3.9Å; L382-I391 HydrophobicContact CD2-CD1 3.79Å
383	G	67	Low	78.9	Confident	25 Å²	25	66.1 Å²	66.1	26%	0.258	39%	0.391	S	S	.	.			trans	72	173.8	177.3	0	0	0	0	0	114.7	L380 A381 S385	L380-G383 PolarHBondContact O-N 3.14Å; L380-G383 VanDerWaalsContact O-N 3.07Å; A381-G383 VanDerWaalsContact C-N 3.31Å; G383-S385 PolarHBondContact O-N 2.81Å; G383-S385 VanDerWaalsContact O-N 3.1Å
384	P	63.6	Low	78.7	Confident	144 Å²	144	64.2 Å²	64.2	94%	0.935	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	4.4	-172.7	30.7	-35.7	0	0	0	114.5	G386	P384-G386 PolarHBondContact O-N 3.38Å
385	S	63.1	Low	78.7	Confident	89 Å²	89	66.3 Å²	66.3	62%	0.622	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	16.6	-170.1	54.7	0	0	0	0	115	G383 T387	G383-S385 PolarHBondContact O-N 2.81Å; G383-S385 VanDerWaalsContact O-N 3.1Å; S385-T387 PolarHBondContact O-N 3.17Å; S385-T387 PolarHBondContact OG-OG1 2.92Å
386	G	67.5	Low	78.8	Confident	34 Å²	34	64 Å²	64	35%	0.351	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	-9.5	-175.5	0	0	0	0	0	114.5	P384 Y388 N389 T390	P384-G386 PolarHBondContact O-N 3.38Å; G386-Y388 PolarHBondContact O-N 3.17Å; G386-N389 PolarHBondContact O-N 3.14Å; G386-T390 PolarHBondContact O-N 2.95Å; G386-T390 VanDerWaalsContact O-N 3.14Å; G386-T390 PolarHBondContact O-OG1 2.99Å
387	T	76.4	Confident	78.9	Confident	55 Å²	55	63.5 Å²	63.5	34%	0.337	37%	0.371	S	S	.	.	H	α-helix	trans	-51.9	-39.9	178.8	-53	0	0	0	0	112.2	L382 S385 N389 T390 I391	L382-T387 HydrophobicContact CD2-CG2 4.29Å; S385-T387 PolarHBondContact O-N 3.17Å; S385-T387 PolarHBondContact OG-OG1 2.92Å; T387-N389 PolarHBondContact O-N 3.32Å; T387-T390 PolarHBondContact O-N 3.47Å; T387-I391 HydrophobicContact CG2-CD1 3.8Å; T387-I391 HydrophobicContact CG2-CG1 4.32Å; T387-I391 VanDerWaalsContact O-CG1 3.29Å; T387-I391 WeakPolarHBondContact O-CG1 2.94Å; T387-I391 PolarHBondContact O-N 2.77Å
388	Y	76.8	Confident	79.1	Confident	34 Å²	34	62.2 Å²	62.2	13%	0.133	37%	0.365	C	S	.	.	H	α-helix	trans	-55.6	-49.4	174.1	171.5	-106.6	0	0	0	112.7	W374 Q379 L382 G386 T390 I391 L392	W374-Y388 HydrophobicContact CB-CE2 4.13Å; W374-Y388 AromaticContact CD1-CE2 3.87Å; W374-Y388 HydrophobicContact CD2-CD2 4.02Å; W374-Y388 AromaticContact CD2-CE2 3.38Å; W374-Y388 HydrophobicContact CD2-CE2 3.38Å; W374-Y388 AromaticContact CE2-CE2 3.6Å; W374-Y388 AromaticContact CE3-CD2 4Å; W374-Y388 HydrophobicContact CE3-CD2 4Å; W374-Y388 AromaticContact CE3-CE2 3.74Å; W374-Y388 HydrophobicContact CE3-CE2 3.74Å; W374-Y388 AromaticContact CG-CE2 3.53Å; W374-Y388 HydrophobicContact CG-CE2 3.53Å; W374-Y388 HydrophobicContact CH2-CD2 4.23Å; W374-Y388 HydrophobicContact CH2-CE2 4.49Å; W374-Y388 HydrophobicContact CZ2-CD2 4.21Å; W374-Y388 HydrophobicContact CZ2-CE2 4.17Å; W374-Y388 HydrophobicContact CZ3-CD2 4.11Å; W374-Y388 HydrophobicContact CZ3-CE2 4.29Å; W374-Y388 AromaticContact NE1-CE2 3.9Å; Q379-Y388 HydrophobicContact CG-CD2 3.85Å; Q379-Y388 HydrophobicContact CG-CE2 3.55Å; Q379-Y388 PolarHBondContact NE2-OH 3.47Å; Q379-Y388 VanDerWaalsContact NE2-OH 3.14Å; L382-Y388 HydrophobicContact CD1-CD2 4.28Å; G386-Y388 PolarHBondContact O-N 3.17Å; Y388-T390 VanDerWaalsContact C-N 3.33Å; Y388-T390 PolarHBondContact O-N 3.43Å; Y388-I391 PolarHBondContact O-N 2.9Å; Y388-L392 HydrophobicContact CE1-CD2 4.15Å; Y388-L392 VanDerWaalsContact O-CB 3.27Å; Y388-L392 WeakPolarHBondContact O-CB 3.34Å; Y388-L392 PolarHBondContact O-N 3.03Å
389	N	78.8	Confident	79.4	Confident	77 Å²	77	58.6 Å²	58.6	41%	0.412	35%	0.349	S	S	.	.	H	α-helix	trans	-67.6	-35.9	-178.8	-72.1	-18.7	0	0	0	111.5	G386 T387 A393	G386-N389 PolarHBondContact O-N 3.14Å; T387-N389 PolarHBondContact O-N 3.32Å; N389-A393 WeakPolarHBondContact O-CB 3.38Å; N389-A393 PolarHBondContact O-N 2.89Å
390	T	81.5	Confident	79.7	Confident	84 Å²	84	55.4 Å²	55.4	52%	0.515	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-47.1	174.9	-49	0	0	0	0	111.5	G386 T387 Y388 A393 D394	G386-T390 PolarHBondContact O-N 2.95Å; G386-T390 VanDerWaalsContact O-N 3.14Å; G386-T390 PolarHBondContact O-OG1 2.99Å; T387-T390 PolarHBondContact O-N 3.47Å; Y388-T390 VanDerWaalsContact C-N 3.33Å; Y388-T390 PolarHBondContact O-N 3.43Å; T390-A393 WeakPolarHBondContact O-CB 3.42Å; T390-A393 PolarHBondContact O-N 3.02Å; T390-D394 PolarHBondContact O-N 2.75Å
391	I	82.9	Confident	80.1	Confident	57 Å²	57	52.3 Å²	52.3	29%	0.292	31%	0.313	S	S	.	.	H	α-helix	trans	-65.8	-42.6	177.8	-62.5	169.1	0	0	0	110.4	W374 L382 T387 Y388 A393 D394 Q395	W374-I391 HydrophobicContact CH2-CB 4.39Å; W374-I391 HydrophobicContact CH2-CG2 3.92Å; W374-I391 HydrophobicContact CZ2-CB 4.2Å; W374-I391 HydrophobicContact CZ2-CG2 3.66Å; L382-I391 HydrophobicContact CD1-CD1 3.9Å; L382-I391 HydrophobicContact CD2-CD1 3.79Å; T387-I391 HydrophobicContact CG2-CD1 3.8Å; T387-I391 HydrophobicContact CG2-CG1 4.32Å; T387-I391 VanDerWaalsContact O-CG1 3.29Å; T387-I391 WeakPolarHBondContact O-CG1 2.94Å; T387-I391 PolarHBondContact O-N 2.77Å; Y388-I391 PolarHBondContact O-N 2.9Å; I391-A393 VanDerWaalsContact C-N 3.31Å; I391-A393 PolarHBondContact O-N 2.84Å; I391-D394 PolarHBondContact O-N 2.92Å; I391-Q395 HydrophobicContact CG2-CG 4.32Å; I391-Q395 WeakPolarHBondContact O-CG 3.47Å; I391-Q395 PolarHBondContact O-N 2.84Å
392	L	84.9	Confident	80.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-44.3	176.3	-179.5	64.9	0	0	0	110.9	L293 V372 Y388 Q395 F396 Y642	L293-L392 HydrophobicContact CD1-CD2 4.29Å; L293-L392 HydrophobicContact CD2-CD2 4.35Å; V372-L392 HydrophobicContact CG1-CD1 3.82Å; Y388-L392 HydrophobicContact CE1-CD2 4.15Å; Y388-L392 VanDerWaalsContact O-CB 3.27Å; Y388-L392 WeakPolarHBondContact O-CB 3.34Å; Y388-L392 PolarHBondContact O-N 3.03Å; L392-Q395 PolarHBondContact O-N 2.89Å; L392-F396 HydrophobicContact CD1-CD2 4.15Å; L392-F396 HydrophobicContact CD1-CE2 3.7Å; L392-F396 HydrophobicContact CD2-CE2 4.32Å; L392-F396 HydrophobicContact CG-CD2 4.04Å; L392-F396 HydrophobicContact CG-CE2 3.78Å; L392-F396 WeakPolarHBondContact O-CD2 3.39Å; L392-F396 PolarHBondContact O-N 2.91Å; L392-Y642 HydrophobicContact CD1-CD2 3.95Å; L392-Y642 HydrophobicContact CD1-CE2 3.84Å; L392-Y642 HydrophobicContact CD2-CE2 4.26Å
393	A	84.2	Confident	81.2	Confident	11 Å²	11	48.5 Å²	48.5	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-50.8	173.6	0	0	0	0	0	110.9	T296 A300 N389 T390 I391 Q395 F396 K397	T296-A393 HydrophobicContact CG2-CB 3.53Å; A300-A393 HydrophobicContact CB-CB 4.49Å; A300-A393 WeakPolarHBondContact CB-O 3.35Å; N389-A393 WeakPolarHBondContact O-CB 3.38Å; N389-A393 PolarHBondContact O-N 2.89Å; T390-A393 WeakPolarHBondContact O-CB 3.42Å; T390-A393 PolarHBondContact O-N 3.02Å; I391-A393 VanDerWaalsContact C-N 3.31Å; I391-A393 PolarHBondContact O-N 2.84Å; A393-Q395 VanDerWaalsContact C-N 3.3Å; A393-Q395 PolarHBondContact O-N 3.03Å; A393-F396 WeakPolarHBondContact O-CB 3.35Å; A393-F396 PolarHBondContact O-N 3Å; A393-F396 VanDerWaalsContact O-N 3.1Å; A393-K397 WeakPolarHBondContact O-CG 3.42Å; A393-K397 PolarHBondContact O-N 3.14Å
394	D	84.9	Confident	82.3	Confident	69 Å²	69	47.5 Å²	47.5	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-34	179.9	-71.4	-20.9	0	0	0	112.9	T390 I391 K397 Q398	T390-D394 PolarHBondContact O-N 2.75Å; I391-D394 PolarHBondContact O-N 2.92Å; D394-K397 WeakPolarHBondContact O-CB 3.03Å; D394-K397 PolarHBondContact O-N 2.83Å; D394-K397 WeakPolarHBondContact OD1-CD 3.48Å; D394-K397 WeakPolarHBondContact OD1-CE 3.35Å; D394-K397 IonicContact OD1-NZ 3.74Å; D394-K397 PolarHBondContact OD1-NZ 3.29Å; D394-Q398 WeakPolarHBondContact O-CG 3.2Å; D394-Q398 PolarHBondContact O-N 2.75Å
395	Q	88.5	Confident	83.5	Confident	64 Å²	64	42.4 Å²	42.4	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-42.7	172.3	-73.7	173.2	-35.4	0	0	111.6	V372 W374 I391 L392 A393 K397 Q398 A399	V372-Q395 HydrophobicContact CG1-CB 3.8Å; V372-Q395 HydrophobicContact CG1-CG 4.33Å; V372-Q395 HydrophobicContact CG2-CB 3.92Å; W374-Q395 VanDerWaalsContact CE2-OE1 3.27Å; W374-Q395 VanDerWaalsContact CZ2-OE1 3.31Å; I391-Q395 HydrophobicContact CG2-CG 4.32Å; I391-Q395 WeakPolarHBondContact O-CG 3.47Å; I391-Q395 PolarHBondContact O-N 2.84Å; L392-Q395 PolarHBondContact O-N 2.89Å; A393-Q395 VanDerWaalsContact C-N 3.3Å; A393-Q395 PolarHBondContact O-N 3.03Å; Q395-K397 VanDerWaalsContact C-N 3.31Å; Q395-K397 PolarHBondContact O-N 3.21Å; Q395-Q398 PolarHBondContact O-N 2.97Å; Q395-A399 WeakPolarHBondContact O-CB 3.35Å; Q395-A399 PolarHBondContact O-N 3.29Å
396	F	88.2	Confident	84.9	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-39.2	170.8	-79.7	-67.1	0	0	0	111.7	A300 L392 A393 Q398 A399 F400 I631 Y642 V644	A300-F396 HydrophobicContact CB-CB 4.04Å; L392-F396 HydrophobicContact CD1-CD2 4.15Å; L392-F396 HydrophobicContact CD1-CE2 3.7Å; L392-F396 HydrophobicContact CD2-CE2 4.32Å; L392-F396 HydrophobicContact CG-CD2 4.04Å; L392-F396 HydrophobicContact CG-CE2 3.78Å; L392-F396 WeakPolarHBondContact O-CD2 3.39Å; L392-F396 PolarHBondContact O-N 2.91Å; A393-F396 WeakPolarHBondContact O-CB 3.35Å; A393-F396 PolarHBondContact O-N 3Å; A393-F396 VanDerWaalsContact O-N 3.1Å; F396-Q398 PolarHBondContact O-N 2.81Å; F396-A399 WeakPolarHBondContact O-CB 3.32Å; F396-A399 PolarHBondContact O-N 2.71Å; F396-F400 HydrophobicContact CB-CE2 4.19Å; F396-F400 WeakPolarHBondContact O-CD2 3.45Å; F396-F400 PolarHBondContact O-N 3.06Å; F396-I631 HydrophobicContact CE1-CG2 4.09Å; F396-I631 HydrophobicContact CZ-CG2 4.47Å; F396-Y642 HydrophobicContact CE1-CG 4.49Å; F396-Y642 HydrophobicContact CE2-CD1 4.46Å; F396-Y642 HydrophobicContact CE2-CG 4.37Å; F396-Y642 AromaticContact CZ-CD1 3.72Å; F396-Y642 HydrophobicContact CZ-CD1 3.72Å; F396-Y642 HydrophobicContact CZ-CD2 4.34Å; F396-Y642 HydrophobicContact CZ-CE1 4.45Å; F396-Y642 AromaticContact CZ-CG 3.65Å; F396-Y642 HydrophobicContact CZ-CG 3.65Å; F396-V644 HydrophobicContact CD1-CG2 3.63Å; F396-V644 HydrophobicContact CE1-CG2 3.9Å
397	K	84.7	Confident	86.1	Confident	31 Å²	31	38.9 Å²	38.9	14%	0.135	21%	0.208	C	C	.	.	H	α-helix	trans	-56.4	-49.2	174.5	-62.1	-175.6	-169.5	157.9	0	111.7	A300 V303 V304 A393 D394 Q395 A399 R401	A300-K397 HydrophobicContact CB-CG 3.58Å; A300-K397 WeakPolarHBondContact O-CG 3.35Å; V303-K397 HydrophobicContact CB-CD 4.48Å; V304-K397 HydrophobicContact CB-CB 4.49Å; V304-K397 HydrophobicContact CG1-CB 4.42Å; V304-K397 HydrophobicContact CG2-CB 3.81Å; V304-K397 HydrophobicContact CG2-CG 4Å; A393-K397 WeakPolarHBondContact O-CG 3.42Å; A393-K397 PolarHBondContact O-N 3.14Å; D394-K397 WeakPolarHBondContact O-CB 3.03Å; D394-K397 PolarHBondContact O-N 2.83Å; D394-K397 WeakPolarHBondContact OD1-CD 3.48Å; D394-K397 WeakPolarHBondContact OD1-CE 3.35Å; D394-K397 IonicContact OD1-NZ 3.74Å; D394-K397 PolarHBondContact OD1-NZ 3.29Å; Q395-K397 VanDerWaalsContact C-N 3.31Å; Q395-K397 PolarHBondContact O-N 3.21Å; K397-A399 VanDerWaalsContact C-N 3.33Å; K397-R401 WeakPolarHBondContact O-CB 3.22Å; K397-R401 PolarHBondContact O-N 2.84Å
398	Q	87.9	Confident	86.9	Confident	114 Å²	114	36.4 Å²	36.4	53%	0.533	19%	0.192	S	C	.	.	H	α-helix	trans	-66.8	-35.4	179.2	-64.6	-58.8	-24.6	0	0	111.9	D394 Q395 F396 R401 A402	D394-Q398 WeakPolarHBondContact O-CG 3.2Å; D394-Q398 PolarHBondContact O-N 2.75Å; Q395-Q398 PolarHBondContact O-N 2.97Å; F396-Q398 PolarHBondContact O-N 2.81Å; Q398-R401 PolarHBondContact O-N 3.41Å; Q398-A402 WeakPolarHBondContact O-CB 3Å; Q398-A402 PolarHBondContact O-N 3.46Å
399	A	88.9	Confident	87.6	Confident	7 Å²	7	36.1 Å²	36.1	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-49	176.2	0	0	0	0	0	112.3	A370 Q395 F396 K397 R401 A402 L403 V644	A370-A399 HydrophobicContact CB-CB 3.59Å; Q395-A399 WeakPolarHBondContact O-CB 3.35Å; Q395-A399 PolarHBondContact O-N 3.29Å; F396-A399 WeakPolarHBondContact O-CB 3.32Å; F396-A399 PolarHBondContact O-N 2.71Å; K397-A399 VanDerWaalsContact C-N 3.33Å; A399-R401 VanDerWaalsContact C-N 3.34Å; A399-R401 PolarHBondContact O-N 2.87Å; A399-A402 PolarHBondContact O-N 3.22Å; A399-L403 PolarHBondContact O-N 2.65Å; A399-V644 HydrophobicContact CB-CB 4.14Å; A399-V644 HydrophobicContact CB-CG2 3.75Å
400	F	88.2	Confident	88.3	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-60.7	-43.7	174.4	-67.5	-58.2	0	0	0	111.8	I297 L301 F396 A402 L403 A404 F629 I631 V644	I297-F400 HydrophobicContact CG2-CE2 4.4Å; I297-F400 HydrophobicContact CG2-CZ 4.14Å; L301-F400 HydrophobicContact CD1-CD1 4.23Å; L301-F400 HydrophobicContact CD1-CD2 3.99Å; L301-F400 HydrophobicContact CD1-CE1 4.41Å; L301-F400 HydrophobicContact CD1-CE2 4.19Å; L301-F400 HydrophobicContact CD1-CG 4.03Å; L301-F400 HydrophobicContact CD1-CZ 4.39Å; F396-F400 HydrophobicContact CB-CE2 4.19Å; F396-F400 WeakPolarHBondContact O-CD2 3.45Å; F396-F400 PolarHBondContact O-N 3.06Å; F400-A402 PolarHBondContact O-N 2.78Å; F400-L403 PolarHBondContact O-N 3.25Å; F400-A404 WeakPolarHBondContact O-CB 3.27Å; F400-A404 PolarHBondContact O-N 2.73Å; F400-F629 HydrophobicContact CD1-CB 4.23Å; F400-F629 HydrophobicContact CD1-CD1 4.12Å; F400-F629 AromaticContact CD1-CD2 3.7Å; F400-F629 HydrophobicContact CD1-CD2 3.7Å; F400-F629 HydrophobicContact CD1-CE1 4.43Å; F400-F629 HydrophobicContact CD1-CE2 4.04Å; F400-F629 AromaticContact CD1-CG 3.74Å; F400-F629 HydrophobicContact CD1-CG 3.74Å; F400-F629 HydrophobicContact CD1-CZ 4.39Å; F400-F629 HydrophobicContact CE1-CB 3.81Å; F400-F629 AromaticContact CE1-CD2 3.91Å; F400-F629 HydrophobicContact CE1-CD2 3.91Å; F400-F629 AromaticContact CE1-CG 3.83Å; F400-F629 HydrophobicContact CE1-CG 3.83Å; F400-I631 HydrophobicContact CZ-CD1 3.97Å; F400-V644 HydrophobicContact CD1-CG1 3.65Å; F400-V644 HydrophobicContact CE1-CG1 3.54Å; F400-V644 HydrophobicContact CE1-CG2 4.4Å; F400-V644 HydrophobicContact CZ-CG1 4.43Å
401	R	86.3	Confident	88.9	Confident	60 Å²	60	30.1 Å²	30.1	23%	0.226	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-45.6	178	-179.4	175	172.9	172.5	-12.8	112.1	V304 S305 E307 K397 Q398 A399 L403 A404 N405	V304-R401 HydrophobicContact CG1-CB 3.98Å; S305-R401 PolarHBondContact O-NH1 2.93Å; E307-R401 IonicContact OE1-CZ 3.87Å; E307-R401 IonicContact OE1-NE 2.9Å; E307-R401 IonicContact OE1-NH2 2.69Å; E307-R401 PolarHBondContact OE1-NH2 3.05Å; K397-R401 WeakPolarHBondContact O-CB 3.22Å; K397-R401 PolarHBondContact O-N 2.84Å; Q398-R401 PolarHBondContact O-N 3.41Å; A399-R401 VanDerWaalsContact C-N 3.34Å; A399-R401 PolarHBondContact O-N 2.87Å; R401-L403 VanDerWaalsContact C-N 3.34Å; R401-L403 PolarHBondContact O-N 3.3Å; R401-A404 PolarHBondContact O-N 2.84Å; R401-N405 WeakPolarHBondContact O-CB 3.47Å; R401-N405 PolarHBondContact O-N 3.38Å; R401-N405 PolarHBondContact O-OD1 2.82Å
402	A	90.3	Very high	89.4	Confident	55 Å²	55	27.4 Å²	27.4	46%	0.455	15%	0.148	S	C	.	.	H	α-helix	trans	-59.4	-45.3	-178.5	0	0	0	0	0	111.6	Q398 A399 F400 E406	Q398-A402 WeakPolarHBondContact O-CB 3Å; Q398-A402 PolarHBondContact O-N 3.46Å; A399-A402 PolarHBondContact O-N 3.22Å; F400-A402 PolarHBondContact O-N 2.78Å; A402-E406 PolarHBondContact O-N 3.49Å
403	L	91.4	Very high	89.9	Confident	5 Å²	5	29 Å²	29	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-47.4	178	-66.7	171.9	0	0	0	111.8	K368 A370 A399 F400 R401 N405 E406 V407 F629 V644 L646 W648	K368-L403 HydrophobicContact CB-CD2 4.12Å; A370-L403 HydrophobicContact CB-CG 4.5Å; A399-L403 PolarHBondContact O-N 2.65Å; F400-L403 PolarHBondContact O-N 3.25Å; R401-L403 VanDerWaalsContact C-N 3.34Å; R401-L403 PolarHBondContact O-N 3.3Å; L403-N405 VanDerWaalsContact C-N 3.35Å; L403-N405 PolarHBondContact O-N 2.84Å; L403-E406 PolarHBondContact O-N 2.92Å; L403-V407 WeakPolarHBondContact O-CG2 3.35Å; L403-V407 PolarHBondContact O-N 3.32Å; L403-V407 VanDerWaalsContact O-N 3.08Å; L403-F629 HydrophobicContact CB-CE1 3.84Å; L403-F629 HydrophobicContact CD1-CD1 3.91Å; L403-F629 HydrophobicContact CD1-CE1 4.01Å; L403-V644 HydrophobicContact CD1-CB 4.26Å; L403-V644 HydrophobicContact CD1-CG1 3.74Å; L403-V644 WeakPolarHBondContact CD1-O 3.38Å; L403-L646 HydrophobicContact CD1-CB 4.16Å; L403-W648 HydrophobicContact CD2-CH2 4.38Å; L403-W648 HydrophobicContact CD2-CZ3 4.19Å
404	A	89.6	Confident	90.3	Very high	5 Å²	5	29.2 Å²	29.2	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-41.6	179.5	0	0	0	0	0	112.4	F400 R401 E406 V407 E408	F400-A404 WeakPolarHBondContact O-CB 3.27Å; F400-A404 PolarHBondContact O-N 2.73Å; R401-A404 PolarHBondContact O-N 2.84Å; A404-E406 VanDerWaalsContact C-N 3.3Å; A404-E406 PolarHBondContact O-N 3.25Å; A404-V407 PolarHBondContact O-N 2.84Å; A404-E408 PolarHBondContact O-N 2.75Å
405	N	89.4	Confident	90.8	Very high	36 Å²	36	27.3 Å²	27.3	19%	0.193	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-36.8	176.5	-78.8	5.8	0	0	0	112.1	E307 R401 L403 A409	E307-N405 VanDerWaalsContact CD-ND2 3.26Å; E307-N405 PolarHBondContact OE2-ND2 3.43Å; R401-N405 WeakPolarHBondContact O-CB 3.47Å; R401-N405 PolarHBondContact O-N 3.38Å; R401-N405 PolarHBondContact O-OD1 2.82Å; L403-N405 VanDerWaalsContact C-N 3.35Å; L403-N405 PolarHBondContact O-N 2.84Å; N405-A409 VanDerWaalsContact O-CB 3.23Å; N405-A409 WeakPolarHBondContact O-CB 3.45Å; N405-A409 PolarHBondContact O-N 2.91Å
406	E	92.7	Very high	91	Very high	49 Å²	49	28 Å²	28	23%	0.229	15%	0.151	C	C	.	.	H	α-helix	trans	-69.2	-39.4	177	-159.1	-178.9	157.2	0	0	111.6	K366 K368 A402 L403 A404 A409 D410 W648	K366-E406 WeakPolarHBondContact CD-OE1 3.48Å; K366-E406 WeakPolarHBondContact CE-OE1 3.13Å; K366-E406 IonicContact NZ-OE1 3.68Å; K366-E406 PolarHBondContact NZ-OE1 3.02Å; K368-E406 VanDerWaalsContact CD-OE2 3.26Å; K368-E406 WeakPolarHBondContact CD-OE2 3.44Å; K368-E406 WeakPolarHBondContact CE-OE1 3.24Å; K368-E406 IonicContact NZ-OE1 3.74Å; K368-E406 PolarHBondContact NZ-OE1 3.16Å; K368-E406 IonicContact NZ-OE2 3.62Å; K368-E406 PolarHBondContact NZ-OE2 2.93Å; A402-E406 PolarHBondContact O-N 3.49Å; L403-E406 PolarHBondContact O-N 2.92Å; A404-E406 VanDerWaalsContact C-N 3.3Å; A404-E406 PolarHBondContact O-N 3.25Å; E406-A409 PolarHBondContact O-N 2.55Å; E406-D410 VanDerWaalsContact O-CG 3.3Å; E406-D410 PolarHBondContact O-N 3.3Å; E406-W648 HydrophobicContact CB-CH2 4.22Å; E406-W648 HydrophobicContact CB-CZ2 3.89Å; E406-W648 HydrophobicContact CG-CH2 4.34Å; E406-W648 HydrophobicContact CG-CZ2 3.79Å
407	V	92	Very high	91.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-47.3	173.5	178.2	0	0	0	0	111.1	I312 L403 A404 A409 D410 L411 L600 I627 L646 W648	I312-V407 HydrophobicContact CD1-CB 4.05Å; I312-V407 HydrophobicContact CD1-CG1 3.81Å; I312-V407 HydrophobicContact CG1-CB 4.47Å; I312-V407 HydrophobicContact CG1-CG1 3.73Å; L403-V407 WeakPolarHBondContact O-CG2 3.35Å; L403-V407 PolarHBondContact O-N 3.32Å; L403-V407 VanDerWaalsContact O-N 3.08Å; A404-V407 PolarHBondContact O-N 2.84Å; V407-A409 VanDerWaalsContact C-N 3.31Å; V407-A409 PolarHBondContact O-N 2.85Å; V407-D410 PolarHBondContact O-N 2.85Å; V407-L411 HydrophobicContact CG1-CD1 4.19Å; V407-L411 WeakPolarHBondContact O-CG 3.04Å; V407-L411 PolarHBondContact O-N 2.92Å; V407-L600 HydrophobicContact CG1-CD1 3.77Å; V407-L600 HydrophobicContact CG1-CD2 4.13Å; V407-I627 HydrophobicContact CG1-CD1 4.25Å; V407-L646 HydrophobicContact CG2-CD2 3.67Å; V407-W648 HydrophobicContact CG2-CB 4.46Å; V407-W648 HydrophobicContact CG2-CD2 3.64Å; V407-W648 HydrophobicContact CG2-CE3 4.18Å; V407-W648 HydrophobicContact CG2-CG 3.76Å; V407-W648 HydrophobicContact CG2-CZ2 4.21Å
408	E	92.1	Very high	91.5	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-58.3	-42.8	174.6	-80.3	-72.5	128	0	0	111.9	V309 G310 F311 I312 A404 D410 L411 G412 S503	V309-E408 HydrophobicContact CB-CG 4.25Å; V309-E408 VanDerWaalsContact CG1-CD 3.48Å; V309-E408 HydrophobicContact CG1-CG 3.68Å; V309-E408 WeakPolarHBondContact CG1-OE1 3.37Å; V309-E408 HydrophobicContact CG2-CG 4.32Å; G310-E408 PolarHBondContact N-OE1 3.22Å; G310-E408 PolarHBondContact N-OE2 3.03Å; F311-E408 WeakPolarHBondContact CA-OE1 3Å; F311-E408 PolarHBondContact N-OE1 2.79Å; F311-E408 PolarHBondContact N-OE2 3.35Å; I312-E408 WeakPolarHBondContact CB-OE1 3.38Å; I312-E408 HydrophobicContact CD1-CG 3.89Å; I312-E408 HydrophobicContact CG1-CG 4.26Å; I312-E408 WeakPolarHBondContact CG1-OE1 2.95Å; I312-E408 PolarHBondContact N-OE1 3.45Å; A404-E408 PolarHBondContact O-N 2.75Å; E408-D410 VanDerWaalsContact C-N 3.31Å; E408-D410 PolarHBondContact O-N 2.84Å; E408-L411 PolarHBondContact O-N 2.89Å; E408-G412 PolarHBondContact O-N 2.9Å; E408-S503 WeakPolarHBondContact OE2-CB 3.45Å; E408-S503 PolarHBondContact OE2-OG 2.72Å
409	A	92.3	Very high	91.9	Very high	28 Å²	28	21.4 Å²	21.4	23%	0.231	12%	0.122	C	C	.	.	H	α-helix	trans	-67.5	-31.5	180	0	0	0	0	0	112.6	N405 E406 V407 A413 K507	N405-A409 VanDerWaalsContact O-CB 3.23Å; N405-A409 WeakPolarHBondContact O-CB 3.45Å; N405-A409 PolarHBondContact O-N 2.91Å; E406-A409 PolarHBondContact O-N 2.55Å; V407-A409 VanDerWaalsContact C-N 3.31Å; V407-A409 PolarHBondContact O-N 2.85Å; A409-A413 WeakPolarHBondContact O-CB 3.41Å; A409-A413 PolarHBondContact O-N 2.85Å; A409-A413 VanDerWaalsContact O-N 3.14Å; A409-K507 WeakPolarHBondContact O-CE 3.35Å; A409-K507 PolarHBondContact O-NZ 3Å; A409-K507 VanDerWaalsContact O-NZ 3.07Å
