A0A096MQK8_PAPAN Loading...

Interleukin-1 receptor-like 1

Inhibits IL-33 signaling. Receptor for interleukin-33 (IL-33) which plays crucial roles in innate and adaptive immunity, contributing to tissue homeostasis and responses to environmental stresses together with coreceptor IL1RAP. Its stimulation recruits MYD88, IRAK1, IRAK4, and TRAF6, followed by phosphorylation of MAPK3/ERK1 and/or MAPK1/ERK2, MAPK14, and MAPK8. Possibly involved in helper T-cell function. Upon tissue injury, induces UCP2-dependent mitochondrial rewiring that attenuates the generation of reactive oxygen species and preserves the integrity of Krebs cycle required for persistent production of itaconate and subsequent GATA3-dependent differentiation of inflammation-resolving alternatively activated macrophages.

AlphaFold DB , UniProt , Accession A0A096MQK8, Species PAPAN (Papio anubis, Olive baboon), Gene IL1RL1, Length 556 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	49.2	Very low	47	Very low	208 Å²	208	115.9 Å²	115.9	100%	1.025	61%	0.613	S	S	*	*				0	-12.1	0	-82.7	-155.6	-84.4	0	0	115.2	I5	M1-I5 WeakPolarHBondContact O-CD1 3.34Å; M1-I5 WeakPolarHBondContact O-CG1 3.47Å
2	G	49.1	Very low	46.3	Very low	50 Å²	50	114.9 Å²	114.9	52%	0.515	61%	0.608	S	S	.	*	H	α-helix	trans	-75.4	-34.5	-177.2	0	0	0	0	0	116.8	L6	G2-L6 PolarHBondContact O-N 3.34Å
3	L	44.8	Very low	46.2	Very low	154 Å²	154	112.3 Å²	112.3	81%	0.806	60%	0.599	S	S	*	*	H	α-helix	trans	-73.5	-32.8	-176.6	-90.4	109.4	0	0	0	114.2	A7	L3-A7 PolarHBondContact O-N 3.28Å
4	W	40.7	Very low	45.8	Very low	202 Å²	202	117.1 Å²	117.1	77%	0.765	61%	0.606	S	S	*	*	H	α-helix	trans	-72.2	-32.9	178	-82.5	75.5	0	0	0	112.2	A7 I8	W4-A7 PolarHBondContact O-N 2.65Å; W4-I8 WeakPolarHBondContact O-CB 3.5Å; W4-I8 WeakPolarHBondContact O-CD1 3.29Å; W4-I8 WeakPolarHBondContact O-CG1 3.31Å; W4-I8 PolarHBondContact O-N 3.22Å
5	I	48.9	Very low	45.2	Very low	98 Å²	98	114.6 Å²	114.6	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-68.8	-38.5	177	-63.1	170.1	0	0	0	110.8	M1 I8 L9	M1-I5 WeakPolarHBondContact O-CD1 3.34Å; M1-I5 WeakPolarHBondContact O-CG1 3.47Å; I5-I8 PolarHBondContact O-N 2.92Å; I5-L9 HydrophobicContact CG2-CD1 3.95Å; I5-L9 WeakPolarHBondContact O-CB 3.37Å; I5-L9 PolarHBondContact O-N 3.27Å
6	L	48	Very low	45.1	Very low	122 Å²	122	112.1 Å²	112.1	64%	0.639	59%	0.593	S	S	*	*	H	α-helix	trans	-66.1	-39.1	174.3	-95.6	144.2	0	0	0	112.9	G2 T10	G2-L6 PolarHBondContact O-N 3.34Å; L6-T10 WeakPolarHBondContact O-CB 3.39Å; L6-T10 VanDerWaalsContact O-CG2 3.32Å; L6-T10 WeakPolarHBondContact O-CG2 3.38Å; L6-T10 PolarHBondContact O-N 3.25Å; L6-T10 PolarHBondContact O-OG1 3.11Å
7	A	48.7	Very low	45.2	Very low	43 Å²	43	106.6 Å²	106.6	36%	0.355	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-40.9	174.6	0	0	0	0	0	112	L3 W4 T10 I11	L3-A7 PolarHBondContact O-N 3.28Å; W4-A7 PolarHBondContact O-N 2.65Å; A7-T10 WeakPolarHBondContact CA-OG1 3.42Å; A7-T10 PolarHBondContact O-N 2.84Å; A7-T10 PolarHBondContact O-OG1 2.85Å; A7-I11 WeakPolarHBondContact O-CB 3.19Å; A7-I11 WeakPolarHBondContact O-CD1 3.38Å; A7-I11 WeakPolarHBondContact O-CG1 3.25Å; A7-I11 PolarHBondContact O-N 3.4Å
8	I	51.5	Low	45.3	Very low	90 Å²	90	104.6 Å²	104.6	46%	0.462	57%	0.568	S	S	.	*	H	α-helix	trans	-69.5	-39.7	179	-66.2	163.4	0	0	0	111.2	W4 I5 I11 L12	W4-I8 WeakPolarHBondContact O-CB 3.5Å; W4-I8 WeakPolarHBondContact O-CD1 3.29Å; W4-I8 WeakPolarHBondContact O-CG1 3.31Å; W4-I8 PolarHBondContact O-N 3.22Å; I5-I8 PolarHBondContact O-N 2.92Å; I8-I11 PolarHBondContact O-N 3.5Å; I8-L12 HydrophobicContact CG2-CD1 3.78Å; I8-L12 WeakPolarHBondContact O-CB 3.46Å; I8-L12 PolarHBondContact O-N 3.14Å
9	L	44	Very low	45.4	Very low	106 Å²	106	108.9 Å²	108.9	56%	0.555	58%	0.581	S	S	*	*	H	α-helix	trans	-64.8	-41.3	174.6	-105	137	0	0	0	112.5	I5 L12 V13	I5-L9 HydrophobicContact CG2-CD1 3.95Å; I5-L9 WeakPolarHBondContact O-CB 3.37Å; I5-L9 PolarHBondContact O-N 3.27Å; L9-L12 PolarHBondContact O-N 2.83Å; L9-V13 WeakPolarHBondContact O-CB 3.37Å; L9-V13 WeakPolarHBondContact O-CG2 3.37Å; L9-V13 PolarHBondContact O-N 3.09Å
10	T	47.7	Very low	45.8	Very low	86 Å²	86	109.2 Å²	109.2	53%	0.528	58%	0.577	S	S	.	*	H	α-helix	trans	-67.4	-38.1	177.4	46.7	0	0	0	0	112.1	L6 A7 Y14	L6-T10 WeakPolarHBondContact O-CB 3.39Å; L6-T10 VanDerWaalsContact O-CG2 3.32Å; L6-T10 WeakPolarHBondContact O-CG2 3.38Å; L6-T10 PolarHBondContact O-N 3.25Å; L6-T10 PolarHBondContact O-OG1 3.11Å; A7-T10 WeakPolarHBondContact CA-OG1 3.42Å; A7-T10 PolarHBondContact O-N 2.84Å; A7-T10 PolarHBondContact O-OG1 2.85Å; T10-Y14 WeakPolarHBondContact O-CB 3.29Å; T10-Y14 PolarHBondContact O-N 3.15Å
11	I	44.6	Very low	46.9	Very low	116 Å²	116	106 Å²	106	60%	0.595	56%	0.564	S	S	*	*	H	α-helix	trans	-68.7	-40.1	175.8	-65.9	166.1	0	0	0	111.9	A7 I8 Y14 S15	A7-I11 WeakPolarHBondContact O-CB 3.19Å; A7-I11 WeakPolarHBondContact O-CD1 3.38Å; A7-I11 WeakPolarHBondContact O-CG1 3.25Å; A7-I11 PolarHBondContact O-N 3.4Å; I8-I11 PolarHBondContact O-N 3.5Å; I11-Y14 PolarHBondContact O-N 3.12Å; I11-S15 VanDerWaalsContact O-CB 3.23Å; I11-S15 WeakPolarHBondContact O-CB 3.21Å; I11-S15 PolarHBondContact O-N 3.05Å
12	L	38.5	Very low	48.4	Very low	104 Å²	104	101.8 Å²	101.8	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-68.7	-35.7	175.4	-98.6	136.3	0	0	0	113	I8 L9 T16	I8-L12 HydrophobicContact CG2-CD1 3.78Å; I8-L12 WeakPolarHBondContact O-CB 3.46Å; I8-L12 PolarHBondContact O-N 3.14Å; L9-L12 PolarHBondContact O-N 2.83Å; L12-T16 WeakPolarHBondContact O-CB 3.44Å; L12-T16 WeakPolarHBondContact O-CG2 3.24Å; L12-T16 PolarHBondContact O-N 2.98Å; L12-T16 PolarHBondContact O-OG1 2.92Å
13	V	44.7	Very low	50.2	Low	81 Å²	81	105.2 Å²	105.2	49%	0.491	54%	0.542	S	S	.	.	H	α-helix	trans	-69.3	-40.1	174.8	171.9	0	0	0	0	111.1	L9 T16 A17	L9-V13 WeakPolarHBondContact O-CB 3.37Å; L9-V13 WeakPolarHBondContact O-CG2 3.37Å; L9-V13 PolarHBondContact O-N 3.09Å; V13-T16 PolarHBondContact O-OG1 3.42Å; V13-A17 WeakPolarHBondContact O-CB 3.26Å; V13-A17 PolarHBondContact O-N 3.05Å
14	Y	41.3	Very low	52.5	Low	180 Å²	180	99 Å²	99	71%	0.706	51%	0.512	S	S	*	.	H	α-helix	trans	-66.7	-39.8	175.4	-142.3	-92.8	0	0	0	111.9	T10 I11 A17 A18	T10-Y14 WeakPolarHBondContact O-CB 3.29Å; T10-Y14 PolarHBondContact O-N 3.15Å; I11-Y14 PolarHBondContact O-N 3.12Å; Y14-A17 PolarHBondContact O-N 3.24Å; Y14-A18 PolarHBondContact O-N 3.43Å
15	S	36.4	Very low	55	Low	79 Å²	79	91.1 Å²	91.1	55%	0.552	48%	0.482	S	S	*	.	H	α-helix	trans	-71.6	-32.4	179.6	-168.7	0	0	0	0	113.6	I11	I11-S15 VanDerWaalsContact O-CB 3.23Å; I11-S15 WeakPolarHBondContact O-CB 3.21Å; I11-S15 PolarHBondContact O-N 3.05Å
16	T	43.7	Very low	57.1	Low	74 Å²	74	86.8 Å²	86.8	45%	0.454	46%	0.461	S	S	.	.	H	α-helix	trans	-78.5	-32	173.7	50	0	0	0	0	112.9	L12 V13 F20	L12-T16 WeakPolarHBondContact O-CB 3.44Å; L12-T16 WeakPolarHBondContact O-CG2 3.24Å; L12-T16 PolarHBondContact O-N 2.98Å; L12-T16 PolarHBondContact O-OG1 2.92Å; V13-T16 PolarHBondContact O-OG1 3.42Å; T16-F20 WeakPolarHBondContact O-CD2 3.4Å
17	A	46.4	Very low	59.2	Low	19 Å²	19	82.2 Å²	82.2	16%	0.157	44%	0.437	C	S	.	.	H	α-helix	trans	-64.4	-39.1	173.5	0	0	0	0	0	112.2	V13 Y14 K19 F20 S21 Y99	V13-A17 WeakPolarHBondContact O-CB 3.26Å; V13-A17 PolarHBondContact O-N 3.05Å; Y14-A17 PolarHBondContact O-N 3.24Å; A17-K19 PolarHBondContact O-N 3.14Å; A17-F20 PolarHBondContact O-N 3.44Å; A17-S21 WeakPolarHBondContact O-CB 3.3Å; A17-S21 PolarHBondContact O-N 3.2Å; A17-Y99 HydrophobicContact CB-CD2 4.25Å; A17-Y99 HydrophobicContact CB-CE2 4.24Å; A17-Y99 HydrophobicContact CB-CG 4.45Å
18	A	46.3	Very low	61.4	Low	70 Å²	70	82.7 Å²	82.7	58%	0.579	43%	0.433	S	S	*	.	H	α-helix	trans	-61.8	-38.1	178.9	0	0	0	0	0	113.3	Y14 F20 S21	Y14-A18 PolarHBondContact O-N 3.43Å; A18-F20 VanDerWaalsContact C-N 3.33Å; A18-F20 PolarHBondContact O-N 3.1Å; A18-S21 PolarHBondContact O-OG 3.23Å
19	K	47.9	Very low	63.5	Low	187 Å²	187	83.8 Å²	83.8	81%	0.813	44%	0.439	S	S	*	.	H	α-helix	trans	-74.2	-15.9	178.5	-90	-177	176.2	177.9	0	114.9	A17	A17-K19 PolarHBondContact O-N 3.14Å
20	F	53.3	Low	65.9	Low	115 Å²	115	79.4 Å²	79.4	50%	0.504	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	11.9	-178.1	-70.3	-73.7	0	0	0	113.8	T16 A17 A18	T16-F20 WeakPolarHBondContact O-CD2 3.4Å; A17-F20 PolarHBondContact O-N 3.44Å; A18-F20 VanDerWaalsContact C-N 3.33Å; A18-F20 PolarHBondContact O-N 3.1Å
21	S	68.8	Low	68.2	Low	42 Å²	42	75.5 Å²	75.5	29%	0.294	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.8	176	73.2	0	0	0	0	111.3	A17 A18 Y99	A17-S21 WeakPolarHBondContact O-CB 3.3Å; A17-S21 PolarHBondContact O-N 3.2Å; A18-S21 PolarHBondContact O-OG 3.23Å; S21-Y99 CarbonylContact C-O 3.56Å; S21-Y99 WeakPolarHBondContact CA-O 3.48Å
22	K	80.7	Confident	70.7	Confident	119 Å²	119	70.5 Å²	70.5	52%	0.517	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122	169.5	-170	176.6	179.6	-179.3	0	108.2	P37 Y99 A100 N101	K22-P37 HydrophobicContact CB-CB 3.97Å; K22-P37 HydrophobicContact CB-CG 3.63Å; K22-Y99 PolarHBondContact N-O 3.03Å; K22-A100 WeakPolarHBondContact O-CA 3.25Å; K22-N101 PolarHBondContact O-N 2.88Å
23	Q	88.2	Confident	73.5	Confident	122 Å²	122	65.9 Å²	65.9	57%	0.57	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	135	173.8	-168.8	172	-3.7	0	0	110	N101	Q23-N101 CarbonylContact C-O 3.56Å; Q23-N101 WeakPolarHBondContact CA-O 3.34Å