410	D	93.9	Very high	92.2	Very high	30 Å²	30	21.4 Å²	21.4	16%	0.16	12%	0.12	C	C	.	.	H	α-helix	trans	-73.5	-42.5	173.8	-72.3	-20.1	0	0	0	111.4	K366 E406 V407 E408 A413 L414 W648 V650	K366-D410 WeakPolarHBondContact CD-OD2 3.25Å; K366-D410 VanDerWaalsContact CE-OD2 3.25Å; K366-D410 WeakPolarHBondContact CE-OD2 3.35Å; K366-D410 IonicContact NZ-OD1 2.7Å; K366-D410 PolarHBondContact NZ-OD1 2.66Å; K366-D410 IonicContact NZ-OD2 2.8Å; K366-D410 PolarHBondContact NZ-OD2 2.87Å; E406-D410 VanDerWaalsContact O-CG 3.3Å; E406-D410 PolarHBondContact O-N 3.3Å; V407-D410 PolarHBondContact O-N 2.85Å; E408-D410 VanDerWaalsContact C-N 3.31Å; E408-D410 PolarHBondContact O-N 2.84Å; D410-A413 VanDerWaalsContact O-CB 3.32Å; D410-A413 WeakPolarHBondContact O-CB 3.43Å; D410-A413 PolarHBondContact O-N 2.98Å; D410-A413 VanDerWaalsContact O-N 3.13Å; D410-L414 PolarHBondContact O-N 3.4Å; D410-W648 PolarHBondContact OD2-NE1 2.89Å; D410-V650 HydrophobicContact CB-CG1 4.21Å; D410-V650 HydrophobicContact CB-CG2 3.95Å
411	L	94.4	Very high	92.6	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-46.5	174.7	-72.6	170.1	0	0	0	111.5	F311 I312 V315 V407 E408 A413 L414 L600 V650	F311-L411 HydrophobicContact CB-CB 3.63Å; F311-L411 HydrophobicContact CB-CD1 3.74Å; F311-L411 HydrophobicContact CB-CG 4.31Å; F311-L411 HydrophobicContact CD1-CB 4.42Å; F311-L411 HydrophobicContact CG-CB 4.03Å; I312-L411 HydrophobicContact CB-CD1 4.4Å; I312-L411 HydrophobicContact CG1-CD1 3.74Å; V315-L411 HydrophobicContact CG1-CD2 4.13Å; V315-L411 HydrophobicContact CG2-CD1 4Å; V315-L411 HydrophobicContact CG2-CD2 3.96Å; V407-L411 HydrophobicContact CG1-CD1 4.19Å; V407-L411 WeakPolarHBondContact O-CG 3.04Å; V407-L411 PolarHBondContact O-N 2.92Å; E408-L411 PolarHBondContact O-N 2.89Å; L411-A413 PolarHBondContact O-N 3.22Å; L411-L414 HydrophobicContact CD2-CD1 4.45Å; L411-L414 VanDerWaalsContact O-CB 3.31Å; L411-L414 WeakPolarHBondContact O-CB 3.41Å; L411-L414 PolarHBondContact O-N 2.54Å; L411-L600 HydrophobicContact CD1-CD2 4.49Å; L411-L600 HydrophobicContact CD2-CB 4.38Å; L411-V650 HydrophobicContact CD2-CB 3.9Å; L411-V650 HydrophobicContact CD2-CG1 3.47Å; L411-V650 VanDerWaalsContact CD2-CG1 3.47Å; L411-V650 HydrophobicContact CG-CG1 3.78Å
412	G	93.5	Very high	93.1	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-64	-23.2	174.7	0	0	0	0	0	113	E408 L414 Y415 K507	E408-G412 PolarHBondContact O-N 2.9Å; G412-L414 PolarHBondContact O-N 3.18Å; G412-Y415 WeakPolarHBondContact O-CD1 3.4Å; G412-K507 WeakPolarHBondContact O-CG 3.38Å
413	A	94.3	Very high	93.3	Very high	32 Å²	32	17.6 Å²	17.6	26%	0.264	10%	0.103	S	C	.	.	H	α-helix	trans	-70.8	-17.8	173.1	0	0	0	0	0	113	A409 D410 L411 Y415 F416	A409-A413 WeakPolarHBondContact O-CB 3.41Å; A409-A413 PolarHBondContact O-N 2.85Å; A409-A413 VanDerWaalsContact O-N 3.14Å; D410-A413 VanDerWaalsContact O-CB 3.32Å; D410-A413 WeakPolarHBondContact O-CB 3.43Å; D410-A413 PolarHBondContact O-N 2.98Å; D410-A413 VanDerWaalsContact O-N 3.13Å; L411-A413 PolarHBondContact O-N 3.22Å; A413-Y415 PolarHBondContact O-N 3.35Å; A413-Y415 VanDerWaalsContact O-N 3.17Å; A413-F416 WeakPolarHBondContact O-CD1 3.25Å; A413-F416 WeakPolarHBondContact O-CE1 3.21Å
414	L	93.8	Very high	93.4	Very high	16 Å²	16	21.9 Å²	21.9	8%	0.084	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-74.7	5.7	177.6	-64.4	-179.8	0	0	0	114.3	D410 L411 G412 F416 G417 F598 V650	D410-L414 PolarHBondContact O-N 3.4Å; L411-L414 HydrophobicContact CD2-CD1 4.45Å; L411-L414 VanDerWaalsContact O-CB 3.31Å; L411-L414 WeakPolarHBondContact O-CB 3.41Å; L411-L414 PolarHBondContact O-N 2.54Å; G412-L414 PolarHBondContact O-N 3.18Å; L414-F416 HydrophobicContact CD2-CZ 4.36Å; L414-F416 PolarHBondContact O-N 2.89Å; L414-F416 VanDerWaalsContact O-N 3.12Å; L414-G417 WeakPolarHBondContact O-CA 3.36Å; L414-G417 PolarHBondContact O-N 2.9Å; L414-F598 HydrophobicContact CB-CD1 3.88Å; L414-F598 HydrophobicContact CB-CE1 3.89Å; L414-F598 HydrophobicContact CD1-CD1 3.9Å; L414-F598 WeakPolarHBondContact O-CE1 2.84Å; L414-V650 HydrophobicContact CD1-CB 3.74Å; L414-V650 HydrophobicContact CD1-CG2 3.86Å; L414-V650 HydrophobicContact CD2-CG2 4.05Å; L414-V650 HydrophobicContact CG-CB 4.38Å; L414-V650 HydrophobicContact CG-CG2 3.94Å
415	Y	94.4	Very high	93.5	Very high	29 Å²	29	22.9 Å²	22.9	11%	0.114	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-56.3	-28.6	179	80.4	-87.5	0	0	0	113.5	G412 A413 G417 A418 K507 A509 G542 F587 A589 L660	G412-Y415 WeakPolarHBondContact O-CD1 3.4Å; A413-Y415 PolarHBondContact O-N 3.35Å; A413-Y415 VanDerWaalsContact O-N 3.17Å; Y415-G417 PolarHBondContact O-N 3.06Å; Y415-A418 WeakPolarHBondContact O-CB 3.37Å; Y415-A418 PolarHBondContact O-N 2.95Å; Y415-K507 HydrophobicContact CD1-CB 3.95Å; Y415-K507 HydrophobicContact CD1-CG 4.09Å; Y415-K507 HydrophobicContact CE1-CB 4.05Å; Y415-K507 HydrophobicContact CE1-CG 4.3Å; Y415-A509 HydrophobicContact CE2-CB 4.43Å; Y415-G542 WeakPolarHBondContact CE2-O 3.5Å; Y415-G542 PolarHBondContact OH-O 3.37Å; Y415-F587 HydrophobicContact CD2-CE2 4.37Å; Y415-F587 HydrophobicContact CE2-CE2 4.1Å; Y415-F587 HydrophobicContact CE2-CZ 4.12Å; Y415-A589 HydrophobicContact CD1-CB 4.47Å; Y415-A589 HydrophobicContact CD2-CB 3.66Å; Y415-A589 HydrophobicContact CE2-CB 4.3Å; Y415-A589 HydrophobicContact CG-CB 3.75Å; Y415-L660 HydrophobicContact CD2-CD1 3.93Å
416	F	91.9	Very high	93.7	Very high	80 Å²	80	23.9 Å²	23.9	35%	0.351	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-68.1	-14.6	174.6	66.9	-96.6	0	0	0	113.4	A413 L414 A418 G542 V555	A413-F416 WeakPolarHBondContact O-CD1 3.25Å; A413-F416 WeakPolarHBondContact O-CE1 3.21Å; L414-F416 HydrophobicContact CD2-CZ 4.36Å; L414-F416 PolarHBondContact O-N 2.89Å; L414-F416 VanDerWaalsContact O-N 3.12Å; F416-A418 VanDerWaalsContact C-N 3.31Å; F416-G542 VanDerWaalsContact CB-CA 3.43Å; F416-V555 WeakPolarHBondContact O-CG1 3.28Å
417	G	90.4	Very high	93.7	Very high	6 Å²	6	25.5 Å²	25.5	6%	0.062	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-90.9	18.6	174.1	0	0	0	0	0	113.5	L414 Y415 S652 P655	L414-G417 WeakPolarHBondContact O-CA 3.36Å; L414-G417 PolarHBondContact O-N 2.9Å; Y415-G417 PolarHBondContact O-N 3.06Å; G417-S652 PolarHBondContact O-OG 2.6Å; G417-S652 VanDerWaalsContact O-OG 3.12Å; G417-P655 WeakPolarHBondContact O-CA 3.09Å; G417-P655 VanDerWaalsContact O-CB 3.24Å; G417-P655 WeakPolarHBondContact O-CB 3.36Å
418	A	94.5	Very high	93.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-92.8	151.7	167.3	0	0	0	0	0	110	Y415 F416 V555 A567 G658 L660	Y415-A418 WeakPolarHBondContact O-CB 3.37Å; Y415-A418 PolarHBondContact O-N 2.95Å; F416-A418 VanDerWaalsContact C-N 3.31Å; A418-V555 WeakPolarHBondContact O-CB 3.42Å; A418-V555 WeakPolarHBondContact O-CG2 3.46Å; A418-A567 WeakPolarHBondContact O-CB 3.3Å; A418-G658 CarbonylContact C-O 3.55Å; A418-L660 HydrophobicContact CB-CD2 3.79Å; A418-L660 HydrophobicContact CB-CG 3.82Å
419	S	94.9	Very high	93.9	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	18%	0.182	C	C	.	.	S	Bend	trans	-71.7	-48.8	-175.1	69.3	0	0	0	0	113.5	N449 V555 A568 P655 G658	S419-N449 PolarHBondContact OG-ND2 3.23Å; S419-V555 PolarHBondContact O-N 3.47Å; S419-A568 WeakPolarHBondContact CB-O 3.29Å; S419-P655 PolarHBondContact N-O 3.12Å; S419-P655 VanDerWaalsContact N-O 3.07Å; S419-G658 PolarHBondContact N-O 3.3Å; S419-G658 PolarHBondContact OG-O 2.91Å; S419-G658 VanDerWaalsContact OG-O 3.13Å
420	R	96.1	Very high	93.9	Very high	6 Å²	6	26.1 Å²	26.1	2%	0.023	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	163.8	-165.2	-72.1	-170.1	-74.9	158.9	-0.6	109.9	V445 D448 N449 N552 Q553 Y554 C659 L660	R420-V445 HydrophobicContact CB-CG1 3.88Å; R420-V445 PolarHBondContact NH2-O 3.2Å; R420-D448 IonicContact NH1-OD2 3.06Å; R420-D448 IonicContact NH2-OD2 2.71Å; R420-N449 PolarHBondContact NH2-OD1 2.87Å; R420-N552 PolarHBondContact NH1-OD1 3Å; R420-Q553 CarbonylContact C-O 3.43Å; R420-Q553 WeakPolarHBondContact CA-O 3.49Å; R420-Q553 WeakPolarHBondContact CB-O 3.31Å; R420-Y554 HydrophobicContact CG-CD1 4.17Å; R420-Y554 HydrophobicContact CG-CE1 4.46Å; R420-C659 CarbonylContact O-C 3.6Å; R420-C659 VanDerWaalsContact O-CA 3.32Å; R420-C659 WeakPolarHBondContact O-CA 3.5Å; R420-C659 PolarHBondContact O-SG 3.03Å; R420-C659 VanDerWaalsContact O-SG 3.39Å; R420-L660 PolarHBondContact O-N 2.87Å
421	A	96.8	Very high	93.6	Very high	5 Å²	5	26 Å²	26	4%	0.041	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.6	176.5	0	0	0	0	0	112.2	I544 Q553 L660 L662	A421-I544 HydrophobicContact CB-CD1 3.63Å; A421-I544 HydrophobicContact CB-CG1 4.37Å; A421-I544 HydrophobicContact CB-CG2 4.28Å; A421-Q553 HydrophobicContact CB-CB 4.09Å; A421-Q553 PolarHBondContact N-O 3.33Å; A421-Q553 WeakPolarHBondContact O-CB 3.39Å; A421-L660 CarbonylContact C-O 3.55Å; A421-L660 VanDerWaalsContact CA-O 3.29Å; A421-L660 WeakPolarHBondContact CA-O 3.32Å; A421-L660 HydrophobicContact CB-CB 3.98Å; A421-L662 HydrophobicContact CB-CD1 4.14Å; A421-L662 HydrophobicContact CB-CD2 3.9Å; A421-L662 HydrophobicContact CB-CG 4.01Å
422	V	95.9	Very high	93.4	Very high	14 Å²	14	30.3 Å²	30.3	9%	0.085	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	158.9	173.3	-60	0	0	0	0	110.4	L441 A442 V445 L660 I661 L662	V422-L441 HydrophobicContact CB-CB 4.09Å; V422-L441 HydrophobicContact CG1-CB 3.99Å; V422-L441 HydrophobicContact CG2-CB 4.37Å; V422-A442 HydrophobicContact CG2-CB 4.01Å; V422-V445 HydrophobicContact CG1-CG2 3.7Å; V422-L660 PolarHBondContact N-O 2.95Å; V422-I661 HydrophobicContact CG2-CB 4.45Å; V422-I661 HydrophobicContact CG2-CG1 3.99Å; V422-L662 WeakPolarHBondContact O-CG 3.36Å; V422-L662 PolarHBondContact O-N 3.25Å
423	G	94.3	Very high	93.1	Very high	19 Å²	19	36.5 Å²	36.5	20%	0.196	23%	0.229	C	C	.	.	S	Bend	trans	87.4	-172.4	-177.1	0	0	0	0	0	113.2	Q553	G423-Q553 PolarHBondContact O-NE2 3.17Å
424	T	93.5	Very high	92.6	Very high	94 Å²	94	38.9 Å²	38.9	58%	0.577	24%	0.238	S	C	*	.			trans	-116.1	125.6	-175.3	-58.5	0	0	0	0	110.3	G426 T427	T424-G426 PolarHBondContact O-N 2.84Å; T424-T427 WeakPolarHBondContact O-CB 3.21Å; T424-T427 PolarHBondContact O-N 2.99Å
425	A	93	Very high	92.3	Very high	27 Å²	27	40.8 Å²	40.8	22%	0.223	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	133.8	178.6	0	0	0	0	0	112.8	T427 V584 F587 L662	A425-T427 PolarHBondContact O-N 3.42Å; A425-V584 HydrophobicContact CB-CG1 3.3Å; A425-F587 HydrophobicContact CB-CB 3.97Å; A425-L662 HydrophobicContact CB-CD1 4.37Å
426	G	92.2	Very high	92	Very high	57 Å²	57	41 Å²	41	59%	0.588	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	0.2	-176.9	0	0	0	0	0	114.4	T424 A586 G663	T424-G426 PolarHBondContact O-N 2.84Å; G426-A586 PolarHBondContact N-O 3Å; G426-G663 PolarHBondContact N-O 3.39Å
427	T	93.9	Very high	92	Very high	83 Å²	83	39.2 Å²	39.2	51%	0.509	25%	0.248	S	C	.	.	S	Bend	trans	-107.7	111.2	172.9	-56.7	0	0	0	0	109.3	T424 A425 G663	T424-T427 WeakPolarHBondContact O-CB 3.21Å; T424-T427 PolarHBondContact O-N 2.99Å; A425-T427 PolarHBondContact O-N 3.42Å; T427-G663 WeakPolarHBondContact O-CA 3.49Å
428	T	93.8	Very high	92.2	Very high	42 Å²	42	40.1 Å²	40.1	26%	0.258	25%	0.252	S	S	.	.			trans	-61.1	129.8	-179.6	-57.1	0	0	0	0	111.2	A464 N467 G663	T428-A464 HydrophobicContact CG2-CB 4.45Å; T428-N467 VanDerWaalsContact CG2-ND2 3.32Å; T428-N467 WeakPolarHBondContact CG2-ND2 2.99Å; T428-N467 PolarHBondContact O-ND2 2.93Å; T428-G663 WeakPolarHBondContact CA-OXT 3.19Å; T428-G663 PolarHBondContact N-OXT 2.85Å; T428-G663 PolarHBondContact OG1-OXT 3.18Å
429	P	93.6	Very high	92.1	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.019	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	162.6	-175.6	29	-36.7	0	0	0	112.1	G431 D438 A464 N467 I661	P429-G431 PolarHBondContact O-N 3.19Å; P429-D438 WeakPolarHBondContact CA-OD2 3.33Å; P429-D438 HydrophobicContact CB-CB 4.17Å; P429-D438 WeakPolarHBondContact CB-OD2 3.25Å; P429-A464 HydrophobicContact CG-CB 3.7Å; P429-N467 WeakPolarHBondContact O-CB 3.18Å; P429-N467 PolarHBondContact O-ND2 3.3Å; P429-I661 HydrophobicContact CB-CG2 3.58Å; P429-I661 HydrophobicContact CG-CG2 3.95Å
430	F	91.8	Very high	92	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	24.3	-173.9	-47.3	-68.2	0	0	0	112.7	V432 L436 D438 A439 M458 L460 N467 Q472	F430-V432 VanDerWaalsContact C-N 3.33Å; F430-V432 PolarHBondContact O-N 3.42Å; F430-L436 HydrophobicContact CD1-CD2 4.4Å; F430-D438 HydrophobicContact CD1-CB 4.15Å; F430-D438 HydrophobicContact CE1-CB 3.76Å; F430-D438 HydrophobicContact CZ-CB 4.09Å; F430-D438 PolarHBondContact N-OD2 3.37Å; F430-A439 HydrophobicContact CE1-CB 3.94Å; F430-A439 HydrophobicContact CZ-CB 4.2Å; F430-M458 HydrophobicContact CE2-SD 4.43Å; F430-M458 HydrophobicContact CZ-SD 4Å; F430-L460 HydrophobicContact CD2-CD1 4.37Å; F430-L460 HydrophobicContact CE2-CD1 3.65Å; F430-L460 HydrophobicContact CE2-CD2 4.19Å; F430-L460 HydrophobicContact CZ-CD1 4.46Å; F430-N467 HydrophobicContact CB-CB 4.07Å; F430-N467 WeakPolarHBondContact O-CB 3.01Å; F430-Q472 HydrophobicContact CB-CG 4.29Å; F430-Q472 PolarHBondContact O-NE2 3.2Å
431	G	89.1	Confident	91.9	Very high	27 Å²	27	45.6 Å²	45.6	28%	0.278	29%	0.288	S	S	.	.			trans	-75.6	-19.1	-173.7	0	0	0	0	0	114.7	P429 N467 K471	P429-G431 PolarHBondContact O-N 3.19Å; G431-N467 WeakPolarHBondContact CA-ND2 3.41Å; G431-K471 WeakPolarHBondContact O-CD 3.25Å; G431-K471 PolarHBondContact O-NZ 2.84Å
432	V	88.9	Confident	91.8	Very high	94 Å²	94	45.4 Å²	45.4	57%	0.57	29%	0.286	S	S	*	.	S	Bend	trans	-99.7	134.9	178.9	-179.5	0	0	0	0	109.2	F430 D435 Q472	F430-V432 VanDerWaalsContact C-N 3.33Å; F430-V432 PolarHBondContact O-N 3.42Å; V432-D435 HydrophobicContact CB-CB 3.87Å; V432-D435 HydrophobicContact CG1-CB 3.88Å; V432-Q472 PolarHBondContact O-NE2 3.45Å
433	K	87.2	Confident	91.7	Very high	131 Å²	131	47.8 Å²	47.8	57%	0.57	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	136.7	-177.5	173	-175.1	168.1	71.2	0	111	D435 S473	K433-D435 PolarHBondContact O-N 3.48Å; K433-S473 PolarHBondContact NZ-OG 3.38Å
434	D	83.8	Confident	91.7	Very high	83 Å²	83	51.6 Å²	51.6	44%	0.444	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	29.7	177.4	-54.9	-41.9	0	0	0	112.9	S473 V474	D434-S473 PolarHBondContact OD1-OG 2.91Å; D434-S473 PolarHBondContact OD2-OG 2.84Å; D434-V474 PolarHBondContact OD1-N 3.15Å
435	D	88.2	Confident	91.7	Very high	55 Å²	55	47.6 Å²	47.6	29%	0.294	28%	0.282	S	S	.	.			trans	-122.7	109.9	179.1	-176.3	2.8	0	0	0	109.3	V432 K433 S437 Q472	V432-D435 HydrophobicContact CB-CB 3.87Å; V432-D435 HydrophobicContact CG1-CB 3.88Å; K433-D435 PolarHBondContact O-N 3.48Å; D435-S437 VanDerWaalsContact CG-OG 3.29Å; D435-S437 WeakPolarHBondContact OD1-CB 3.33Å; D435-S437 PolarHBondContact OD1-N 3.41Å; D435-S437 PolarHBondContact OD1-OG 3.46Å; D435-S437 PolarHBondContact OD2-OG 2.86Å; D435-Q472 PolarHBondContact O-NE2 3.08Å
436	L	88.8	Confident	91.8	Very high	34 Å²	34	46.4 Å²	46.4	18%	0.178	27%	0.272	C	S	.	.			trans	-105.6	16.9	177.4	-57.9	177.1	0	0	0	111.6	F430 D438 A439 A440 Q472 V474 L495	F430-L436 HydrophobicContact CD1-CD2 4.4Å; L436-D438 PolarHBondContact O-N 2.82Å; L436-A439 PolarHBondContact O-N 3.32Å; L436-A440 PolarHBondContact O-N 2.91Å; L436-A440 VanDerWaalsContact O-N 3.11Å; L436-Q472 HydrophobicContact CD2-CB 4.42Å; L436-Q472 HydrophobicContact CD2-CG 3.95Å; L436-V474 HydrophobicContact CD1-CG1 4.44Å; L436-L495 HydrophobicContact CD1-CD1 3.93Å; L436-L495 HydrophobicContact CD2-CD2 4.37Å
437	S	92.2	Very high	91.9	Very high	42 Å²	42	48 Å²	48	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-56.1	-34.6	-177.9	56.8	0	0	0	0	112.9	D435 A439 A440 L441	D435-S437 VanDerWaalsContact CG-OG 3.29Å; D435-S437 WeakPolarHBondContact OD1-CB 3.33Å; D435-S437 PolarHBondContact OD1-N 3.41Å; D435-S437 PolarHBondContact OD1-OG 3.46Å; D435-S437 PolarHBondContact OD2-OG 2.86Å; S437-A439 VanDerWaalsContact C-N 3.27Å; S437-A439 PolarHBondContact O-N 3.24Å; S437-A440 PolarHBondContact O-N 3.14Å; S437-A440 VanDerWaalsContact O-N 3.16Å; S437-L441 VanDerWaalsContact O-CB 3.32Å; S437-L441 WeakPolarHBondContact O-CB 3.33Å; S437-L441 VanDerWaalsContact O-CG 3.23Å; S437-L441 WeakPolarHBondContact O-CG 3.42Å; S437-L441 PolarHBondContact O-N 3.42Å
438	D	93.7	Very high	91.8	Very high	25 Å²	25	47.5 Å²	47.5	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-41.3	175.5	-67.5	-51.2	0	0	0	112.3	P429 F430 L436 A442 I661	P429-D438 WeakPolarHBondContact CA-OD2 3.33Å; P429-D438 HydrophobicContact CB-CB 4.17Å; P429-D438 WeakPolarHBondContact CB-OD2 3.25Å; F430-D438 HydrophobicContact CD1-CB 4.15Å; F430-D438 HydrophobicContact CE1-CB 3.76Å; F430-D438 HydrophobicContact CZ-CB 4.09Å; F430-D438 PolarHBondContact N-OD2 3.37Å; L436-D438 PolarHBondContact O-N 2.82Å; D438-A442 WeakPolarHBondContact O-CB 3.37Å; D438-A442 PolarHBondContact O-N 3.37Å; D438-I661 HydrophobicContact CB-CG2 4.05Å
439	A	91.4	Very high	91.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-74.7	-40.6	176.4	0	0	0	0	0	111.7	F430 L436 S437 A442 R443 M458	F430-A439 HydrophobicContact CE1-CB 3.94Å; F430-A439 HydrophobicContact CZ-CB 4.2Å; L436-A439 PolarHBondContact O-N 3.32Å; S437-A439 VanDerWaalsContact C-N 3.27Å; S437-A439 PolarHBondContact O-N 3.24Å; A439-A442 PolarHBondContact O-N 3.13Å; A439-R443 WeakPolarHBondContact O-CB 3.28Å; A439-R443 PolarHBondContact O-N 2.95Å; A439-M458 HydrophobicContact CB-CE 3.84Å
440	A	93	Very high	91.6	Very high	51 Å²	51	49.2 Å²	49.2	42%	0.421	28%	0.279	S	S	.	.	H	α-helix	trans	-64.2	-43.6	179.4	0	0	0	0	0	112.1	L436 S437 R443 Q444	L436-A440 PolarHBondContact O-N 2.91Å; L436-A440 VanDerWaalsContact O-N 3.11Å; S437-A440 PolarHBondContact O-N 3.14Å; S437-A440 VanDerWaalsContact O-N 3.16Å; A440-R443 PolarHBondContact O-N 3.48Å; A440-Q444 PolarHBondContact O-N 3.45Å
441	L	95.1	Very high	91.5	Very high	72 Å²	72	49.6 Å²	49.6	38%	0.377	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-39.7	177.4	-68	173.1	0	0	0	111.4	V422 S437 R443 Q444 V445	V422-L441 HydrophobicContact CB-CB 4.09Å; V422-L441 HydrophobicContact CG1-CB 3.99Å; V422-L441 HydrophobicContact CG2-CB 4.37Å; S437-L441 VanDerWaalsContact O-CB 3.32Å; S437-L441 WeakPolarHBondContact O-CB 3.33Å; S437-L441 VanDerWaalsContact O-CG 3.23Å; S437-L441 WeakPolarHBondContact O-CG 3.42Å; S437-L441 PolarHBondContact O-N 3.42Å; L441-R443 VanDerWaalsContact C-N 3.28Å; L441-R443 PolarHBondContact O-N 3.07Å; L441-Q444 WeakPolarHBondContact O-CB 3.44Å; L441-Q444 PolarHBondContact O-N 2.87Å; L441-V445 WeakPolarHBondContact O-CG2 3.05Å; L441-V445 PolarHBondContact O-N 3Å
442	A	94.5	Very high	91.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-40.5	174	0	0	0	0	0	111.3	V422 D438 A439 V445 L446 A592 I661	V422-A442 HydrophobicContact CG2-CB 4.01Å; D438-A442 WeakPolarHBondContact O-CB 3.37Å; D438-A442 PolarHBondContact O-N 3.37Å; A439-A442 PolarHBondContact O-N 3.13Å; A442-V445 PolarHBondContact O-N 2.96Å; A442-L446 WeakPolarHBondContact O-CG 3.48Å; A442-L446 PolarHBondContact O-N 2.97Å; A442-A592 HydrophobicContact CB-CB 4.01Å; A442-I661 HydrophobicContact CB-CD1 3.84Å; A442-I661 HydrophobicContact CB-CG1 3.82Å
443	R	94	Very high	91.5	Very high	65 Å²	65	49.3 Å²	49.3	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-43.3	175.3	-172.4	164.1	172.2	175.2	-5.2	112.6	A439 A440 L441 V445 L446 E447 L456 E496 F498	A439-R443 WeakPolarHBondContact O-CB 3.28Å; A439-R443 PolarHBondContact O-N 2.95Å; A440-R443 PolarHBondContact O-N 3.48Å; L441-R443 VanDerWaalsContact C-N 3.28Å; L441-R443 PolarHBondContact O-N 3.07Å; R443-V445 VanDerWaalsContact C-N 3.26Å; R443-V445 PolarHBondContact O-N 3.18Å; R443-L446 PolarHBondContact O-N 3.18Å; R443-L446 VanDerWaalsContact O-N 3.08Å; R443-E447 HydrophobicContact CG-CG 4.25Å; R443-E447 IonicContact CZ-OE1 2.63Å; R443-E447 IonicContact NE-OE1 2.72Å; R443-E447 PolarHBondContact NE-OE1 3.31Å; R443-E447 IonicContact NH2-OE1 3.26Å; R443-E447 PolarHBondContact NH2-OE1 3.39Å; R443-E447 WeakPolarHBondContact O-CG 3.32Å; R443-E447 PolarHBondContact O-N 3.31Å; R443-L456 HydrophobicContact CG-CD1 4.4Å; R443-E496 WeakPolarHBondContact CD-O 3.45Å; R443-E496 PolarHBondContact NH1-O 2.86Å; R443-F498 HydrophobicContact CB-CE2 3.76Å; R443-F498 HydrophobicContact CB-CZ 3.85Å; R443-F498 HydrophobicContact CG-CE2 4.4Å; R443-F498 HydrophobicContact CG-CZ 4.42Å
444	Q	94.2	Very high	91.5	Very high	99 Å²	99	48.7 Å²	48.7	46%	0.463	28%	0.284	S	S	.	.	H	α-helix	trans	-55	-45.4	175.4	-178.3	-174.2	2.5	0	0	110.9	A440 L441 L446 E447 D448	A440-Q444 PolarHBondContact O-N 3.45Å; L441-Q444 WeakPolarHBondContact O-CB 3.44Å; L441-Q444 PolarHBondContact O-N 2.87Å; Q444-L446 VanDerWaalsContact C-N 3.31Å; Q444-L446 PolarHBondContact O-N 3.44Å; Q444-E447 PolarHBondContact O-N 3.42Å; Q444-D448 WeakPolarHBondContact O-CB 3.18Å; Q444-D448 VanDerWaalsContact O-CG 3.23Å; Q444-D448 PolarHBondContact O-N 3.08Å
445	V	94	Very high	91.9	Very high	10 Å²	10	46.6 Å²	46.6	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-58.3	-43.3	176.8	165.3	0	0	0	0	112	R420 V422 L441 A442 R443 N449 C659	R420-V445 HydrophobicContact CB-CG1 3.88Å; R420-V445 PolarHBondContact NH2-O 3.2Å; V422-V445 HydrophobicContact CG1-CG2 3.7Å; L441-V445 WeakPolarHBondContact O-CG2 3.05Å; L441-V445 PolarHBondContact O-N 3Å; A442-V445 PolarHBondContact O-N 2.96Å; R443-V445 VanDerWaalsContact C-N 3.26Å; R443-V445 PolarHBondContact O-N 3.18Å; V445-N449 WeakPolarHBondContact O-CB 3.43Å; V445-N449 PolarHBondContact O-N 2.72Å; V445-N449 VanDerWaalsContact O-N 3.15Å; V445-N449 PolarHBondContact O-ND2 2.79Å; V445-N449 PolarHBondContact O-OD1 2.71Å; V445-C659 HydrophobicContact CB-CB 4.32Å; V445-C659 HydrophobicContact CG1-CB 3.83Å