24	S	91.6	Very high	75.9	Confident	23 Å²	23	62.1 Å²	62.1	16%	0.161	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.8	172.6	-61.3	0	0	0	0	107.8	N101 V102 T103	S24-N101 PolarHBondContact N-O 3.13Å; S24-N101 VanDerWaalsContact O-O 3.09Å; S24-V102 WeakPolarHBondContact O-CA 3.3Å; S24-T103 PolarHBondContact O-N 3.47Å
25	W	93.7	Very high	78.4	Confident	37 Å²	37	59 Å²	59	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	159.5	-179.2	55.7	-102.9	0	0	0	110.4	L32 T103 Y105 L117 Y119	W25-L32 WeakPolarHBondContact O-CD1 3.39Å; W25-T103 WeakPolarHBondContact CA-O 3.31Å; W25-T103 WeakPolarHBondContact CB-O 3.42Å; W25-Y105 HydrophobicContact CB-CD2 4.32Å; W25-Y105 HydrophobicContact CB-CE2 3.89Å; W25-L117 HydrophobicContact CD2-CD2 4.01Å; W25-L117 HydrophobicContact CE3-CB 4.47Å; W25-L117 HydrophobicContact CE3-CD2 3.76Å; W25-L117 HydrophobicContact CG-CD2 4.38Å; W25-L117 VanDerWaalsContact CH2-C 3.44Å; W25-L117 HydrophobicContact CH2-CB 4.37Å; W25-L117 WeakPolarHBondContact CH2-O 3.46Å; W25-L117 WeakPolarHBondContact CZ2-O 3.35Å; W25-L117 HydrophobicContact CZ3-CB 4.23Å; W25-L117 HydrophobicContact CZ3-CD2 4.31Å; W25-Y119 AromaticContact CH2-CD2 3.85Å; W25-Y119 HydrophobicContact CH2-CD2 3.85Å; W25-Y119 AromaticContact CH2-CE2 3.33Å; W25-Y119 HydrophobicContact CH2-CE2 3.33Å; W25-Y119 AromaticContact CZ2-CD2 3.72Å; W25-Y119 HydrophobicContact CZ2-CD2 3.72Å; W25-Y119 HydrophobicContact CZ2-CE1 4.48Å; W25-Y119 AromaticContact CZ2-CE2 3.42Å; W25-Y119 HydrophobicContact CZ2-CE2 3.42Å; W25-Y119 VanDerWaalsContact CZ2-CE2 3.42Å; W25-Y119 HydrophobicContact CZ2-CG 4.39Å; W25-Y119 AromaticContact CZ2-CZ 3.86Å; W25-Y119 HydrophobicContact CZ3-CE2 4.37Å
26	G	92.4	Very high	81.1	Confident	7 Å²	7	55.4 Å²	55.4	7%	0.072	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	173.3	176.8	0	0	0	0	0	111.4	T103 I104 Y105	G26-T103 PolarHBondContact N-O 3.41Å; G26-T103 VanDerWaalsContact N-O 3.16Å; G26-I104 WeakPolarHBondContact O-CA 3.49Å; G26-Y105 PolarHBondContact O-N 2.94Å
27	L	93.8	Very high	83.3	Confident	26 Å²	26	53.7 Å²	53.7	14%	0.136	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147	175.4	-63.7	179.9	0	0	0	110.7	E30 Y105 L117	L27-E30 HydrophobicContact CB-CB 4.46Å; L27-E30 HydrophobicContact CB-CG 4.12Å; L27-E30 PolarHBondContact O-N 3.07Å; L27-Y105 CarbonylContact C-O 3.5Å; L27-Y105 WeakPolarHBondContact CA-O 3.14Å; L27-L117 HydrophobicContact CD2-CD1 4.06Å
28	E	94.6	Very high	85.3	Confident	54 Å²	54	57 Å²	57	25%	0.252	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	139	172.4	-172	178.5	-123.9	0	0	110.4	E30 A77 V79 I104 Y105	E28-E30 PolarHBondContact O-N 2.95Å; E28-A77 WeakPolarHBondContact CA-O 3.36Å; E28-V79 HydrophobicContact CB-CG2 4.13Å; E28-V79 HydrophobicContact CG-CG2 4.19Å; E28-V79 WeakPolarHBondContact OE1-CG2 3.07Å; E28-I104 HydrophobicContact CB-CG2 4.35Å; E28-Y105 PolarHBondContact N-O 2.91Å
29	N	93.9	Very high	86.7	Confident	112 Å²	112	60.9 Å²	60.9	60%	0.599	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	6	-175.9	-51	-58.2	0	0	0	115.7	A77	N29-A77 PolarHBondContact N-O 3.26Å
30	E	95.5	Very high	88	Confident	15 Å²	15	53.1 Å²	53.1	7%	0.07	26%	0.259	C	S	.	.	S	Bend	trans	-101	159.2	171.2	-65.2	-167	179.1	0	0	111.5	L27 E28 A77 S193 T195	L27-E30 HydrophobicContact CB-CB 4.46Å; L27-E30 HydrophobicContact CB-CG 4.12Å; L27-E30 PolarHBondContact O-N 3.07Å; E28-E30 PolarHBondContact O-N 2.95Å; E30-A77 WeakPolarHBondContact O-CB 3.3Å; E30-A77 PolarHBondContact O-N 3.3Å; E30-S193 CarbonylContact C-O 3.53Å; E30-S193 WeakPolarHBondContact CA-O 3.33Å; E30-S193 WeakPolarHBondContact CB-O 3.29Å; E30-T195 VanDerWaalsContact CD-OG1 3.28Å; E30-T195 WeakPolarHBondContact OE1-CG2 3.48Å; E30-T195 PolarHBondContact OE1-OG1 3.01Å; E30-T195 PolarHBondContact OE2-N 3.32Å; E30-T195 PolarHBondContact OE2-OG1 3.38Å
31	A	96.7	Very high	89.2	Confident	4 Å²	4	53.9 Å²	53.9	3%	0.033	26%	0.262	C	S	.	.			trans	-74.3	132.5	168.7	0	0	0	0	0	110.2	F74 L75 Y139 H185 Y192 S193 V194	A31-F74 WeakPolarHBondContact CA-O 3.47Å; A31-L75 HydrophobicContact CB-CD2 3.43Å; A31-L75 VanDerWaalsContact CB-CD2 3.43Å; A31-Y139 HydrophobicContact CB-CE1 4.25Å; A31-Y139 PolarHBondContact O-OH 2.98Å; A31-H185 HydrophobicContact CB-CB 4.28Å; A31-Y192 VanDerWaalsContact CB-CB 3.44Å; A31-Y192 HydrophobicContact CB-CG 4.18Å; A31-S193 PolarHBondContact N-O 3.43Å; A31-V194 HydrophobicContact CB-CG2 3.76Å
32	L	96.6	Very high	89.6	Confident	11 Å²	11	58.3 Å²	58.3	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.9	172.1	178.9	64	0	0	0	109.3	W25 V34 F74 A77 V102 I104	W25-L32 WeakPolarHBondContact O-CD1 3.39Å; L32-V34 HydrophobicContact CD1-CG2 4.35Å; L32-V34 HydrophobicContact CD2-CG2 4.12Å; L32-V34 HydrophobicContact CG-CG2 3.94Å; L32-F74 HydrophobicContact CB-CB 4.21Å; L32-F74 HydrophobicContact CB-CD2 4.19Å; L32-F74 HydrophobicContact CD2-CD2 4.23Å; L32-F74 HydrophobicContact CD2-CE2 4.49Å; L32-F74 HydrophobicContact CG-CD2 4.21Å; L32-F74 PolarHBondContact N-O 3.35Å; L32-F74 WeakPolarHBondContact O-CD2 3.46Å; L32-F74 PolarHBondContact O-N 2.86Å; L32-A77 HydrophobicContact CB-CB 4.22Å; L32-V102 HydrophobicContact CD2-CG1 3.76Å; L32-I104 HydrophobicContact CD2-CG1 4.25Å
33	I	96.5	Very high	89.5	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.6	173.7	-61.5	-179.3	0	0	0	109	L71 L72 K73 L138 Y139	I33-L71 HydrophobicContact CG2-CB 4.03Å; I33-L71 HydrophobicContact CG2-CD1 4.16Å; I33-L71 HydrophobicContact CG2-CD2 4.09Å; I33-L71 HydrophobicContact CG2-CG 4.31Å; I33-L72 WeakPolarHBondContact CA-O 3.37Å; I33-K73 HydrophobicContact CD1-CD 4.3Å; I33-K73 HydrophobicContact CD1-CG 4.39Å; I33-K73 HydrophobicContact CG1-CB 4.44Å; I33-K73 HydrophobicContact CG1-CG 4.09Å; I33-K73 HydrophobicContact CG2-CG 4.37Å; I33-L138 HydrophobicContact CB-CB 4.25Å; I33-L138 WeakPolarHBondContact CD1-O 3.22Å; I33-L138 HydrophobicContact CG2-CB 4.09Å; I33-L138 WeakPolarHBondContact O-CD1 3.22Å; I33-Y139 HydrophobicContact CB-CD1 4.4Å; I33-Y139 HydrophobicContact CB-CE1 3.91Å; I33-Y139 HydrophobicContact CD1-CD1 3.55Å; I33-Y139 HydrophobicContact CD1-CE1 3.86Å; I33-Y139 HydrophobicContact CD1-CG 4.25Å; I33-Y139 HydrophobicContact CG1-CD1 3.87Å; I33-Y139 HydrophobicContact CG1-CE1 3.59Å; I33-Y139 PolarHBondContact N-OH 3.13Å; I33-Y139 VanDerWaalsContact N-OH 3.13Å
34	V	95.4	Very high	89.4	Confident	2 Å²	2	54 Å²	54	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.8	-177.3	-178.6	0	0	0	0	109.5	L32 L71 L72 F74 A100 V102	L32-V34 HydrophobicContact CD1-CG2 4.35Å; L32-V34 HydrophobicContact CD2-CG2 4.12Å; L32-V34 HydrophobicContact CG-CG2 3.94Å; V34-L71 WeakPolarHBondContact O-CA 3.34Å; V34-L72 HydrophobicContact CB-CB 4.41Å; V34-L72 PolarHBondContact N-O 3.47Å; V34-L72 PolarHBondContact O-N 3.05Å; V34-F74 HydrophobicContact CG2-CE2 4.01Å; V34-A100 HydrophobicContact CG1-CB 3.86Å; V34-V102 HydrophobicContact CG1-CG2 4.36Å; V34-V102 HydrophobicContact CG2-CG2 4.02Å
35	R	93.9	Very high	89.2	Confident	115 Å²	115	58.4 Å²	58.4	43%	0.434	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	138.7	175	-176.8	176.5	-76.8	153.7	-3.9	110.8	Q70 L71 L138	R35-Q70 WeakPolarHBondContact CA-O 3.47Å; R35-L71 HydrophobicContact CB-CD2 3.98Å; R35-L71 HydrophobicContact CG-CD2 4.21Å; R35-L138 HydrophobicContact CB-CD2 4.43Å; R35-L138 VanDerWaalsContact CZ-CD2 3.44Å
36	C	92.4	Very high	89.2	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.027	30%	0.298	C	S	.	.			trans	-53.9	129.4	172.7	179.5	0	0	0	0	110.7	R38 W48 Q70 C87	C36-R38 PolarHBondContact O-N 2.93Å; C36-R38 PolarHBondContact SG-O 2.92Å; C36-R38 VanDerWaalsContact SG-O 3.4Å; C36-W48 HydrophobicContact CB-CH2 4.06Å; C36-W48 HydrophobicContact CB-CZ2 3.63Å; C36-Q70 PolarHBondContact N-O 3.45Å; C36-C87 VanDerWaalsContact CA-SG 3.54Å; C36-C87 HydrophobicContact CB-CB 3.74Å; C36-C87 WeakPolarHBondContact CB-SG 3.41Å; C36-C87 WeakPolarHBondContact SG-CB 3.49Å; C36-C87 CovalentContact SG-SG 2.04Å; C36-C87 PolarHBondContact SG-SG 3.4Å
37	P	91.6	Very high	89.2	Confident	38 Å²	38	58.8 Å²	58.8	25%	0.247	31%	0.305	C	S	.	.	S	Bend	trans	-65.1	-23	-179.2	-24.4	35.3	0	0	0	113.6	K22 C87 Y99 A100	K22-P37 HydrophobicContact CB-CB 3.97Å; K22-P37 HydrophobicContact CB-CG 3.63Å; P37-C87 WeakPolarHBondContact CD-SG 3.37Å; P37-Y99 WeakPolarHBondContact CG-O 3.5Å; P37-A100 HydrophobicContact CG-CB 4.48Å
38	R	87	Confident	89.3	Confident	88 Å²	88	57.7 Å²	57.7	33%	0.332	30%	0.299	S	S	.	.	S	Bend	trans	-92.7	120.2	174.5	-64.8	-57.8	-173.2	-170.2	-0.2	109.4	C36 V89 R96 T97	C36-R38 PolarHBondContact O-N 2.93Å; C36-R38 PolarHBondContact SG-O 2.92Å; C36-R38 VanDerWaalsContact SG-O 3.4Å; R38-V89 HydrophobicContact CB-CG2 4.14Å; R38-R96 HydrophobicContact CB-CB 4.23Å; R38-R96 HydrophobicContact CG-CB 4.26Å; R38-T97 WeakPolarHBondContact CG-O 3.24Å; R38-T97 PolarHBondContact NE-O 2.99Å
39	Q	77	Confident	89.3	Confident	151 Å²	151	57.5 Å²	57.5	71%	0.706	30%	0.296	S	S	*	.			trans	-82.4	140.4	173.7	-63.9	-178	-0	0	0	110.5
40	G	75.1	Confident	89.3	Confident	24 Å²	24	53.9 Å²	53.9	25%	0.247	27%	0.274	C	S	.	.			trans	-135.6	172.6	172.8	0	0	0	0	0	110.9	Q70	G40-Q70 PolarHBondContact O-NE2 3.38Å
41	K	77.9	Confident	89.1	Confident	132 Å²	132	55.1 Å²	55.1	57%	0.574	29%	0.285	S	S	*	.			trans	-62.3	150.4	172.1	-68.6	-174.4	178.4	-179.4	0	109.6	S43 Y44	K41-S43 PolarHBondContact O-N 2.8Å; K41-S43 VanDerWaalsContact O-N 3.08Å; K41-Y44 HydrophobicContact CB-CD1 3.96Å; K41-Y44 HydrophobicContact CB-CD2 4.25Å; K41-Y44 HydrophobicContact CB-CE1 3.87Å; K41-Y44 HydrophobicContact CB-CE2 4.17Å; K41-Y44 HydrophobicContact CB-CG 4.15Å; K41-Y44 HydrophobicContact CD-CE1 4.05Å; K41-Y44 HydrophobicContact CG-CE1 4.24Å; K41-Y44 HydrophobicContact CG-CE2 4.25Å; K41-Y44 WeakPolarHBondContact O-CB 3.43Å; K41-Y44 PolarHBondContact O-N 3.09Å
42	P	76.2	Confident	88.6	Confident	134 Å²	134	61.8 Å²	61.8	87%	0.87	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.9	178.6	-27.1	34.9	0	0	0	114.4	Y44	P42-Y44 VanDerWaalsContact C-N 3.32Å; P42-Y44 PolarHBondContact O-N 3.25Å
43	S	78.8	Confident	88.2	Confident	98 Å²	98	64.7 Å²	64.7	69%	0.685	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-6.3	178.2	57.1	0	0	0	0	115	K41	K41-S43 PolarHBondContact O-N 2.8Å; K41-S43 VanDerWaalsContact O-N 3.08Å
44	Y	87.1	Confident	87.9	Confident	52 Å²	52	70.1 Å²	70.1	20%	0.204	36%	0.362	C	S	.	.	S	Bend	trans	-81.8	134.7	-177	-68	-1.9	0	0	0	111	K41 P42 V89 R90 S91	K41-Y44 HydrophobicContact CB-CD1 3.96Å; K41-Y44 HydrophobicContact CB-CD2 4.25Å; K41-Y44 HydrophobicContact CB-CE1 3.87Å; K41-Y44 HydrophobicContact CB-CE2 4.17Å; K41-Y44 HydrophobicContact CB-CG 4.15Å; K41-Y44 HydrophobicContact CD-CE1 4.05Å; K41-Y44 HydrophobicContact CG-CE1 4.24Å; K41-Y44 HydrophobicContact CG-CE2 4.25Å; K41-Y44 WeakPolarHBondContact O-CB 3.43Å; K41-Y44 PolarHBondContact O-N 3.09Å; P42-Y44 VanDerWaalsContact C-N 3.32Å; P42-Y44 PolarHBondContact O-N 3.25Å; Y44-V89 HydrophobicContact CD2-CG1 3.98Å; Y44-R90 WeakPolarHBondContact CB-O 3.4Å; Y44-S91 VanDerWaalsContact CE2-CB 3.43Å; Y44-S91 PolarHBondContact OH-OG 3.25Å
45	I	87.7	Confident	87.8	Confident	116 Å²	116	77.1 Å²	77.1	60%	0.595	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	136.3	175.8	-59.5	172.7	0	0	0	108.5	R90	I45-R90 PolarHBondContact O-N 3.47Å
46	V	92.4	Very high	87.7	Confident	13 Å²	13	75.6 Å²	75.6	8%	0.079	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.9	178.5	-175.2	0	0	0	0	109.4	G69 Q70 C87 I88 V89	V46-G69 WeakPolarHBondContact CB-O 3.19Å; V46-Q70 HydrophobicContact CG2-CG 3.79Å; V46-C87 HydrophobicContact CG1-CB 4.15Å; V46-I88 WeakPolarHBondContact CA-O 3.4Å; V46-V89 HydrophobicContact CG1-CG2 4.3Å; V46-V89 HydrophobicContact CG2-CB 4.41Å; V46-V89 HydrophobicContact CG2-CG1 4.26Å; V46-V89 HydrophobicContact CG2-CG2 4.01Å
47	D	93.4	Very high	87.9	Confident	39 Å²	39	76.5 Å²	76.5	21%	0.209	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.6	176.6	-51	-99	0	0	0	109.8	Y49 C87 I88 R90	D47-Y49 HydrophobicContact CB-CE2 3.67Å; D47-C87 CarbonylContact O-C 3.5Å; D47-C87 WeakPolarHBondContact O-CA 3.39Å; D47-I88 PolarHBondContact N-O 3.26Å; D47-I88 PolarHBondContact O-N 3.24Å; D47-R90 IonicContact OD1-CZ 3.52Å; D47-R90 IonicContact OD1-NH1 3.3Å; D47-R90 PolarHBondContact OD1-NH1 2.84Å; D47-R90 IonicContact OD1-NH2 3.82Å; D47-R90 WeakPolarHBondContact OD2-CD 3.46Å; D47-R90 IonicContact OD2-CZ 2.64Å; D47-R90 IonicContact OD2-NE 3.35Å; D47-R90 PolarHBondContact OD2-NE 3.48Å; D47-R90 IonicContact OD2-NH1 2.9Å; D47-R90 PolarHBondContact OD2-NH1 3.02Å; D47-R90 IonicContact OD2-NH2 3.99Å; D47-R90 PolarHBondContact OD2-NH2 3.01Å
48	W	95.4	Very high	88	Confident	4 Å²	4	77.2 Å²	77.2	2%	0.015	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	140.9	179.2	-74.3	86	0	0	0	110.9	C36 S56 I57 A67 G69 L72 T86 C87 A100	C36-W48 HydrophobicContact CB-CH2 4.06Å; C36-W48 HydrophobicContact CB-CZ2 3.63Å; W48-S56 CarbonylContact O-C 3.59Å; W48-S56 WeakPolarHBondContact O-CA 3.36Å; W48-I57 HydrophobicContact CB-CB 3.9Å; W48-I57 HydrophobicContact CB-CG1 3.83Å; W48-I57 PolarHBondContact O-N 2.83Å; W48-A67 HydrophobicContact CB-CB 3.95Å; W48-A67 HydrophobicContact CG-CB 3.91Å; W48-G69 PolarHBondContact NE1-O 3.5Å; W48-L72 HydrophobicContact CD2-CB 4Å; W48-L72 HydrophobicContact CE3-CB 4.02Å; W48-L72 HydrophobicContact CE3-CD2 3.88Å; W48-L72 HydrophobicContact CE3-CG 4.41Å; W48-L72 HydrophobicContact CH2-CB 3.89Å; W48-L72 HydrophobicContact CZ2-CB 3.89Å; W48-L72 HydrophobicContact CZ3-CB 3.98Å; W48-L72 HydrophobicContact CZ3-CD2 3.89Å; W48-T86 CarbonylContact C-O 3.53Å; W48-T86 WeakPolarHBondContact CA-O 3.31Å; W48-C87 HydrophobicContact CD2-CB 3.71Å; W48-C87 HydrophobicContact CE3-CB 3.73Å; W48-C87 HydrophobicContact CG-CB 4.45Å; W48-C87 HydrophobicContact CH2-CB 3.84Å; W48-C87 HydrophobicContact CZ2-CB 3.78Å; W48-C87 HydrophobicContact CZ3-CB 3.79Å; W48-A100 HydrophobicContact CH2-CB 4.44Å; W48-A100 HydrophobicContact CZ3-CB 4.14Å
49	Y	94.9	Very high	88.2	Confident	50 Å²	50	77.7 Å²	77.7	20%	0.196	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	142.9	178.8	-59	-95.2	0	0	0	110.3	D47 S51 K55 Y85 T86 I88	D47-Y49 HydrophobicContact CB-CE2 3.67Å; Y49-S51 PolarHBondContact O-N 2.96Å; Y49-K55 CarbonylContact C-O 3.34Å; Y49-K55 VanDerWaalsContact CA-O 3.27Å; Y49-K55 WeakPolarHBondContact CA-O 3.49Å; Y49-Y85 CarbonylContact O-C 3.56Å; Y49-Y85 WeakPolarHBondContact O-CA 3.21Å; Y49-T86 PolarHBondContact N-O 3.13Å; Y49-T86 PolarHBondContact O-N 3.15Å; Y49-I88 HydrophobicContact CD2-CD1 4.08Å; Y49-I88 HydrophobicContact CD2-CG1 4.38Å; Y49-I88 HydrophobicContact CE2-CD1 3.73Å; Y49-I88 HydrophobicContact CE2-CG1 4.24Å
50	Y	94.1	Very high	88.7	Confident	36 Å²	36	75.1 Å²	75.1	14%	0.141	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	111.7	167.9	-172	-122.1	0	0	0	109.4	Q52 T53 N54 K55 S82 Y85	Y50-Q52 VanDerWaalsContact C-N 3.28Å; Y50-Q52 HydrophobicContact CD1-CB 4.19Å; Y50-Q52 HydrophobicContact CE1-CB 3.72Å; Y50-Q52 HydrophobicContact CE1-CG 4.18Å; Y50-Q52 PolarHBondContact O-N 3.36Å; Y50-Q52 VanDerWaalsContact O-N 3.17Å; Y50-Q52 VanDerWaalsContact OH-CD 3.28Å; Y50-Q52 PolarHBondContact OH-OE1 3.36Å; Y50-T53 HydrophobicContact CD1-CG2 3.99Å; Y50-T53 HydrophobicContact CE1-CG2 4.3Å; Y50-T53 PolarHBondContact O-N 2.76Å; Y50-N54 VanDerWaalsContact O-CA 3.31Å; Y50-N54 WeakPolarHBondContact O-CA 3.22Å; Y50-N54 PolarHBondContact O-N 2.74Å; Y50-K55 PolarHBondContact N-O 2.75Å; Y50-S82 PolarHBondContact OH-O 3.07Å; Y50-Y85 AromaticContact CD2-CD1 3.98Å; Y50-Y85 HydrophobicContact CD2-CD1 3.98Å; Y50-Y85 HydrophobicContact CD2-CD2 4.47Å; Y50-Y85 AromaticContact CD2-CE1 3.55Å; Y50-Y85 HydrophobicContact CD2-CE1 3.55Å; Y50-Y85 HydrophobicContact CD2-CE2 4.06Å; Y50-Y85 HydrophobicContact CD2-CG 4.42Å; Y50-Y85 AromaticContact CD2-CZ 3.58Å; Y50-Y85 HydrophobicContact CE2-CE1 4.28Å; Y50-Y85 HydrophobicContact CE2-CE2 4.05Å; Y50-Y85 AromaticContact CE2-CZ 3.83Å; Y50-Y85 HydrophobicContact CG-CE1 4.43Å
51	S	90.4	Very high	89.1	Confident	41 Å²	41	78.6 Å²	78.6	29%	0.287	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-31.3	-164.8	-52	0	0	0	0	113.7	Y49 I84 T86	Y49-S51 PolarHBondContact O-N 2.96Å; S51-I84 VanDerWaalsContact CB-O 3.23Å; S51-I84 WeakPolarHBondContact CB-O 3.17Å; S51-I84 PolarHBondContact N-O 3.01Å; S51-I84 WeakPolarHBondContact OG-CG2 3.14Å; S51-I84 PolarHBondContact OG-O 3.08Å; S51-T86 PolarHBondContact OG-N 3.39Å; S51-T86 PolarHBondContact OG-OG1 3.42Å
52	Q	86.6	Confident	89.5	Confident	143 Å²	143	82.6 Å²	82.6	67%	0.668	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-37.4	-179.3	-66.5	179.4	0.6	0	0	113.1	Y50	Y50-Q52 VanDerWaalsContact C-N 3.28Å; Y50-Q52 HydrophobicContact CD1-CB 4.19Å; Y50-Q52 HydrophobicContact CE1-CB 3.72Å; Y50-Q52 HydrophobicContact CE1-CG 4.18Å; Y50-Q52 PolarHBondContact O-N 3.36Å; Y50-Q52 VanDerWaalsContact O-N 3.17Å; Y50-Q52 VanDerWaalsContact OH-CD 3.28Å; Y50-Q52 PolarHBondContact OH-OE1 3.36Å
53	T	89.1	Confident	90.2	Very high	72 Å²	72	78.7 Å²	78.7	44%	0.442	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-8.3	-177.5	64.4	0	0	0	0	113	Y50 K55	Y50-T53 HydrophobicContact CD1-CG2 3.99Å; Y50-T53 HydrophobicContact CE1-CG2 4.3Å; Y50-T53 PolarHBondContact O-N 2.76Å; T53-K55 PolarHBondContact O-N 2.92Å; T53-K55 VanDerWaalsContact O-N 3.11Å; T53-K55 WeakPolarHBondContact OG1-CB 3.21Å; T53-K55 WeakPolarHBondContact OG1-CG 3.45Å; T53-K55 PolarHBondContact OG1-N 2.91Å
54	N	89.8	Confident	90.9	Very high	120 Å²	120	77.5 Å²	77.5	64%	0.642	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	25.1	-171.4	-155.3	34.9	0	0	0	114.1	Y50	Y50-N54 VanDerWaalsContact O-CA 3.31Å; Y50-N54 WeakPolarHBondContact O-CA 3.22Å; Y50-N54 PolarHBondContact O-N 2.74Å
55	K	92.1	Very high	91.2	Very high	149 Å²	149	76.1 Å²	76.1	65%	0.648	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	136.8	176.8	-70.3	-179.6	178.6	-178.5	0	110.3	Y49 Y50 T53	Y49-K55 CarbonylContact C-O 3.34Å; Y49-K55 VanDerWaalsContact CA-O 3.27Å; Y49-K55 WeakPolarHBondContact CA-O 3.49Å; Y50-K55 PolarHBondContact N-O 2.75Å; T53-K55 PolarHBondContact O-N 2.92Å; T53-K55 VanDerWaalsContact O-N 3.11Å; T53-K55 WeakPolarHBondContact OG1-CB 3.21Å; T53-K55 WeakPolarHBondContact OG1-CG 3.45Å; T53-K55 PolarHBondContact OG1-N 2.91Å
56	S	93.8	Very high	91.6	Very high	84 Å²	84	70.7 Å²	70.7	59%	0.587	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	135.3	174.4	59.2	0	0	0	0	110.6	W48	W48-S56 CarbonylContact O-C 3.59Å; W48-S56 WeakPolarHBondContact O-CA 3.36Å