446	L	94.6	Very high	92.2	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-68	-40.6	179.1	-67.4	176.7	0	0	0	111.9	A442 R443 Q444 N449 G450 A451 L456 F498 H657 C659	A442-L446 WeakPolarHBondContact O-CG 3.48Å; A442-L446 PolarHBondContact O-N 2.97Å; R443-L446 PolarHBondContact O-N 3.18Å; R443-L446 VanDerWaalsContact O-N 3.08Å; Q444-L446 VanDerWaalsContact C-N 3.31Å; Q444-L446 PolarHBondContact O-N 3.44Å; L446-N449 PolarHBondContact O-N 3.32Å; L446-G450 PolarHBondContact O-N 3.3Å; L446-A451 HydrophobicContact CB-CB 3.98Å; L446-A451 HydrophobicContact CD2-CB 4.32Å; L446-A451 VanDerWaalsContact O-CB 3.22Å; L446-A451 WeakPolarHBondContact O-CB 3.49Å; L446-A451 PolarHBondContact O-N 3.01Å; L446-L456 HydrophobicContact CD1-CD2 4Å; L446-F498 HydrophobicContact CD1-CE1 3.73Å; L446-F498 HydrophobicContact CD1-CZ 3.99Å; L446-H657 WeakPolarHBondContact CD2-O 3.25Å; L446-C659 HydrophobicContact CD2-CB 4.28Å; L446-C659 HydrophobicContact CG-CB 4.39Å
447	E	93.7	Very high	92.5	Very high	91 Å²	91	42.5 Å²	42.5	43%	0.425	25%	0.251	S	S	.	.	H	α-helix	trans	-67	-44.3	177.2	-72.1	177.1	175.7	0	0	111.7	R443 Q444 N449 G450 T453	R443-E447 HydrophobicContact CG-CG 4.25Å; R443-E447 IonicContact CZ-OE1 2.63Å; R443-E447 IonicContact NE-OE1 2.72Å; R443-E447 PolarHBondContact NE-OE1 3.31Å; R443-E447 IonicContact NH2-OE1 3.26Å; R443-E447 PolarHBondContact NH2-OE1 3.39Å; R443-E447 WeakPolarHBondContact O-CG 3.32Å; R443-E447 PolarHBondContact O-N 3.31Å; Q444-E447 PolarHBondContact O-N 3.42Å; E447-N449 PolarHBondContact O-N 2.83Å; E447-G450 PolarHBondContact O-N 2.92Å; E447-T453 HydrophobicContact CG-CG2 3.9Å
448	D	92.8	Very high	92.6	Very high	73 Å²	73	40.5 Å²	40.5	39%	0.39	24%	0.237	S	C	.	.	H	α-helix	trans	-58	-34.8	174.1	-77.5	-9.5	0	0	0	112.4	R420 Q444 G450	R420-D448 IonicContact NH1-OD2 3.06Å; R420-D448 IonicContact NH2-OD2 2.71Å; Q444-D448 WeakPolarHBondContact O-CB 3.18Å; Q444-D448 VanDerWaalsContact O-CG 3.23Å; Q444-D448 PolarHBondContact O-N 3.08Å; D448-G450 VanDerWaalsContact C-N 3.29Å
449	N	92.1	Very high	92.7	Very high	22 Å²	22	39.3 Å²	39.3	12%	0.118	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-0.6	178.1	-66.5	-2.8	0	0	0	113	S419 R420 V445 L446 E447 A656	S419-N449 PolarHBondContact OG-ND2 3.23Å; R420-N449 PolarHBondContact NH2-OD1 2.87Å; V445-N449 WeakPolarHBondContact O-CB 3.43Å; V445-N449 PolarHBondContact O-N 2.72Å; V445-N449 VanDerWaalsContact O-N 3.15Å; V445-N449 PolarHBondContact O-ND2 2.79Å; V445-N449 PolarHBondContact O-OD1 2.71Å; L446-N449 PolarHBondContact O-N 3.32Å; E447-N449 PolarHBondContact O-N 2.83Å; N449-A656 VanDerWaalsContact CB-O 3.25Å; N449-A656 WeakPolarHBondContact CB-O 3.46Å; N449-A656 PolarHBondContact ND2-O 3.32Å
450	G	90.4	Very high	92.8	Very high	58 Å²	58	39.3 Å²	39.3	60%	0.598	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	22.6	-179.6	0	0	0	0	0	115	L446 E447 D448	L446-G450 PolarHBondContact O-N 3.3Å; E447-G450 PolarHBondContact O-N 2.92Å; D448-G450 VanDerWaalsContact C-N 3.29Å
451	A	90.5	Very high	92.8	Very high	8 Å²	8	37.2 Å²	37.2	7%	0.066	21%	0.214	C	C	.	.			trans	-66.2	142.9	177.7	0	0	0	0	0	111.6	L446 T453 H657	L446-A451 HydrophobicContact CB-CB 3.98Å; L446-A451 HydrophobicContact CD2-CB 4.32Å; L446-A451 VanDerWaalsContact O-CB 3.22Å; L446-A451 WeakPolarHBondContact O-CB 3.49Å; L446-A451 PolarHBondContact O-N 3.01Å; A451-T453 PolarHBondContact O-N 2.81Å; A451-H657 HydrophobicContact CB-CB 3.92Å
452	P	90.1	Very high	92.6	Very high	53 Å²	53	37.5 Å²	37.5	34%	0.344	22%	0.222	S	C	.	.			trans	-58.4	130.1	171.3	-22.8	32.9	0	0	0	111.3	L456 H657	P452-L456 VanDerWaalsContact O-CD2 3.28Å; P452-L456 WeakPolarHBondContact O-CD2 3.02Å; P452-H657 VanDerWaalsContact CD-CE1 3.4Å; P452-H657 WeakPolarHBondContact CD-CE1 3.48Å; P452-H657 WeakPolarHBondContact CD-ND1 3.43Å
453	T	86.9	Confident	92.4	Very high	63 Å²	63	40 Å²	40	39%	0.387	24%	0.237	S	C	.	.	S	Bend	trans	-93.7	7.6	-178.7	55.7	0	0	0	0	113.5	E447 A451	E447-T453 HydrophobicContact CG-CG2 3.9Å; A451-T453 PolarHBondContact O-N 2.81Å
454	T	88	Confident	92.3	Very high	117 Å²	117	36.9 Å²	36.9	72%	0.718	23%	0.226	S	C	*	.	S	Bend	trans	-77.5	-37.7	-173.6	49.6	0	0	0	0	113.7
455	D	91.7	Very high	92.1	Very high	40 Å²	40	32.4 Å²	32.4	21%	0.214	21%	0.205	C	C	.	.	S	Bend	trans	-140.1	65.1	-174.5	-167	6.9	0	0	0	111.4	Q457 N499 R595	D455-Q457 PolarHBondContact OD1-NE2 2.94Å; D455-N499 PolarHBondContact OD1-ND2 2.88Å; D455-R595 PolarHBondContact O-N 2.66Å; D455-R595 VanDerWaalsContact O-N 3.1Å; D455-R595 IonicContact OD1-NH1 2.93Å; D455-R595 WeakPolarHBondContact OD2-CD 3.42Å; D455-R595 IonicContact OD2-CZ 3.54Å; D455-R595 IonicContact OD2-NE 2.83Å; D455-R595 IonicContact OD2-NH1 3.69Å; D455-R595 PolarHBondContact OD2-NH1 2.8Å
456	L	94.6	Very high	91.9	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.3	177.1	-61.2	-179.5	0	0	0	111.1	R443 L446 P452 F498 N499 D594	R443-L456 HydrophobicContact CG-CD1 4.4Å; L446-L456 HydrophobicContact CD1-CD2 4Å; P452-L456 VanDerWaalsContact O-CD2 3.28Å; P452-L456 WeakPolarHBondContact O-CD2 3.02Å; L456-F498 HydrophobicContact CB-CD1 3.47Å; L456-F498 VanDerWaalsContact CB-CD1 3.47Å; L456-F498 HydrophobicContact CB-CE1 3.75Å; L456-F498 HydrophobicContact CB-CG 4.16Å; L456-F498 HydrophobicContact CD1-CD1 4.38Å; L456-F498 HydrophobicContact CD1-CE1 3.98Å; L456-F498 HydrophobicContact CD1-CZ 4.18Å; L456-F498 HydrophobicContact CG-CD1 4.49Å; L456-F498 HydrophobicContact CG-CE1 4.33Å; L456-F498 CarbonylContact O-C 3.56Å; L456-F498 WeakPolarHBondContact O-CA 3.19Å; L456-N499 PolarHBondContact O-N 3.12Å; L456-D594 HydrophobicContact CD2-CB 4.31Å
457	Q	94.9	Very high	91.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.6	-173.6	-59.2	-67.9	-26.9	0	0	108.6	A314 D455 N499 H501 A592 F593 R595	A314-Q457 HydrophobicContact CB-CB 4.2Å; A314-Q457 HydrophobicContact CB-CG 4.37Å; A314-Q457 WeakPolarHBondContact O-CG 3.34Å; D455-Q457 PolarHBondContact OD1-NE2 2.94Å; Q457-N499 PolarHBondContact NE2-ND2 2.89Å; Q457-N499 VanDerWaalsContact NE2-ND2 3.17Å; Q457-H501 PolarHBondContact OE1-CD2 2.93Å; Q457-H501 PolarHBondContact OE1-NE2 2.85Å; Q457-A592 CarbonylContact O-C 3.47Å; Q457-A592 WeakPolarHBondContact O-CA 2.94Å; Q457-F593 HydrophobicContact CB-CD2 3.91Å; Q457-F593 HydrophobicContact CB-CE2 3.66Å; Q457-F593 HydrophobicContact CB-CG 4.49Å; Q457-F593 HydrophobicContact CB-CZ 4.03Å; Q457-F593 HydrophobicContact CG-CD2 4.49Å; Q457-F593 HydrophobicContact CG-CE2 4.2Å; Q457-F593 PolarHBondContact N-O 2.82Å; Q457-F593 PolarHBondContact O-N 3.37Å; Q457-R595 HydrophobicContact CG-CB 4.07Å
458	M	95.3	Very high	91.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	114.1	175.1	-176.3	-175.5	-64.5	0	0	109.8	F430 A439 L460 F498 N499 I500 H501 M591 A592 I661	F430-M458 HydrophobicContact CE2-SD 4.43Å; F430-M458 HydrophobicContact CZ-SD 4Å; A439-M458 HydrophobicContact CB-CE 3.84Å; M458-L460 HydrophobicContact CG-CD1 4.32Å; M458-L460 HydrophobicContact CG-CD2 3.67Å; M458-L460 HydrophobicContact CG-CG 3.88Å; M458-L460 HydrophobicContact SD-CD1 3.93Å; M458-L460 HydrophobicContact SD-CD2 3.83Å; M458-L460 HydrophobicContact SD-CG 4.1Å; M458-F498 HydrophobicContact CB-CB 3.81Å; M458-F498 HydrophobicContact CB-CD1 4.02Å; M458-F498 HydrophobicContact CB-CG 4.03Å; M458-F498 HydrophobicContact CE-CB 4.23Å; M458-F498 HydrophobicContact CE-CD1 4.16Å; M458-F498 HydrophobicContact CE-CD2 3.47Å; M458-F498 VanDerWaalsContact CE-CD2 3.47Å; M458-F498 HydrophobicContact CE-CE1 4.42Å; M458-F498 HydrophobicContact CE-CE2 3.71Å; M458-F498 HydrophobicContact CE-CG 3.71Å; M458-F498 HydrophobicContact CE-CZ 4.2Å; M458-N499 PolarHBondContact N-O 2.87Å; M458-I500 HydrophobicContact CB-CD1 3.71Å; M458-I500 HydrophobicContact CG-CD1 4.14Å; M458-I500 HydrophobicContact SD-CD1 3.74Å; M458-H501 PolarHBondContact O-N 3.31Å; M458-M591 CarbonylContact C-O 3.57Å; M458-M591 WeakPolarHBondContact CA-O 3.29Å; M458-A592 HydrophobicContact CE-CB 4.35Å; M458-A592 HydrophobicContact CG-CB 4.38Å; M458-I661 HydrophobicContact CE-CD1 3.68Å; M458-I661 HydrophobicContact CG-CD1 4.26Å; M458-I661 HydrophobicContact SD-CD1 3.79Å
459	V	94.8	Very high	91.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.6	-179.9	-171.8	0	0	0	0	109.5	F311 A314 H501 V506 M591 F593	F311-V459 HydrophobicContact CD1-CB 4.01Å; F311-V459 HydrophobicContact CD1-CG1 3.94Å; F311-V459 HydrophobicContact CD1-CG2 3.74Å; F311-V459 HydrophobicContact CD2-CG1 3.81Å; F311-V459 HydrophobicContact CE1-CB 3.63Å; F311-V459 HydrophobicContact CE1-CG1 3.73Å; F311-V459 HydrophobicContact CE1-CG2 3.82Å; F311-V459 HydrophobicContact CE2-CB 4.39Å; F311-V459 HydrophobicContact CE2-CG1 3.59Å; F311-V459 HydrophobicContact CG-CG1 3.97Å; F311-V459 HydrophobicContact CG-CG2 4.33Å; F311-V459 HydrophobicContact CZ-CB 3.84Å; F311-V459 HydrophobicContact CZ-CG1 3.55Å; F311-V459 HydrophobicContact CZ-CG2 4.48Å; A314-V459 HydrophobicContact CB-CG2 3.83Å; V459-H501 WeakPolarHBondContact CA-O 3.41Å; V459-H501 HydrophobicContact CB-CB 4.46Å; V459-H501 HydrophobicContact CG1-CB 4.43Å; V459-H501 HydrophobicContact CG2-CB 4Å; V459-V506 HydrophobicContact CG1-CG2 4.27Å; V459-M591 PolarHBondContact N-O 3.1Å; V459-M591 PolarHBondContact O-N 3.07Å; V459-F593 HydrophobicContact CB-CE1 4.48Å; V459-F593 HydrophobicContact CG2-CE1 3.75Å; V459-F593 HydrophobicContact CG2-CZ 3.78Å
460	L	94.7	Very high	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.6	-171.9	-60.7	-179.7	0	0	0	111.7	F430 M458 A464 I465 L468 I500 H501 S502 S503 N590	F430-L460 HydrophobicContact CD2-CD1 4.37Å; F430-L460 HydrophobicContact CE2-CD1 3.65Å; F430-L460 HydrophobicContact CE2-CD2 4.19Å; F430-L460 HydrophobicContact CZ-CD1 4.46Å; M458-L460 HydrophobicContact CG-CD1 4.32Å; M458-L460 HydrophobicContact CG-CD2 3.67Å; M458-L460 HydrophobicContact CG-CG 3.88Å; M458-L460 HydrophobicContact SD-CD1 3.93Å; M458-L460 HydrophobicContact SD-CD2 3.83Å; M458-L460 HydrophobicContact SD-CG 4.1Å; L460-A464 HydrophobicContact CB-CB 4.07Å; L460-A464 HydrophobicContact CD2-CB 4.47Å; L460-I465 HydrophobicContact CB-CD1 3.46Å; L460-I465 VanDerWaalsContact CB-CD1 3.46Å; L460-I465 HydrophobicContact CB-CG1 4.01Å; L460-I465 HydrophobicContact CD1-CD1 3.44Å; L460-I465 VanDerWaalsContact CD1-CD1 3.44Å; L460-I465 HydrophobicContact CG-CD1 4.01Å; L460-L468 HydrophobicContact CD1-CD1 4.28Å; L460-I500 HydrophobicContact CD1-CG2 4.13Å; L460-H501 PolarHBondContact N-O 2.65Å; L460-S502 VanDerWaalsContact O-CA 3.31Å; L460-S502 WeakPolarHBondContact O-CA 3.32Å; L460-S503 PolarHBondContact O-N 2.98Å; L460-N590 HydrophobicContact CD2-CB 3.7Å
461	G	92.9	Very high	90.3	Very high	7 Å²	7	36.7 Å²	36.7	7%	0.072	23%	0.226	C	C	.	.			trans	-74.2	165.5	171.4	0	0	0	0	0	112.4	T463 A464 I465 N590	G461-T463 VanDerWaalsContact C-N 3.25Å; G461-T463 PolarHBondContact O-N 3.35Å; G461-A464 PolarHBondContact O-N 3.15Å; G461-A464 VanDerWaalsContact O-N 3.16Å; G461-I465 PolarHBondContact O-N 3.35Å; G461-N590 PolarHBondContact N-OD1 2.9Å
462	S	89.8	Confident	89.9	Confident	79 Å²	79	36.3 Å²	36.3	55%	0.552	22%	0.223	S	C	*	.	H	α-helix	trans	-58.6	-32.5	-177	59.2	0	0	0	0	114.2	A466	S462-A466 WeakPolarHBondContact O-CB 3.32Å; S462-A466 PolarHBondContact O-N 3.37Å
463	T	91.5	Very high	89	Confident	51 Å²	51	35.2 Å²	35.2	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-72	-40.5	178	52.7	0	0	0	0	112.4	G461 A466 N467	G461-T463 VanDerWaalsContact C-N 3.25Å; G461-T463 PolarHBondContact O-N 3.35Å; T463-A466 WeakPolarHBondContact O-CB 3.42Å; T463-A466 PolarHBondContact O-N 2.79Å; T463-N467 PolarHBondContact O-N 3.17Å
464	A	91.6	Very high	88.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-42	174.5	0	0	0	0	0	111.1	T428 P429 L460 G461 A466 N467 L468	T428-A464 HydrophobicContact CG2-CB 4.45Å; P429-A464 HydrophobicContact CG-CB 3.7Å; L460-A464 HydrophobicContact CB-CB 4.07Å; L460-A464 HydrophobicContact CD2-CB 4.47Å; G461-A464 PolarHBondContact O-N 3.15Å; G461-A464 VanDerWaalsContact O-N 3.16Å; A464-A466 VanDerWaalsContact C-N 3.35Å; A464-A466 PolarHBondContact O-N 2.93Å; A464-N467 WeakPolarHBondContact O-CB 3.05Å; A464-N467 PolarHBondContact O-N 3.17Å; A464-L468 PolarHBondContact O-N 3.06Å
465	I	90	Very high	87.5	Confident	5 Å²	5	30.4 Å²	30.4	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-38.2	173	-72.5	-28.3	0	0	0	112.5	L460 G461 N467 L468 R469 L492 I500 S502	L460-I465 HydrophobicContact CB-CD1 3.46Å; L460-I465 VanDerWaalsContact CB-CD1 3.46Å; L460-I465 HydrophobicContact CB-CG1 4.01Å; L460-I465 HydrophobicContact CD1-CD1 3.44Å; L460-I465 VanDerWaalsContact CD1-CD1 3.44Å; L460-I465 HydrophobicContact CG-CD1 4.01Å; G461-I465 PolarHBondContact O-N 3.35Å; I465-N467 VanDerWaalsContact C-N 3.3Å; I465-N467 PolarHBondContact O-N 3.22Å; I465-L468 PolarHBondContact O-N 2.99Å; I465-R469 HydrophobicContact CG2-CG 4.31Å; I465-R469 WeakPolarHBondContact O-CB 3.42Å; I465-R469 WeakPolarHBondContact O-CG 3.42Å; I465-R469 PolarHBondContact O-N 3.49Å; I465-L492 HydrophobicContact CB-CD1 4.33Å; I465-L492 HydrophobicContact CD1-CD1 3.29Å; I465-L492 HydrophobicContact CG1-CD1 3.86Å; I465-L492 HydrophobicContact CG2-CD1 3.88Å; I465-I500 HydrophobicContact CD1-CG2 4.02Å; I465-S502 WeakPolarHBondContact CG1-OG 3.49Å
466	A	88.7	Confident	86.1	Confident	57 Å²	57	31 Å²	31	47%	0.471	19%	0.186	S	C	.	.	H	α-helix	trans	-62	-39.3	174.2	0	0	0	0	0	111.7	S462 T463 A464 G470	S462-A466 WeakPolarHBondContact O-CB 3.32Å; S462-A466 PolarHBondContact O-N 3.37Å; T463-A466 WeakPolarHBondContact O-CB 3.42Å; T463-A466 PolarHBondContact O-N 2.79Å; A464-A466 VanDerWaalsContact C-N 3.35Å; A464-A466 PolarHBondContact O-N 2.93Å; A466-G470 WeakPolarHBondContact O-CA 3.21Å; A466-G470 PolarHBondContact O-N 3.32Å
467	N	91	Very high	84.7	Confident	21 Å²	21	35.8 Å²	35.8	11%	0.112	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-45.3	173.5	-87.9	-13	0	0	0	112	T428 P429 F430 G431 T463 A464 I465 R469 G470 K471	T428-N467 VanDerWaalsContact CG2-ND2 3.32Å; T428-N467 WeakPolarHBondContact CG2-ND2 2.99Å; T428-N467 PolarHBondContact O-ND2 2.93Å; P429-N467 WeakPolarHBondContact O-CB 3.18Å; P429-N467 PolarHBondContact O-ND2 3.3Å; F430-N467 HydrophobicContact CB-CB 4.07Å; F430-N467 WeakPolarHBondContact O-CB 3.01Å; G431-N467 WeakPolarHBondContact CA-ND2 3.41Å; T463-N467 PolarHBondContact O-N 3.17Å; A464-N467 WeakPolarHBondContact O-CB 3.05Å; A464-N467 PolarHBondContact O-N 3.17Å; I465-N467 VanDerWaalsContact C-N 3.3Å; I465-N467 PolarHBondContact O-N 3.22Å; N467-R469 VanDerWaalsContact C-N 3.32Å; N467-R469 PolarHBondContact O-N 3.34Å; N467-G470 PolarHBondContact O-N 3.02Å; N467-K471 WeakPolarHBondContact O-CB 3.23Å; N467-K471 PolarHBondContact O-N 3.4Å; N467-K471 WeakPolarHBondContact OD1-CD 3.34Å; N467-K471 WeakPolarHBondContact OD1-CE 3.42Å; N467-K471 PolarHBondContact OD1-NZ 3Å
468	L	87.7	Confident	82.9	Confident	4 Å²	4	38 Å²	38	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-43.2	177	-165.7	157.3	0	0	0	111.2	L460 A464 I465 Q472 L475 L492 L495	L460-L468 HydrophobicContact CD1-CD1 4.28Å; A464-L468 PolarHBondContact O-N 3.06Å; I465-L468 PolarHBondContact O-N 2.99Å; L468-Q472 WeakPolarHBondContact O-CB 3.37Å; L468-L475 HydrophobicContact CD2-CD1 3.58Å; L468-L475 HydrophobicContact CG-CD1 4.03Å; L468-L492 HydrophobicContact CD2-CD1 4.12Å; L468-L492 HydrophobicContact CD2-CD2 3.46Å; L468-L492 VanDerWaalsContact CD2-CD2 3.46Å; L468-L492 HydrophobicContact CD2-CG 4.38Å; L468-L495 HydrophobicContact CD1-CD2 3.96Å
469	R	85.2	Confident	81.2	Confident	114 Å²	114	46 Å²	46	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-78.3	-22	177	-68.7	177.4	178.7	169.3	-1.1	114.8	I465 N467 F476 G490 L492	I465-R469 HydrophobicContact CG2-CG 4.31Å; I465-R469 WeakPolarHBondContact O-CB 3.42Å; I465-R469 WeakPolarHBondContact O-CG 3.42Å; I465-R469 PolarHBondContact O-N 3.49Å; N467-R469 VanDerWaalsContact C-N 3.32Å; N467-R469 PolarHBondContact O-N 3.34Å; R469-F476 HydrophobicContact CB-CZ 4.45Å; R469-F476 WeakPolarHBondContact O-CE2 3.32Å; R469-F476 WeakPolarHBondContact O-CZ 3.48Å; R469-G490 PolarHBondContact NE-O 2.85Å; R469-G490 PolarHBondContact NH2-O 2.82Å; R469-L492 HydrophobicContact CG-CD2 4.05Å
470	G	83.6	Confident	79.7	Confident	61 Å²	61	51.5 Å²	51.5	63%	0.629	29%	0.289	S	S	*	.	H	α-helix	trans	-100.4	-34.9	-172.8	0	0	0	0	0	113.2	A466 N467	A466-G470 WeakPolarHBondContact O-CA 3.21Å; A466-G470 PolarHBondContact O-N 3.32Å; N467-G470 PolarHBondContact O-N 3.02Å
471	K	83.7	Confident	77.9	Confident	88 Å²	88	53.5 Å²	53.5	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-116.3	-27.2	-165	-59.7	-176.6	176.3	172	0	113.8	G431 N467 S473	G431-K471 WeakPolarHBondContact O-CD 3.25Å; G431-K471 PolarHBondContact O-NZ 2.84Å; N467-K471 WeakPolarHBondContact O-CB 3.23Å; N467-K471 PolarHBondContact O-N 3.4Å; N467-K471 WeakPolarHBondContact OD1-CD 3.34Å; N467-K471 WeakPolarHBondContact OD1-CE 3.42Å; N467-K471 PolarHBondContact OD1-NZ 3Å; K471-S473 VanDerWaalsContact C-N 3.29Å; K471-S473 PolarHBondContact O-N 2.89Å
472	Q	80.4	Confident	76.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.332	C	S	.	.			trans	-83.7	73.3	-178.9	-55.6	-54.1	-28.6	0	0	111.3	F430 V432 D435 L436 L468 V474 L475	F430-Q472 HydrophobicContact CB-CG 4.29Å; F430-Q472 PolarHBondContact O-NE2 3.2Å; V432-Q472 PolarHBondContact O-NE2 3.45Å; D435-Q472 PolarHBondContact O-NE2 3.08Å; L436-Q472 HydrophobicContact CD2-CB 4.42Å; L436-Q472 HydrophobicContact CD2-CG 3.95Å; L468-Q472 WeakPolarHBondContact O-CB 3.37Å; Q472-V474 PolarHBondContact O-N 2.85Å; Q472-L475 HydrophobicContact CB-CD1 4.1Å; Q472-L475 HydrophobicContact CB-CG 4.29Å; Q472-L475 PolarHBondContact O-N 2.88Å; Q472-L475 VanDerWaalsContact O-N 3.13Å
473	S	73	Confident	75.2	Confident	30 Å²	30	56.3 Å²	56.3	21%	0.21	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-59.3	-27.7	-177.5	42.4	0	0	0	0	115	K433 D434 K471 L475 F476 K477	K433-S473 PolarHBondContact NZ-OG 3.38Å; D434-S473 PolarHBondContact OD1-OG 2.91Å; D434-S473 PolarHBondContact OD2-OG 2.84Å; K471-S473 VanDerWaalsContact C-N 3.29Å; K471-S473 PolarHBondContact O-N 2.89Å; S473-L475 PolarHBondContact O-N 3.19Å; S473-F476 WeakPolarHBondContact O-CB 3.26Å; S473-F476 PolarHBondContact O-N 3.49Å; S473-K477 PolarHBondContact O-N 3.19Å
474	V	73.1	Confident	74.1	Confident	48 Å²	48	57.9 Å²	57.9	29%	0.291	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-55.7	-33.4	175.1	65.9	0	0	0	0	112.8	D434 L436 Q472 F476	D434-V474 PolarHBondContact OD1-N 3.15Å; L436-V474 HydrophobicContact CD1-CG1 4.44Å; Q472-V474 PolarHBondContact O-N 2.85Å; V474-F476 VanDerWaalsContact C-N 3.28Å; V474-F476 PolarHBondContact O-N 2.78Å
475	L	69.5	Low	73	Confident	32 Å²	32	62.4 Å²	62.4	17%	0.168	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-75.8	-17.1	178.8	-57.2	179.9	0	0	0	113.1	L468 Q472 S473 L486 L495	L468-L475 HydrophobicContact CD2-CD1 3.58Å; L468-L475 HydrophobicContact CG-CD1 4.03Å; Q472-L475 HydrophobicContact CB-CD1 4.1Å; Q472-L475 HydrophobicContact CB-CG 4.29Å; Q472-L475 PolarHBondContact O-N 2.88Å; Q472-L475 VanDerWaalsContact O-N 3.13Å; S473-L475 PolarHBondContact O-N 3.19Å; L475-L486 HydrophobicContact CB-CD1 4.1Å; L475-L495 HydrophobicContact CD1-CD1 4.36Å; L475-L495 HydrophobicContact CD2-CD1 3.76Å
476	F	62.7	Low	72.1	Confident	52 Å²	52	63.8 Å²	63.8	23%	0.228	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-20.5	-177.6	-69.5	-53.2	0	0	0	114.6	R469 S473 V474 V478 L487	R469-F476 HydrophobicContact CB-CZ 4.45Å; R469-F476 WeakPolarHBondContact O-CE2 3.32Å; R469-F476 WeakPolarHBondContact O-CZ 3.48Å; S473-F476 WeakPolarHBondContact O-CB 3.26Å; S473-F476 PolarHBondContact O-N 3.49Å; V474-F476 VanDerWaalsContact C-N 3.28Å; V474-F476 PolarHBondContact O-N 2.78Å; F476-V478 PolarHBondContact O-N 2.79Å; F476-L487 HydrophobicContact CB-CD2 4.04Å; F476-L487 HydrophobicContact CD1-CD2 3.3Å; F476-L487 HydrophobicContact CD1-CG 3.82Å; F476-L487 HydrophobicContact CE1-CD2 4.04Å; F476-L487 HydrophobicContact CG-CD2 3.94Å; F476-L487 WeakPolarHBondContact O-CD1 3.38Å
477	K	64.3	Low	71	Confident	102 Å²	102	65.6 Å²	65.6	44%	0.443	36%	0.362	S	S	.	.			trans	-72.6	101.9	-179.8	-70.2	172.6	175.8	177.1	0	108.2	S473 N479 E480 S481	S473-K477 PolarHBondContact O-N 3.19Å; K477-N479 PolarHBondContact O-N 3.22Å; K477-E480 HydrophobicContact CB-CB 4.08Å; K477-E480 HydrophobicContact CB-CG 4.23Å; K477-E480 HydrophobicContact CD-CG 4.23Å; K477-E480 VanDerWaalsContact CD-OE1 3.27Å; K477-E480 WeakPolarHBondContact CD-OE1 3.44Å; K477-E480 VanDerWaalsContact CD-OE2 3.23Å; K477-E480 WeakPolarHBondContact CD-OE2 3.29Å; K477-E480 IonicContact NZ-OE1 3.95Å; K477-E480 PolarHBondContact NZ-OE1 3.35Å; K477-E480 IonicContact NZ-OE2 3.65Å; K477-E480 PolarHBondContact NZ-OE2 2.92Å; K477-E480 CarbonylContact O-C 3.59Å; K477-E480 WeakPolarHBondContact O-CA 3.34Å; K477-E480 PolarHBondContact O-N 2.79Å; K477-S481 PolarHBondContact O-N 2.93Å; K477-S481 PolarHBondContact O-OG 3.28Å