57	I	95.7	Very high	91.7	Very high	23 Å²	23	70.2 Å²	70.2	12%	0.118	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-72.2	132.5	173.5	-55.6	-55	0	0	0	108.7	W48 V65 A67 L72 Y85	W48-I57 HydrophobicContact CB-CB 3.9Å; W48-I57 HydrophobicContact CB-CG1 3.83Å; W48-I57 PolarHBondContact O-N 2.83Å; I57-V65 HydrophobicContact CG2-CG1 4.45Å; I57-A67 HydrophobicContact CB-CB 4.41Å; I57-A67 HydrophobicContact CG2-CB 4.15Å; I57-L72 HydrophobicContact CB-CD1 4.43Å; I57-L72 HydrophobicContact CG1-CD1 4.24Å; I57-L72 HydrophobicContact CG2-CD1 3.73Å; I57-Y85 HydrophobicContact CD1-CD1 4.04Å; I57-Y85 HydrophobicContact CD1-CE1 3.83Å; I57-Y85 HydrophobicContact CG1-CD1 4.26Å; I57-Y85 HydrophobicContact CG1-CE1 4.46Å
58	P	94	Very high	91.7	Very high	52 Å²	52	70.8 Å²	70.8	34%	0.338	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-58.5	149.9	176.5	-23.8	33.8	0	0	0	112.7	N63 F66 A67	P58-N63 HydrophobicContact CB-CB 4.42Å; P58-N63 WeakPolarHBondContact CB-ND2 3.36Å; P58-F66 CarbonylContact O-C 3.53Å; P58-F66 WeakPolarHBondContact O-CA 3.38Å; P58-F66 WeakPolarHBondContact O-CB 3.12Å; P58-A67 PolarHBondContact O-N 3.48Å
59	T	91.6	Very high	91.4	Very high	99 Å²	99	72.6 Å²	72.6	61%	0.607	38%	0.376	S	S	*	.			trans	-102.1	-6.9	174.1	54.3	0	0	0	0	113.2	A67	T59-A67 WeakPolarHBondContact CA-O 3.08Å
60	Q	87.8	Confident	91.2	Very high	97 Å²	97	72.4 Å²	72.4	45%	0.453	38%	0.378	S	S	.	.			trans	-76.8	128.1	178.2	-52.7	86.1	4.4	0	0	110.4	R62 N63	Q60-R62 HydrophobicContact CB-CG 4.09Å; Q60-R62 PolarHBondContact O-N 3.04Å; Q60-R62 VanDerWaalsContact O-N 3.11Å; Q60-N63 PolarHBondContact O-N 3.02Å; Q60-N63 VanDerWaalsContact O-N 3.16Å; Q60-N63 PolarHBondContact O-ND2 2.88Å; Q60-N63 PolarHBondContact OE1-ND2 3.05Å
61	E	83.5	Confident	91.2	Very high	96 Å²	96	72.5 Å²	72.5	45%	0.449	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.3	-176.1	-51.4	-178	170.8	0	0	114.1	N63 F66 N188	E61-N63 PolarHBondContact O-N 3.14Å; E61-F66 HydrophobicContact CB-CD2 4.47Å; E61-F66 HydrophobicContact CB-CE2 4.01Å; E61-F66 HydrophobicContact CB-CZ 4.18Å; E61-F66 HydrophobicContact CG-CD2 4.3Å; E61-F66 HydrophobicContact CG-CE2 3.81Å; E61-F66 HydrophobicContact CG-CZ 4.4Å; E61-N188 VanDerWaalsContact CB-ND2 3.32Å; E61-N188 WeakPolarHBondContact CB-ND2 3.44Å; E61-N188 PolarHBondContact OE2-ND2 3.26Å; E61-N188 PolarHBondContact OE2-OD1 2.89Å
62	R	85.3	Confident	91.5	Very high	216 Å²	216	70.5 Å²	70.5	82%	0.815	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.1	173	70.6	179.4	-179.1	-173.4	-0.9	113.5	Q60	Q60-R62 HydrophobicContact CB-CG 4.09Å; Q60-R62 PolarHBondContact O-N 3.04Å; Q60-R62 VanDerWaalsContact O-N 3.11Å
63	N	89.9	Confident	91.9	Very high	52 Å²	52	64.8 Å²	64.8	28%	0.278	34%	0.339	S	S	.	.	S	Bend	trans	-82.8	146.1	-179.9	-59.1	-65.1	0	0	0	109.8	P58 Q60 E61 V65 F66	P58-N63 HydrophobicContact CB-CB 4.42Å; P58-N63 WeakPolarHBondContact CB-ND2 3.36Å; Q60-N63 PolarHBondContact O-N 3.02Å; Q60-N63 VanDerWaalsContact O-N 3.16Å; Q60-N63 PolarHBondContact O-ND2 2.88Å; Q60-N63 PolarHBondContact OE1-ND2 3.05Å; E61-N63 PolarHBondContact O-N 3.14Å; N63-V65 VanDerWaalsContact C-N 3.33Å; N63-V65 PolarHBondContact O-N 2.97Å; N63-F66 HydrophobicContact CB-CB 4.37Å; N63-F66 WeakPolarHBondContact O-CD1 3.41Å
64	R	93.5	Very high	92.3	Very high	74 Å²	74	61.3 Å²	61.3	28%	0.279	32%	0.318	S	S	.	.	S	Bend	trans	-60.9	-41.5	176.7	-171.4	177.5	59.8	62.3	-1.7	112.5	L75 P76 E78 D81	R64-L75 WeakPolarHBondContact CG-O 3.47Å; R64-L75 PolarHBondContact O-N 3.24Å; R64-P76 WeakPolarHBondContact CD-O 3.39Å; R64-P76 WeakPolarHBondContact CG-O 3.48Å; R64-P76 PolarHBondContact NH1-O 2.71Å; R64-E78 WeakPolarHBondContact CD-OE1 3.44Å; R64-E78 IonicContact CZ-OE1 2.62Å; R64-E78 IonicContact CZ-OE2 3.34Å; R64-E78 VanDerWaalsContact NE-CD 3.31Å; R64-E78 IonicContact NE-OE1 3.34Å; R64-E78 PolarHBondContact NE-OE1 2.95Å; R64-E78 IonicContact NE-OE2 2.69Å; R64-E78 IonicContact NH2-OE1 3.27Å; R64-E78 IonicContact NH2-OE2 2.69Å; R64-E78 PolarHBondContact NH2-OE2 3.38Å; R64-D81 IonicContact CZ-OD1 3.18Å; R64-D81 IonicContact CZ-OD2 3.29Å; R64-D81 IonicContact NH1-OD1 3.63Å; R64-D81 PolarHBondContact NH1-OD1 2.84Å; R64-D81 IonicContact NH1-OD2 3.64Å; R64-D81 PolarHBondContact NH1-OD2 3.26Å; R64-D81 IonicContact NH2-OD1 2.79Å; R64-D81 PolarHBondContact NH2-OD1 2.79Å; R64-D81 IonicContact NH2-OD2 2.75Å; R64-D81 PolarHBondContact NH2-OD2 2.89Å
65	V	95.1	Very high	92.6	Very high	22 Å²	22	56 Å²	56	13%	0.133	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.1	173.8	-175	0	0	0	0	108.7	I57 N63 L72 K73 F74	I57-V65 HydrophobicContact CG2-CG1 4.45Å; N63-V65 VanDerWaalsContact C-N 3.33Å; N63-V65 PolarHBondContact O-N 2.97Å; V65-L72 HydrophobicContact CG1-CD1 4.24Å; V65-K73 WeakPolarHBondContact CA-O 3.31Å; V65-F74 HydrophobicContact CB-CD1 4.39Å; V65-F74 HydrophobicContact CG1-CD1 3.81Å; V65-F74 HydrophobicContact CG1-CE1 3.76Å; V65-F74 HydrophobicContact CG1-CG 4.5Å; V65-F74 HydrophobicContact CG1-CZ 4.43Å; V65-F74 HydrophobicContact CG2-CD1 3.7Å; V65-F74 HydrophobicContact CG2-CE1 4.28Å
66	F	95.4	Very high	92.8	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158	-178.4	68.4	-78.8	0	0	0	112.4	P58 E61 N63 K73 L75	P58-F66 CarbonylContact O-C 3.53Å; P58-F66 WeakPolarHBondContact O-CA 3.38Å; P58-F66 WeakPolarHBondContact O-CB 3.12Å; E61-F66 HydrophobicContact CB-CD2 4.47Å; E61-F66 HydrophobicContact CB-CE2 4.01Å; E61-F66 HydrophobicContact CB-CZ 4.18Å; E61-F66 HydrophobicContact CG-CD2 4.3Å; E61-F66 HydrophobicContact CG-CE2 3.81Å; E61-F66 HydrophobicContact CG-CZ 4.4Å; N63-F66 HydrophobicContact CB-CB 4.37Å; N63-F66 WeakPolarHBondContact O-CD1 3.41Å; F66-K73 HydrophobicContact CD1-CB 4.34Å; F66-K73 HydrophobicContact CE1-CB 4.03Å; F66-K73 HydrophobicContact CE1-CD 4.36Å; F66-K73 HydrophobicContact CE2-CD 3.88Å; F66-K73 HydrophobicContact CZ-CB 4.14Å; F66-K73 HydrophobicContact CZ-CD 3.66Å; F66-K73 HydrophobicContact CZ-CG 4.42Å; F66-K73 PolarHBondContact N-O 3.42Å; F66-K73 VanDerWaalsContact N-O 3.09Å; F66-K73 PolarHBondContact O-N 2.87Å; F66-L75 HydrophobicContact CE1-CD1 3.82Å; F66-L75 HydrophobicContact CE1-CG 4.33Å; F66-L75 HydrophobicContact CZ-CD1 4.09Å
67	A	94.5	Very high	92.9	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.033	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.9	176.5	0	0	0	0	0	110.9	W48 I57 P58 T59	W48-A67 HydrophobicContact CB-CB 3.95Å; W48-A67 HydrophobicContact CG-CB 3.91Å; I57-A67 HydrophobicContact CB-CB 4.41Å; I57-A67 HydrophobicContact CG2-CB 4.15Å; P58-A67 PolarHBondContact O-N 3.48Å; T59-A67 WeakPolarHBondContact CA-O 3.08Å
68	S	92.5	Very high	92.9	Very high	50 Å²	50	49.2 Å²	49.2	35%	0.35	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	89.3	172.2	-174.2	0	0	0	0	108.6	Q70 L71	S68-Q70 PolarHBondContact O-N 2.97Å; S68-L71 PolarHBondContact N-O 2.9Å; S68-L71 PolarHBondContact O-N 2.95Å
69	G	90.3	Very high	93	Very high	42 Å²	42	49 Å²	49	43%	0.433	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	-119.8	-174.9	0	0	0	0	0	112.7	V46 W48 L71	V46-G69 WeakPolarHBondContact CB-O 3.19Å; W48-G69 PolarHBondContact NE1-O 3.5Å; G69-L71 PolarHBondContact O-N 3.43Å
70	Q	91.1	Very high	93.1	Very high	47 Å²	47	48.4 Å²	48.4	22%	0.22	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-4	180	-71.6	-176.9	20.7	0	0	114.3	R35 C36 G40 V46 S68	R35-Q70 WeakPolarHBondContact CA-O 3.47Å; C36-Q70 PolarHBondContact N-O 3.45Å; G40-Q70 PolarHBondContact O-NE2 3.38Å; V46-Q70 HydrophobicContact CG2-CG 3.79Å; S68-Q70 PolarHBondContact O-N 2.97Å
71	L	93.8	Very high	93.4	Very high	37 Å²	37	44.7 Å²	44.7	19%	0.194	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.6	-175.3	-55.9	179.8	0	0	0	110.4	I33 V34 R35 S68 G69 L138	I33-L71 HydrophobicContact CG2-CB 4.03Å; I33-L71 HydrophobicContact CG2-CD1 4.16Å; I33-L71 HydrophobicContact CG2-CD2 4.09Å; I33-L71 HydrophobicContact CG2-CG 4.31Å; V34-L71 WeakPolarHBondContact O-CA 3.34Å; R35-L71 HydrophobicContact CB-CD2 3.98Å; R35-L71 HydrophobicContact CG-CD2 4.21Å; S68-L71 PolarHBondContact N-O 2.9Å; S68-L71 PolarHBondContact O-N 2.95Å; G69-L71 PolarHBondContact O-N 3.43Å; L71-L138 HydrophobicContact CD2-CD2 4.34Å
72	L	95.8	Very high	94	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124	166.2	176.9	66	0	0	0	107.9	I33 V34 W48 I57 V65 F74 Y85	I33-L72 WeakPolarHBondContact CA-O 3.37Å; V34-L72 HydrophobicContact CB-CB 4.41Å; V34-L72 PolarHBondContact N-O 3.47Å; V34-L72 PolarHBondContact O-N 3.05Å; W48-L72 HydrophobicContact CD2-CB 4Å; W48-L72 HydrophobicContact CE3-CB 4.02Å; W48-L72 HydrophobicContact CE3-CD2 3.88Å; W48-L72 HydrophobicContact CE3-CG 4.41Å; W48-L72 HydrophobicContact CH2-CB 3.89Å; W48-L72 HydrophobicContact CZ2-CB 3.89Å; W48-L72 HydrophobicContact CZ3-CB 3.98Å; W48-L72 HydrophobicContact CZ3-CD2 3.89Å; I57-L72 HydrophobicContact CB-CD1 4.43Å; I57-L72 HydrophobicContact CG1-CD1 4.24Å; I57-L72 HydrophobicContact CG2-CD1 3.73Å; V65-L72 HydrophobicContact CG1-CD1 4.24Å; L72-F74 HydrophobicContact CD2-CE2 3.7Å; L72-F74 HydrophobicContact CD2-CZ 3.56Å; L72-F74 HydrophobicContact CG-CD2 4.49Å; L72-F74 HydrophobicContact CG-CE2 3.66Å; L72-F74 HydrophobicContact CG-CZ 3.88Å; L72-Y85 HydrophobicContact CD2-CD1 3.41Å; L72-Y85 VanDerWaalsContact CD2-CD1 3.41Å; L72-Y85 HydrophobicContact CD2-CD2 4.06Å; L72-Y85 HydrophobicContact CD2-CE1 3.93Å; L72-Y85 HydrophobicContact CD2-CG 3.47Å; L72-Y85 VanDerWaalsContact CD2-CG 3.47Å