478	V	57.3	Low	69.9	Low	48 Å²	48	73.6 Å²	73.6	29%	0.291	39%	0.391	S	S	.	.	H	α-helix	trans	-49.6	-36	176.6	-176.5	0	0	0	0	111.9	F476 E480 G482 E484 L487	F476-V478 PolarHBondContact O-N 2.79Å; V478-E480 VanDerWaalsContact C-N 3.25Å; V478-E480 PolarHBondContact O-N 2.89Å; V478-G482 PolarHBondContact O-N 3.24Å; V478-E484 HydrophobicContact CB-CG 4.39Å; V478-E484 HydrophobicContact CG1-CG 3.66Å; V478-E484 HydrophobicContact CG2-CG 3.77Å; V478-L487 HydrophobicContact CG2-CD1 3.73Å
479	N	60.4	Low	69.2	Low	166 Å²	166	79.5 Å²	79.5	89%	0.888	42%	0.418	S	S	*	.	H	α-helix	trans	-63.3	-26.9	176	-69.2	-1.2	0	0	0	113.8	K477	K477-N479 PolarHBondContact O-N 3.22Å
480	E	62	Low	68.4	Low	117 Å²	117	74.9 Å²	74.9	55%	0.547	41%	0.406	S	S	.	.	H	α-helix	trans	-104.3	-31.4	-179.4	-66	174	-163.2	0	0	111.8	K477 V478	K477-E480 HydrophobicContact CB-CB 4.08Å; K477-E480 HydrophobicContact CB-CG 4.23Å; K477-E480 HydrophobicContact CD-CG 4.23Å; K477-E480 VanDerWaalsContact CD-OE1 3.27Å; K477-E480 WeakPolarHBondContact CD-OE1 3.44Å; K477-E480 VanDerWaalsContact CD-OE2 3.23Å; K477-E480 WeakPolarHBondContact CD-OE2 3.29Å; K477-E480 IonicContact NZ-OE1 3.95Å; K477-E480 PolarHBondContact NZ-OE1 3.35Å; K477-E480 IonicContact NZ-OE2 3.65Å; K477-E480 PolarHBondContact NZ-OE2 2.92Å; K477-E480 CarbonylContact O-C 3.59Å; K477-E480 WeakPolarHBondContact O-CA 3.34Å; K477-E480 PolarHBondContact O-N 2.79Å; V478-E480 VanDerWaalsContact C-N 3.25Å; V478-E480 PolarHBondContact O-N 2.89Å
481	S	58	Low	67.8	Low	41 Å²	41	75.1 Å²	75.1	29%	0.287	40%	0.395	S	S	.	.	H	α-helix	trans	-90.2	-17.5	-176.7	70.5	0	0	0	0	114.8	K477 T483	K477-S481 PolarHBondContact O-N 2.93Å; K477-S481 PolarHBondContact O-OG 3.28Å; S481-T483 PolarHBondContact O-N 2.73Å; S481-T483 VanDerWaalsContact O-N 3.08Å; S481-T483 PolarHBondContact OG-O 3.26Å; S481-T483 VanDerWaalsContact OG-O 3.12Å
482	G	63.3	Low	67.4	Low	66 Å²	66	72 Å²	72	68%	0.68	38%	0.383	S	S	*	.	S	Bend	trans	70.9	-5.2	179	0	0	0	0	0	115.9	V478	V478-G482 PolarHBondContact O-N 3.24Å
483	T	62.4	Low	67.5	Low	79 Å²	79	74.1 Å²	74.1	49%	0.485	41%	0.405	S	S	.	.			trans	-145	143.1	179.2	62.9	0	0	0	0	112.2	S481 Q485	S481-T483 PolarHBondContact O-N 2.73Å; S481-T483 VanDerWaalsContact O-N 3.08Å; S481-T483 PolarHBondContact OG-O 3.26Å; S481-T483 VanDerWaalsContact OG-O 3.12Å; T483-Q485 VanDerWaalsContact C-N 3.35Å
484	E	68.6	Low	68.1	Low	85 Å²	85	80.3 Å²	80.3	40%	0.397	42%	0.423	S	S	.	.	S	Bend	trans	-89.6	1.6	178.6	-56.7	-172.4	156.9	0	0	113.3	V478 L486 L487 R488	V478-E484 HydrophobicContact CB-CG 4.39Å; V478-E484 HydrophobicContact CG1-CG 3.66Å; V478-E484 HydrophobicContact CG2-CG 3.77Å; E484-L486 PolarHBondContact O-N 3.14Å; E484-L487 WeakPolarHBondContact O-CB 3.49Å; E484-L487 PolarHBondContact O-N 3.47Å; E484-L487 VanDerWaalsContact O-N 3.08Å; E484-R488 HydrophobicContact CB-CG 4.49Å; E484-R488 PolarHBondContact O-N 3.17Å; E484-R488 IonicContact OE2-CZ 2.83Å; E484-R488 IonicContact OE2-NE 3.27Å; E484-R488 PolarHBondContact OE2-NE 2.81Å; E484-R488 IonicContact OE2-NH2 2.79Å; E484-R488 PolarHBondContact OE2-NH2 3.34Å
485	Q	68.7	Low	68.7	Low	95 Å²	95	78.8 Å²	78.8	44%	0.444	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-38.1	-168.7	-165.7	177.9	0.1	0	0	112.8	T483 L487 R488 E489 G490 V491	T483-Q485 VanDerWaalsContact C-N 3.35Å; Q485-L487 VanDerWaalsContact C-N 3.29Å; Q485-L487 PolarHBondContact O-N 3.31Å; Q485-R488 PolarHBondContact O-N 2.7Å; Q485-E489 HydrophobicContact CG-CB 4.31Å; Q485-E489 HydrophobicContact CG-CG 4.32Å; Q485-E489 VanDerWaalsContact CG-OE2 3.23Å; Q485-E489 WeakPolarHBondContact CG-OE2 3.39Å; Q485-E489 PolarHBondContact NE2-OE2 3.19Å; Q485-E489 WeakPolarHBondContact O-CB 3.38Å; Q485-E489 PolarHBondContact O-N 3.46Å; Q485-G490 PolarHBondContact O-N 3.45Å; Q485-V491 HydrophobicContact CG-CB 4.39Å
486	L	70.2	Confident	69.4	Low	33 Å²	33	82 Å²	82	17%	0.173	43%	0.427	C	S	.	.	H	α-helix	trans	-58.5	-40.6	173.6	-79.7	167.5	0	0	0	112.4	L475 E484 G490 V491 L492	L475-L486 HydrophobicContact CB-CD1 4.1Å; E484-L486 PolarHBondContact O-N 3.14Å; L486-G490 WeakPolarHBondContact O-CA 3.44Å; L486-G490 PolarHBondContact O-N 3.13Å; L486-G490 VanDerWaalsContact O-N 3.13Å; L486-V491 WeakPolarHBondContact CD2-O 3.4Å; L486-L492 HydrophobicContact CD2-CD2 3.47Å; L486-L492 VanDerWaalsContact CD2-CD2 3.47Å
487	L	65.4	Low	70.5	Confident	96 Å²	96	80 Å²	80	50%	0.503	42%	0.422	S	S	.	.	H	α-helix	trans	-72.6	-41.4	180	-74.7	168.6	0	0	0	112.1	F476 V478 E484 Q485	F476-L487 HydrophobicContact CB-CD2 4.04Å; F476-L487 HydrophobicContact CD1-CD2 3.3Å; F476-L487 HydrophobicContact CD1-CG 3.82Å; F476-L487 HydrophobicContact CE1-CD2 4.04Å; F476-L487 HydrophobicContact CG-CD2 3.94Å; F476-L487 WeakPolarHBondContact O-CD1 3.38Å; V478-L487 HydrophobicContact CG2-CD1 3.73Å; E484-L487 WeakPolarHBondContact O-CB 3.49Å; E484-L487 PolarHBondContact O-N 3.47Å; E484-L487 VanDerWaalsContact O-N 3.08Å; Q485-L487 VanDerWaalsContact C-N 3.29Å; Q485-L487 PolarHBondContact O-N 3.31Å
488	R	69	Low	71.9	Confident	189 Å²	189	75.1 Å²	75.1	71%	0.713	40%	0.401	S	S	*	.	H	α-helix	trans	-86	-39.2	-172.3	-65.9	-177.4	-174.6	-94.9	2.5	113.3	E484 Q485	E484-R488 HydrophobicContact CB-CG 4.49Å; E484-R488 PolarHBondContact O-N 3.17Å; E484-R488 IonicContact OE2-CZ 2.83Å; E484-R488 IonicContact OE2-NE 3.27Å; E484-R488 PolarHBondContact OE2-NE 2.81Å; E484-R488 IonicContact OE2-NH2 2.79Å; E484-R488 PolarHBondContact OE2-NH2 3.34Å; Q485-R488 PolarHBondContact O-N 2.7Å
489	E	72.3	Confident	73.5	Confident	127 Å²	127	75.3 Å²	75.3	59%	0.593	40%	0.4	S	S	*	.	H	α-helix	trans	-114.2	-13.6	-172.7	-57.8	180	172.9	0	0	112.7	Q485 V491	Q485-E489 HydrophobicContact CG-CB 4.31Å; Q485-E489 HydrophobicContact CG-CG 4.32Å; Q485-E489 VanDerWaalsContact CG-OE2 3.23Å; Q485-E489 WeakPolarHBondContact CG-OE2 3.39Å; Q485-E489 PolarHBondContact NE2-OE2 3.19Å; Q485-E489 WeakPolarHBondContact O-CB 3.38Å; Q485-E489 PolarHBondContact O-N 3.46Å; E489-V491 HydrophobicContact CB-CG2 3.76Å; E489-V491 PolarHBondContact O-N 3.29Å
490	G	69.4	Low	75	Confident	17 Å²	17	68.1 Å²	68.1	18%	0.175	36%	0.361	C	S	.	.			trans	68.1	11.8	-176.1	0	0	0	0	0	114.2	R469 Q485 L486 L492	R469-G490 PolarHBondContact NE-O 2.85Å; R469-G490 PolarHBondContact NH2-O 2.82Å; Q485-G490 PolarHBondContact O-N 3.45Å; L486-G490 WeakPolarHBondContact O-CA 3.44Å; L486-G490 PolarHBondContact O-N 3.13Å; L486-G490 VanDerWaalsContact O-N 3.13Å; G490-L492 PolarHBondContact O-N 2.83Å
491	V	71.2	Confident	76.4	Confident	67 Å²	67	64.5 Å²	64.5	41%	0.406	34%	0.344	S	S	.	.			trans	-72.9	115.2	-178.5	176.4	0	0	0	0	109.6	Q485 L486 E489 G493	Q485-V491 HydrophobicContact CG-CB 4.39Å; L486-V491 WeakPolarHBondContact CD2-O 3.4Å; E489-V491 HydrophobicContact CB-CG2 3.76Å; E489-V491 PolarHBondContact O-N 3.29Å; V491-G493 PolarHBondContact O-N 3.24Å
492	L	73.6	Confident	77.9	Confident	23 Å²	23	63.4 Å²	63.4	12%	0.12	34%	0.336	C	S	.	.			trans	-81.5	108.6	175.7	-55.9	-176.7	0	0	0	108.5	I465 L468 R469 L486 G490 I500	I465-L492 HydrophobicContact CB-CD1 4.33Å; I465-L492 HydrophobicContact CD1-CD1 3.29Å; I465-L492 HydrophobicContact CG1-CD1 3.86Å; I465-L492 HydrophobicContact CG2-CD1 3.88Å; L468-L492 HydrophobicContact CD2-CD1 4.12Å; L468-L492 HydrophobicContact CD2-CD2 3.46Å; L468-L492 VanDerWaalsContact CD2-CD2 3.46Å; L468-L492 HydrophobicContact CD2-CG 4.38Å; R469-L492 HydrophobicContact CG-CD2 4.05Å; L486-L492 HydrophobicContact CD2-CD2 3.47Å; L486-L492 VanDerWaalsContact CD2-CD2 3.47Å; G490-L492 PolarHBondContact O-N 2.83Å; L492-I500 HydrophobicContact CB-CB 3.91Å; L492-I500 HydrophobicContact CB-CG2 3.79Å; L492-I500 HydrophobicContact CD1-CG2 3.78Å; L492-I500 HydrophobicContact CG-CG2 4.47Å
493	G	83.1	Confident	79.2	Confident	44 Å²	44	60.3 Å²	60.3	45%	0.454	30%	0.304	S	S	.	.			trans	-81.2	-133.3	177.9	0	0	0	0	0	112.2	V491 I500	V491-G493 PolarHBondContact O-N 3.24Å; G493-I500 WeakPolarHBondContact O-CB 3.24Å; G493-I500 PolarHBondContact O-N 3.3Å; G493-I500 VanDerWaalsContact O-N 3.1Å
494	R	84.8	Confident	80.4	Confident	160 Å²	160	59.4 Å²	59.4	60%	0.604	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.5	178.4	-163.9	179.4	-176.7	-160.7	-0.6	111.1	G497 F498	R494-G497 PolarHBondContact NE-O 2.98Å; R494-G497 PolarHBondContact NH2-O 2.92Å; R494-F498 CarbonylContact C-O 3.53Å; R494-F498 WeakPolarHBondContact CA-O 3.5Å; R494-F498 WeakPolarHBondContact CG-O 3.45Å
495	L	86.1	Confident	81.3	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	125.6	177.8	178.7	66.3	0	0	0	110	L436 L468 L475 G497 F498 I500	L436-L495 HydrophobicContact CD1-CD1 3.93Å; L436-L495 HydrophobicContact CD2-CD2 4.37Å; L468-L495 HydrophobicContact CD1-CD2 3.96Å; L475-L495 HydrophobicContact CD1-CD1 4.36Å; L475-L495 HydrophobicContact CD2-CD1 3.76Å; L495-G497 PolarHBondContact O-N 3.33Å; L495-F498 PolarHBondContact N-O 3.4Å; L495-F498 WeakPolarHBondContact O-CB 3.2Å; L495-F498 PolarHBondContact O-N 3.2Å; L495-I500 HydrophobicContact CB-CD1 4.01Å; L495-I500 HydrophobicContact CB-CG1 3.87Å
496	E	85	Confident	82.4	Confident	99 Å²	99	52.2 Å²	52.2	46%	0.463	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	33.5	179	-64.6	-59.8	155.8	0	0	114.1	R443	R443-E496 WeakPolarHBondContact CD-O 3.45Å; R443-E496 PolarHBondContact NH1-O 2.86Å
497	G	86.1	Confident	83.5	Confident	11 Å²	11	54 Å²	54	11%	0.113	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	-17.4	-177.7	0	0	0	0	0	115.3	R494 L495	R494-G497 PolarHBondContact NE-O 2.98Å; R494-G497 PolarHBondContact NH2-O 2.92Å; L495-G497 PolarHBondContact O-N 3.33Å
498	F	92	Very high	84.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.7	178.9	-62.5	-83.4	0	0	0	112.8	R443 L446 L456 M458 R494 L495 I500 A592	R443-F498 HydrophobicContact CB-CE2 3.76Å; R443-F498 HydrophobicContact CB-CZ 3.85Å; R443-F498 HydrophobicContact CG-CE2 4.4Å; R443-F498 HydrophobicContact CG-CZ 4.42Å; L446-F498 HydrophobicContact CD1-CE1 3.73Å; L446-F498 HydrophobicContact CD1-CZ 3.99Å; L456-F498 HydrophobicContact CB-CD1 3.47Å; L456-F498 VanDerWaalsContact CB-CD1 3.47Å; L456-F498 HydrophobicContact CB-CE1 3.75Å; L456-F498 HydrophobicContact CB-CG 4.16Å; L456-F498 HydrophobicContact CD1-CD1 4.38Å; L456-F498 HydrophobicContact CD1-CE1 3.98Å; L456-F498 HydrophobicContact CD1-CZ 4.18Å; L456-F498 HydrophobicContact CG-CD1 4.49Å; L456-F498 HydrophobicContact CG-CE1 4.33Å; L456-F498 CarbonylContact O-C 3.56Å; L456-F498 WeakPolarHBondContact O-CA 3.19Å; M458-F498 HydrophobicContact CB-CB 3.81Å; M458-F498 HydrophobicContact CB-CD1 4.02Å; M458-F498 HydrophobicContact CB-CG 4.03Å; M458-F498 HydrophobicContact CE-CB 4.23Å; M458-F498 HydrophobicContact CE-CD1 4.16Å; M458-F498 HydrophobicContact CE-CD2 3.47Å; M458-F498 VanDerWaalsContact CE-CD2 3.47Å; M458-F498 HydrophobicContact CE-CE1 4.42Å; M458-F498 HydrophobicContact CE-CE2 3.71Å; M458-F498 HydrophobicContact CE-CG 3.71Å; M458-F498 HydrophobicContact CE-CZ 4.2Å; R494-F498 CarbonylContact C-O 3.53Å; R494-F498 WeakPolarHBondContact CA-O 3.5Å; R494-F498 WeakPolarHBondContact CG-O 3.45Å; L495-F498 PolarHBondContact N-O 3.4Å; L495-F498 WeakPolarHBondContact O-CB 3.2Å; L495-F498 PolarHBondContact O-N 3.2Å; F498-I500 HydrophobicContact CB-CD1 3.99Å; F498-I500 PolarHBondContact O-N 2.84Å; F498-A592 HydrophobicContact CD1-CB 4.45Å; F498-A592 HydrophobicContact CE1-CB 3.84Å; F498-A592 HydrophobicContact CZ-CB 4.23Å
499	N	91.2	Very high	86	Confident	51 Å²	51	49 Å²	49	27%	0.273	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	119.2	162.5	-64.9	-44	0	0	0	108.7	D455 L456 Q457 M458 H501	D455-N499 PolarHBondContact OD1-ND2 2.88Å; L456-N499 PolarHBondContact O-N 3.12Å; Q457-N499 PolarHBondContact NE2-ND2 2.89Å; Q457-N499 VanDerWaalsContact NE2-ND2 3.17Å; M458-N499 PolarHBondContact N-O 2.87Å; N499-H501 PolarHBondContact O-CD2 3.33Å
500	I	91.8	Very high	87	Confident	15 Å²	15	47.2 Å²	47.2	8%	0.077	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.5	-175.7	-55.1	-53.7	0	0	0	109.9	M458 L460 I465 L492 G493 L495 F498	M458-I500 HydrophobicContact CB-CD1 3.71Å; M458-I500 HydrophobicContact CG-CD1 4.14Å; M458-I500 HydrophobicContact SD-CD1 3.74Å; L460-I500 HydrophobicContact CD1-CG2 4.13Å; I465-I500 HydrophobicContact CD1-CG2 4.02Å; L492-I500 HydrophobicContact CB-CB 3.91Å; L492-I500 HydrophobicContact CB-CG2 3.79Å; L492-I500 HydrophobicContact CD1-CG2 3.78Å; L492-I500 HydrophobicContact CG-CG2 4.47Å; G493-I500 WeakPolarHBondContact O-CB 3.24Å; G493-I500 PolarHBondContact O-N 3.3Å; G493-I500 VanDerWaalsContact O-N 3.1Å; L495-I500 HydrophobicContact CB-CD1 4.01Å; L495-I500 HydrophobicContact CB-CG1 3.87Å; F498-I500 HydrophobicContact CB-CD1 3.99Å; F498-I500 PolarHBondContact O-N 2.84Å
501	H	91.5	Very high	88	Confident	42 Å²	42	54.1 Å²	54.1	19%	0.194	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	149.1	172.3	-68.6	-83.1	0	0	0	109.3	Q457 M458 V459 L460 N499	Q457-H501 PolarHBondContact OE1-CD2 2.93Å; Q457-H501 PolarHBondContact OE1-NE2 2.85Å; M458-H501 PolarHBondContact O-N 3.31Å; V459-H501 WeakPolarHBondContact CA-O 3.41Å; V459-H501 HydrophobicContact CB-CB 4.46Å; V459-H501 HydrophobicContact CG1-CB 4.43Å; V459-H501 HydrophobicContact CG2-CB 4Å; L460-H501 PolarHBondContact N-O 2.65Å; N499-H501 PolarHBondContact O-CD2 3.33Å
502	S	90.1	Very high	89	Confident	17 Å²	17	52.2 Å²	52.2	12%	0.119	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139	173.1	-160.3	0	0	0	0	107.2	Q308 G310 L460 I465	Q308-S502 VanDerWaalsContact CG-O 3.26Å; Q308-S502 WeakPolarHBondContact CG-O 3.35Å; Q308-S502 PolarHBondContact NE2-OG 3.3Å; Q308-S502 PolarHBondContact OE1-OG 2.98Å; G310-S502 VanDerWaalsContact CA-O 3.23Å; G310-S502 WeakPolarHBondContact CA-O 3.4Å; G310-S502 PolarHBondContact N-O 3.17Å; L460-S502 VanDerWaalsContact O-CA 3.31Å; L460-S502 WeakPolarHBondContact O-CA 3.32Å; I465-S502 WeakPolarHBondContact CG1-OG 3.49Å
503	S	90.8	Very high	89.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.007	30%	0.3	C	S	.	.			trans	-144.4	141.2	178.5	178.5	0	0	0	0	112.2	Q308 F311 E408 L460 G505	Q308-S503 VanDerWaalsContact O-CA 3.32Å; Q308-S503 WeakPolarHBondContact O-CA 3.46Å; F311-S503 WeakPolarHBondContact CD2-OG 3.03Å; E408-S503 WeakPolarHBondContact OE2-CB 3.45Å; E408-S503 PolarHBondContact OE2-OG 2.72Å; L460-S503 PolarHBondContact O-N 2.98Å; S503-G505 VanDerWaalsContact C-N 3.26Å; S503-G505 PolarHBondContact OG-N 3.15Å
504	A	87.3	Confident	90.3	Very high	60 Å²	60	53.9 Å²	53.9	50%	0.496	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-15.5	167	0	0	0	0	0	112.6	E307 Q308 V506	E307-A504 HydrophobicContact CB-CB 4.21Å; Q308-A504 PolarHBondContact O-N 2.86Å; A504-V506 PolarHBondContact O-N 2.91Å
505	G	87.2	Confident	90.8	Very high	12 Å²	12	50.5 Å²	50.5	12%	0.124	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.9	179	0	0	0	0	0	114.5	S503 K507	S503-G505 VanDerWaalsContact C-N 3.26Å; S503-G505 PolarHBondContact OG-N 3.15Å; G505-K507 PolarHBondContact O-N 3.15Å
506	V	92.9	Very high	91.2	Very high	17 Å²	17	51.9 Å²	51.9	10%	0.103	30%	0.299	C	S	.	.			trans	-58.1	119.6	177.8	175.7	0	0	0	0	109.9	F311 V459 A504 T588 A589	F311-V506 HydrophobicContact CE2-CG2 3.84Å; F311-V506 HydrophobicContact CZ-CG2 4.07Å; V459-V506 HydrophobicContact CG1-CG2 4.27Å; A504-V506 PolarHBondContact O-N 2.91Å; V506-T588 HydrophobicContact CG1-CG2 3.64Å; V506-A589 WeakPolarHBondContact CG1-O 3.46Å
507	K	93.8	Very high	91.7	Very high	70 Å²	70	48 Å²	48	30%	0.304	28%	0.28	S	S	.	.			trans	-75.5	153.1	-174.4	-66.8	-64.9	-176.6	-174.1	0	112.1	A409 G412 Y415 G505 A589	A409-K507 WeakPolarHBondContact O-CE 3.35Å; A409-K507 PolarHBondContact O-NZ 3Å; A409-K507 VanDerWaalsContact O-NZ 3.07Å; G412-K507 WeakPolarHBondContact O-CG 3.38Å; Y415-K507 HydrophobicContact CD1-CB 3.95Å; Y415-K507 HydrophobicContact CD1-CG 4.09Å; Y415-K507 HydrophobicContact CE1-CB 4.05Å; Y415-K507 HydrophobicContact CE1-CG 4.3Å; G505-K507 PolarHBondContact O-N 3.15Å; K507-A589 PolarHBondContact O-N 3.2Å
508	R	93.4	Very high	92.3	Very high	177 Å²	177	49.6 Å²	49.6	67%	0.668	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.5	166.9	-65.1	177.9	-175.8	-97.8	1.6	107.9	F587	R508-F587 CarbonylContact C-O 3.52Å; R508-F587 WeakPolarHBondContact CA-O 3.41Å
509	A	93.1	Very high	92.5	Very high	3 Å²	3	49.6 Å²	49.6	3%	0.025	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.6	174.2	0	0	0	0	0	108.9	Y415 A586 F587	Y415-A509 HydrophobicContact CE2-CB 4.43Å; A509-A586 WeakPolarHBondContact O-CA 3.27Å; A509-F587 HydrophobicContact CB-CD1 4.03Å; A509-F587 HydrophobicContact CB-CD2 4.08Å; A509-F587 HydrophobicContact CB-CE1 3.59Å; A509-F587 HydrophobicContact CB-CE2 3.67Å; A509-F587 HydrophobicContact CB-CG 4.25Å; A509-F587 HydrophobicContact CB-CZ 3.4Å; A509-F587 PolarHBondContact N-O 2.9Å; A509-F587 PolarHBondContact O-N 3.33Å; A509-F587 VanDerWaalsContact O-N 3.15Å
510	P	92.7	Very high	92.7	Very high	91 Å²	91	50.9 Å²	50.9	59%	0.591	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-72.2	154.4	176.2	31.7	-34.8	0	0	0	110.5	V512 Q543	P510-V512 PolarHBondContact O-N 3.06Å; P510-Q543 PolarHBondContact O-NE2 3.16Å
511	K	90.8	Very high	92.8	Very high	161 Å²	161	51.3 Å²	51.3	70%	0.7	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-64.7	130.8	168.4	180	174.9	-179.7	176.3	0	109.3	A586	K511-A586 HydrophobicContact CB-CB 4.04Å
512	V	92.6	Very high	93	Very high	28 Å²	28	55.3 Å²	55.3	17%	0.17	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-94.7	155.9	170.3	-63.7	0	0	0	0	111.1	P510 A514 Q543 V583	P510-V512 PolarHBondContact O-N 3.06Å; V512-A514 HydrophobicContact CG2-CB 4.02Å; V512-A514 PolarHBondContact O-N 3.46Å; V512-Q543 HydrophobicContact CG1-CG 3.98Å; V512-Q543 HydrophobicContact CG2-CG 4.02Å; V512-V583 HydrophobicContact CG2-CB 4.47Å; V512-V583 HydrophobicContact CG2-CG1 3.57Å
513	A	91	Very high	93.2	Very high	90 Å²	90	55.9 Å²	55.9	74%	0.744	32%	0.319	S	S	*	.			trans	-84.7	10.5	-180	0	0	0	0	0	113.7	T515	A513-T515 PolarHBondContact O-N 3.08Å
514	A	93	Very high	93.3	Very high	11 Å²	11	60.3 Å²	60.3	9%	0.091	34%	0.339	C	S	.	.			trans	-65.7	125.8	-179.9	0	0	0	0	0	111.2	V512 Y517 S536 I539 V583	V512-A514 HydrophobicContact CG2-CB 4.02Å; V512-A514 PolarHBondContact O-N 3.46Å; A514-Y517 HydrophobicContact CB-CD2 4.38Å; A514-Y517 HydrophobicContact CB-CE2 3.88Å; A514-S536 VanDerWaalsContact CA-O 3.29Å; A514-S536 WeakPolarHBondContact CA-O 3.41Å; A514-I539 HydrophobicContact CB-CG1 3.78Å; A514-V583 HydrophobicContact CB-CG2 3.88Å
515	T	94.4	Very high	93.6	Very high	89 Å²	89	62.5 Å²	62.5	55%	0.546	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-152.2	151.1	-178	-172.1	0	0	0	0	111.9	A513 G535 S536	A513-T515 PolarHBondContact O-N 3.08Å; T515-G535 VanDerWaalsContact O-CA 3.32Å; T515-G535 WeakPolarHBondContact O-CA 3.44Å; T515-S536 WeakPolarHBondContact CG2-OG 3.41Å; T515-S536 PolarHBondContact N-O 3.43Å; T515-S536 PolarHBondContact O-N 3.45Å
516	G	94.2	Very high	93.8	Very high	45 Å²	45	63.8 Å²	63.8	46%	0.464	35%	0.352	S	S	.	.			trans	76.4	19.5	172.2	0	0	0	0	0	115.2	T534 G535	G516-T534 CarbonylContact O-C 3.58Å; G516-T534 PolarHBondContact O-OG1 2.96Å; G516-G535 WeakPolarHBondContact O-CA 3.49Å; G516-G535 PolarHBondContact O-N 3Å
517	Y	96.5	Very high	93.9	Very high	18 Å²	18	65.8 Å²	65.8	7%	0.071	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.1	175.4	-75.4	-79.6	0	0	0	111.2	A514 I532 D533 G537 I539 I581	A514-Y517 HydrophobicContact CB-CD2 4.38Å; A514-Y517 HydrophobicContact CB-CE2 3.88Å; Y517-I532 HydrophobicContact CD1-CB 4.12Å; Y517-I532 HydrophobicContact CD1-CD1 3.67Å; Y517-I532 HydrophobicContact CD1-CG1 4.19Å; Y517-I532 HydrophobicContact CE1-CD1 3.71Å; Y517-I532 HydrophobicContact CE1-CG1 4.41Å; Y517-I532 HydrophobicContact CG-CD1 4.39Å; Y517-D533 WeakPolarHBondContact CA-O 3.31Å; Y517-D533 WeakPolarHBondContact CD1-O 3.46Å; Y517-G537 PolarHBondContact OH-O 3.48Å; Y517-I539 HydrophobicContact CD2-CD1 3.92Å; Y517-I539 HydrophobicContact CD2-CG1 4.22Å; Y517-I539 HydrophobicContact CE2-CD1 4.16Å; Y517-I539 HydrophobicContact CE2-CG1 4Å; Y517-I539 HydrophobicContact CG-CD1 4.25Å; Y517-I581 WeakPolarHBondContact O-CB 3.49Å; Y517-I581 PolarHBondContact O-N 3.42Å
518	L	97.2	Very high	93.9	Very high	44 Å²	44	64.7 Å²	64.7	23%	0.23	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	156.1	169.9	-59.8	-179.2	0	0	0	109.9	I532 D533 T534 D578 T579 A580	L518-I532 VanDerWaalsContact O-CA 3.31Å; L518-I532 WeakPolarHBondContact O-CA 3.22Å; L518-D533 PolarHBondContact N-O 3.37Å; L518-D533 VanDerWaalsContact N-O 3.14Å; L518-D533 PolarHBondContact O-N 3.41Å; L518-D533 VanDerWaalsContact O-N 3.15Å; L518-T534 HydrophobicContact CD1-CG2 4.16Å; L518-T534 VanDerWaalsContact CG-OG1 3.31Å; L518-T534 WeakPolarHBondContact CG-OG1 3.44Å; L518-T534 PolarHBondContact N-OG1 2.99Å; L518-D578 HydrophobicContact CD1-CB 4.3Å; L518-T579 WeakPolarHBondContact CA-O 3.38Å; L518-A580 HydrophobicContact CD2-CB 3.92Å
519	V	96.9	Very high	94	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.8	168.7	178.2	0	0	0	0	108.2	G521 K523 I530 F547 L575 D578 T579 I581	V519-G521 VanDerWaalsContact CG1-O 3.31Å; V519-G521 WeakPolarHBondContact CG1-O 3.43Å; V519-K523 HydrophobicContact CG1-CG 3.85Å; V519-I530 HydrophobicContact CG1-CG2 4.13Å; V519-I530 HydrophobicContact CG2-CG2 4.12Å; V519-F547 HydrophobicContact CG2-CD1 3.71Å; V519-F547 HydrophobicContact CG2-CE1 3.75Å; V519-L575 HydrophobicContact CG2-CD1 4.06Å; V519-D578 PolarHBondContact O-N 3.14Å; V519-T579 WeakPolarHBondContact CG2-O 3.42Å; V519-T579 PolarHBondContact N-O 2.88Å; V519-I581 HydrophobicContact CG2-CD1 3.83Å; V519-I581 HydrophobicContact CG2-CG1 3.86Å
520	N	96.1	Very high	94.2	Very high	77 Å²	77	60.6 Å²	60.6	41%	0.412	35%	0.351	S	S	.	.			trans	-98.9	103.7	178.7	-175	-25.4	0	0	0	110.5	S531 D533	N520-S531 PolarHBondContact N-O 2.85Å; N520-S531 WeakPolarHBondContact O-CB 3.43Å; N520-D533 HydrophobicContact CB-CB 4.32Å; N520-D533 WeakPolarHBondContact CB-OD2 3.2Å; N520-D533 VanDerWaalsContact CG-OD2 3.25Å; N520-D533 PolarHBondContact ND2-OD2 3.39Å
521	G	94.3	Very high	94.4	Very high	24 Å²	24	58.1 Å²	58.1	25%	0.247	34%	0.337	C	S	.	.	S	Bend	trans	86.9	155.1	-175	0	0	0	0	0	113.5	V519 D577	V519-G521 VanDerWaalsContact CG1-O 3.31Å; V519-G521 WeakPolarHBondContact CG1-O 3.43Å; G521-D577 WeakPolarHBondContact CA-OD1 3.49Å; G521-D577 PolarHBondContact N-OD1 3.4Å
522	E	94.5	Very high	94.6	Very high	126 Å²	126	50.6 Å²	50.6	59%	0.589	30%	0.304	S	S	*	.			trans	-60.2	139.5	176.5	-170.4	-177.7	176.2	0	0	111.7	K524	E522-K524 WeakPolarHBondContact OE1-CE 3.45Å; E522-K524 IonicContact OE1-NZ 3.55Å; E522-K524 PolarHBondContact OE1-NZ 3.38Å
523	K	94.7	Very high	94.7	Very high	29 Å²	29	51.6 Å²	51.6	13%	0.126	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-126.6	146.2	176.8	-59.5	-67.1	175.5	169.1	0	110.7	V519 D527 L529 I530 S531 L571 D574 L575	V519-K523 HydrophobicContact CG1-CG 3.85Å; K523-D527 WeakPolarHBondContact CA-OD2 3.26Å; K523-L529 PolarHBondContact NZ-O 2.72Å; K523-I530 HydrophobicContact CB-CD1 4.32Å; K523-I530 HydrophobicContact CD-CD1 4.23Å; K523-I530 HydrophobicContact CG-CD1 4.06Å; K523-S531 PolarHBondContact NZ-OG 2.94Å; K523-L571 HydrophobicContact CB-CD1 3.77Å; K523-D574 WeakPolarHBondContact O-CA 3.49Å; K523-L575 HydrophobicContact CB-CB 4.31Å; K523-L575 PolarHBondContact N-O 3.45Å; K523-L575 PolarHBondContact O-N 3.21Å
524	K	93.8	Very high	94.7	Very high	94 Å²	94	51.9 Å²	51.9	41%	0.409	30%	0.301	S	S	.	.			trans	-104.9	156.9	-178.1	-64.1	-54.3	-167.9	-175.3	0	112.1	E522 G526 D527 D574	E522-K524 WeakPolarHBondContact OE1-CE 3.45Å; E522-K524 IonicContact OE1-NZ 3.55Å; E522-K524 PolarHBondContact OE1-NZ 3.38Å; K524-G526 PolarHBondContact O-N 3.32Å; K524-D527 PolarHBondContact N-OD2 2.79Å; K524-D527 VanDerWaalsContact O-CB 3.25Å; K524-D527 WeakPolarHBondContact O-CB 3.41Å; K524-D527 PolarHBondContact O-N 3.17Å; K524-D574 WeakPolarHBondContact CA-OD1 3.4Å; K524-D574 HydrophobicContact CD-CB 4.49Å; K524-D574 VanDerWaalsContact CD-CG 3.49Å; K524-D574 WeakPolarHBondContact CD-OD2 3.35Å; K524-D574 IonicContact NZ-OD2 2.66Å; K524-D574 PolarHBondContact NZ-OD2 3.36Å
525	E	92.7	Very high	94.6	Very high	106 Å²	106	52.6 Å²	52.6	50%	0.495	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	135.7	168.1	-174.9	177.1	-173.9	0	0	110.5	D527 L571 R572 D574	E525-D527 VanDerWaalsContact C-N 3.32Å; E525-L571 WeakPolarHBondContact CG-O 3.33Å; E525-R572 IonicContact OE1-CZ 2.81Å; E525-R572 IonicContact OE1-NH1 2.72Å; E525-R572 PolarHBondContact OE1-NH1 2.98Å; E525-D574 PolarHBondContact N-OD1 2.9Å
526	G	91.3	Very high	94.5	Very high	39 Å²	39	51.6 Å²	51.6	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-8.8	-175	0	0	0	0	0	115	K524 V528 L571	K524-G526 PolarHBondContact O-N 3.32Å; G526-V528 PolarHBondContact O-N 3.14Å; G526-L571 PolarHBondContact N-O 3.31Å
527	D	94.1	Very high	94.4	Very high	60 Å²	60	51.6 Å²	51.6	32%	0.321	31%	0.306	S	S	.	.			trans	-65.2	129.9	174.6	-79.3	-19	0	0	0	110.7	K523 K524 E525 I530 G570 L571	K523-D527 WeakPolarHBondContact CA-OD2 3.26Å; K524-D527 PolarHBondContact N-OD2 2.79Å; K524-D527 VanDerWaalsContact O-CB 3.25Å; K524-D527 WeakPolarHBondContact O-CB 3.41Å; K524-D527 PolarHBondContact O-N 3.17Å; E525-D527 VanDerWaalsContact C-N 3.32Å; D527-I530 HydrophobicContact CB-CD1 4.16Å; D527-G570 WeakPolarHBondContact O-CA 3.29Å; D527-L571 HydrophobicContact CB-CD1 4.27Å; D527-L571 PolarHBondContact O-N 2.91Å
528	V	94.2	Very high	94.2	Very high	46 Å²	46	55.3 Å²	55.3	28%	0.279	33%	0.334	S	S	.	.			trans	-100.8	-25.9	178.7	-172.7	0	0	0	0	111.3	G526 T565 L566	G526-V528 PolarHBondContact O-N 3.14Å; V528-T565 HydrophobicContact CG1-CG2 3.88Å; V528-T565 CarbonylContact O-C 3.6Å; V528-T565 WeakPolarHBondContact O-CA 3.47Å; V528-L566 WeakPolarHBondContact CG1-O 3.31Å; V528-L566 PolarHBondContact O-N 2.97Å
529	L	96.1	Very high	94	Very high	94 Å²	94	53.8 Å²	53.8	49%	0.492	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	102.7	-177.2	-64.3	-178.9	0	0	0	110.6	K523 L563 T565	K523-L529 PolarHBondContact NZ-O 2.72Å; L529-L563 HydrophobicContact CB-CD1 4.05Å; L529-L563 HydrophobicContact CD2-CD2 4.16Å; L529-T565 HydrophobicContact CD2-CG2 3.98Å; L529-T565 WeakPolarHBondContact CD2-OG1 3.41Å
530	I	96.8	Very high	93.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	109.7	-177.6	-46.5	-54.6	0	0	0	108.8	V519 K523 D527 I532 F547 L563 I564 L566 L571	V519-I530 HydrophobicContact CG1-CG2 4.13Å; V519-I530 HydrophobicContact CG2-CG2 4.12Å; K523-I530 HydrophobicContact CB-CD1 4.32Å; K523-I530 HydrophobicContact CD-CD1 4.23Å; K523-I530 HydrophobicContact CG-CD1 4.06Å; D527-I530 HydrophobicContact CB-CD1 4.16Å; I530-I532 HydrophobicContact CG2-CG2 4.39Å; I530-F547 HydrophobicContact CG1-CZ 4.35Å; I530-F547 HydrophobicContact CG2-CE1 4.08Å; I530-F547 HydrophobicContact CG2-CZ 4.23Å; I530-L563 WeakPolarHBondContact O-CD1 3.46Å; I530-I564 HydrophobicContact CB-CD1 4.24Å; I530-I564 HydrophobicContact CB-CG1 3.73Å; I530-I564 HydrophobicContact CG1-CG1 4.45Å; I530-I564 HydrophobicContact CG2-CG1 4.4Å; I530-I564 PolarHBondContact N-O 3.15Å; I530-I564 PolarHBondContact O-N 3.4Å; I530-L566 HydrophobicContact CD1-CD1 4.38Å; I530-L566 HydrophobicContact CG1-CD1 3.85Å; I530-L566 HydrophobicContact CG1-CG 3.96Å; I530-L571 HydrophobicContact CD1-CD1 3.54Å; I530-L571 HydrophobicContact CD1-CD2 4.38Å; I530-L571 HydrophobicContact CD1-CG 3.87Å
531	S	96.7	Very high	93.6	Very high	40 Å²	40	55.1 Å²	55.1	28%	0.28	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.5	173.9	-52.5	0	0	0	0	108.7	N520 K523	N520-S531 PolarHBondContact N-O 2.85Å; N520-S531 WeakPolarHBondContact O-CB 3.43Å; K523-S531 PolarHBondContact NZ-OG 2.94Å
532	I	95.9	Very high	93.5	Very high	3 Å²	3	54 Å²	54	2%	0.015	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.2	-175.9	60.3	165.7	0	0	0	111	Y517 L518 I530 I539 N562 I564 I581	Y517-I532 HydrophobicContact CD1-CB 4.12Å; Y517-I532 HydrophobicContact CD1-CD1 3.67Å; Y517-I532 HydrophobicContact CD1-CG1 4.19Å; Y517-I532 HydrophobicContact CE1-CD1 3.71Å; Y517-I532 HydrophobicContact CE1-CG1 4.41Å; Y517-I532 HydrophobicContact CG-CD1 4.39Å; L518-I532 VanDerWaalsContact O-CA 3.31Å; L518-I532 WeakPolarHBondContact O-CA 3.22Å; I530-I532 HydrophobicContact CG2-CG2 4.39Å; I532-I539 HydrophobicContact CD1-CD1 4.06Å; I532-N562 PolarHBondContact N-O 3.33Å; I532-I564 HydrophobicContact CD1-CG2 3.68Å; I532-I564 HydrophobicContact CG1-CG2 4.48Å; I532-I564 HydrophobicContact CG2-CD1 4.05Å; I532-I564 HydrophobicContact CG2-CG1 4Å; I532-I581 HydrophobicContact CB-CD1 4.23Å; I532-I581 HydrophobicContact CG2-CD1 3.31Å
533	D	94.9	Very high	93.6	Very high	49 Å²	49	48.1 Å²	48.1	26%	0.262	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	-169.3	175.2	61.6	9.8	0	0	0	111.9	Y517 L518 N520 G535	Y517-D533 WeakPolarHBondContact CA-O 3.31Å; Y517-D533 WeakPolarHBondContact CD1-O 3.46Å; L518-D533 PolarHBondContact N-O 3.37Å; L518-D533 VanDerWaalsContact N-O 3.14Å; L518-D533 PolarHBondContact O-N 3.41Å; L518-D533 VanDerWaalsContact O-N 3.15Å; N520-D533 HydrophobicContact CB-CB 4.32Å; N520-D533 WeakPolarHBondContact CB-OD2 3.2Å; N520-D533 VanDerWaalsContact CG-OD2 3.25Å; N520-D533 PolarHBondContact ND2-OD2 3.39Å; D533-G535 PolarHBondContact O-N 3.5Å
534	T	90.9	Very high	93.6	Very high	96 Å²	96	46.8 Å²	46.8	59%	0.589	30%	0.3	S	S	*	.	S	Bend	trans	57.2	-16.1	178.3	68.4	0	0	0	0	118.2	G516 L518	G516-T534 CarbonylContact O-C 3.58Å; G516-T534 PolarHBondContact O-OG1 2.96Å; L518-T534 HydrophobicContact CD1-CG2 4.16Å; L518-T534 VanDerWaalsContact CG-OG1 3.31Å; L518-T534 WeakPolarHBondContact CG-OG1 3.44Å; L518-T534 PolarHBondContact N-OG1 2.99Å
535	G	90.8	Very high	93.8	Very high	25 Å²	25	42.3 Å²	42.3	26%	0.258	28%	0.28	S	S	.	.			trans	-78.8	165.1	-174.3	0	0	0	0	0	114.3	T515 G516 D533	T515-G535 VanDerWaalsContact O-CA 3.32Å; T515-G535 WeakPolarHBondContact O-CA 3.44Å; G516-G535 WeakPolarHBondContact O-CA 3.49Å; G516-G535 PolarHBondContact O-N 3Å; D533-G535 PolarHBondContact O-N 3.5Å
536	S	92.1	Very high	94	Very high	69 Å²	69	38.9 Å²	38.9	48%	0.483	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-122.7	154.2	173.8	61.8	0	0	0	0	110	A514 T515	A514-S536 VanDerWaalsContact CA-O 3.29Å; A514-S536 WeakPolarHBondContact CA-O 3.41Å; T515-S536 WeakPolarHBondContact CG2-OG 3.41Å; T515-S536 PolarHBondContact N-O 3.43Å; T515-S536 PolarHBondContact O-N 3.45Å
537	G	92.2	Very high	94.3	Very high	45 Å²	45	37.2 Å²	37.2	46%	0.464	25%	0.248	S	C	.	.	S	Bend	trans	89	-160.8	-172.5	0	0	0	0	0	112	Y517	Y517-G537 PolarHBondContact OH-O 3.48Å
538	S	91.6	Very high	94.4	Very high	95 Å²	95	37.4 Å²	37.4	66%	0.664	26%	0.258	S	S	*	.			trans	-139.1	129.1	176.2	-56.7	0	0	0	0	109.5
539	I	93	Very high	94.4	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.067	28%	0.281	C	S	.	.			trans	-79.3	130.1	166.1	-57.3	178.8	0	0	0	106.7	A514 Y517 I532 Q543 V545 V556 A559 I564 V583	A514-I539 HydrophobicContact CB-CG1 3.78Å; Y517-I539 HydrophobicContact CD2-CD1 3.92Å; Y517-I539 HydrophobicContact CD2-CG1 4.22Å; Y517-I539 HydrophobicContact CE2-CD1 4.16Å; Y517-I539 HydrophobicContact CE2-CG1 4Å; Y517-I539 HydrophobicContact CG-CD1 4.25Å; I532-I539 HydrophobicContact CD1-CD1 4.06Å; I539-Q543 HydrophobicContact CG2-CB 4.28Å; I539-V545 HydrophobicContact CD1-CG1 4.45Å; I539-V556 HydrophobicContact CG2-CG1 4.18Å; I539-V556 HydrophobicContact CG2-CG2 4.14Å; I539-A559 HydrophobicContact CB-CB 4.38Å; I539-A559 HydrophobicContact CG2-CB 4.31Å; I539-A559 WeakPolarHBondContact O-CB 3.15Å; I539-I564 HydrophobicContact CB-CG2 4.28Å; I539-I564 HydrophobicContact CD1-CG2 4.05Å; I539-I564 HydrophobicContact CG2-CG2 4.11Å; I539-V583 HydrophobicContact CD1-CG2 4.01Å; I539-V583 HydrophobicContact CG1-CG2 4Å
540	S	92.5	Very high	94.3	Very high	53 Å²	53	34.8 Å²	34.8	37%	0.371	26%	0.26	S	S	.	.			trans	-109.9	159.8	176.8	55.9	0	0	0	0	111.2	Q543	S540-Q543 WeakPolarHBondContact O-CB 3.41Å; S540-Q543 VanDerWaalsContact O-CG 3.28Å; S540-Q543 WeakPolarHBondContact O-CG 3.49Å; S540-Q543 PolarHBondContact O-N 3.5Å; S540-Q543 WeakPolarHBondContact OG-CG 3.5Å
541	A	91.9	Very high	94.2	Very high	51 Å²	51	40.2 Å²	40.2	42%	0.421	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	140.6	172.1	0	0	0	0	0	110.9	Q543 A557	A541-Q543 VanDerWaalsContact C-N 3.31Å; A541-A557 WeakPolarHBondContact CB-O 3.41Å
542	G	92.6	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	3.2	-175.3	0	0	0	0	0	114.7	Y415 F416 V556 F587	Y415-G542 WeakPolarHBondContact CE2-O 3.5Å; Y415-G542 PolarHBondContact OH-O 3.37Å; F416-G542 VanDerWaalsContact CB-CA 3.43Å; G542-V556 PolarHBondContact N-O 3.19Å; G542-F587 WeakPolarHBondContact O-CZ 3.41Å
543	Q	96.2	Very high	94.1	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.019	30%	0.299	C	S	.	.			trans	-76.6	160.5	165.5	-62.9	-58.5	-48.3	0	0	110.3	P510 V512 I539 S540 A541 V556 V583	P510-Q543 PolarHBondContact O-NE2 3.16Å; V512-Q543 HydrophobicContact CG1-CG 3.98Å; V512-Q543 HydrophobicContact CG2-CG 4.02Å; I539-Q543 HydrophobicContact CG2-CB 4.28Å; S540-Q543 WeakPolarHBondContact O-CB 3.41Å; S540-Q543 VanDerWaalsContact O-CG 3.28Å; S540-Q543 WeakPolarHBondContact O-CG 3.49Å; S540-Q543 PolarHBondContact O-N 3.5Å; S540-Q543 WeakPolarHBondContact OG-CG 3.5Å; A541-Q543 VanDerWaalsContact C-N 3.31Å; Q543-V556 WeakPolarHBondContact O-CB 3.45Å; Q543-V556 PolarHBondContact O-N 3.38Å; Q543-V583 HydrophobicContact CB-CG1 4.18Å
544	I	96.2	Very high	94.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.9	176.1	-62	165.4	0	0	0	108	A421 Q553 Y554 V555 V583 V584 F587 L660 L662	A421-I544 HydrophobicContact CB-CD1 3.63Å; A421-I544 HydrophobicContact CB-CG1 4.37Å; A421-I544 HydrophobicContact CB-CG2 4.28Å; I544-Q553 HydrophobicContact CG2-CB 3.73Å; I544-Y554 CarbonylContact C-O 3.47Å; I544-Y554 VanDerWaalsContact CA-O 3.27Å; I544-Y554 WeakPolarHBondContact CA-O 3.36Å; I544-Y554 WeakPolarHBondContact CG2-O 3.38Å; I544-V555 HydrophobicContact CG1-CG2 4.35Å; I544-V583 WeakPolarHBondContact O-CA 3.32Å; I544-V584 HydrophobicContact CB-CB 3.92Å; I544-V584 HydrophobicContact CB-CG2 3.93Å; I544-V584 HydrophobicContact CG2-CB 4.15Å; I544-V584 HydrophobicContact CG2-CG2 3.59Å; I544-V584 PolarHBondContact O-N 3.44Å; I544-F587 HydrophobicContact CB-CE1 4.46Å; I544-F587 HydrophobicContact CD1-CD1 4.08Å; I544-F587 HydrophobicContact CD1-CD2 4.29Å; I544-F587 HydrophobicContact CD1-CE1 3.61Å; I544-F587 HydrophobicContact CD1-CE2 3.81Å; I544-F587 HydrophobicContact CD1-CG 4.43Å; I544-F587 HydrophobicContact CD1-CZ 3.44Å; I544-F587 VanDerWaalsContact CD1-CZ 3.44Å; I544-F587 HydrophobicContact CG1-CE1 3.94Å; I544-F587 HydrophobicContact CG1-CZ 3.79Å; I544-L660 HydrophobicContact CD1-CD1 4.23Å; I544-L662 HydrophobicContact CD1-CD1 4.04Å; I544-L662 HydrophobicContact CD1-CD2 3.26Å; I544-L662 HydrophobicContact CD1-CG 4.24Å
545	V	96.3	Very high	94.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.9	177.5	-63.8	0	0	0	0	110.4	I539 F547 Y554 V556 I564 L566 I581 T582 V583	I539-V545 HydrophobicContact CD1-CG1 4.45Å; V545-F547 HydrophobicContact CG2-CE2 4.16Å; V545-F547 HydrophobicContact CG2-CZ 4.05Å; V545-Y554 PolarHBondContact N-O 2.92Å; V545-Y554 PolarHBondContact O-N 2.84Å; V545-V556 HydrophobicContact CB-CG2 4.4Å; V545-V556 HydrophobicContact CG1-CG2 3.71Å; V545-V556 HydrophobicContact CG2-CG2 3.89Å; V545-I564 HydrophobicContact CG1-CD1 4.49Å; V545-I564 HydrophobicContact CG2-CD1 4.14Å; V545-L566 HydrophobicContact CG2-CD2 3.93Å; V545-I581 HydrophobicContact CB-CG2 3.93Å; V545-I581 HydrophobicContact CG1-CG2 4.03Å; V545-T582 CarbonylContact C-O 3.58Å; V545-T582 WeakPolarHBondContact CA-O 3.38Å; V545-V583 HydrophobicContact CG1-CG2 4.25Å
546	T	97.1	Very high	94.8	Very high	34 Å²	34	33.5 Å²	33.5	21%	0.209	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	149	170.7	51.3	0	0	0	0	108.3	Q553 I581 T582 V584	T546-Q553 HydrophobicContact CG2-CB 4.16Å; T546-Q553 HydrophobicContact CG2-CG 3.72Å; T546-I581 WeakPolarHBondContact O-CA 3.44Å; T546-T582 PolarHBondContact N-O 3.26Å; T546-T582 PolarHBondContact O-N 2.94Å; T546-T582 WeakPolarHBondContact OG1-CB 3.39Å; T546-T582 PolarHBondContact OG1-O 3.07Å; T546-T582 VanDerWaalsContact OG1-O 3.12Å; T546-V584 HydrophobicContact CG2-CG2 4.17Å
547	F	97.4	Very high	94.9	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.2	178	-59.3	-79.8	0	0	0	109	V519 I530 V545 G549 D550 Y554 I564 L566 L571 L575 T579 I581	V519-F547 HydrophobicContact CG2-CD1 3.71Å; V519-F547 HydrophobicContact CG2-CE1 3.75Å; I530-F547 HydrophobicContact CG1-CZ 4.35Å; I530-F547 HydrophobicContact CG2-CE1 4.08Å; I530-F547 HydrophobicContact CG2-CZ 4.23Å; V545-F547 HydrophobicContact CG2-CE2 4.16Å; V545-F547 HydrophobicContact CG2-CZ 4.05Å; F547-G549 PolarHBondContact O-N 3.45Å; F547-D550 HydrophobicContact CB-CB 4.24Å; F547-D550 PolarHBondContact O-N 3.16Å; F547-Y554 AromaticContact CD2-CD2 3.68Å; F547-Y554 HydrophobicContact CD2-CD2 3.68Å; F547-Y554 AromaticContact CD2-CE2 3.71Å; F547-Y554 HydrophobicContact CD2-CE2 3.71Å; F547-Y554 AromaticContact CE2-CD2 3.6Å; F547-Y554 HydrophobicContact CE2-CD2 3.6Å; F547-Y554 AromaticContact CE2-CE2 3.98Å; F547-Y554 HydrophobicContact CE2-CE2 3.98Å; F547-Y554 HydrophobicContact CE2-CG 4.27Å; F547-I564 HydrophobicContact CZ-CD1 4.36Å; F547-L566 HydrophobicContact CE2-CD1 4.21Å; F547-L566 HydrophobicContact CZ-CD1 4.43Å; F547-L571 HydrophobicContact CD2-CD2 3.94Å; F547-L571 HydrophobicContact CE2-CD2 3.57Å; F547-L571 HydrophobicContact CZ-CD2 4.22Å; F547-L575 HydrophobicContact CB-CD1 3.99Å; F547-L575 HydrophobicContact CB-CD2 3.66Å; F547-L575 HydrophobicContact CD1-CD1 3.44Å; F547-L575 VanDerWaalsContact CD1-CD1 3.44Å; F547-L575 HydrophobicContact CD2-CD1 3.77Å; F547-L575 HydrophobicContact CE1-CD1 3.76Å; F547-L575 HydrophobicContact CE2-CD1 4.07Å; F547-L575 HydrophobicContact CG-CD1 3.45Å; F547-L575 VanDerWaalsContact CG-CD1 3.45Å; F547-L575 HydrophobicContact CG-CD2 4.07Å; F547-L575 HydrophobicContact CG-CG 4.43Å; F547-L575 HydrophobicContact CZ-CD1 4.07Å; F547-T579 HydrophobicContact CB-CG2 4.14Å; F547-I581 HydrophobicContact CD1-CD1 4.42Å; F547-I581 HydrophobicContact CD1-CG1 3.82Å; F547-I581 HydrophobicContact CE1-CD1 3.86Å; F547-I581 HydrophobicContact CE1-CG1 3.75Å; F547-I581 HydrophobicContact CE1-CG2 4.24Å
548	A	96.4	Very high	94.9	Very high	64 Å²	64	31.6 Å²	31.6	53%	0.529	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	124.4	-179.2	0	0	0	0	0	111.2	T579 A580	A548-T579 HydrophobicContact CB-CG2 4.14Å; A548-A580 HydrophobicContact CB-CB 4.1Å; A548-A580 PolarHBondContact N-O 2.89Å
549	G	94.1	Very high	95	Very high	73 Å²	73	28.6 Å²	28.6	75%	0.753	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.7	-8.8	-177.7	0	0	0	0	0	115.1	F547	F547-G549 PolarHBondContact O-N 3.45Å
550	D	95	Very high	95	Very high	12 Å²	12	32.4 Å²	32.4	6%	0.064	24%	0.235	C	C	.	.			trans	-103.5	122	174.1	-173	-13.5	0	0	0	110.1	F547 N552 Y554	F547-D550 HydrophobicContact CB-CB 4.24Å; F547-D550 PolarHBondContact O-N 3.16Å; D550-N552 PolarHBondContact O-N 3.23Å; D550-N552 VanDerWaalsContact OD1-CB 3.25Å; D550-N552 WeakPolarHBondContact OD1-CB 3.29Å; D550-N552 PolarHBondContact OD1-N 3.16Å; D550-N552 PolarHBondContact OD1-ND2 3.43Å; D550-Y554 WeakPolarHBondContact OD2-CE2 3.44Å; D550-Y554 VanDerWaalsContact OD2-CZ 3.28Å; D550-Y554 PolarHBondContact OD2-OH 3.21Å
551	P	93.5	Very high	94.9	Very high	114 Å²	114	34.7 Å²	34.7	74%	0.74	25%	0.251	S	S	*	.			trans	-72.1	-13.3	177.3	30.4	-36.3	0	0	0	114
552	N	95.5	Very high	94.9	Very high	37 Å²	37	37.8 Å²	37.8	20%	0.198	26%	0.26	C	S	.	.			trans	-77.2	142.8	-177.1	-64.1	-79.9	0	0	0	112.1	R420 D550 Y554	R420-N552 PolarHBondContact NH1-OD1 3Å; D550-N552 PolarHBondContact O-N 3.23Å; D550-N552 VanDerWaalsContact OD1-CB 3.25Å; D550-N552 WeakPolarHBondContact OD1-CB 3.29Å; D550-N552 PolarHBondContact OD1-N 3.16Å; D550-N552 PolarHBondContact OD1-ND2 3.43Å; N552-Y554 HydrophobicContact CB-CD2 4.43Å; N552-Y554 HydrophobicContact CB-CE1 4.23Å; N552-Y554 HydrophobicContact CB-CE2 3.66Å
553	Q	96.7	Very high	95.1	Very high	35 Å²	35	40.2 Å²	40.2	16%	0.164	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.7	172.5	-52.4	-178.4	60	0	0	109.3	R420 A421 G423 I544 T546 L662	R420-Q553 CarbonylContact C-O 3.43Å; R420-Q553 WeakPolarHBondContact CA-O 3.49Å; R420-Q553 WeakPolarHBondContact CB-O 3.31Å; A421-Q553 HydrophobicContact CB-CB 4.09Å; A421-Q553 PolarHBondContact N-O 3.33Å; A421-Q553 WeakPolarHBondContact O-CB 3.39Å; G423-Q553 PolarHBondContact O-NE2 3.17Å; I544-Q553 HydrophobicContact CG2-CB 3.73Å; T546-Q553 HydrophobicContact CG2-CB 4.16Å; T546-Q553 HydrophobicContact CG2-CG 3.72Å; Q553-L662 VanDerWaalsContact OE1-CD1 3.24Å
554	Y	97.2	Very high	95.1	Very high	1 Å²	1	40 Å²	40	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.5	-173.1	-59.5	-87.1	0	0	0	111.4	R420 I544 V545 F547 D550 N552 L566 G570 L571 R572	R420-Y554 HydrophobicContact CG-CD1 4.17Å; R420-Y554 HydrophobicContact CG-CE1 4.46Å; I544-Y554 CarbonylContact C-O 3.47Å; I544-Y554 VanDerWaalsContact CA-O 3.27Å; I544-Y554 WeakPolarHBondContact CA-O 3.36Å; I544-Y554 WeakPolarHBondContact CG2-O 3.38Å; V545-Y554 PolarHBondContact N-O 2.92Å; V545-Y554 PolarHBondContact O-N 2.84Å; F547-Y554 AromaticContact CD2-CD2 3.68Å; F547-Y554 HydrophobicContact CD2-CD2 3.68Å; F547-Y554 AromaticContact CD2-CE2 3.71Å; F547-Y554 HydrophobicContact CD2-CE2 3.71Å; F547-Y554 AromaticContact CE2-CD2 3.6Å; F547-Y554 HydrophobicContact CE2-CD2 3.6Å; F547-Y554 AromaticContact CE2-CE2 3.98Å; F547-Y554 HydrophobicContact CE2-CE2 3.98Å; F547-Y554 HydrophobicContact CE2-CG 4.27Å; D550-Y554 WeakPolarHBondContact OD2-CE2 3.44Å; D550-Y554 VanDerWaalsContact OD2-CZ 3.28Å; D550-Y554 PolarHBondContact OD2-OH 3.21Å; N552-Y554 HydrophobicContact CB-CD2 4.43Å; N552-Y554 HydrophobicContact CB-CE1 4.23Å; N552-Y554 HydrophobicContact CB-CE2 3.66Å; Y554-L566 HydrophobicContact CD1-CD1 4.09Å; Y554-L566 HydrophobicContact CG-CD1 4.09Å; Y554-G570 WeakPolarHBondContact CE1-O 3.37Å; Y554-L571 HydrophobicContact CE1-CD2 4.35Å; Y554-L571 HydrophobicContact CE2-CD2 4.18Å; Y554-R572 HydrophobicContact CE1-CG 4.34Å; Y554-R572 WeakPolarHBondContact OH-CB 3.35Å; Y554-R572 PolarHBondContact OH-N 3.19Å
555	V	96.6	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.3	175.4	-177	0	0	0	0	109.1	F416 A418 S419 I544 A557 A567 L660	F416-V555 WeakPolarHBondContact O-CG1 3.28Å; A418-V555 WeakPolarHBondContact O-CB 3.42Å; A418-V555 WeakPolarHBondContact O-CG2 3.46Å; S419-V555 PolarHBondContact O-N 3.47Å; I544-V555 HydrophobicContact CG1-CG2 4.35Å; V555-A557 PolarHBondContact O-N 3.47Å; V555-A567 PolarHBondContact O-N 3.19Å; V555-L660 HydrophobicContact CG2-CD1 3.77Å; V555-L660 HydrophobicContact CG2-CG 4.21Å