73	K	96.6	Very high	94.4	Very high	22 Å²	22	31.9 Å²	31.9	10%	0.096	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.8	-172.8	-54.6	-170.2	179.5	-174.6	0	111	I33 V65 F66 L75 E187	I33-K73 HydrophobicContact CD1-CD 4.3Å; I33-K73 HydrophobicContact CD1-CG 4.39Å; I33-K73 HydrophobicContact CG1-CB 4.44Å; I33-K73 HydrophobicContact CG1-CG 4.09Å; I33-K73 HydrophobicContact CG2-CG 4.37Å; V65-K73 WeakPolarHBondContact CA-O 3.31Å; F66-K73 HydrophobicContact CD1-CB 4.34Å; F66-K73 HydrophobicContact CE1-CB 4.03Å; F66-K73 HydrophobicContact CE1-CD 4.36Å; F66-K73 HydrophobicContact CE2-CD 3.88Å; F66-K73 HydrophobicContact CZ-CB 4.14Å; F66-K73 HydrophobicContact CZ-CD 3.66Å; F66-K73 HydrophobicContact CZ-CG 4.42Å; F66-K73 PolarHBondContact N-O 3.42Å; F66-K73 VanDerWaalsContact N-O 3.09Å; F66-K73 PolarHBondContact O-N 2.87Å; K73-L75 HydrophobicContact CB-CG 4.29Å; K73-E187 WeakPolarHBondContact CD-OE2 3.44Å; K73-E187 IonicContact NZ-OE1 2.69Å; K73-E187 PolarHBondContact NZ-OE1 2.64Å; K73-E187 IonicContact NZ-OE2 2.7Å; K73-E187 PolarHBondContact NZ-OE2 3.13Å
74	F	97.1	Very high	94.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	104.7	176.2	-56.3	-100.8	0	0	0	108.2	A31 L32 V34 V65 L72 P76 A77 D81 Y85 V102 I104	A31-F74 WeakPolarHBondContact CA-O 3.47Å; L32-F74 HydrophobicContact CB-CB 4.21Å; L32-F74 HydrophobicContact CB-CD2 4.19Å; L32-F74 HydrophobicContact CD2-CD2 4.23Å; L32-F74 HydrophobicContact CD2-CE2 4.49Å; L32-F74 HydrophobicContact CG-CD2 4.21Å; L32-F74 PolarHBondContact N-O 3.35Å; L32-F74 WeakPolarHBondContact O-CD2 3.46Å; L32-F74 PolarHBondContact O-N 2.86Å; V34-F74 HydrophobicContact CG2-CE2 4.01Å; V65-F74 HydrophobicContact CB-CD1 4.39Å; V65-F74 HydrophobicContact CG1-CD1 3.81Å; V65-F74 HydrophobicContact CG1-CE1 3.76Å; V65-F74 HydrophobicContact CG1-CG 4.5Å; V65-F74 HydrophobicContact CG1-CZ 4.43Å; V65-F74 HydrophobicContact CG2-CD1 3.7Å; V65-F74 HydrophobicContact CG2-CE1 4.28Å; L72-F74 HydrophobicContact CD2-CE2 3.7Å; L72-F74 HydrophobicContact CD2-CZ 3.56Å; L72-F74 HydrophobicContact CG-CD2 4.49Å; L72-F74 HydrophobicContact CG-CE2 3.66Å; L72-F74 HydrophobicContact CG-CZ 3.88Å; F74-P76 CarbonylContact O-C 3.56Å; F74-A77 HydrophobicContact CB-CB 3.9Å; F74-D81 HydrophobicContact CD1-CB 3.92Å; F74-D81 HydrophobicContact CE1-CB 3.81Å; F74-Y85 HydrophobicContact CE1-CE1 4.4Å; F74-Y85 HydrophobicContact CE1-CE2 4.14Å; F74-Y85 AromaticContact CE1-CZ 3.75Å; F74-Y85 WeakPolarHBondContact CE1-OH 3.48Å; F74-Y85 HydrophobicContact CZ-CD2 4.35Å; F74-Y85 HydrophobicContact CZ-CE1 4.23Å; F74-Y85 AromaticContact CZ-CE2 3.78Å; F74-Y85 HydrophobicContact CZ-CE2 3.78Å; F74-Y85 AromaticContact CZ-CZ 3.71Å; F74-V102 HydrophobicContact CE2-CG1 4.24Å; F74-V102 HydrophobicContact CZ-CG1 4.05Å; F74-V102 HydrophobicContact CZ-CG2 4.4Å; F74-I104 HydrophobicContact CD1-CD1 4.41Å
75	L	95.3	Very high	94.7	Very high	9 Å²	9	28.5 Å²	28.5	5%	0.047	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.2	81.2	-168.8	-59.6	-173.9	0	0	0	111.8	A31 R64 F66 K73 E187 Y192	A31-L75 HydrophobicContact CB-CD2 3.43Å; A31-L75 VanDerWaalsContact CB-CD2 3.43Å; R64-L75 WeakPolarHBondContact CG-O 3.47Å; R64-L75 PolarHBondContact O-N 3.24Å; F66-L75 HydrophobicContact CE1-CD1 3.82Å; F66-L75 HydrophobicContact CE1-CG 4.33Å; F66-L75 HydrophobicContact CZ-CD1 4.09Å; K73-L75 HydrophobicContact CB-CG 4.29Å; L75-E187 HydrophobicContact CD1-CB 4.12Å; L75-E187 HydrophobicContact CD1-CG 4.17Å; L75-E187 WeakPolarHBondContact CD1-OE2 3.35Å; L75-Y192 VanDerWaalsContact C-CE1 3.44Å; L75-Y192 HydrophobicContact CB-CD1 4.35Å; L75-Y192 HydrophobicContact CB-CD2 4.34Å; L75-Y192 HydrophobicContact CB-CE1 3.92Å; L75-Y192 HydrophobicContact CB-CE2 3.91Å; L75-Y192 HydrophobicContact CD1-CD2 4.49Å; L75-Y192 HydrophobicContact CD1-CE2 4.09Å; L75-Y192 HydrophobicContact CD2-CD2 4.1Å; L75-Y192 HydrophobicContact CD2-CE2 4.4Å; L75-Y192 HydrophobicContact CD2-CG 4.33Å; L75-Y192 HydrophobicContact CG-CE2 4.37Å; L75-Y192 WeakPolarHBondContact O-CE1 3.42Å; L75-Y192 PolarHBondContact O-OH 3.29Å
76	P	95.6	Very high	94.7	Very high	34 Å²	34	28.3 Å²	28.3	22%	0.221	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.7	171.5	-3.6	36.7	-35.1	0	0	0	113.2	R64 F74 Y192	R64-P76 WeakPolarHBondContact CD-O 3.39Å; R64-P76 WeakPolarHBondContact CG-O 3.48Å; R64-P76 PolarHBondContact NH1-O 2.71Å; F74-P76 CarbonylContact O-C 3.56Å; P76-Y192 HydrophobicContact CB-CD1 4.36Å
77	A	96.3	Very high	94.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.18	C	C	.	.			trans	-77.1	135.7	173.4	0	0	0	0	0	112.4	E28 N29 E30 L32 F74 I104	E28-A77 WeakPolarHBondContact CA-O 3.36Å; N29-A77 PolarHBondContact N-O 3.26Å; E30-A77 WeakPolarHBondContact O-CB 3.3Å; E30-A77 PolarHBondContact O-N 3.3Å; L32-A77 HydrophobicContact CB-CB 4.22Å; F74-A77 HydrophobicContact CB-CB 3.9Å; A77-I104 HydrophobicContact CB-CD1 3.86Å; A77-I104 HydrophobicContact CB-CG1 4.07Å; A77-I104 HydrophobicContact CB-CG2 4.1Å
78	E	96.5	Very high	94.6	Very high	79 Å²	79	29.7 Å²	29.7	37%	0.369	19%	0.187	S	C	.	.			trans	-117.4	148.9	173.4	-69	173.2	-169	0	0	110.3	R64 A80 D81 I104	R64-E78 WeakPolarHBondContact CD-OE1 3.44Å; R64-E78 IonicContact CZ-OE1 2.62Å; R64-E78 IonicContact CZ-OE2 3.34Å; R64-E78 VanDerWaalsContact NE-CD 3.31Å; R64-E78 IonicContact NE-OE1 3.34Å; R64-E78 PolarHBondContact NE-OE1 2.95Å; R64-E78 IonicContact NE-OE2 2.69Å; R64-E78 IonicContact NH2-OE1 3.27Å; R64-E78 IonicContact NH2-OE2 2.69Å; R64-E78 PolarHBondContact NH2-OE2 3.38Å; E78-A80 PolarHBondContact O-N 2.89Å; E78-A80 VanDerWaalsContact O-N 3.1Å; E78-D81 PolarHBondContact N-OD2 3.08Å; E78-D81 WeakPolarHBondContact O-CB 3.37Å; E78-D81 PolarHBondContact O-N 3.3Å; E78-I104 WeakPolarHBondContact O-CD1 3.31Å
79	V	95.4	Very high	94.5	Very high	47 Å²	47	27.5 Å²	27.5	29%	0.285	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-57.4	-32.5	-179.1	176.4	0	0	0	0	112.2	E28 D81 S82 I104 K106	E28-V79 HydrophobicContact CB-CG2 4.13Å; E28-V79 HydrophobicContact CG-CG2 4.19Å; E28-V79 WeakPolarHBondContact OE1-CG2 3.07Å; V79-D81 PolarHBondContact O-N 3.19Å; V79-S82 VanDerWaalsContact O-CB 3.32Å; V79-S82 WeakPolarHBondContact O-CB 3.16Å; V79-S82 PolarHBondContact O-N 3.47Å; V79-S82 VanDerWaalsContact O-N 3.11Å; V79-S82 PolarHBondContact O-OG 3.33Å; V79-I104 HydrophobicContact CG2-CG2 4.39Å; V79-K106 HydrophobicContact CG2-CD 4.46Å; V79-K106 HydrophobicContact CG2-CG 3.53Å
80	A	94.1	Very high	94.5	Very high	87 Å²	87	30.3 Å²	30.3	72%	0.719	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-64.5	-18.3	177	0	0	0	0	0	113.8	E78 S82	E78-A80 PolarHBondContact O-N 2.89Å; E78-A80 VanDerWaalsContact O-N 3.1Å; A80-S82 PolarHBondContact O-N 3.09Å
81	D	94.7	Very high	94.2	Very high	19 Å²	19	28.6 Å²	28.6	10%	0.102	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-81.6	0.8	175.8	-45.8	-47.3	0	0	0	112.4	R64 F74 E78 V79 G83 Y85 I104	R64-D81 IonicContact CZ-OD1 3.18Å; R64-D81 IonicContact CZ-OD2 3.29Å; R64-D81 IonicContact NH1-OD1 3.63Å; R64-D81 PolarHBondContact NH1-OD1 2.84Å; R64-D81 IonicContact NH1-OD2 3.64Å; R64-D81 PolarHBondContact NH1-OD2 3.26Å; R64-D81 IonicContact NH2-OD1 2.79Å; R64-D81 PolarHBondContact NH2-OD1 2.79Å; R64-D81 IonicContact NH2-OD2 2.75Å; R64-D81 PolarHBondContact NH2-OD2 2.89Å; F74-D81 HydrophobicContact CD1-CB 3.92Å; F74-D81 HydrophobicContact CE1-CB 3.81Å; E78-D81 PolarHBondContact N-OD2 3.08Å; E78-D81 WeakPolarHBondContact O-CB 3.37Å; E78-D81 PolarHBondContact O-N 3.3Å; V79-D81 PolarHBondContact O-N 3.19Å; D81-G83 PolarHBondContact O-N 2.97Å; D81-Y85 WeakPolarHBondContact O-CE2 3.3Å; D81-Y85 PolarHBondContact O-OH 3.5Å; D81-I104 HydrophobicContact CB-CD1 3.65Å
82	S	95.6	Very high	93.6	Very high	34 Å²	34	32.6 Å²	32.6	24%	0.238	19%	0.19	C	C	.	.			trans	-66.2	126.9	178.3	-59.5	0	0	0	0	111.3	Y50 V79 A80 V102 I104	Y50-S82 PolarHBondContact OH-O 3.07Å; V79-S82 VanDerWaalsContact O-CB 3.32Å; V79-S82 WeakPolarHBondContact O-CB 3.16Å; V79-S82 PolarHBondContact O-N 3.47Å; V79-S82 VanDerWaalsContact O-N 3.11Å; V79-S82 PolarHBondContact O-OG 3.33Å; A80-S82 PolarHBondContact O-N 3.09Å; S82-V102 CarbonylContact C-O 3.19Å; S82-V102 WeakPolarHBondContact CA-O 3.46Å; S82-I104 PolarHBondContact OG-N 2.8Å
83	G	94	Very high	93	Very high	9 Å²	9	38.1 Å²	38.1	9%	0.093	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.9	-172.9	178.2	0	0	0	0	0	113.5	D81 V102	D81-G83 PolarHBondContact O-N 2.97Å; G83-V102 PolarHBondContact N-O 2.82Å; G83-V102 PolarHBondContact O-N 3.2Å
84	I	95.1	Very high	92.3	Very high	47 Å²	47	41.2 Å²	41.2	24%	0.241	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.1	178.3	-54	176	0	0	0	108.4	S51 Y99 A100	S51-I84 VanDerWaalsContact CB-O 3.23Å; S51-I84 WeakPolarHBondContact CB-O 3.17Å; S51-I84 PolarHBondContact N-O 3.01Å; S51-I84 WeakPolarHBondContact OG-CG2 3.14Å; S51-I84 PolarHBondContact OG-O 3.08Å; I84-Y99 HydrophobicContact CG2-CD1 4.47Å; I84-A100 WeakPolarHBondContact CA-O 3.4Å