556	V	96.1	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	108.7	176	-179.9	0	0	0	0	109	I539 G542 Q543 V545 A558 A559 I564 T565 L566	I539-V556 HydrophobicContact CG2-CG1 4.18Å; I539-V556 HydrophobicContact CG2-CG2 4.14Å; G542-V556 PolarHBondContact N-O 3.19Å; Q543-V556 WeakPolarHBondContact O-CB 3.45Å; Q543-V556 PolarHBondContact O-N 3.38Å; V545-V556 HydrophobicContact CB-CG2 4.4Å; V545-V556 HydrophobicContact CG1-CG2 3.71Å; V545-V556 HydrophobicContact CG2-CG2 3.89Å; V556-A558 WeakPolarHBondContact CG1-O 3.39Å; V556-A559 HydrophobicContact CG1-CB 4.05Å; V556-I564 HydrophobicContact CG1-CB 4.21Å; V556-I564 HydrophobicContact CG1-CG2 4.41Å; V556-T565 CarbonylContact C-O 3.58Å; V556-L566 HydrophobicContact CG2-CD2 4.47Å
557	A	93.8	Very high	94.9	Very high	30 Å²	30	40.5 Å²	40.5	25%	0.248	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-37	178.1	0	0	0	0	0	112.2	A541 V555 T565 A567	A541-A557 WeakPolarHBondContact CB-O 3.41Å; V555-A557 PolarHBondContact O-N 3.47Å; A557-T565 PolarHBondContact N-O 2.97Å; A557-A567 HydrophobicContact CB-CB 4.3Å
558	A	93.7	Very high	94.6	Very high	44 Å²	44	42.3 Å²	42.3	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157.1	174.8	0	0	0	0	0	110.6	V556 T565	V556-A558 WeakPolarHBondContact CG1-O 3.39Å; A558-T565 PolarHBondContact N-O 3.22Å; A558-T565 PolarHBondContact O-N 3.16Å
559	A	93.8	Very high	94.3	Very high	32 Å²	32	41.3 Å²	41.3	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	143.9	177.7	0	0	0	0	0	111	I539 V556 I564	I539-A559 HydrophobicContact CB-CB 4.38Å; I539-A559 HydrophobicContact CG2-CB 4.31Å; I539-A559 WeakPolarHBondContact O-CB 3.15Å; V556-A559 HydrophobicContact CG1-CB 4.05Å; A559-I564 HydrophobicContact CB-CG2 4.07Å
560	T	92.8	Very high	94.3	Very high	92 Å²	92	37.9 Å²	37.9	56%	0.564	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	179	168.2	69.1	0	0	0	0	108.5	N562 L563	T560-N562 PolarHBondContact O-N 3.04Å; T560-L563 PolarHBondContact N-O 3.47Å; T560-L563 WeakPolarHBondContact OG1-CB 3.44Å; T560-L563 PolarHBondContact OG1-N 3.18Å; T560-L563 PolarHBondContact OG1-O 3.01Å
561	S	89.6	Confident	94.3	Very high	101 Å²	101	37.4 Å²	37.4	71%	0.706	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.7	-177.4	-52.6	0	0	0	0	114.5
562	N	93.4	Very high	94.2	Very high	117 Å²	117	35.9 Å²	35.9	63%	0.626	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.5	4.2	-172.5	-57.6	-3.4	0	0	0	113.3	I532 T560	I532-N562 PolarHBondContact N-O 3.33Å; T560-N562 PolarHBondContact O-N 3.04Å
563	L	95.3	Very high	94.2	Very high	50 Å²	50	38.4 Å²	38.4	26%	0.262	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	129.3	-173.8	-178.3	74.2	0	0	0	110.4	L529 I530 T560	L529-L563 HydrophobicContact CB-CD1 4.05Å; L529-L563 HydrophobicContact CD2-CD2 4.16Å; I530-L563 WeakPolarHBondContact O-CD1 3.46Å; T560-L563 PolarHBondContact N-O 3.47Å; T560-L563 WeakPolarHBondContact OG1-CB 3.44Å; T560-L563 PolarHBondContact OG1-N 3.18Å; T560-L563 PolarHBondContact OG1-O 3.01Å
564	I	96.4	Very high	94.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.1	165.7	62.4	-179.5	0	0	0	109.5	I530 I532 I539 V545 F547 V556 A559 L566	I530-I564 HydrophobicContact CB-CD1 4.24Å; I530-I564 HydrophobicContact CB-CG1 3.73Å; I530-I564 HydrophobicContact CG1-CG1 4.45Å; I530-I564 HydrophobicContact CG2-CG1 4.4Å; I530-I564 PolarHBondContact N-O 3.15Å; I530-I564 PolarHBondContact O-N 3.4Å; I532-I564 HydrophobicContact CD1-CG2 3.68Å; I532-I564 HydrophobicContact CG1-CG2 4.48Å; I532-I564 HydrophobicContact CG2-CD1 4.05Å; I532-I564 HydrophobicContact CG2-CG1 4Å; I539-I564 HydrophobicContact CB-CG2 4.28Å; I539-I564 HydrophobicContact CD1-CG2 4.05Å; I539-I564 HydrophobicContact CG2-CG2 4.11Å; V545-I564 HydrophobicContact CG1-CD1 4.49Å; V545-I564 HydrophobicContact CG2-CD1 4.14Å; F547-I564 HydrophobicContact CZ-CD1 4.36Å; V556-I564 HydrophobicContact CG1-CB 4.21Å; V556-I564 HydrophobicContact CG1-CG2 4.41Å; A559-I564 HydrophobicContact CB-CG2 4.07Å; I564-L566 HydrophobicContact CD1-CD2 4.3Å
565	T	96.4	Very high	94	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.239	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.4	172.9	-55.5	0	0	0	0	107.4	V528 L529 V556 A557 A558	V528-T565 HydrophobicContact CG1-CG2 3.88Å; V528-T565 CarbonylContact O-C 3.6Å; V528-T565 WeakPolarHBondContact O-CA 3.47Å; L529-T565 HydrophobicContact CD2-CG2 3.98Å; L529-T565 WeakPolarHBondContact CD2-OG1 3.41Å; V556-T565 CarbonylContact C-O 3.58Å; A557-T565 PolarHBondContact N-O 2.97Å; A558-T565 PolarHBondContact N-O 3.22Å; A558-T565 PolarHBondContact O-N 3.16Å
566	L	95.7	Very high	93.9	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	158.9	172.8	-56.2	-175.4	0	0	0	109.8	V528 I530 V545 F547 Y554 V556 I564 L571	V528-L566 WeakPolarHBondContact CG1-O 3.31Å; V528-L566 PolarHBondContact O-N 2.97Å; I530-L566 HydrophobicContact CD1-CD1 4.38Å; I530-L566 HydrophobicContact CG1-CD1 3.85Å; I530-L566 HydrophobicContact CG1-CG 3.96Å; V545-L566 HydrophobicContact CG2-CD2 3.93Å; F547-L566 HydrophobicContact CE2-CD1 4.21Å; F547-L566 HydrophobicContact CZ-CD1 4.43Å; Y554-L566 HydrophobicContact CD1-CD1 4.09Å; Y554-L566 HydrophobicContact CG-CD1 4.09Å; V556-L566 HydrophobicContact CG2-CD2 4.47Å; I564-L566 HydrophobicContact CD1-CD2 4.3Å; L566-L571 HydrophobicContact CD1-CD2 3.67Å; L566-L571 HydrophobicContact CD1-CG 4.04Å
567	A	93.2	Very high	93.9	Very high	4 Å²	4	47.4 Å²	47.4	3%	0.033	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-72.1	145.3	166.7	0	0	0	0	0	110.3	A418 V555 A557 G570 P655	A418-A567 WeakPolarHBondContact O-CB 3.3Å; V555-A567 PolarHBondContact O-N 3.19Å; A557-A567 HydrophobicContact CB-CB 4.3Å; A567-G570 PolarHBondContact O-N 3.32Å; A567-P655 HydrophobicContact CB-CB 4.22Å
568	A	90.8	Very high	94	Very high	42 Å²	42	50.9 Å²	50.9	35%	0.347	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	142.6	173.8	0	0	0	0	0	110.5	S419 P655 A656	S419-A568 WeakPolarHBondContact CB-O 3.29Å; A568-P655 CarbonylContact O-C 3.57Å; A568-A656 WeakPolarHBondContact O-CA 3.48Å; A568-A656 PolarHBondContact O-N 3.41Å
569	P	91.1	Very high	94.2	Very high	43 Å²	43	49.7 Å²	49.7	28%	0.279	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	cis	-85	4.7	10.7	34.5	-35.9	0	0	0	115.8
570	G	92.8	Very high	94.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.01	30%	0.296	C	S	.	.			trans	89.7	-152.6	-177	0	0	0	0	0	113	D527 Y554 A567	D527-G570 WeakPolarHBondContact O-CA 3.29Å; Y554-G570 WeakPolarHBondContact CE1-O 3.37Å; A567-G570 PolarHBondContact O-N 3.32Å
571	L	95.1	Very high	94.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	27%	0.271	C	S	.	.			trans	-61.9	146.1	-177.9	-69.3	177.7	0	0	0	113	K523 E525 G526 D527 I530 F547 Y554 L566 L575	K523-L571 HydrophobicContact CB-CD1 3.77Å; E525-L571 WeakPolarHBondContact CG-O 3.33Å; G526-L571 PolarHBondContact N-O 3.31Å; D527-L571 HydrophobicContact CB-CD1 4.27Å; D527-L571 PolarHBondContact O-N 2.91Å; I530-L571 HydrophobicContact CD1-CD1 3.54Å; I530-L571 HydrophobicContact CD1-CD2 4.38Å; I530-L571 HydrophobicContact CD1-CG 3.87Å; F547-L571 HydrophobicContact CD2-CD2 3.94Å; F547-L571 HydrophobicContact CE2-CD2 3.57Å; F547-L571 HydrophobicContact CZ-CD2 4.22Å; Y554-L571 HydrophobicContact CE1-CD2 4.35Å; Y554-L571 HydrophobicContact CE2-CD2 4.18Å; L566-L571 HydrophobicContact CD1-CD2 3.67Å; L566-L571 HydrophobicContact CD1-CG 4.04Å; L571-L575 HydrophobicContact CD1-CD1 3.67Å; L571-L575 HydrophobicContact CD1-CG 3.89Å; L571-L575 HydrophobicContact CD2-CD1 3.67Å; L571-L575 HydrophobicContact CD2-CG 4.29Å; L571-L575 HydrophobicContact CG-CD1 4.35Å
572	R	93.1	Very high	94.9	Very high	82 Å²	82	45.4 Å²	45.4	31%	0.309	26%	0.262	S	S	.	.	S	Bend	trans	-101.5	-5.1	172.5	-66.8	-69.2	-71.3	146.7	-14.8	113.4	E525 Y554	E525-R572 IonicContact OE1-CZ 2.81Å; E525-R572 IonicContact OE1-NH1 2.72Å; E525-R572 PolarHBondContact OE1-NH1 2.98Å; Y554-R572 HydrophobicContact CE1-CG 4.34Å; Y554-R572 WeakPolarHBondContact OH-CB 3.35Å; Y554-R572 PolarHBondContact OH-N 3.19Å
573	Q	94	Very high	94.9	Very high	90 Å²	90	41 Å²	41	42%	0.421	24%	0.24	S	C	.	.	S	Bend	trans	-150	147.7	-179.1	-169.4	-178.1	-47.1	0	0	109.2
574	D	95.2	Very high	94.9	Very high	71 Å²	71	39.5 Å²	39.5	38%	0.38	23%	0.232	S	C	.	.			trans	-58.4	139.7	168.9	-73.1	8.8	0	0	0	110.8	K523 K524 E525	K523-D574 WeakPolarHBondContact O-CA 3.49Å; K524-D574 WeakPolarHBondContact CA-OD1 3.4Å; K524-D574 HydrophobicContact CD-CB 4.49Å; K524-D574 VanDerWaalsContact CD-CG 3.49Å; K524-D574 WeakPolarHBondContact CD-OD2 3.35Å; K524-D574 IonicContact NZ-OD2 2.66Å; K524-D574 PolarHBondContact NZ-OD2 3.36Å; E525-D574 PolarHBondContact N-OD1 2.9Å
575	L	95	Very high	94.7	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.031	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-115.9	130	173.8	-57.5	178.2	0	0	0	109.3	V519 K523 F547 L571 T579	V519-L575 HydrophobicContact CG2-CD1 4.06Å; K523-L575 HydrophobicContact CB-CB 4.31Å; K523-L575 PolarHBondContact N-O 3.45Å; K523-L575 PolarHBondContact O-N 3.21Å; F547-L575 HydrophobicContact CB-CD1 3.99Å; F547-L575 HydrophobicContact CB-CD2 3.66Å; F547-L575 HydrophobicContact CD1-CD1 3.44Å; F547-L575 VanDerWaalsContact CD1-CD1 3.44Å; F547-L575 HydrophobicContact CD2-CD1 3.77Å; F547-L575 HydrophobicContact CE1-CD1 3.76Å; F547-L575 HydrophobicContact CE2-CD1 4.07Å; F547-L575 HydrophobicContact CG-CD1 3.45Å; F547-L575 VanDerWaalsContact CG-CD1 3.45Å; F547-L575 HydrophobicContact CG-CD2 4.07Å; F547-L575 HydrophobicContact CG-CG 4.43Å; F547-L575 HydrophobicContact CZ-CD1 4.07Å; L571-L575 HydrophobicContact CD1-CD1 3.67Å; L571-L575 HydrophobicContact CD1-CG 3.89Å; L571-L575 HydrophobicContact CD2-CD1 3.67Å; L571-L575 HydrophobicContact CD2-CG 4.29Å; L571-L575 HydrophobicContact CG-CD1 4.35Å; L575-T579 HydrophobicContact CD2-CG2 4.32Å
576	A	95.1	Very high	94.6	Very high	61 Å²	61	41.3 Å²	41.3	50%	0.504	25%	0.253	S	S	.	.			trans	-72.4	159.1	170.9	0	0	0	0	0	110.6	T579	A576-T579 PolarHBondContact N-OG1 2.98Å; A576-T579 WeakPolarHBondContact O-CB 3.46Å; A576-T579 PolarHBondContact O-N 3.01Å; A576-T579 PolarHBondContact O-OG1 3.48Å
577	D	95.8	Very high	94.6	Very high	87 Å²	87	41.5 Å²	41.5	47%	0.465	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	150.2	166.2	-165.9	23.5	0	0	0	110.9	G521 T579	G521-D577 WeakPolarHBondContact CA-OD1 3.49Å; G521-D577 PolarHBondContact N-OD1 3.4Å; D577-T579 PolarHBondContact O-N 3.26Å
578	D	96.1	Very high	94.7	Very high	102 Å²	102	41.6 Å²	41.6	55%	0.545	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	16.5	-175.3	-67.2	-38.7	0	0	0	115.5	L518 V519 A580	L518-D578 HydrophobicContact CD1-CB 4.3Å; V519-D578 PolarHBondContact O-N 3.14Å; D578-A580 PolarHBondContact O-N 2.97Å
579	T	97.4	Very high	95	Very high	20 Å²	20	39.6 Å²	39.6	12%	0.123	24%	0.238	C	C	.	.			trans	-65	126.8	174	-61	0	0	0	0	110.4	L518 V519 F547 A548 L575 A576 D577	L518-T579 WeakPolarHBondContact CA-O 3.38Å; V519-T579 WeakPolarHBondContact CG2-O 3.42Å; V519-T579 PolarHBondContact N-O 2.88Å; F547-T579 HydrophobicContact CB-CG2 4.14Å; A548-T579 HydrophobicContact CB-CG2 4.14Å; L575-T579 HydrophobicContact CD2-CG2 4.32Å; A576-T579 PolarHBondContact N-OG1 2.98Å; A576-T579 WeakPolarHBondContact O-CB 3.46Å; A576-T579 PolarHBondContact O-N 3.01Å; A576-T579 PolarHBondContact O-OG1 3.48Å; D577-T579 PolarHBondContact O-N 3.26Å
580	A	97.2	Very high	95.2	Very high	42 Å²	42	37.6 Å²	37.6	35%	0.347	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.5	-176.9	0	0	0	0	0	113.1	L518 A548 D578	L518-A580 HydrophobicContact CD2-CB 3.92Å; A548-A580 HydrophobicContact CB-CB 4.1Å; A548-A580 PolarHBondContact N-O 2.89Å; D578-A580 PolarHBondContact O-N 2.97Å
581	I	97	Very high	95.4	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.9	179	-50.2	-179.7	0	0	0	109.2	Y517 V519 I532 V545 T546 F547	Y517-I581 WeakPolarHBondContact O-CB 3.49Å; Y517-I581 PolarHBondContact O-N 3.42Å; V519-I581 HydrophobicContact CG2-CD1 3.83Å; V519-I581 HydrophobicContact CG2-CG1 3.86Å; I532-I581 HydrophobicContact CB-CD1 4.23Å; I532-I581 HydrophobicContact CG2-CD1 3.31Å; V545-I581 HydrophobicContact CB-CG2 3.93Å; V545-I581 HydrophobicContact CG1-CG2 4.03Å; T546-I581 WeakPolarHBondContact O-CA 3.44Å; F547-I581 HydrophobicContact CD1-CD1 4.42Å; F547-I581 HydrophobicContact CD1-CG1 3.82Å; F547-I581 HydrophobicContact CE1-CD1 3.86Å; F547-I581 HydrophobicContact CE1-CG1 3.75Å; F547-I581 HydrophobicContact CE1-CG2 4.24Å
582	T	96.1	Very high	95.5	Very high	85 Å²	85	37.6 Å²	37.6	52%	0.521	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.3	174.9	-60.6	0	0	0	0	110.2	V545 T546	V545-T582 CarbonylContact C-O 3.58Å; V545-T582 WeakPolarHBondContact CA-O 3.38Å; T546-T582 PolarHBondContact N-O 3.26Å; T546-T582 PolarHBondContact O-N 2.94Å; T546-T582 WeakPolarHBondContact OG1-CB 3.39Å; T546-T582 PolarHBondContact OG1-O 3.07Å; T546-T582 VanDerWaalsContact OG1-O 3.12Å
583	V	95	Very high	95.7	Very high	25 Å²	25	33.7 Å²	33.7	15%	0.152	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	126.9	172.4	-170.8	0	0	0	0	109.1	V512 A514 I539 Q543 I544 V545	V512-V583 HydrophobicContact CG2-CB 4.47Å; V512-V583 HydrophobicContact CG2-CG1 3.57Å; A514-V583 HydrophobicContact CB-CG2 3.88Å; I539-V583 HydrophobicContact CD1-CG2 4.01Å; I539-V583 HydrophobicContact CG1-CG2 4Å; Q543-V583 HydrophobicContact CB-CG1 4.18Å; I544-V583 WeakPolarHBondContact O-CA 3.32Å; V545-V583 HydrophobicContact CG1-CG2 4.25Å
584	V	94.2	Very high	95.7	Very high	18 Å²	18	29.5 Å²	29.5	11%	0.109	19%	0.19	C	C	.	.			trans	-66.9	149	-180	176.4	0	0	0	0	110.3	A425 I544 T546 L662	A425-V584 HydrophobicContact CB-CG1 3.3Å; I544-V584 HydrophobicContact CB-CB 3.92Å; I544-V584 HydrophobicContact CB-CG2 3.93Å; I544-V584 HydrophobicContact CG2-CB 4.15Å; I544-V584 HydrophobicContact CG2-CG2 3.59Å; I544-V584 PolarHBondContact O-N 3.44Å; T546-V584 HydrophobicContact CG2-CG2 4.17Å; V584-L662 HydrophobicContact CG1-CD1 4.25Å
585	G	92.4	Very high	95.5	Very high	26 Å²	26	29.7 Å²	29.7	27%	0.268	19%	0.186	S	C	.	.			trans	-66.4	-169.6	-179	0	0	0	0	0	114.2	F587	G585-F587 VanDerWaalsContact O-CD1 3.29Å; G585-F587 WeakPolarHBondContact O-CD1 3.37Å
586	A	94.7	Very high	95.3	Very high	50 Å²	50	34 Å²	34	41%	0.413	21%	0.209	S	C	.	.	S	Bend	trans	-64.3	139.4	175.7	0	0	0	0	0	111	G426 A509 K511	G426-A586 PolarHBondContact N-O 3Å; A509-A586 WeakPolarHBondContact O-CA 3.27Å; K511-A586 HydrophobicContact CB-CB 4.04Å
587	F	95.4	Very high	95.1	Very high	6 Å²	6	31 Å²	31	3%	0.026	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.8	-178.8	61.1	-92.5	0	0	0	112.9	Y415 A425 R508 A509 G542 I544 G585 A589 L660 L662 G663	Y415-F587 HydrophobicContact CD2-CE2 4.37Å; Y415-F587 HydrophobicContact CE2-CE2 4.1Å; Y415-F587 HydrophobicContact CE2-CZ 4.12Å; A425-F587 HydrophobicContact CB-CB 3.97Å; R508-F587 CarbonylContact C-O 3.52Å; R508-F587 WeakPolarHBondContact CA-O 3.41Å; A509-F587 HydrophobicContact CB-CD1 4.03Å; A509-F587 HydrophobicContact CB-CD2 4.08Å; A509-F587 HydrophobicContact CB-CE1 3.59Å; A509-F587 HydrophobicContact CB-CE2 3.67Å; A509-F587 HydrophobicContact CB-CG 4.25Å; A509-F587 HydrophobicContact CB-CZ 3.4Å; A509-F587 PolarHBondContact N-O 2.9Å; A509-F587 PolarHBondContact O-N 3.33Å; A509-F587 VanDerWaalsContact O-N 3.15Å; G542-F587 WeakPolarHBondContact O-CZ 3.41Å; I544-F587 HydrophobicContact CB-CE1 4.46Å; I544-F587 HydrophobicContact CD1-CD1 4.08Å; I544-F587 HydrophobicContact CD1-CD2 4.29Å; I544-F587 HydrophobicContact CD1-CE1 3.61Å; I544-F587 HydrophobicContact CD1-CE2 3.81Å; I544-F587 HydrophobicContact CD1-CG 4.43Å; I544-F587 HydrophobicContact CD1-CZ 3.44Å; I544-F587 VanDerWaalsContact CD1-CZ 3.44Å; I544-F587 HydrophobicContact CG1-CE1 3.94Å; I544-F587 HydrophobicContact CG1-CZ 3.79Å; G585-F587 VanDerWaalsContact O-CD1 3.29Å; G585-F587 WeakPolarHBondContact O-CD1 3.37Å; F587-A589 HydrophobicContact CD2-CB 4.12Å; F587-A589 HydrophobicContact CE2-CB 3.86Å; F587-L660 HydrophobicContact CE2-CD1 4.36Å; F587-L662 HydrophobicContact CB-CB 4.49Å; F587-L662 HydrophobicContact CB-CD2 4.15Å; F587-L662 HydrophobicContact CD1-CD2 4.5Å; F587-L662 HydrophobicContact CD2-CD2 3.65Å; F587-L662 HydrophobicContact CE2-CD2 4.14Å; F587-L662 HydrophobicContact CG-CD2 3.87Å; F587-G663 CarbonylContact C-O 3.52Å; F587-G663 WeakPolarHBondContact CA-O 3.48Å
588	T	96	Very high	94.9	Very high	7 Å²	7	27 Å²	27	4%	0.043	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.5	163.5	-52.6	0	0	0	0	109.2	V506 N590 G663	V506-T588 HydrophobicContact CG1-CG2 3.64Å; T588-N590 PolarHBondContact O-N 3.33Å; T588-G663 PolarHBondContact N-O 3.24Å; T588-G663 PolarHBondContact O-N 3.07Å; T588-G663 VanDerWaalsContact O-N 3.08Å
589	A	95.9	Very high	94.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	69.5	-171.2	0	0	0	0	0	111.7	Y415 V506 K507 F587	Y415-A589 HydrophobicContact CD1-CB 4.47Å; Y415-A589 HydrophobicContact CD2-CB 3.66Å; Y415-A589 HydrophobicContact CE2-CB 4.3Å; Y415-A589 HydrophobicContact CG-CB 3.75Å; V506-A589 WeakPolarHBondContact CG1-O 3.46Å; K507-A589 PolarHBondContact O-N 3.2Å; F587-A589 HydrophobicContact CD2-CB 4.12Å; F587-A589 HydrophobicContact CE2-CB 3.86Å
590	N	96.7	Very high	94.2	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	145.8	171.2	-48.1	-83.3	0	0	0	109.3	L460 G461 T588 L660 I661	L460-N590 HydrophobicContact CD2-CB 3.7Å; G461-N590 PolarHBondContact N-OD1 2.9Å; T588-N590 PolarHBondContact O-N 3.33Å; N590-L660 CarbonylContact O-C 3.38Å; N590-L660 VanDerWaalsContact O-CA 3.28Å; N590-L660 WeakPolarHBondContact O-CA 3.22Å; N590-I661 HydrophobicContact CB-CB 4.2Å; N590-I661 VanDerWaalsContact CB-O 3.3Å; N590-I661 WeakPolarHBondContact CB-O 3.38Å; N590-I661 PolarHBondContact N-O 2.84Å; N590-I661 PolarHBondContact ND2-O 2.9Å; N590-I661 PolarHBondContact O-N 2.82Å
591	M	96.9	Very high	93.8	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.2	-168.9	-63.2	177.5	62.4	0	0	111.1	F311 M458 V459 F593 F598 L660	F311-M591 HydrophobicContact CE1-CB 4.13Å; F311-M591 HydrophobicContact CE1-CE 4.31Å; F311-M591 HydrophobicContact CE1-CG 4.19Å; F311-M591 HydrophobicContact CE1-SD 3.43Å; F311-M591 WeakPolarHBondContact CE1-SD 3.44Å; F311-M591 HydrophobicContact CZ-CB 4.5Å; F311-M591 HydrophobicContact CZ-CG 4.27Å; F311-M591 HydrophobicContact CZ-SD 3.65Å; M458-M591 CarbonylContact C-O 3.57Å; M458-M591 WeakPolarHBondContact CA-O 3.29Å; V459-M591 PolarHBondContact N-O 3.1Å; V459-M591 PolarHBondContact O-N 3.07Å; M591-F593 HydrophobicContact CB-CD1 3.88Å; M591-F593 HydrophobicContact CB-CE1 3.91Å; M591-F598 HydrophobicContact CE-CD2 4.08Å; M591-F598 HydrophobicContact CE-CE1 3.93Å; M591-F598 HydrophobicContact CE-CE2 3.35Å; M591-F598 HydrophobicContact CE-CZ 3.26Å; M591-L660 HydrophobicContact CG-CD2 3.75Å
592	A	96.4	Very high	93.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.7	171.3	0	0	0	0	0	109	A442 Q457 M458 F498 G658 C659 I661	A442-A592 HydrophobicContact CB-CB 4.01Å; Q457-A592 CarbonylContact O-C 3.47Å; Q457-A592 WeakPolarHBondContact O-CA 2.94Å; M458-A592 HydrophobicContact CE-CB 4.35Å; M458-A592 HydrophobicContact CG-CB 4.38Å; F498-A592 HydrophobicContact CD1-CB 4.45Å; F498-A592 HydrophobicContact CE1-CB 3.84Å; F498-A592 HydrophobicContact CZ-CB 4.23Å; A592-G658 CarbonylContact O-C 3.55Å; A592-C659 PolarHBondContact N-O 3.05Å; A592-C659 PolarHBondContact O-N 3.4Å; A592-C659 VanDerWaalsContact O-O 3.11Å; A592-I661 HydrophobicContact CB-CD1 4.29Å
593	F	96.7	Very high	93.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	159.2	-170.8	52.3	-90.6	0	0	0	112.9	F311 A314 V315 Q457 V459 M591 A597 F598 H657	F311-F593 HydrophobicContact CD1-CE1 4.47Å; F311-F593 HydrophobicContact CD1-CZ 4.45Å; F311-F593 HydrophobicContact CE1-CE1 4.3Å; A314-F593 HydrophobicContact CB-CE2 4.15Å; A314-F593 HydrophobicContact CB-CZ 3.82Å; V315-F593 HydrophobicContact CG1-CE2 4.04Å; V315-F593 HydrophobicContact CG1-CZ 4.14Å; Q457-F593 HydrophobicContact CB-CD2 3.91Å; Q457-F593 HydrophobicContact CB-CE2 3.66Å; Q457-F593 HydrophobicContact CB-CG 4.49Å; Q457-F593 HydrophobicContact CB-CZ 4.03Å; Q457-F593 HydrophobicContact CG-CD2 4.49Å; Q457-F593 HydrophobicContact CG-CE2 4.2Å; Q457-F593 PolarHBondContact N-O 2.82Å; Q457-F593 PolarHBondContact O-N 3.37Å; V459-F593 HydrophobicContact CB-CE1 4.48Å; V459-F593 HydrophobicContact CG2-CE1 3.75Å; V459-F593 HydrophobicContact CG2-CZ 3.78Å; M591-F593 HydrophobicContact CB-CD1 3.88Å; M591-F593 HydrophobicContact CB-CE1 3.91Å; F593-A597 HydrophobicContact CB-CB 4.06Å; F593-F598 HydrophobicContact CB-CD2 4.03Å; F593-F598 HydrophobicContact CB-CE2 3.7Å; F593-F598 AromaticContact CD1-CD2 3.93Å; F593-F598 HydrophobicContact CD1-CD2 3.93Å; F593-F598 AromaticContact CD1-CE2 3.75Å; F593-F598 HydrophobicContact CD1-CE2 3.75Å; F593-F598 AromaticContact CD2-CD2 3.71Å; F593-F598 HydrophobicContact CD2-CD2 3.71Å; F593-F598 HydrophobicContact CD2-CE2 4.21Å; F593-F598 HydrophobicContact CE1-CD2 4.29Å; F593-F598 HydrophobicContact CE1-CE2 4.4Å; F593-F598 HydrophobicContact CE2-CD2 4.08Å; F593-F598 AromaticContact CG-CD2 3.62Å; F593-F598 HydrophobicContact CG-CD2 3.62Å; F593-F598 AromaticContact CG-CE2 3.63Å; F593-F598 HydrophobicContact CG-CE2 3.63Å; F593-F598 HydrophobicContact CZ-CD2 4.36Å; F593-H657 VanDerWaalsContact CA-O 3.25Å; F593-H657 WeakPolarHBondContact CA-O 2.9Å; F593-H657 WeakPolarHBondContact CB-O 3.2Å