85	Y	94.7	Very high	91.9	Very high	8 Å²	8	46.1 Å²	46.1	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127	176	-68.4	-95.1	0	0	0	109.6	Y49 Y50 I57 L72 F74 D81 Y99 A100 V102	Y49-Y85 CarbonylContact O-C 3.56Å; Y49-Y85 WeakPolarHBondContact O-CA 3.21Å; Y50-Y85 AromaticContact CD2-CD1 3.98Å; Y50-Y85 HydrophobicContact CD2-CD1 3.98Å; Y50-Y85 HydrophobicContact CD2-CD2 4.47Å; Y50-Y85 AromaticContact CD2-CE1 3.55Å; Y50-Y85 HydrophobicContact CD2-CE1 3.55Å; Y50-Y85 HydrophobicContact CD2-CE2 4.06Å; Y50-Y85 HydrophobicContact CD2-CG 4.42Å; Y50-Y85 AromaticContact CD2-CZ 3.58Å; Y50-Y85 HydrophobicContact CE2-CE1 4.28Å; Y50-Y85 HydrophobicContact CE2-CE2 4.05Å; Y50-Y85 AromaticContact CE2-CZ 3.83Å; Y50-Y85 HydrophobicContact CG-CE1 4.43Å; I57-Y85 HydrophobicContact CD1-CD1 4.04Å; I57-Y85 HydrophobicContact CD1-CE1 3.83Å; I57-Y85 HydrophobicContact CG1-CD1 4.26Å; I57-Y85 HydrophobicContact CG1-CE1 4.46Å; L72-Y85 HydrophobicContact CD2-CD1 3.41Å; L72-Y85 VanDerWaalsContact CD2-CD1 3.41Å; L72-Y85 HydrophobicContact CD2-CD2 4.06Å; L72-Y85 HydrophobicContact CD2-CE1 3.93Å; L72-Y85 HydrophobicContact CD2-CG 3.47Å; L72-Y85 VanDerWaalsContact CD2-CG 3.47Å; F74-Y85 HydrophobicContact CE1-CE1 4.4Å; F74-Y85 HydrophobicContact CE1-CE2 4.14Å; F74-Y85 AromaticContact CE1-CZ 3.75Å; F74-Y85 WeakPolarHBondContact CE1-OH 3.48Å; F74-Y85 HydrophobicContact CZ-CD2 4.35Å; F74-Y85 HydrophobicContact CZ-CE1 4.23Å; F74-Y85 AromaticContact CZ-CE2 3.78Å; F74-Y85 HydrophobicContact CZ-CE2 3.78Å; F74-Y85 AromaticContact CZ-CZ 3.71Å; D81-Y85 WeakPolarHBondContact O-CE2 3.3Å; D81-Y85 PolarHBondContact O-OH 3.5Å; Y85-Y99 CarbonylContact O-C 3.57Å; Y85-A100 PolarHBondContact N-O 3.07Å; Y85-A100 PolarHBondContact O-N 2.66Å; Y85-V102 HydrophobicContact CD2-CB 3.96Å; Y85-V102 HydrophobicContact CD2-CG2 3.69Å; Y85-V102 HydrophobicContact CE2-CB 3.97Å; Y85-V102 HydrophobicContact CE2-CG2 4.13Å
86	T	94.8	Very high	91.6	Very high	17 Å²	17	51.6 Å²	51.6	10%	0.104	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.9	177	-53.3	0	0	0	0	109.1	W48 Y49 S51 I88 T97 G98 Y99	W48-T86 CarbonylContact C-O 3.53Å; W48-T86 WeakPolarHBondContact CA-O 3.31Å; Y49-T86 PolarHBondContact N-O 3.13Å; Y49-T86 PolarHBondContact O-N 3.15Å; S51-T86 PolarHBondContact OG-N 3.39Å; S51-T86 PolarHBondContact OG-OG1 3.42Å; T86-I88 HydrophobicContact CG2-CG1 4.17Å; T86-T97 HydrophobicContact CG2-CG2 3.42Å; T86-T97 VanDerWaalsContact CG2-CG2 3.42Å; T86-G98 WeakPolarHBondContact CA-O 3.37Å; T86-Y99 HydrophobicContact CG2-CD1 4.18Å; T86-Y99 HydrophobicContact CG2-CE1 3.93Å
87	C	93.9	Very high	91.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.2	166.9	62.2	0	0	0	0	110.3	C36 P37 V46 D47 W48 T97 G98	C36-C87 VanDerWaalsContact CA-SG 3.54Å; C36-C87 HydrophobicContact CB-CB 3.74Å; C36-C87 WeakPolarHBondContact CB-SG 3.41Å; C36-C87 WeakPolarHBondContact SG-CB 3.49Å; C36-C87 CovalentContact SG-SG 2.04Å; C36-C87 PolarHBondContact SG-SG 3.4Å; P37-C87 WeakPolarHBondContact CD-SG 3.37Å; V46-C87 HydrophobicContact CG1-CB 4.15Å; D47-C87 CarbonylContact O-C 3.5Å; D47-C87 WeakPolarHBondContact O-CA 3.39Å; W48-C87 HydrophobicContact CD2-CB 3.71Å; W48-C87 HydrophobicContact CE3-CB 3.73Å; W48-C87 HydrophobicContact CG-CB 4.45Å; W48-C87 HydrophobicContact CH2-CB 3.84Å; W48-C87 HydrophobicContact CZ2-CB 3.78Å; W48-C87 HydrophobicContact CZ3-CB 3.79Å; C87-T97 CarbonylContact O-C 3.53Å; C87-T97 WeakPolarHBondContact O-CA 3.46Å; C87-G98 PolarHBondContact N-O 2.66Å; C87-G98 PolarHBondContact O-N 3.14Å
88	I	93	Very high	91.1	Very high	36 Å²	36	52.4 Å²	52.4	19%	0.185	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	109.2	177.6	-55.5	-178.6	0	0	0	107.7	V46 D47 Y49 T86 R90 N95 T97	V46-I88 WeakPolarHBondContact CA-O 3.4Å; D47-I88 PolarHBondContact N-O 3.26Å; D47-I88 PolarHBondContact O-N 3.24Å; Y49-I88 HydrophobicContact CD2-CD1 4.08Å; Y49-I88 HydrophobicContact CD2-CG1 4.38Å; Y49-I88 HydrophobicContact CE2-CD1 3.73Å; Y49-I88 HydrophobicContact CE2-CG1 4.24Å; T86-I88 HydrophobicContact CG2-CG1 4.17Å; I88-R90 HydrophobicContact CG2-CG 4.38Å; I88-N95 HydrophobicContact CG2-CB 4.28Å; I88-T97 HydrophobicContact CG1-CG2 4.36Å
89	V	91.9	Very high	90.9	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.3	174.6	-175.7	0	0	0	0	108.4	R38 Y44 V46 R96	R38-V89 HydrophobicContact CB-CG2 4.14Å; Y44-V89 HydrophobicContact CD2-CG1 3.98Å; V46-V89 HydrophobicContact CG1-CG2 4.3Å; V46-V89 HydrophobicContact CG2-CB 4.41Å; V46-V89 HydrophobicContact CG2-CG1 4.26Å; V46-V89 HydrophobicContact CG2-CG2 4.01Å; V89-R96 HydrophobicContact CB-CB 4.39Å; V89-R96 PolarHBondContact N-O 2.9Å; V89-R96 PolarHBondContact O-N 3.49Å
90	R	89.9	Confident	90.8	Very high	101 Å²	101	49.2 Å²	49.2	38%	0.381	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	111	179.9	-64.7	-172.5	174.6	132.3	9.9	110.4	Y44 I45 D47 I88	Y44-R90 WeakPolarHBondContact CB-O 3.4Å; I45-R90 PolarHBondContact O-N 3.47Å; D47-R90 IonicContact OD1-CZ 3.52Å; D47-R90 IonicContact OD1-NH1 3.3Å; D47-R90 PolarHBondContact OD1-NH1 2.84Å; D47-R90 IonicContact OD1-NH2 3.82Å; D47-R90 WeakPolarHBondContact OD2-CD 3.46Å; D47-R90 IonicContact OD2-CZ 2.64Å; D47-R90 IonicContact OD2-NE 3.35Å; D47-R90 PolarHBondContact OD2-NE 3.48Å; D47-R90 IonicContact OD2-NH1 2.9Å; D47-R90 PolarHBondContact OD2-NH1 3.02Å; D47-R90 IonicContact OD2-NH2 3.99Å; D47-R90 PolarHBondContact OD2-NH2 3.01Å; I88-R90 HydrophobicContact CG2-CG 4.38Å
91	S	83.6	Confident	90.8	Very high	11 Å²	11	47.5 Å²	47.5	8%	0.077	25%	0.247	C	C	.	.			trans	-100.2	152.7	168.4	172.8	0	0	0	0	108.9	Y44 T93 F94	Y44-S91 VanDerWaalsContact CE2-CB 3.43Å; Y44-S91 PolarHBondContact OH-OG 3.25Å; S91-T93 PolarHBondContact O-N 3.12Å; S91-T93 PolarHBondContact OG-OG1 3.15Å; S91-F94 WeakPolarHBondContact CA-O 3.27Å; S91-F94 WeakPolarHBondContact CB-O 3.11Å; S91-F94 PolarHBondContact N-O 2.86Å; S91-F94 PolarHBondContact O-N 3.41Å
92	P	82.4	Confident	90.9	Very high	121 Å²	121	46.6 Å²	46.6	79%	0.786	24%	0.242	S	C	*	.	S	Bend	trans	-54.6	-24.3	176.6	-27.5	35.2	0	0	0	114.7
93	T	83.2	Confident	90.9	Very high	116 Å²	116	46.6 Å²	46.6	71%	0.712	24%	0.241	S	C	*	.	S	Bend	trans	-110.4	-20.2	-174.1	51	0	0	0	0	114.9	S91	S91-T93 PolarHBondContact O-N 3.12Å; S91-T93 PolarHBondContact OG-OG1 3.15Å
94	F	81.8	Confident	90.9	Very high	88 Å²	88	46.4 Å²	46.4	39%	0.386	24%	0.238	S	C	.	.			trans	-163.2	157.4	-178.7	58.3	-100.8	0	0	0	111.2	S91 R96	S91-F94 WeakPolarHBondContact CA-O 3.27Å; S91-F94 WeakPolarHBondContact CB-O 3.11Å; S91-F94 PolarHBondContact N-O 2.86Å; S91-F94 PolarHBondContact O-N 3.41Å; F94-R96 HydrophobicContact CD2-CG 3.72Å; F94-R96 HydrophobicContact CE2-CG 3.58Å
95	N	88.6	Confident	90.8	Very high	103 Å²	103	47 Å²	47	55%	0.551	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	137.4	171.3	-66.7	-22.9	0	0	0	110	I88	I88-N95 HydrophobicContact CG2-CB 4.28Å
96	R	88.4	Confident	90.7	Very high	123 Å²	123	53.1 Å²	53.1	46%	0.464	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.9	173	-73.4	-178.2	-178.4	-176.2	2.3	110.2	R38 V89 F94	R38-R96 HydrophobicContact CB-CB 4.23Å; R38-R96 HydrophobicContact CG-CB 4.26Å; V89-R96 HydrophobicContact CB-CB 4.39Å; V89-R96 PolarHBondContact N-O 2.9Å; V89-R96 PolarHBondContact O-N 3.49Å; F94-R96 HydrophobicContact CD2-CG 3.72Å; F94-R96 HydrophobicContact CE2-CG 3.58Å
97	T	90.4	Very high	90.1	Very high	52 Å²	52	59.3 Å²	59.3	32%	0.319	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.2	175.6	-50.2	0	0	0	0	110.4	R38 T86 C87 I88 Y99	R38-T97 WeakPolarHBondContact CG-O 3.24Å; R38-T97 PolarHBondContact NE-O 2.99Å; T86-T97 HydrophobicContact CG2-CG2 3.42Å; T86-T97 VanDerWaalsContact CG2-CG2 3.42Å; C87-T97 CarbonylContact O-C 3.53Å; C87-T97 WeakPolarHBondContact O-CA 3.46Å; I88-T97 HydrophobicContact CG1-CG2 4.36Å; T97-Y99 HydrophobicContact CG2-CE1 4.08Å; T97-Y99 HydrophobicContact CG2-CE2 4.28Å
98	G	91.2	Very high	89.4	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.7	171	0	0	0	0	0	110.7	T86 C87	T86-G98 WeakPolarHBondContact CA-O 3.37Å; C87-G98 PolarHBondContact N-O 2.66Å; C87-G98 PolarHBondContact O-N 3.14Å
99	Y	92.6	Very high	88.6	Confident	59 Å²	59	69.1 Å²	69.1	23%	0.231	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.2	178.9	-56.3	-78.7	0	0	0	109	A17 S21 K22 P37 I84 Y85 T86 T97	A17-Y99 HydrophobicContact CB-CD2 4.25Å; A17-Y99 HydrophobicContact CB-CE2 4.24Å; A17-Y99 HydrophobicContact CB-CG 4.45Å; S21-Y99 CarbonylContact C-O 3.56Å; S21-Y99 WeakPolarHBondContact CA-O 3.48Å; K22-Y99 PolarHBondContact N-O 3.03Å; P37-Y99 WeakPolarHBondContact CG-O 3.5Å; I84-Y99 HydrophobicContact CG2-CD1 4.47Å; Y85-Y99 CarbonylContact O-C 3.57Å; T86-Y99 HydrophobicContact CG2-CD1 4.18Å; T86-Y99 HydrophobicContact CG2-CE1 3.93Å; T97-Y99 HydrophobicContact CG2-CE1 4.08Å; T97-Y99 HydrophobicContact CG2-CE2 4.28Å
100	A	93.1	Very high	87.8	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.1	172.9	0	0	0	0	0	108.4	K22 V34 P37 W48 I84 Y85 V102	K22-A100 WeakPolarHBondContact O-CA 3.25Å; V34-A100 HydrophobicContact CG1-CB 3.86Å; P37-A100 HydrophobicContact CG-CB 4.48Å; W48-A100 HydrophobicContact CH2-CB 4.44Å; W48-A100 HydrophobicContact CZ3-CB 4.14Å; I84-A100 WeakPolarHBondContact CA-O 3.4Å; Y85-A100 PolarHBondContact N-O 3.07Å; Y85-A100 PolarHBondContact O-N 2.66Å; A100-V102 HydrophobicContact CB-CG2 4.39Å
101	N	94.9	Very high	87.2	Confident	50 Å²	50	70.9 Å²	70.9	27%	0.267	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	107.1	173.6	-175.4	12.7	0	0	0	108	K22 Q23 S24	K22-N101 PolarHBondContact O-N 2.88Å; Q23-N101 CarbonylContact C-O 3.56Å; Q23-N101 WeakPolarHBondContact CA-O 3.34Å; S24-N101 PolarHBondContact N-O 3.13Å; S24-N101 VanDerWaalsContact O-O 3.09Å
102	V	95.3	Very high	87	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122	-174.5	-179.1	0	0	0	0	109.4	S24 L32 V34 F74 S82 G83 Y85 A100 I104	S24-V102 WeakPolarHBondContact O-CA 3.3Å; L32-V102 HydrophobicContact CD2-CG1 3.76Å; V34-V102 HydrophobicContact CG1-CG2 4.36Å; V34-V102 HydrophobicContact CG2-CG2 4.02Å; F74-V102 HydrophobicContact CE2-CG1 4.24Å; F74-V102 HydrophobicContact CZ-CG1 4.05Å; F74-V102 HydrophobicContact CZ-CG2 4.4Å; S82-V102 CarbonylContact C-O 3.19Å; S82-V102 WeakPolarHBondContact CA-O 3.46Å; G83-V102 PolarHBondContact N-O 2.82Å; G83-V102 PolarHBondContact O-N 3.2Å; Y85-V102 HydrophobicContact CD2-CB 3.96Å; Y85-V102 HydrophobicContact CD2-CG2 3.69Å; Y85-V102 HydrophobicContact CE2-CB 3.97Å; Y85-V102 HydrophobicContact CE2-CG2 4.13Å; A100-V102 HydrophobicContact CB-CG2 4.39Å; V102-I104 HydrophobicContact CG1-CD1 4.27Å; V102-I104 HydrophobicContact CG1-CG1 4.27Å
103	T	95.3	Very high	87.1	Confident	35 Å²	35	71.7 Å²	71.7	22%	0.215	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.5	176.1	-47.6	0	0	0	0	110.4	S24 W25 G26 Y105	S24-T103 PolarHBondContact O-N 3.47Å; W25-T103 WeakPolarHBondContact CA-O 3.31Å; W25-T103 WeakPolarHBondContact CB-O 3.42Å; G26-T103 PolarHBondContact N-O 3.41Å; G26-T103 VanDerWaalsContact N-O 3.16Å; T103-Y105 HydrophobicContact CG2-CD2 4.16Å; T103-Y105 HydrophobicContact CG2-CE1 4.05Å; T103-Y105 HydrophobicContact CG2-CE2 3.48Å; T103-Y105 VanDerWaalsContact CG2-CE2 3.48Å; T103-Y105 VanDerWaalsContact CG2-CZ 3.43Å
104	I	95.4	Very high	87.4	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.7	-179.5	-64.7	152.2	0	0	0	108.9	G26 E28 L32 F74 A77 E78 V79 D81 S82 V102	G26-I104 WeakPolarHBondContact O-CA 3.49Å; E28-I104 HydrophobicContact CB-CG2 4.35Å; L32-I104 HydrophobicContact CD2-CG1 4.25Å; F74-I104 HydrophobicContact CD1-CD1 4.41Å; A77-I104 HydrophobicContact CB-CD1 3.86Å; A77-I104 HydrophobicContact CB-CG1 4.07Å; A77-I104 HydrophobicContact CB-CG2 4.1Å; E78-I104 WeakPolarHBondContact O-CD1 3.31Å; V79-I104 HydrophobicContact CG2-CG2 4.39Å; D81-I104 HydrophobicContact CB-CD1 3.65Å; S82-I104 PolarHBondContact OG-N 2.8Å; V102-I104 HydrophobicContact CG1-CD1 4.27Å; V102-I104 HydrophobicContact CG1-CG1 4.27Å
105	Y	93.4	Very high	87.6	Confident	59 Å²	59	70.1 Å²	70.1	23%	0.231	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.6	-173.9	-65	-92.6	0	0	0	110.9	W25 G26 L27 E28 T103 Y116 L117	W25-Y105 HydrophobicContact CB-CD2 4.32Å; W25-Y105 HydrophobicContact CB-CE2 3.89Å; G26-Y105 PolarHBondContact O-N 2.94Å; L27-Y105 CarbonylContact C-O 3.5Å; L27-Y105 WeakPolarHBondContact CA-O 3.14Å; E28-Y105 PolarHBondContact N-O 2.91Å; T103-Y105 HydrophobicContact CG2-CD2 4.16Å; T103-Y105 HydrophobicContact CG2-CE1 4.05Å; T103-Y105 HydrophobicContact CG2-CE2 3.48Å; T103-Y105 VanDerWaalsContact CG2-CE2 3.48Å; T103-Y105 VanDerWaalsContact CG2-CZ 3.43Å; Y105-Y116 AromaticContact CD1-CE2 3.82Å; Y105-Y116 HydrophobicContact CD1-CE2 3.82Å; Y105-Y116 HydrophobicContact CE1-CD2 4.07Å; Y105-Y116 AromaticContact CE1-CE2 3.43Å; Y105-Y116 HydrophobicContact CE1-CE2 3.43Å; Y105-Y116 VanDerWaalsContact CE1-CE2 3.43Å; Y105-Y116 HydrophobicContact CE2-CD2 4.49Å; Y105-Y116 HydrophobicContact CE2-CE2 4.38Å; Y105-Y116 HydrophobicContact CG-CE2 4.43Å; Y105-Y116 AromaticContact CZ-CD2 3.9Å; Y105-Y116 AromaticContact CZ-CE2 3.73Å; Y105-L117 HydrophobicContact CD1-CD2 4.49Å; Y105-L117 HydrophobicContact CD2-CD2 3.38Å; Y105-L117 HydrophobicContact CE2-CD2 3.57Å; Y105-L117 HydrophobicContact CG-CD1 4.46Å; Y105-L117 HydrophobicContact CG-CD2 3.86Å
106	K	91.5	Very high	87.5	Confident	138 Å²	138	70.6 Å²	70.6	60%	0.6	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-66.3	137	167.9	-65.2	-166.5	172.6	-176.7	0	109.3	V79 Q108	V79-K106 HydrophobicContact CG2-CD 4.46Å; V79-K106 HydrophobicContact CG2-CG 3.53Å; K106-Q108 PolarHBondContact O-N 3.24Å
107	K	81.5	Confident	87.4	Confident	146 Å²	146	65.3 Å²	65.3	64%	0.635	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-62.9	120.4	173.3	-171.6	169.2	-177.1	168.1	0	109.1
108	Q	79.5	Confident	87.5	Confident	98 Å²	98	64 Å²	64	46%	0.458	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-74.6	150.2	175.8	-64	-166.3	1.5	0	0	110.1	K106	K106-Q108 PolarHBondContact O-N 3.24Å
109	P	76	Confident	87.6	Confident	144 Å²	144	66.8 Å²	66.8	94%	0.935	34%	0.336	S	S	*	.	S	Bend	trans	-72.6	-21.2	174.9	29.6	-34.3	0	0	0	112.3
110	D	76.3	Confident	87.6	Confident	94 Å²	94	68.3 Å²	68.3	50%	0.503	36%	0.355	S	S	.	.	S	Bend	trans	-70.9	143.5	175	-165.4	-1.3	0	0	0	110.6	N112	D110-N112 VanDerWaalsContact C-N 3.33Å; D110-N112 PolarHBondContact OD1-N 3.22Å
111	C	76.6	Confident	87.6	Confident	47 Å²	47	72.2 Å²	72.2	32%	0.318	38%	0.379	S	S	.	.	S	Bend	trans	-69.6	-33.1	176.4	165	0	0	0	0	112	V113 N150 C151	C111-V113 PolarHBondContact O-N 3.5Å; C111-N150 VanDerWaalsContact SG-C 3.54Å; C111-C151 VanDerWaalsContact C-SG 3.55Å; C111-C151 WeakPolarHBondContact CA-SG 3.22Å; C111-C151 HydrophobicContact CB-CB 3.88Å; C111-C151 WeakPolarHBondContact CB-SG 3.19Å; C111-C151 PolarHBondContact O-SG 3.49Å; C111-C151 WeakPolarHBondContact SG-CB 3.46Å; C111-C151 CovalentContact SG-SG 2Å; C111-C151 PolarHBondContact SG-SG 3.08Å
112	N	79.8	Confident	87.4	Confident	107 Å²	107	71.5 Å²	71.5	57%	0.572	38%	0.377	S	S	*	.			trans	-69.1	110.1	-176.4	-68.8	-24.4	0	0	0	110.3	D110 P114	D110-N112 VanDerWaalsContact C-N 3.33Å; D110-N112 PolarHBondContact OD1-N 3.22Å; N112-P114 WeakPolarHBondContact O-CD 3.29Å
113	V	85.3	Confident	87.1	Confident	43 Å²	43	73.8 Å²	73.8	26%	0.261	39%	0.393	S	S	.	.			trans	-70.8	123.9	173.3	-179.1	0	0	0	0	107.5	C111 L117 M118 T197	C111-V113 PolarHBondContact O-N 3.5Å; V113-L117 HydrophobicContact CG1-CB 3.77Å; V113-M118 HydrophobicContact CB-CE 4.32Å; V113-M118 HydrophobicContact CG1-CG 4.14Å; V113-M118 WeakPolarHBondContact O-CE 3.2Å; V113-T197 HydrophobicContact CB-CG2 4.27Å; V113-T197 HydrophobicContact CG1-CG2 4.44Å; V113-T197 HydrophobicContact CG2-CG2 4.31Å
114	P	88.4	Confident	86.5	Confident	32 Å²	32	72.3 Å²	72.3	21%	0.208	38%	0.384	C	S	.	.			trans	-63.4	148.2	176.6	-24.4	34.1	0	0	0	112.9	N112 Y116 L117	N112-P114 WeakPolarHBondContact O-CD 3.29Å; P114-Y116 HydrophobicContact CB-CD1 3.59Å; P114-Y116 HydrophobicContact CB-CE1 3.17Å; P114-Y116 HydrophobicContact CB-CE2 4.45Å; P114-Y116 HydrophobicContact CB-CG 4.37Å; P114-Y116 HydrophobicContact CG-CE1 3.85Å; P114-Y116 PolarHBondContact O-N 3.33Å; P114-L117 WeakPolarHBondContact O-CA 3.38Å; P114-L117 PolarHBondContact O-N 3.39Å
115	D	86.7	Confident	85.8	Confident	138 Å²	138	72.5 Å²	72.5	74%	0.738	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-52	-35.3	-179	-66.6	-8.6	0	0	0	114.1	L117 M118	D115-L117 PolarHBondContact O-N 2.9Å; D115-M118 WeakPolarHBondContact O-CB 3.39Å; D115-M118 PolarHBondContact O-N 3.25Å
116	Y	85.4	Confident	84.9	Confident	114 Å²	114	76.5 Å²	76.5	45%	0.447	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-71.3	-13.1	179.4	66	-95.8	0	0	0	113.9	Y105 P114	Y105-Y116 AromaticContact CD1-CE2 3.82Å; Y105-Y116 HydrophobicContact CD1-CE2 3.82Å; Y105-Y116 HydrophobicContact CE1-CD2 4.07Å; Y105-Y116 AromaticContact CE1-CE2 3.43Å; Y105-Y116 HydrophobicContact CE1-CE2 3.43Å; Y105-Y116 VanDerWaalsContact CE1-CE2 3.43Å; Y105-Y116 HydrophobicContact CE2-CD2 4.49Å; Y105-Y116 HydrophobicContact CE2-CE2 4.38Å; Y105-Y116 HydrophobicContact CG-CE2 4.43Å; Y105-Y116 AromaticContact CZ-CD2 3.9Å; Y105-Y116 AromaticContact CZ-CE2 3.73Å; P114-Y116 HydrophobicContact CB-CD1 3.59Å; P114-Y116 HydrophobicContact CB-CE1 3.17Å; P114-Y116 HydrophobicContact CB-CE2 4.45Å; P114-Y116 HydrophobicContact CB-CG 4.37Å; P114-Y116 HydrophobicContact CG-CE1 3.85Å; P114-Y116 PolarHBondContact O-N 3.33Å
117	L	87.9	Confident	83.8	Confident	12 Å²	12	78 Å²	78	6%	0.063	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-103.7	14.3	171.3	-59.3	-178.1	0	0	0	111.8	W25 L27 Y105 V113 P114 D115	W25-L117 HydrophobicContact CD2-CD2 4.01Å; W25-L117 HydrophobicContact CE3-CB 4.47Å; W25-L117 HydrophobicContact CE3-CD2 3.76Å; W25-L117 HydrophobicContact CG-CD2 4.38Å; W25-L117 VanDerWaalsContact CH2-C 3.44Å; W25-L117 HydrophobicContact CH2-CB 4.37Å; W25-L117 WeakPolarHBondContact CH2-O 3.46Å; W25-L117 WeakPolarHBondContact CZ2-O 3.35Å; W25-L117 HydrophobicContact CZ3-CB 4.23Å; W25-L117 HydrophobicContact CZ3-CD2 4.31Å; L27-L117 HydrophobicContact CD2-CD1 4.06Å; Y105-L117 HydrophobicContact CD1-CD2 4.49Å; Y105-L117 HydrophobicContact CD2-CD2 3.38Å; Y105-L117 HydrophobicContact CE2-CD2 3.57Å; Y105-L117 HydrophobicContact CG-CD1 4.46Å; Y105-L117 HydrophobicContact CG-CD2 3.86Å; V113-L117 HydrophobicContact CG1-CB 3.77Å; P114-L117 WeakPolarHBondContact O-CA 3.38Å; P114-L117 PolarHBondContact O-N 3.39Å; D115-L117 PolarHBondContact O-N 2.9Å
118	M	90.8	Very high	83.4	Confident	25 Å²	25	75.3 Å²	75.3	12%	0.123	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-104.6	146.1	174.4	-61.2	-160.7	-161.2	0	0	111.5	V113 D115 D178 T197 P199	V113-M118 HydrophobicContact CB-CE 4.32Å; V113-M118 HydrophobicContact CG1-CG 4.14Å; V113-M118 WeakPolarHBondContact O-CE 3.2Å; D115-M118 WeakPolarHBondContact O-CB 3.39Å; D115-M118 PolarHBondContact O-N 3.25Å; M118-D178 HydrophobicContact CE-CB 4.36Å; M118-D178 WeakPolarHBondContact CE-OD2 3.35Å; M118-T197 HydrophobicContact CG-CG2 4.33Å; M118-T197 HydrophobicContact SD-CG2 4.37Å; M118-P199 HydrophobicContact SD-CG 3.67Å