594	D	94.9	Very high	92.8	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.011	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	140.7	161.2	171.4	67.1	0	0	0	109.7	L456 N596 A597 H657	L456-D594 HydrophobicContact CD2-CB 4.31Å; D594-N596 PolarHBondContact O-N 3.13Å; D594-N596 WeakPolarHBondContact OD2-CB 3.34Å; D594-N596 PolarHBondContact OD2-N 2.9Å; D594-N596 PolarHBondContact OD2-ND2 3.34Å; D594-A597 WeakPolarHBondContact O-CB 3.4Å; D594-A597 PolarHBondContact O-N 3.13Å; D594-H657 HydrophobicContact CB-CB 4.21Å; D594-H657 PolarHBondContact N-O 2.8Å; D594-H657 VanDerWaalsContact N-O 3.1Å
595	R	92	Very high	92.6	Very high	76 Å²	76	18.9 Å²	18.9	29%	0.287	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-33.3	-178.8	171.6	167.6	-87.1	149.6	-12.9	113.8	P313 A314 A316 D455 Q457	P313-R595 PolarHBondContact O-NH2 3.1Å; A314-R595 WeakPolarHBondContact O-CG 3.4Å; A314-R595 PolarHBondContact O-NE 3.07Å; A316-R595 HydrophobicContact CB-CG 4.19Å; A316-R595 WeakPolarHBondContact CB-O 3.35Å; A316-R595 PolarHBondContact N-O 3.49Å; D455-R595 PolarHBondContact O-N 2.66Å; D455-R595 VanDerWaalsContact O-N 3.1Å; D455-R595 IonicContact OD1-NH1 2.93Å; D455-R595 WeakPolarHBondContact OD2-CD 3.42Å; D455-R595 IonicContact OD2-CZ 3.54Å; D455-R595 IonicContact OD2-NE 2.83Å; D455-R595 IonicContact OD2-NH1 3.69Å; D455-R595 PolarHBondContact OD2-NH1 2.8Å; Q457-R595 HydrophobicContact CG-CB 4.07Å
596	N	89.9	Confident	92.3	Very high	95 Å²	95	21.2 Å²	21.2	51%	0.508	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.1	-179.1	-54.7	-63.5	0	0	0	114.4	D594 F598	D594-N596 PolarHBondContact O-N 3.13Å; D594-N596 WeakPolarHBondContact OD2-CB 3.34Å; D594-N596 PolarHBondContact OD2-N 2.9Å; D594-N596 PolarHBondContact OD2-ND2 3.34Å; N596-F598 VanDerWaalsContact C-N 3.3Å
597	A	90.5	Very high	91.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-38.3	176.2	0	0	0	0	0	111.5	F593 D594 V653 K654 H657	F593-A597 HydrophobicContact CB-CB 4.06Å; D594-A597 WeakPolarHBondContact O-CB 3.4Å; D594-A597 PolarHBondContact O-N 3.13Å; A597-V653 PolarHBondContact O-N 3.35Å; A597-K654 PolarHBondContact O-N 3.35Å; A597-H657 HydrophobicContact CB-CB 3.88Å; A597-H657 WeakPolarHBondContact CB-O 3.15Å
598	F	91.9	Very high	91.3	Very high	3 Å²	3	25.4 Å²	25.4	1%	0.013	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	144.9	177.9	-57.3	-72.7	0	0	0	110.7	V315 A316 L414 M591 F593 N596	V315-F598 HydrophobicContact CB-CB 4.34Å; V315-F598 HydrophobicContact CG1-CB 3.76Å; A316-F598 PolarHBondContact N-O 3.39Å; L414-F598 HydrophobicContact CB-CD1 3.88Å; L414-F598 HydrophobicContact CB-CE1 3.89Å; L414-F598 HydrophobicContact CD1-CD1 3.9Å; L414-F598 WeakPolarHBondContact O-CE1 2.84Å; M591-F598 HydrophobicContact CE-CD2 4.08Å; M591-F598 HydrophobicContact CE-CE1 3.93Å; M591-F598 HydrophobicContact CE-CE2 3.35Å; M591-F598 HydrophobicContact CE-CZ 3.26Å; F593-F598 HydrophobicContact CB-CD2 4.03Å; F593-F598 HydrophobicContact CB-CE2 3.7Å; F593-F598 AromaticContact CD1-CD2 3.93Å; F593-F598 HydrophobicContact CD1-CD2 3.93Å; F593-F598 AromaticContact CD1-CE2 3.75Å; F593-F598 HydrophobicContact CD1-CE2 3.75Å; F593-F598 AromaticContact CD2-CD2 3.71Å; F593-F598 HydrophobicContact CD2-CD2 3.71Å; F593-F598 HydrophobicContact CD2-CE2 4.21Å; F593-F598 HydrophobicContact CE1-CD2 4.29Å; F593-F598 HydrophobicContact CE1-CE2 4.4Å; F593-F598 HydrophobicContact CE2-CD2 4.08Å; F593-F598 AromaticContact CG-CD2 3.62Å; F593-F598 HydrophobicContact CG-CD2 3.62Å; F593-F598 AromaticContact CG-CE2 3.63Å; F593-F598 HydrophobicContact CG-CE2 3.63Å; F593-F598 HydrophobicContact CZ-CD2 4.36Å; N596-F598 VanDerWaalsContact C-N 3.3Å
599	L	89.4	Confident	90.5	Very high	28 Å²	28	35 Å²	35	15%	0.147	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.3	-175.2	-172.2	72.8	0	0	0	110.9	A316 N318 V362 V650 S651 V653	A316-L599 HydrophobicContact CB-CD1 3.8Å; N318-L599 HydrophobicContact CB-CD1 4.01Å; N318-L599 HydrophobicContact CB-CD2 3.96Å; N318-L599 HydrophobicContact CB-CG 4.05Å; V362-L599 HydrophobicContact CB-CD2 4.36Å; V362-L599 HydrophobicContact CG1-CD2 3.9Å; V362-L599 HydrophobicContact CG2-CD2 3.56Å; L599-V650 WeakPolarHBondContact O-CA 3.44Å; L599-S651 PolarHBondContact N-O 2.79Å; L599-S651 PolarHBondContact O-N 2.9Å; L599-S651 VanDerWaalsContact O-N 3.09Å; L599-V653 HydrophobicContact CB-CG2 3.65Å; L599-V653 HydrophobicContact CD2-CG2 4.16Å
600	L	90.2	Very high	89.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.1	167	175.4	62	0	0	0	109.2	I312 V315 A316 K317 N318 V407 L411 I627 W648 V650	I312-L600 HydrophobicContact CG1-CD2 4.35Å; I312-L600 HydrophobicContact CG2-CD2 4Å; V315-L600 HydrophobicContact CG2-CB 3.71Å; A316-L600 PolarHBondContact O-N 2.88Å; K317-L600 WeakPolarHBondContact CA-O 2.87Å; N318-L600 PolarHBondContact N-O 2.94Å; V407-L600 HydrophobicContact CG1-CD1 3.77Å; V407-L600 HydrophobicContact CG1-CD2 4.13Å; L411-L600 HydrophobicContact CD1-CD2 4.49Å; L411-L600 HydrophobicContact CD2-CB 4.38Å; L600-I627 HydrophobicContact CD2-CD1 4.29Å; L600-W648 HydrophobicContact CD1-CB 4.29Å; L600-V650 HydrophobicContact CD1-CG1 3.96Å
601	A	88.5	Confident	88.8	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.017	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.2	165.2	0	0	0	0	0	107.7	N318 A321 V362 I364 W648 G649	N318-A601 HydrophobicContact CB-CB 4.03Å; A321-A601 HydrophobicContact CB-CB 3.81Å; V362-A601 HydrophobicContact CG1-CB 3.84Å; I364-A601 HydrophobicContact CD1-CB 3.66Å; I364-A601 WeakPolarHBondContact CD1-O 3.38Å; A601-W648 CarbonylContact O-C 3.56Å; A601-W648 WeakPolarHBondContact O-CA 3.42Å; A601-W648 WeakPolarHBondContact O-CB 3.33Å; A601-G649 PolarHBondContact N-O 2.96Å; A601-G649 PolarHBondContact O-N 3.44Å
602	S	88.6	Confident	88.3	Confident	23 Å²	23	44.1 Å²	44.1	16%	0.161	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.6	179.4	62.6	0	0	0	0	110.4	A647	S602-A647 CarbonylContact C-O 3.53Å; S602-A647 VanDerWaalsContact CA-O 3.32Å; S602-A647 WeakPolarHBondContact CA-O 3.4Å
603	R	88.9	Confident	87.7	Confident	23 Å²	23	51.2 Å²	51.2	9%	0.087	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	169.1	173.3	61.4	163.4	178.1	89	-8.2	110.8	A321 D322 A324 A606 A647	A321-R603 WeakPolarHBondContact O-CD 3.46Å; D322-R603 WeakPolarHBondContact OD1-CB 3.47Å; A324-R603 VanDerWaalsContact O-CZ 3.3Å; A324-R603 PolarHBondContact O-NE 3.45Å; A324-R603 PolarHBondContact O-NH2 3.16Å; R603-A606 VanDerWaalsContact NH1-N 3.12Å; R603-A647 HydrophobicContact CG-CB 4.24Å; R603-A647 PolarHBondContact N-O 3.02Å; R603-A647 PolarHBondContact O-N 3.45Å
604	T	89.9	Confident	87.1	Confident	32 Å²	32	52.2 Å²	52.2	20%	0.196	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-64.4	147.6	167.3	55.6	0	0	0	0	110.1	N619 T628 Q630	T604-N619 WeakPolarHBondContact CG2-OD1 3.47Å; T604-T628 HydrophobicContact CG2-CG2 4.08Å; T604-Q630 HydrophobicContact CG2-CB 3.92Å
605	P	88.3	Confident	86.6	Confident	21 Å²	21	56.4 Å²	56.4	14%	0.136	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-53.4	148.2	171.8	-26.3	36.6	0	0	0	111.9
606	A	87.1	Confident	86.3	Confident	75 Å²	75	53.7 Å²	53.7	62%	0.62	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-76.9	130.5	-179	0	0	0	0	0	109.6	R603	R603-A606 VanDerWaalsContact NH1-N 3.12Å
607	M	84.4	Confident	86.3	Confident	68 Å²	68	51.9 Å²	51.9	34%	0.335	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-95.4	146.4	170.3	-64.4	-68.1	-82.4	0	0	109.2	D612 A614 V617	M607-D612 HydrophobicContact CE-CB 4.33Å; M607-D612 WeakPolarHBondContact CE-OD1 3.39Å; M607-A614 HydrophobicContact CE-CB 4.3Å; M607-V617 HydrophobicContact CE-CG2 4.18Å
608	P	84.2	Confident	86.2	Confident	76 Å²	76	53.6 Å²	53.6	49%	0.494	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-63.1	147.5	175.5	27	-33.7	0	0	0	111.3	G610 G611 D612	P608-G610 PolarHBondContact O-N 2.93Å; P608-G611 PolarHBondContact O-N 3.13Å; P608-D612 HydrophobicContact CG-CB 4.09Å
609	E	79.5	Confident	86.1	Confident	208 Å²	208	57.5 Å²	57.5	97%	0.972	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	124	170.9	-170.6	173.8	-170.4	0	0	109.2
610	G	78.1	Confident	86	Confident	85 Å²	85	56.2 Å²	56.2	88%	0.876	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	99	-6.5	-170.3	0	0	0	0	0	115.1	P608	P608-G610 PolarHBondContact O-N 2.93Å
611	G	79.4	Confident	85.8	Confident	47 Å²	47	59.6 Å²	59.6	49%	0.485	37%	0.366	S	S	.	.			trans	80.7	169.3	-179.5	0	0	0	0	0	113.3	P608	P608-G611 PolarHBondContact O-N 3.13Å
612	D	85.1	Confident	85.5	Confident	63 Å²	63	59.6 Å²	59.6	34%	0.337	37%	0.366	S	S	.	.			trans	-114.8	-160.2	172.3	73.9	-11	0	0	0	110.2	M607 P608 A614 Y634	M607-D612 HydrophobicContact CE-CB 4.33Å; M607-D612 WeakPolarHBondContact CE-OD1 3.39Å; P608-D612 HydrophobicContact CG-CB 4.09Å; D612-A614 PolarHBondContact O-N 2.94Å; D612-A614 WeakPolarHBondContact OD1-CB 3.33Å; D612-A614 PolarHBondContact OD1-N 3.06Å; D612-Y634 WeakPolarHBondContact OD2-CE1 3.49Å; D612-Y634 PolarHBondContact OD2-OH 3.32Å
613	N	85.3	Confident	84.9	Confident	148 Å²	148	63.8 Å²	63.8	79%	0.791	39%	0.393	S	S	*	.	S	Bend	trans	-80.8	14.7	178.5	-63.8	-40.4	0	0	0	113.8	D615 Y634	N613-D615 PolarHBondContact O-N 3.09Å; N613-Y634 HydrophobicContact CB-CD1 4.44Å; N613-Y634 WeakPolarHBondContact O-CD1 3.39Å
614	A	84	Confident	84.2	Confident	22 Å²	22	68.3 Å²	68.3	18%	0.182	42%	0.417	C	S	.	.			trans	-69.6	126	174.4	0	0	0	0	0	109.7	M607 D612 D616 V617 A632 L633 Y634	M607-A614 HydrophobicContact CE-CB 4.3Å; D612-A614 PolarHBondContact O-N 2.94Å; D612-A614 WeakPolarHBondContact OD1-CB 3.33Å; D612-A614 PolarHBondContact OD1-N 3.06Å; A614-D616 VanDerWaalsContact C-N 3.33Å; A614-V617 HydrophobicContact CB-CG2 3.67Å; A614-A632 HydrophobicContact CB-CB 4.44Å; A614-L633 CarbonylContact C-O 3.48Å; A614-L633 WeakPolarHBondContact CA-O 3.31Å; A614-Y634 HydrophobicContact CB-CD1 4.19Å; A614-Y634 HydrophobicContact CB-CE1 3.68Å; A614-Y634 HydrophobicContact CB-CE2 4.46Å; A614-Y634 VanDerWaalsContact N-CE1 3.32Å
615	D	83.9	Confident	83.6	Confident	89 Å²	89	67.1 Å²	67.1	48%	0.476	41%	0.41	S	S	.	.	S	Bend	trans	-74.4	-28.2	176.4	-65	-58.5	0	0	0	111.9	N613 L633 R635	N613-D615 PolarHBondContact O-N 3.09Å; D615-L633 HydrophobicContact CB-CD2 4.48Å; D615-L633 PolarHBondContact N-O 2.77Å; D615-R635 WeakPolarHBondContact OD2-CA 3.39Å; D615-R635 WeakPolarHBondContact OD2-CB 3.48Å; D615-R635 WeakPolarHBondContact OD2-CD 3.48Å; D615-R635 WeakPolarHBondContact OD2-CG 3.5Å; D615-R635 PolarHBondContact OD2-N 2.89Å
616	D	86	Confident	83.3	Confident	19 Å²	19	67.6 Å²	67.6	10%	0.102	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	141.9	-178.6	-160.2	-4.3	0	0	0	109.9	N288 T289 L290 A614 L633	N288-D616 WeakPolarHBondContact CB-OD2 3.39Å; T289-D616 PolarHBondContact N-OD2 2.83Å; L290-D616 WeakPolarHBondContact CB-OD2 3.43Å; L290-D616 HydrophobicContact CD1-CB 3.72Å; L290-D616 HydrophobicContact CG-CB 3.87Å; L290-D616 WeakPolarHBondContact CG-OD2 3.24Å; L290-D616 PolarHBondContact N-OD2 3.33Å; A614-D616 VanDerWaalsContact C-N 3.33Å; D616-L633 HydrophobicContact CB-CB 4.15Å; D616-L633 HydrophobicContact CB-CD2 4.19Å; D616-L633 PolarHBondContact O-N 2.94Å
617	V	88.6	Confident	83.2	Confident	58 Å²	58	64 Å²	64	35%	0.352	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	129.6	179.8	-177.3	0	0	0	0	109.2	M607 A614 Q630 I631 A632	M607-V617 HydrophobicContact CE-CG2 4.18Å; A614-V617 HydrophobicContact CB-CG2 3.67Å; V617-Q630 HydrophobicContact CG1-CG 3.67Å; V617-I631 CarbonylContact C-O 3.53Å; V617-I631 VanDerWaalsContact CA-O 3.3Å; V617-I631 WeakPolarHBondContact CA-O 3.44Å; V617-A632 HydrophobicContact CG2-CB 4.16Å
618	M	88.9	Confident	83.4	Confident	36 Å²	36	63 Å²	63	18%	0.177	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.4	179.8	178.1	-175	178.5	0	0	110.6	L290 I294 Y298 V620 Q630 I631	L290-M618 HydrophobicContact CD1-CB 3.93Å; I294-M618 HydrophobicContact CD1-CE 4.3Å; I294-M618 HydrophobicContact CD1-SD 4.49Å; I294-M618 HydrophobicContact CG1-CE 3.94Å; I294-M618 HydrophobicContact CG1-SD 3.92Å; Y298-M618 HydrophobicContact CE2-CE 3.79Å; M618-V620 HydrophobicContact CE-CG2 3.66Å; M618-V620 HydrophobicContact CG-CG2 4.1Å; M618-V620 HydrophobicContact SD-CG2 3.93Å; M618-Q630 CarbonylContact O-C 3.44Å; M618-I631 PolarHBondContact N-O 2.88Å; M618-I631 PolarHBondContact O-N 3.03Å
619	N	89.5	Confident	83.7	Confident	85 Å²	85	59.5 Å²	59.5	46%	0.455	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.8	168.8	-66.6	-21.7	0	0	0	110.1	T604 T628 F629	T604-N619 WeakPolarHBondContact CG2-OD1 3.47Å; N619-T628 HydrophobicContact CB-CG2 3.87Å; N619-F629 CarbonylContact C-O 3.54Å; N619-F629 WeakPolarHBondContact CA-O 3.47Å
620	V	87	Confident	84.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118.6	179.5	-178.6	0	0	0	0	109	I297 Y298 L301 M618 T628 F629 I631	I297-V620 HydrophobicContact CG2-CG1 4.34Å; I297-V620 HydrophobicContact CG2-CG2 3.92Å; Y298-V620 HydrophobicContact CE1-CG1 4Å; L301-V620 HydrophobicContact CD2-CG1 3.87Å; M618-V620 HydrophobicContact CE-CG2 3.66Å; M618-V620 HydrophobicContact CG-CG2 4.1Å; M618-V620 HydrophobicContact SD-CG2 3.93Å; V620-T628 WeakPolarHBondContact O-CA 3.44Å; V620-F629 PolarHBondContact N-O 3.45Å; V620-F629 PolarHBondContact O-N 3.19Å; V620-I631 HydrophobicContact CB-CD1 4.33Å; V620-I631 HydrophobicContact CG2-CD1 3.55Å; V620-I631 HydrophobicContact CG2-CG1 4.3Å
621	T	86.4	Confident	85	Confident	72 Å²	72	46.5 Å²	46.5	44%	0.442	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.4	176.6	-55.3	0	0	0	0	110.1	T628	T621-T628 PolarHBondContact OG1-OG1 3.21Å
622	D	82.5	Confident	85.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.011	26%	0.259	C	S	.	.			trans	-74.8	121.1	173.5	172.9	39.2	0	0	0	111.7	L301 R306 I624 S625 G626 I627 F629	L301-D622 HydrophobicContact CD1-CB 4.16Å; L301-D622 HydrophobicContact CD2-CB 4.44Å; R306-D622 IonicContact CZ-OD1 3.38Å; R306-D622 VanDerWaalsContact CZ-OD1 3.26Å; R306-D622 IonicContact CZ-OD2 3.96Å; R306-D622 IonicContact NH1-OD1 3.62Å; R306-D622 PolarHBondContact NH1-OD1 3.29Å; R306-D622 IonicContact NH1-OD2 2.73Å; R306-D622 PolarHBondContact NH1-OD2 2.92Å; R306-D622 VanDerWaalsContact NH2-CG 3.33Å; R306-D622 IonicContact NH2-OD1 2.88Å; R306-D622 PolarHBondContact NH2-OD1 3.46Å; R306-D622 IonicContact NH2-OD2 2.94Å; D622-I624 VanDerWaalsContact C-N 3.29Å; D622-I624 PolarHBondContact O-N 2.88Å; D622-I624 PolarHBondContact OD1-N 3.26Å; D622-S625 WeakPolarHBondContact OD2-CA 3.38Å; D622-S625 WeakPolarHBondContact OD2-CB 3.28Å; D622-S625 PolarHBondContact OD2-N 2.99Å; D622-S625 PolarHBondContact OD2-OG 3.44Å; D622-G626 WeakPolarHBondContact O-CA 3.42Å; D622-G626 PolarHBondContact O-N 3.05Å; D622-I627 PolarHBondContact N-O 3.08Å; D622-F629 HydrophobicContact CB-CE2 4.13Å
623	P	75.3	Confident	85.8	Confident	111 Å²	111	41.6 Å²	41.6	72%	0.721	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.1	-177.8	26.1	-34.7	0	0	0	113.9
624	I	75.1	Confident	86	Confident	118 Å²	118	36 Å²	36	61%	0.605	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-52.1	-176.4	-60.1	174.2	0	0	0	111.1	D622	D622-I624 VanDerWaalsContact C-N 3.29Å; D622-I624 PolarHBondContact O-N 2.88Å; D622-I624 PolarHBondContact OD1-N 3.26Å
625	S	77.9	Confident	86.1	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.042	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-21.8	179.3	73.1	0	0	0	0	112.8	I312 K317 D622 I627	I312-S625 WeakPolarHBondContact CG2-O 3Å; K317-S625 PolarHBondContact NZ-O 2.9Å; D622-S625 WeakPolarHBondContact OD2-CA 3.38Å; D622-S625 WeakPolarHBondContact OD2-CB 3.28Å; D622-S625 PolarHBondContact OD2-N 2.99Å; D622-S625 PolarHBondContact OD2-OG 3.44Å; S625-I627 PolarHBondContact O-N 3.06Å; S625-I627 PolarHBondContact OG-N 2.75Å
626	G	80.8	Confident	86.2	Confident	31 Å²	31	40.5 Å²	40.5	32%	0.32	22%	0.22	S	C	.	.			trans	65.2	20.9	-171.3	0	0	0	0	0	113.7	K317 D622	K317-G626 VanDerWaalsContact NZ-CA 3.27Å; K317-G626 PolarHBondContact NZ-O 3.06Å; D622-G626 WeakPolarHBondContact O-CA 3.42Å; D622-G626 PolarHBondContact O-N 3.05Å
627	I	85	Confident	86.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-86.2	137.2	173.3	-67.4	-178.5	0	0	0	109.1	I312 V407 L600 D622 S625 F629 L646	I312-I627 HydrophobicContact CD1-CD1 3.71Å; I312-I627 HydrophobicContact CG1-CD1 4.19Å; I312-I627 HydrophobicContact CG2-CD1 3.81Å; I312-I627 HydrophobicContact CG2-CG1 3.97Å; V407-I627 HydrophobicContact CG1-CD1 4.25Å; L600-I627 HydrophobicContact CD2-CD1 4.29Å; D622-I627 PolarHBondContact N-O 3.08Å; S625-I627 PolarHBondContact O-N 3.06Å; S625-I627 PolarHBondContact OG-N 2.75Å; I627-F629 HydrophobicContact CB-CE2 4.23Å; I627-F629 HydrophobicContact CB-CZ 4.33Å; I627-F629 HydrophobicContact CG2-CD2 4.39Å; I627-F629 HydrophobicContact CG2-CE1 4.13Å; I627-F629 HydrophobicContact CG2-CE2 3.98Å; I627-F629 HydrophobicContact CG2-CZ 3.84Å; I627-L646 HydrophobicContact CG2-CD1 3.51Å; I627-L646 HydrophobicContact CG2-CD2 3.92Å; I627-L646 HydrophobicContact CG2-CG 4.38Å
628	T	88.3	Confident	86	Confident	47 Å²	47	54.8 Å²	54.8	29%	0.288	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.9	172.9	-57.5	0	0	0	0	110.3	T604 N619 V620 T621 L646	T604-T628 HydrophobicContact CG2-CG2 4.08Å; N619-T628 HydrophobicContact CB-CG2 3.87Å; V620-T628 WeakPolarHBondContact O-CA 3.44Å; T621-T628 PolarHBondContact OG1-OG1 3.21Å; T628-L646 WeakPolarHBondContact O-CD1 3.47Å
629	F	91.1	Very high	85.9	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.013	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	147	173.4	-60.7	-83.6	0	0	0	110.1	F400 L403 N619 V620 D622 I627 V644 L646	F400-F629 HydrophobicContact CD1-CB 4.23Å; F400-F629 HydrophobicContact CD1-CD1 4.12Å; F400-F629 AromaticContact CD1-CD2 3.7Å; F400-F629 HydrophobicContact CD1-CD2 3.7Å; F400-F629 HydrophobicContact CD1-CE1 4.43Å; F400-F629 HydrophobicContact CD1-CE2 4.04Å; F400-F629 AromaticContact CD1-CG 3.74Å; F400-F629 HydrophobicContact CD1-CG 3.74Å; F400-F629 HydrophobicContact CD1-CZ 4.39Å; F400-F629 HydrophobicContact CE1-CB 3.81Å; F400-F629 AromaticContact CE1-CD2 3.91Å; F400-F629 HydrophobicContact CE1-CD2 3.91Å; F400-F629 AromaticContact CE1-CG 3.83Å; F400-F629 HydrophobicContact CE1-CG 3.83Å; L403-F629 HydrophobicContact CB-CE1 3.84Å; L403-F629 HydrophobicContact CD1-CD1 3.91Å; L403-F629 HydrophobicContact CD1-CE1 4.01Å; N619-F629 CarbonylContact C-O 3.54Å; N619-F629 WeakPolarHBondContact CA-O 3.47Å; V620-F629 PolarHBondContact N-O 3.45Å; V620-F629 PolarHBondContact O-N 3.19Å; D622-F629 HydrophobicContact CB-CE2 4.13Å; I627-F629 HydrophobicContact CB-CE2 4.23Å; I627-F629 HydrophobicContact CB-CZ 4.33Å; I627-F629 HydrophobicContact CG2-CD2 4.39Å; I627-F629 HydrophobicContact CG2-CE1 4.13Å; I627-F629 HydrophobicContact CG2-CE2 3.98Å; I627-F629 HydrophobicContact CG2-CZ 3.84Å; F629-V644 HydrophobicContact CB-CG1 4.03Å; F629-V644 HydrophobicContact CD1-CG1 4.06Å; F629-V644 HydrophobicContact CG-CG1 4.27Å; F629-L646 HydrophobicContact CD1-CB 4.13Å; F629-L646 HydrophobicContact CD1-CD2 4.47Å; F629-L646 HydrophobicContact CE1-CB 4.33Å; F629-L646 HydrophobicContact CE1-CD2 3.94Å
630	Q	92.7	Very high	85.8	Confident	19 Å²	19	53.1 Å²	53.1	9%	0.089	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.7	168.8	-174.7	177.1	68.7	0	0	109.3	T604 V617 M618 V644 G645	T604-Q630 HydrophobicContact CG2-CB 3.92Å; V617-Q630 HydrophobicContact CG1-CG 3.67Å; M618-Q630 CarbonylContact O-C 3.44Å; Q630-V644 CarbonylContact O-C 3.55Å; Q630-V644 WeakPolarHBondContact O-CA 3.42Å; Q630-G645 PolarHBondContact N-O 3.11Å; Q630-G645 PolarHBondContact O-N 3.48Å
631	I	91.4	Very high	85.9	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118	172.9	-56.9	176.2	0	0	0	107.3	L290 I297 F396 F400 V617 M618 V620 E643	L290-I631 HydrophobicContact CD1-CG2 4.49Å; L290-I631 HydrophobicContact CD2-CG2 4.07Å; I297-I631 HydrophobicContact CB-CD1 4.45Å; I297-I631 HydrophobicContact CD1-CD1 3.87Å; I297-I631 HydrophobicContact CG1-CD1 4.18Å; I297-I631 HydrophobicContact CG2-CD1 3.43Å; I297-I631 VanDerWaalsContact CG2-CD1 3.43Å; F396-I631 HydrophobicContact CE1-CG2 4.09Å; F396-I631 HydrophobicContact CZ-CG2 4.47Å; F400-I631 HydrophobicContact CZ-CD1 3.97Å; V617-I631 CarbonylContact C-O 3.53Å; V617-I631 VanDerWaalsContact CA-O 3.3Å; V617-I631 WeakPolarHBondContact CA-O 3.44Å; M618-I631 PolarHBondContact N-O 2.88Å; M618-I631 PolarHBondContact O-N 3.03Å; V620-I631 HydrophobicContact CB-CD1 4.33Å; V620-I631 HydrophobicContact CG2-CD1 3.55Å; V620-I631 HydrophobicContact CG2-CG1 4.3Å; I631-E643 CarbonylContact C-O 3.56Å; I631-E643 VanDerWaalsContact CA-O 3.25Å; I631-E643 WeakPolarHBondContact CA-O 3.13Å
632	A	90.3	Very high	86.1	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.033	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.9	175.7	0	0	0	0	0	110.7	A614 V617 Y634 Y642 E643	A614-A632 HydrophobicContact CB-CB 4.44Å; V617-A632 HydrophobicContact CG2-CB 4.16Å; A632-Y634 HydrophobicContact CB-CE2 3.72Å; A632-Y642 CarbonylContact O-C 3.59Å; A632-Y642 WeakPolarHBondContact O-CA 3.1Å; A632-E643 HydrophobicContact CB-CB 4.43Å; A632-E643 PolarHBondContact N-O 3.44Å; A632-E643 PolarHBondContact O-N 2.88Å
633	L	91	Very high	86.5	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.6	175.8	174.2	69.2	0	0	0	109.9	T289 L290 A614 D615 D616 V640 Y642	T289-L633 WeakPolarHBondContact OG1-CD2 3.44Å; L290-L633 HydrophobicContact CD1-CB 4.41Å; L290-L633 HydrophobicContact CD2-CB 4.23Å; L290-L633 HydrophobicContact CG-CB 4.29Å; A614-L633 CarbonylContact C-O 3.48Å; A614-L633 WeakPolarHBondContact CA-O 3.31Å; D615-L633 HydrophobicContact CB-CD2 4.48Å; D615-L633 PolarHBondContact N-O 2.77Å; D616-L633 HydrophobicContact CB-CB 4.15Å; D616-L633 HydrophobicContact CB-CD2 4.19Å; D616-L633 PolarHBondContact O-N 2.94Å; L633-V640 HydrophobicContact CD1-CG1 3.26Å; L633-Y642 HydrophobicContact CD1-CD1 3.67Å; L633-Y642 HydrophobicContact CD1-CE1 3.38Å; L633-Y642 HydrophobicContact CD1-CG 4.43Å
634	Y	89.7	Confident	87.3	Confident	30 Å²	30	50.5 Å²	50.5	12%	0.118	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.3	171.1	-58.4	-92.6	0	0	0	109.6	D612 N613 A614 A632 R641 E643	D612-Y634 WeakPolarHBondContact OD2-CE1 3.49Å; D612-Y634 PolarHBondContact OD2-OH 3.32Å; N613-Y634 HydrophobicContact CB-CD1 4.44Å; N613-Y634 WeakPolarHBondContact O-CD1 3.39Å; A614-Y634 HydrophobicContact CB-CD1 4.19Å; A614-Y634 HydrophobicContact CB-CE1 3.68Å; A614-Y634 HydrophobicContact CB-CE2 4.46Å; A614-Y634 VanDerWaalsContact N-CE1 3.32Å; A632-Y634 HydrophobicContact CB-CE2 3.72Å; Y634-R641 PolarHBondContact N-O 3.09Å; Y634-R641 PolarHBondContact O-N 3.25Å; Y634-E643 HydrophobicContact CD2-CG 4.03Å; Y634-E643 WeakPolarHBondContact CD2-OE1 3.41Å; Y634-E643 HydrophobicContact CE2-CG 3.88Å; Y634-E643 WeakPolarHBondContact CE2-OE1 3.47Å
635	R	86.5	Confident	88.2	Confident	131 Å²	131	45.1 Å²	45.1	49%	0.494	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.9	164.4	-63.4	169	-171	-173.6	6.4	108.5	T289 D615	T289-R635 PolarHBondContact OG1-NH2 2.87Å; D615-R635 WeakPolarHBondContact OD2-CA 3.39Å; D615-R635 WeakPolarHBondContact OD2-CB 3.48Å; D615-R635 WeakPolarHBondContact OD2-CD 3.48Å; D615-R635 WeakPolarHBondContact OD2-CG 3.5Å; D615-R635 PolarHBondContact OD2-N 2.89Å
636	Q	85.4	Confident	88.9	Confident	75 Å²	75	44.9 Å²	44.9	35%	0.35	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	171.8	179.8	-63.2	-179.7	-8.8	0	0	108.7	R638 Q639	Q636-R638 PolarHBondContact O-N 3.37Å; Q636-Q639 CarbonylContact C-O 3.56Å; Q636-Q639 WeakPolarHBondContact CA-O 3.33Å; Q636-Q639 HydrophobicContact CB-CG 3.59Å; Q636-Q639 PolarHBondContact N-O 2.95Å; Q636-Q639 PolarHBondContact O-N 2.85Å
637	Y	88.5	Confident	89.4	Confident	190 Å²	190	43.4 Å²	43.4	75%	0.745	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	111.1	-178.6	-176.5	-111	0	0	0	111.3	Q639	Y637-Q639 PolarHBondContact O-N 2.69Å; Y637-Q639 VanDerWaalsContact O-N 3.17Å
638	R	83.4	Confident	89.7	Confident	188 Å²	188	43.4 Å²	43.4	71%	0.709	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	19	-177.6	-57.9	-174.5	175.1	-163.2	-3.4	115.7	N375 G376 Q636	N375-R638 WeakPolarHBondContact CA-O 3.24Å; G376-R638 PolarHBondContact N-O 3.35Å; Q636-R638 PolarHBondContact O-N 3.37Å
639	Q	86.3	Confident	89.8	Confident	53 Å²	53	41.1 Å²	41.1	25%	0.248	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157.3	178.5	71.1	-169.7	-15.5	0	0	111.8	W374 N375 Q636 Y637	W374-Q639 CarbonylContact O-C 3.49Å; W374-Q639 VanDerWaalsContact O-CA 3.24Å; W374-Q639 WeakPolarHBondContact O-CA 3.43Å; W374-Q639 WeakPolarHBondContact O-CB 3.46Å; N375-Q639 HydrophobicContact CB-CB 4.1Å; Q636-Q639 CarbonylContact C-O 3.56Å; Q636-Q639 WeakPolarHBondContact CA-O 3.33Å; Q636-Q639 HydrophobicContact CB-CG 3.59Å; Q636-Q639 PolarHBondContact N-O 2.95Å; Q636-Q639 PolarHBondContact O-N 2.85Å; Y637-Q639 PolarHBondContact O-N 2.69Å; Y637-Q639 VanDerWaalsContact O-N 3.17Å
640	V	86.4	Confident	89.8	Confident	33 Å²	33	42.3 Å²	42.3	20%	0.2	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.6	174.5	-179.4	0	0	0	0	108.4	K373 W374 L633 Y642	K373-V640 WeakPolarHBondContact CA-O 3.41Å; W374-V640 PolarHBondContact N-O 3.12Å; W374-V640 PolarHBondContact O-N 3.24Å; L633-V640 HydrophobicContact CD1-CG1 3.26Å; V640-Y642 HydrophobicContact CB-CE2 4.47Å; V640-Y642 HydrophobicContact CG1-CD2 4.25Å; V640-Y642 HydrophobicContact CG1-CE1 4.33Å; V640-Y642 HydrophobicContact CG1-CE2 3.67Å
641	R	89	Confident	89.7	Confident	82 Å²	82	42.5 Å²	42.5	31%	0.309	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.5	175.3	-174.9	-176.1	-171.5	-155.8	4.4	109.3	V372 K373 Y634 E643	V372-R641 CarbonylContact O-C 3.4Å; K373-R641 HydrophobicContact CG-CB 4.4Å; Y634-R641 PolarHBondContact N-O 3.09Å; Y634-R641 PolarHBondContact O-N 3.25Å; R641-E643 VanDerWaalsContact CD-OE1 3.25Å; R641-E643 WeakPolarHBondContact CD-OE1 3.43Å; R641-E643 HydrophobicContact CG-CG 4.19Å; R641-E643 IonicContact CZ-OE1 2.66Å; R641-E643 IonicContact NE-OE1 2.81Å; R641-E643 PolarHBondContact NE-OE1 2.99Å; R641-E643 IonicContact NH1-OE1 2.71Å; R641-E643 PolarHBondContact NH1-OE1 2.88Å; R641-E643 IonicContact NH2-OE1 2.72Å
642	Y	91.6	Very high	89.6	Confident	19 Å²	19	43.6 Å²	43.6	8%	0.075	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	149.6	167.7	-53.6	-90.1	0	0	0	109.6	L290 L293 V372 L392 F396 A632 L633 V640	L290-Y642 HydrophobicContact CD2-CD1 4.3Å; L290-Y642 HydrophobicContact CD2-CE1 4.3Å; L293-Y642 HydrophobicContact CD1-CE1 3.65Å; V372-Y642 PolarHBondContact N-O 3.32Å; V372-Y642 PolarHBondContact O-N 2.81Å; V372-Y642 VanDerWaalsContact O-O 3.14Å; L392-Y642 HydrophobicContact CD1-CD2 3.95Å; L392-Y642 HydrophobicContact CD1-CE2 3.84Å; L392-Y642 HydrophobicContact CD2-CE2 4.26Å; F396-Y642 HydrophobicContact CE1-CG 4.49Å; F396-Y642 HydrophobicContact CE2-CD1 4.46Å; F396-Y642 HydrophobicContact CE2-CG 4.37Å; F396-Y642 AromaticContact CZ-CD1 3.72Å; F396-Y642 HydrophobicContact CZ-CD1 3.72Å; F396-Y642 HydrophobicContact CZ-CD2 4.34Å; F396-Y642 HydrophobicContact CZ-CE1 4.45Å; F396-Y642 AromaticContact CZ-CG 3.65Å; F396-Y642 HydrophobicContact CZ-CG 3.65Å; A632-Y642 CarbonylContact O-C 3.59Å; A632-Y642 WeakPolarHBondContact O-CA 3.1Å; L633-Y642 HydrophobicContact CD1-CD1 3.67Å; L633-Y642 HydrophobicContact CD1-CE1 3.38Å; L633-Y642 HydrophobicContact CD1-CG 4.43Å; V640-Y642 HydrophobicContact CB-CE2 4.47Å; V640-Y642 HydrophobicContact CG1-CD2 4.25Å; V640-Y642 HydrophobicContact CG1-CE1 4.33Å; V640-Y642 HydrophobicContact CG1-CE2 3.67Å
643	E	91.9	Very high	89.4	Confident	28 Å²	28	44.9 Å²	44.9	13%	0.131	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	122.2	-177.8	-55.9	-164.4	-175.4	0	0	108.9	M369 I631 A632 Y634 R641	M369-E643 HydrophobicContact CE-CB 3.62Å; M369-E643 HydrophobicContact CE-CG 3.28Å; M369-E643 WeakPolarHBondContact CE-OE2 3.38Å; I631-E643 CarbonylContact C-O 3.56Å; I631-E643 VanDerWaalsContact CA-O 3.25Å; I631-E643 WeakPolarHBondContact CA-O 3.13Å; A632-E643 HydrophobicContact CB-CB 4.43Å; A632-E643 PolarHBondContact N-O 3.44Å; A632-E643 PolarHBondContact O-N 2.88Å; Y634-E643 HydrophobicContact CD2-CG 4.03Å; Y634-E643 WeakPolarHBondContact CD2-OE1 3.41Å; Y634-E643 HydrophobicContact CE2-CG 3.88Å; Y634-E643 WeakPolarHBondContact CE2-OE1 3.47Å; R641-E643 VanDerWaalsContact CD-OE1 3.25Å; R641-E643 WeakPolarHBondContact CD-OE1 3.43Å; R641-E643 HydrophobicContact CG-CG 4.19Å; R641-E643 IonicContact CZ-OE1 2.66Å; R641-E643 IonicContact NE-OE1 2.81Å; R641-E643 PolarHBondContact NE-OE1 2.99Å; R641-E643 IonicContact NH1-OE1 2.71Å; R641-E643 PolarHBondContact NH1-OE1 2.88Å; R641-E643 IonicContact NH2-OE1 2.72Å
644	V	91.7	Very high	89.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	116.3	167.9	-174.3	0	0	0	0	107.8	M369 A370 F396 A399 F400 L403 F629 Q630	M369-V644 CarbonylContact C-O 3.52Å; M369-V644 WeakPolarHBondContact CA-O 3.43Å; A370-V644 HydrophobicContact CB-CB 4.47Å; A370-V644 PolarHBondContact N-O 2.93Å; A370-V644 PolarHBondContact O-N 2.87Å; F396-V644 HydrophobicContact CD1-CG2 3.63Å; F396-V644 HydrophobicContact CE1-CG2 3.9Å; A399-V644 HydrophobicContact CB-CB 4.14Å; A399-V644 HydrophobicContact CB-CG2 3.75Å; F400-V644 HydrophobicContact CD1-CG1 3.65Å; F400-V644 HydrophobicContact CE1-CG1 3.54Å; F400-V644 HydrophobicContact CE1-CG2 4.4Å; F400-V644 HydrophobicContact CZ-CG1 4.43Å; L403-V644 HydrophobicContact CD1-CB 4.26Å; L403-V644 HydrophobicContact CD1-CG1 3.74Å; L403-V644 WeakPolarHBondContact CD1-O 3.38Å; F629-V644 HydrophobicContact CB-CG1 4.03Å; F629-V644 HydrophobicContact CD1-CG1 4.06Å; F629-V644 HydrophobicContact CG-CG1 4.27Å; Q630-V644 CarbonylContact O-C 3.55Å; Q630-V644 WeakPolarHBondContact O-CA 3.42Å
645	G	92.3	Very high	89.4	Confident	5 Å²	5	49.5 Å²	49.5	5%	0.052	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.3	-174.1	0	0	0	0	0	113.5	K368 Q630	K368-G645 WeakPolarHBondContact O-CA 3.31Å; Q630-G645 PolarHBondContact N-O 3.11Å; Q630-G645 PolarHBondContact O-N 3.48Å
646	L	92.9	Very high	89.6	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	137.2	170.8	-176.4	67	0	0	0	110.4	K368 L403 V407 I627 T628 F629 W648	K368-L646 PolarHBondContact N-O 2.9Å; K368-L646 PolarHBondContact O-N 2.99Å; K368-L646 VanDerWaalsContact O-O 3.05Å; L403-L646 HydrophobicContact CD1-CB 4.16Å; V407-L646 HydrophobicContact CG2-CD2 3.67Å; I627-L646 HydrophobicContact CG2-CD1 3.51Å; I627-L646 HydrophobicContact CG2-CD2 3.92Å; I627-L646 HydrophobicContact CG2-CG 4.38Å; T628-L646 WeakPolarHBondContact O-CD1 3.47Å; F629-L646 HydrophobicContact CD1-CB 4.13Å; F629-L646 HydrophobicContact CD1-CD2 4.47Å; F629-L646 HydrophobicContact CE1-CB 4.33Å; F629-L646 HydrophobicContact CE1-CD2 3.94Å; L646-W648 HydrophobicContact CB-CE3 4.15Å; L646-W648 HydrophobicContact CB-CZ3 4.23Å; L646-W648 HydrophobicContact CD2-CD2 4.41Å; L646-W648 HydrophobicContact CD2-CE3 3.82Å; L646-W648 HydrophobicContact CD2-CZ3 4.27Å; L646-W648 HydrophobicContact CG-CE3 3.78Å; L646-W648 HydrophobicContact CG-CZ3 4.32Å; L646-W648 WeakPolarHBondContact O-CZ3 3.48Å
647	A	91.4	Very high	90	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.5	166.6	0	0	0	0	0	109.9	I364 K366 S602 R603	I364-A647 HydrophobicContact CG2-CB 3.92Å; K366-A647 CarbonylContact O-C 3.6Å; K366-A647 VanDerWaalsContact O-CA 3.24Å; K366-A647 WeakPolarHBondContact O-CA 3.45Å; S602-A647 CarbonylContact C-O 3.53Å; S602-A647 VanDerWaalsContact CA-O 3.32Å; S602-A647 WeakPolarHBondContact CA-O 3.4Å; R603-A647 HydrophobicContact CG-CB 4.24Å; R603-A647 PolarHBondContact N-O 3.02Å; R603-A647 PolarHBondContact O-N 3.45Å
648	W	92.1	Very high	90.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	165.1	-178.8	73.6	98.3	0	0	0	113.2	T365 K366 K368 L403 E406 V407 D410 L600 A601 L646	T365-W648 PolarHBondContact N-O 3.11Å; T365-W648 VanDerWaalsContact N-O 3.14Å; K366-W648 HydrophobicContact CB-CD2 4.04Å; K366-W648 HydrophobicContact CB-CE3 4.26Å; K366-W648 HydrophobicContact CB-CH2 4.27Å; K366-W648 HydrophobicContact CB-CZ2 3.98Å; K366-W648 HydrophobicContact CB-CZ3 4.39Å; K366-W648 HydrophobicContact CD-CH2 4.32Å; K366-W648 HydrophobicContact CD-CZ2 3.51Å; K366-W648 HydrophobicContact CG-CZ2 4.4Å; K366-W648 PolarHBondContact N-O 2.88Å; K366-W648 PolarHBondContact O-N 3.4Å; K366-W648 VanDerWaalsContact O-O 3.1Å; K368-W648 HydrophobicContact CB-CH2 4.04Å; K368-W648 HydrophobicContact CB-CZ3 3.93Å; K368-W648 HydrophobicContact CD-CH2 3.9Å; K368-W648 HydrophobicContact CG-CH2 4.13Å; K368-W648 HydrophobicContact CG-CZ3 4.34Å; L403-W648 HydrophobicContact CD2-CH2 4.38Å; L403-W648 HydrophobicContact CD2-CZ3 4.19Å; E406-W648 HydrophobicContact CB-CH2 4.22Å; E406-W648 HydrophobicContact CB-CZ2 3.89Å; E406-W648 HydrophobicContact CG-CH2 4.34Å; E406-W648 HydrophobicContact CG-CZ2 3.79Å; V407-W648 HydrophobicContact CG2-CB 4.46Å; V407-W648 HydrophobicContact CG2-CD2 3.64Å; V407-W648 HydrophobicContact CG2-CE3 4.18Å; V407-W648 HydrophobicContact CG2-CG 3.76Å; V407-W648 HydrophobicContact CG2-CZ2 4.21Å; D410-W648 PolarHBondContact OD2-NE1 2.89Å; L600-W648 HydrophobicContact CD1-CB 4.29Å; A601-W648 CarbonylContact O-C 3.56Å; A601-W648 WeakPolarHBondContact O-CA 3.42Å; A601-W648 WeakPolarHBondContact O-CB 3.33Å; L646-W648 HydrophobicContact CB-CE3 4.15Å; L646-W648 HydrophobicContact CB-CZ3 4.23Å; L646-W648 HydrophobicContact CD2-CD2 4.41Å; L646-W648 HydrophobicContact CD2-CE3 3.82Å; L646-W648 HydrophobicContact CD2-CZ3 4.27Å; L646-W648 HydrophobicContact CG-CE3 3.78Å; L646-W648 HydrophobicContact CG-CZ3 4.32Å; L646-W648 WeakPolarHBondContact O-CZ3 3.48Å
649	G	90.5	Very high	90.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	154.5	168.4	0	0	0	0	0	110.4	K363 A601	K363-G649 WeakPolarHBondContact O-CA 3.29Å; A601-G649 PolarHBondContact N-O 2.96Å; A601-G649 PolarHBondContact O-N 3.44Å
650	V	90.9	Very high	91.4	Very high	28 Å²	28	21.2 Å²	21.2	17%	0.17	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.7	-176.1	-56.4	0	0	0	0	109	D410 L411 L414 L599 L600	D410-V650 HydrophobicContact CB-CG1 4.21Å; D410-V650 HydrophobicContact CB-CG2 3.95Å; L411-V650 HydrophobicContact CD2-CB 3.9Å; L411-V650 HydrophobicContact CD2-CG1 3.47Å; L411-V650 VanDerWaalsContact CD2-CG1 3.47Å; L411-V650 HydrophobicContact CG-CG1 3.78Å; L414-V650 HydrophobicContact CD1-CB 3.74Å; L414-V650 HydrophobicContact CD1-CG2 3.86Å; L414-V650 HydrophobicContact CD2-CG2 4.05Å; L414-V650 HydrophobicContact CG-CB 4.38Å; L414-V650 HydrophobicContact CG-CG2 3.94Å; L599-V650 WeakPolarHBondContact O-CA 3.44Å; L600-V650 HydrophobicContact CD1-CG1 3.96Å
651	S	89.6	Confident	91.9	Very high	23 Å²	23	19.6 Å²	19.6	16%	0.161	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	146.2	178.8	-166.5	0	0	0	0	111.1	D361 L599	D361-S651 PolarHBondContact O-OG 2.73Å; L599-S651 PolarHBondContact N-O 2.79Å; L599-S651 PolarHBondContact O-N 2.9Å; L599-S651 VanDerWaalsContact O-N 3.09Å
652	S	89.5	Confident	92.2	Very high	23 Å²	23	15.7 Å²	15.7	16%	0.161	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	113.7	166.4	-179.8	0	0	0	0	108.4	G417	G417-S652 PolarHBondContact O-OG 2.6Å; G417-S652 VanDerWaalsContact O-OG 3.12Å
653	V	87.3	Confident	92.2	Very high	30 Å²	30	15.3 Å²	15.3	18%	0.182	9%	0.089	C	C	.	.	S	Bend	trans	-90.8	-38.5	-174.9	-175.8	0	0	0	0	111	V360 A597 L599	V360-V653 HydrophobicContact CB-CG1 4.34Å; V360-V653 HydrophobicContact CG1-CB 4.29Å; V360-V653 HydrophobicContact CG1-CG1 4.18Å; V360-V653 HydrophobicContact CG1-CG2 4.14Å; V360-V653 HydrophobicContact CG2-CG1 4.11Å; A597-V653 PolarHBondContact O-N 3.35Å; L599-V653 HydrophobicContact CB-CG2 3.65Å; L599-V653 HydrophobicContact CD2-CG2 4.16Å
654	K	88.9	Confident	92.3	Very high	94 Å²	94	14.7 Å²	14.7	41%	0.409	9%	0.087	S	C	.	.			trans	-135.7	86.1	178.2	-67.1	-169	177.7	-174.5	0	110.4	A597 A656 H657	A597-K654 PolarHBondContact O-N 3.35Å; K654-A656 PolarHBondContact O-N 2.93Å; K654-A656 VanDerWaalsContact O-N 3.17Å; K654-H657 HydrophobicContact CB-CB 4.34Å; K654-H657 PolarHBondContact O-N 2.78Å
655	P	90.6	Very high	92.3	Very high	37 Å²	37	15.4 Å²	15.4	24%	0.24	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-57.4	-31	179.8	-26.7	34.3	0	0	0	114.6	G417 S419 A567 A568 H657 G658	G417-P655 WeakPolarHBondContact O-CA 3.09Å; G417-P655 VanDerWaalsContact O-CB 3.24Å; G417-P655 WeakPolarHBondContact O-CB 3.36Å; S419-P655 PolarHBondContact N-O 3.12Å; S419-P655 VanDerWaalsContact N-O 3.07Å; A567-P655 HydrophobicContact CB-CB 4.22Å; A568-P655 CarbonylContact O-C 3.57Å; P655-H657 PolarHBondContact O-N 2.86Å; P655-H657 VanDerWaalsContact O-N 3.13Å; P655-G658 PolarHBondContact O-N 2.85Å; P655-G658 VanDerWaalsContact O-N 3.16Å
656	A	91	Very high	92.3	Very high	19 Å²	19	16 Å²	16	16%	0.157	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-58.1	-23.9	175.1	0	0	0	0	0	113.3	N449 A568 K654	N449-A656 VanDerWaalsContact CB-O 3.25Å; N449-A656 WeakPolarHBondContact CB-O 3.46Å; N449-A656 PolarHBondContact ND2-O 3.32Å; A568-A656 WeakPolarHBondContact O-CA 3.48Å; A568-A656 PolarHBondContact O-N 3.41Å; K654-A656 PolarHBondContact O-N 2.93Å; K654-A656 VanDerWaalsContact O-N 3.17Å
657	H	94	Very high	92.3	Very high	22 Å²	22	16.9 Å²	16.9	10%	0.102	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-100.3	21.4	-177.5	-58.4	-177.2	0	0	0	112.8	L446 A451 P452 F593 D594 A597 K654 P655	L446-H657 WeakPolarHBondContact CD2-O 3.25Å; A451-H657 HydrophobicContact CB-CB 3.92Å; P452-H657 VanDerWaalsContact CD-CE1 3.4Å; P452-H657 WeakPolarHBondContact CD-CE1 3.48Å; P452-H657 WeakPolarHBondContact CD-ND1 3.43Å; F593-H657 VanDerWaalsContact CA-O 3.25Å; F593-H657 WeakPolarHBondContact CA-O 2.9Å; F593-H657 WeakPolarHBondContact CB-O 3.2Å; D594-H657 HydrophobicContact CB-CB 4.21Å; D594-H657 PolarHBondContact N-O 2.8Å; D594-H657 VanDerWaalsContact N-O 3.1Å; A597-H657 HydrophobicContact CB-CB 3.88Å; A597-H657 WeakPolarHBondContact CB-O 3.15Å; K654-H657 HydrophobicContact CB-CB 4.34Å; K654-H657 PolarHBondContact O-N 2.78Å; P655-H657 PolarHBondContact O-N 2.86Å; P655-H657 VanDerWaalsContact O-N 3.13Å
658	G	94.4	Very high	92.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.9	173.3	0	0	0	0	0	111.7	A418 S419 A592 P655	A418-G658 CarbonylContact C-O 3.55Å; S419-G658 PolarHBondContact N-O 3.3Å; S419-G658 PolarHBondContact OG-O 2.91Å; S419-G658 VanDerWaalsContact OG-O 3.13Å; A592-G658 CarbonylContact O-C 3.55Å; P655-G658 PolarHBondContact O-N 2.85Å; P655-G658 VanDerWaalsContact O-N 3.16Å
659	C	96.4	Very high	92.3	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.007	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.3	175.8	-179.7	0	0	0	0	109.8	R420 V445 L446 A592	R420-C659 CarbonylContact O-C 3.6Å; R420-C659 VanDerWaalsContact O-CA 3.32Å; R420-C659 WeakPolarHBondContact O-CA 3.5Å; R420-C659 PolarHBondContact O-SG 3.03Å; R420-C659 VanDerWaalsContact O-SG 3.39Å; V445-C659 HydrophobicContact CB-CB 4.32Å; V445-C659 HydrophobicContact CG1-CB 3.83Å; L446-C659 HydrophobicContact CD2-CB 4.28Å; L446-C659 HydrophobicContact CG-CB 4.39Å; A592-C659 PolarHBondContact N-O 3.05Å; A592-C659 PolarHBondContact O-N 3.4Å; A592-C659 VanDerWaalsContact O-O 3.11Å
660	L	97	Very high	92.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	139.6	172.3	-56.5	-178.6	0	0	0	111.1	Y415 A418 R420 A421 V422 I544 V555 F587 N590 M591 L662	Y415-L660 HydrophobicContact CD2-CD1 3.93Å; A418-L660 HydrophobicContact CB-CD2 3.79Å; A418-L660 HydrophobicContact CB-CG 3.82Å; R420-L660 PolarHBondContact O-N 2.87Å; A421-L660 CarbonylContact C-O 3.55Å; A421-L660 VanDerWaalsContact CA-O 3.29Å; A421-L660 WeakPolarHBondContact CA-O 3.32Å; A421-L660 HydrophobicContact CB-CB 3.98Å; V422-L660 PolarHBondContact N-O 2.95Å; I544-L660 HydrophobicContact CD1-CD1 4.23Å; V555-L660 HydrophobicContact CG2-CD1 3.77Å; V555-L660 HydrophobicContact CG2-CG 4.21Å; F587-L660 HydrophobicContact CE2-CD1 4.36Å; N590-L660 CarbonylContact O-C 3.38Å; N590-L660 VanDerWaalsContact O-CA 3.28Å; N590-L660 WeakPolarHBondContact O-CA 3.22Å; M591-L660 HydrophobicContact CG-CD2 3.75Å; L660-L662 HydrophobicContact CB-CD2 4.34Å
661	I	96.7	Very high	92.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.8	166.7	-54.3	173.9	0	0	0	107.3	V422 P429 D438 A442 M458 N590 A592	V422-I661 HydrophobicContact CG2-CB 4.45Å; V422-I661 HydrophobicContact CG2-CG1 3.99Å; P429-I661 HydrophobicContact CB-CG2 3.58Å; P429-I661 HydrophobicContact CG-CG2 3.95Å; D438-I661 HydrophobicContact CB-CG2 4.05Å; A442-I661 HydrophobicContact CB-CD1 3.84Å; A442-I661 HydrophobicContact CB-CG1 3.82Å; M458-I661 HydrophobicContact CE-CD1 3.68Å; M458-I661 HydrophobicContact CG-CD1 4.26Å; M458-I661 HydrophobicContact SD-CD1 3.79Å; N590-I661 HydrophobicContact CB-CB 4.2Å; N590-I661 VanDerWaalsContact CB-O 3.3Å; N590-I661 WeakPolarHBondContact CB-O 3.38Å; N590-I661 PolarHBondContact N-O 2.84Å; N590-I661 PolarHBondContact ND2-O 2.9Å; N590-I661 PolarHBondContact O-N 2.82Å; A592-I661 HydrophobicContact CB-CD1 4.29Å
662	L	95.7	Very high	92.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.2	-174.8	-55.8	-175.6	0	0	0	111.4	A421 V422 A425 I544 Q553 V584 F587 L660	A421-L662 HydrophobicContact CB-CD1 4.14Å; A421-L662 HydrophobicContact CB-CD2 3.9Å; A421-L662 HydrophobicContact CB-CG 4.01Å; V422-L662 WeakPolarHBondContact O-CG 3.36Å; V422-L662 PolarHBondContact O-N 3.25Å; A425-L662 HydrophobicContact CB-CD1 4.37Å; I544-L662 HydrophobicContact CD1-CD1 4.04Å; I544-L662 HydrophobicContact CD1-CD2 3.26Å; I544-L662 HydrophobicContact CD1-CG 4.24Å; Q553-L662 VanDerWaalsContact OE1-CD1 3.24Å; V584-L662 HydrophobicContact CG1-CD1 4.25Å; F587-L662 HydrophobicContact CB-CB 4.49Å; F587-L662 HydrophobicContact CB-CD2 4.15Å; F587-L662 HydrophobicContact CD1-CD2 4.5Å; F587-L662 HydrophobicContact CD2-CD2 3.65Å; F587-L662 HydrophobicContact CE2-CD2 4.14Å; F587-L662 HydrophobicContact CG-CD2 3.87Å; L660-L662 HydrophobicContact CB-CD2 4.34Å
663	G	92.3	Very high	93.1	Very high	10 Å²	10	19.4 Å²	19.4	10%	0.103	11%	0.109	C	C	.	.			trans	-137.5	0	-178.7	0	0	0	0	0	115.8	G426 T427 T428 F587 T588	G426-G663 PolarHBondContact N-O 3.39Å; T427-G663 WeakPolarHBondContact O-CA 3.49Å; T428-G663 WeakPolarHBondContact CA-OXT 3.19Å; T428-G663 PolarHBondContact N-OXT 2.85Å; T428-G663 PolarHBondContact OG1-OXT 3.18Å; F587-G663 CarbonylContact C-O 3.52Å; F587-G663 WeakPolarHBondContact CA-O 3.48Å; T588-G663 PolarHBondContact N-O 3.24Å; T588-G663 PolarHBondContact O-N 3.07Å; T588-G663 VanDerWaalsContact O-N 3.08Å

Retrieved 663 of 663 residues in 171.6 ms (Link to these results)

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