119	Y	93.6	Very high	83.5	Confident	57 Å²	57	71.2 Å²	71.2	22%	0.224	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-81.9	168.9	168.6	-68.9	-95	0	0	0	110.7	W25 T121 P134 T135 A196 T197 P199	W25-Y119 AromaticContact CH2-CD2 3.85Å; W25-Y119 HydrophobicContact CH2-CD2 3.85Å; W25-Y119 AromaticContact CH2-CE2 3.33Å; W25-Y119 HydrophobicContact CH2-CE2 3.33Å; W25-Y119 AromaticContact CZ2-CD2 3.72Å; W25-Y119 HydrophobicContact CZ2-CD2 3.72Å; W25-Y119 HydrophobicContact CZ2-CE1 4.48Å; W25-Y119 AromaticContact CZ2-CE2 3.42Å; W25-Y119 HydrophobicContact CZ2-CE2 3.42Å; W25-Y119 VanDerWaalsContact CZ2-CE2 3.42Å; W25-Y119 HydrophobicContact CZ2-CG 4.39Å; W25-Y119 AromaticContact CZ2-CZ 3.86Å; W25-Y119 HydrophobicContact CZ3-CE2 4.37Å; Y119-T121 PolarHBondContact O-N 3.11Å; Y119-P134 HydrophobicContact CD1-CB 3.52Å; Y119-P134 HydrophobicContact CD1-CG 4.18Å; Y119-P134 HydrophobicContact CD2-CB 3.4Å; Y119-P134 VanDerWaalsContact CD2-CB 3.4Å; Y119-P134 HydrophobicContact CD2-CG 3.33Å; Y119-P134 HydrophobicContact CE1-CB 3.67Å; Y119-P134 HydrophobicContact CE2-CB 3.55Å; Y119-P134 HydrophobicContact CE2-CG 3.87Å; Y119-P134 HydrophobicContact CG-CB 3.37Å; Y119-P134 HydrophobicContact CG-CG 3.49Å; Y119-P134 VanDerWaalsContact CG-CG 3.49Å; Y119-T135 HydrophobicContact CE1-CG2 3.51Å; Y119-T135 VanDerWaalsContact OH-CG2 3.29Å; Y119-T135 WeakPolarHBondContact OH-CG2 3.35Å; Y119-T135 PolarHBondContact OH-OG1 3.26Å; Y119-A196 HydrophobicContact CD2-CB 4.26Å; Y119-A196 HydrophobicContact CE2-CB 3.77Å; Y119-T197 WeakPolarHBondContact CD2-O 3.33Å; Y119-T197 PolarHBondContact N-O 2.86Å; Y119-P199 VanDerWaalsContact O-CD 3.29Å; Y119-P199 WeakPolarHBondContact O-CD 3.33Å
120	S	92.9	Very high	84.2	Confident	92 Å²	92	70 Å²	70	64%	0.643	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-52.2	134.8	-178	58.2	0	0	0	0	113.3
121	T	92.8	Very high	85.1	Confident	82 Å²	82	65.6 Å²	65.6	50%	0.503	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-55	137.6	174.6	-52.3	0	0	0	0	112	Y119 P199 T201	Y119-T121 PolarHBondContact O-N 3.11Å; T121-P199 WeakPolarHBondContact CA-O 3.46Å; T121-P199 HydrophobicContact CG2-CB 4.07Å; T121-T201 HydrophobicContact CG2-CG2 3.9Å
122	V	91.6	Very high	85.9	Confident	35 Å²	35	68.2 Å²	68.2	21%	0.212	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.2	171.8	-71.2	0	0	0	0	109.9	I131 R198 P199 F200 T201	V122-I131 HydrophobicContact CG2-CG2 4.31Å; V122-R198 HydrophobicContact CG2-CG 4.37Å; V122-P199 PolarHBondContact N-O 3.22Å; V122-F200 HydrophobicContact CG2-CD2 4.09Å; V122-F200 VanDerWaalsContact O-CA 3.31Å; V122-F200 WeakPolarHBondContact O-CA 3.4Å; V122-T201 PolarHBondContact O-N 2.79Å
123	S	88.4	Confident	86.6	Confident	48 Å²	48	63.2 Å²	63.2	34%	0.336	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.7	177.1	62.6	0	0	0	0	110.6	T201 K203	S123-T201 CarbonylContact C-O 3.5Å; S123-T201 WeakPolarHBondContact CA-O 3.31Å; S123-K203 VanDerWaalsContact CB-CE 3.49Å; S123-K203 WeakPolarHBondContact OG-CE 3.36Å; S123-K203 PolarHBondContact OG-NZ 3.16Å
124	G	83.8	Confident	87.1	Confident	4 Å²	4	61.3 Å²	61.3	4%	0.041	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	169.3	174.6	0	0	0	0	0	114	N128 F200 T201 K203	G124-N128 CarbonylContact C-O 3.52Å; G124-N128 WeakPolarHBondContact CA-O 3.46Å; G124-F200 VanDerWaalsContact N-CE2 3.32Å; G124-T201 PolarHBondContact N-O 3.03Å; G124-K203 PolarHBondContact O-N 2.86Å
125	S	80.4	Confident	87.3	Confident	8 Å²	8	62 Å²	62	6%	0.056	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-145.4	176.2	177.6	63.6	0	0	0	0	109.6	K127 N128 S129 E205	S125-K127 PolarHBondContact O-N 3.24Å; S125-K127 PolarHBondContact OG-N 3.3Å; S125-N128 PolarHBondContact N-O 3.17Å; S125-N128 CarbonylContact O-C 3.58Å; S125-N128 PolarHBondContact O-N 3.43Å; S125-N128 PolarHBondContact OG-N 2.82Å; S125-S129 PolarHBondContact O-N 2.83Å; S125-E205 VanDerWaalsContact CB-CG 3.46Å; S125-E205 WeakPolarHBondContact CB-OE1 3.48Å; S125-E205 PolarHBondContact OG-OE1 3Å
126	E	73.4	Confident	87.6	Confident	142 Å²	142	55.5 Å²	55.5	66%	0.664	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-35.1	176.1	-166.4	-174.7	176.2	0	0	112.2
127	K	68.4	Low	88	Confident	169 Å²	169	55.7 Å²	55.7	74%	0.735	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.8	178	-65.7	-179.5	-172.8	163.5	0	114	S125 E205	S125-K127 PolarHBondContact O-N 3.24Å; S125-K127 PolarHBondContact OG-N 3.3Å; K127-E205 WeakPolarHBondContact CD-OE2 3.4Å; K127-E205 WeakPolarHBondContact CG-OE2 3.36Å
128	N	72.8	Confident	88.3	Confident	91 Å²	91	56.7 Å²	56.7	49%	0.487	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-143.2	79.6	-176.8	-171.7	18.2	0	0	0	111.7	G124 S125	G124-N128 CarbonylContact C-O 3.52Å; G124-N128 WeakPolarHBondContact CA-O 3.46Å; S125-N128 PolarHBondContact N-O 3.17Å; S125-N128 CarbonylContact O-C 3.58Å; S125-N128 PolarHBondContact O-N 3.43Å; S125-N128 PolarHBondContact OG-N 2.82Å
129	S	81.7	Confident	88.4	Confident	12 Å²	12	56.4 Å²	56.4	8%	0.084	29%	0.291	C	S	.	.			trans	-106.7	40.9	-177	58.6	0	0	0	0	112.9	S125 I168	S125-S129 PolarHBondContact O-N 2.83Å; S129-I168 WeakPolarHBondContact CB-O 3.41Å; S129-I168 PolarHBondContact O-N 3.16Å; S129-I168 VanDerWaalsContact O-N 3.1Å; S129-I168 PolarHBondContact OG-O 3.23Å
130	K	90.9	Very high	88.5	Confident	119 Å²	119	58.6 Å²	58.6	52%	0.517	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.7	-177.4	-64.2	-176.9	-177.2	173.9	0	112.2	F165 L166 V167	K130-F165 HydrophobicContact CB-CD2 4.41Å; K130-F165 HydrophobicContact CD-CD2 4.17Å; K130-F165 HydrophobicContact CD-CE2 4.01Å; K130-F165 HydrophobicContact CG-CD2 4.18Å; K130-F165 HydrophobicContact CG-CE2 4.36Å; K130-L166 CarbonylContact C-O 3.59Å; K130-L166 WeakPolarHBondContact CA-O 3.22Å; K130-V167 HydrophobicContact CG-CG2 4.35Å
131	I	94.3	Very high	88.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	109.6	173.8	-51.9	179.1	0	0	0	108.6	V122 W147 F165 L166 I168 Y179 R198 F200	V122-I131 HydrophobicContact CG2-CG2 4.31Å; I131-W147 HydrophobicContact CB-CH2 4.37Å; I131-W147 HydrophobicContact CB-CZ3 4.41Å; I131-W147 HydrophobicContact CG2-CH2 3.97Å; I131-W147 HydrophobicContact CG2-CZ3 3.83Å; I131-W147 VanDerWaalsContact O-CH2 3.26Å; I131-W147 WeakPolarHBondContact O-CH2 3.47Å; I131-F165 CarbonylContact O-C 3.56Å; I131-F165 WeakPolarHBondContact O-CA 3.35Å; I131-F165 VanDerWaalsContact O-CB 3.31Å; I131-F165 WeakPolarHBondContact O-CB 3.5Å; I131-L166 HydrophobicContact CB-CB 4.34Å; I131-L166 HydrophobicContact CD1-CD2 4.41Å; I131-L166 PolarHBondContact N-O 3.49Å; I131-L166 PolarHBondContact O-N 2.9Å; I131-I168 HydrophobicContact CD1-CD1 3.83Å; I131-Y179 HydrophobicContact CD1-CD1 3.75Å; I131-Y179 HydrophobicContact CD1-CD2 3.6Å; I131-Y179 HydrophobicContact CD1-CE1 3.89Å; I131-Y179 HydrophobicContact CD1-CE2 3.76Å; I131-Y179 HydrophobicContact CD1-CG 3.59Å; I131-R198 HydrophobicContact CG2-CG 4.16Å; I131-F200 HydrophobicContact CD1-CB 3.79Å; I131-F200 HydrophobicContact CD1-CD1 4.05Å; I131-F200 HydrophobicContact CD1-CD2 3.68Å; I131-F200 HydrophobicContact CD1-CE2 4.22Å; I131-F200 HydrophobicContact CD1-CG 3.57Å; I131-F200 HydrophobicContact CG1-CB 4.49Å; I131-F200 HydrophobicContact CG1-CD2 3.64Å; I131-F200 HydrophobicContact CG1-CE2 3.97Å; I131-F200 HydrophobicContact CG1-CG 4.09Å
132	Y	94.4	Very high	88.2	Confident	103 Å²	103	58.5 Å²	58.5	40%	0.404	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.5	180	-142.3	-91.3	0	0	0	111.2	P134 I136 S164 F165 R198	Y132-P134 WeakPolarHBondContact O-CD 3.41Å; Y132-I136 HydrophobicContact CE1-CG2 4.32Å; Y132-S164 WeakPolarHBondContact CE2-OG 3.47Å; Y132-S164 PolarHBondContact OH-OG 3.45Å; Y132-F165 HydrophobicContact CD2-CB 3.79Å; Y132-F165 HydrophobicContact CD2-CD1 4.1Å; Y132-F165 HydrophobicContact CD2-CG 4.32Å; Y132-F165 HydrophobicContact CE2-CB 4.36Å; Y132-F165 AromaticContact CE2-CD1 3.87Å; Y132-F165 HydrophobicContact CE2-CD1 3.87Å; Y132-F165 HydrophobicContact CG-CB 4.34Å; Y132-R198 PolarHBondContact O-NE 3.34Å; Y132-R198 PolarHBondContact O-NH1 2.94Å; Y132-R198 VanDerWaalsContact O-NH1 3.1Å; Y132-R198 PolarHBondContact O-NH2 3.49Å
133	C	95.1	Very high	87.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.007	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-75.1	123	174.9	-175.1	0	0	0	0	110.1	I136 L145 W147 S164 C181 F183	C133-I136 HydrophobicContact CB-CB 4.3Å; C133-I136 HydrophobicContact CB-CD1 4.19Å; C133-I136 HydrophobicContact CB-CG2 4.39Å; C133-I136 WeakPolarHBondContact O-CG2 3.4Å; C133-L145 HydrophobicContact CB-CD2 3.67Å; C133-W147 HydrophobicContact CB-CH2 4.12Å; C133-W147 HydrophobicContact CB-CZ2 4.02Å; C133-S164 VanDerWaalsContact CB-O 3.31Å; C133-S164 WeakPolarHBondContact CB-O 3.23Å; C133-S164 PolarHBondContact N-O 2.78Å; C133-C181 WeakPolarHBondContact CA-SG 3.27Å; C133-C181 HydrophobicContact CB-CB 3.75Å; C133-C181 WeakPolarHBondContact CB-SG 3.41Å; C133-C181 WeakPolarHBondContact SG-CB 3.43Å; C133-C181 CovalentContact SG-SG 2.04Å; C133-C181 PolarHBondContact SG-SG 3.36Å; C133-F183 VanDerWaalsContact SG-CE1 3.57Å
134	P	94.5	Very high	87.7	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.026	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	148.1	177.9	-12.3	19.2	0	0	0	113.3	Y119 Y132 I136 A196 R198	Y119-P134 HydrophobicContact CD1-CB 3.52Å; Y119-P134 HydrophobicContact CD1-CG 4.18Å; Y119-P134 HydrophobicContact CD2-CB 3.4Å; Y119-P134 VanDerWaalsContact CD2-CB 3.4Å; Y119-P134 HydrophobicContact CD2-CG 3.33Å; Y119-P134 HydrophobicContact CE1-CB 3.67Å; Y119-P134 HydrophobicContact CE2-CB 3.55Å; Y119-P134 HydrophobicContact CE2-CG 3.87Å; Y119-P134 HydrophobicContact CG-CB 3.37Å; Y119-P134 HydrophobicContact CG-CG 3.49Å; Y119-P134 VanDerWaalsContact CG-CG 3.49Å; Y132-P134 WeakPolarHBondContact O-CD 3.41Å; P134-I136 PolarHBondContact O-N 3.01Å; P134-A196 HydrophobicContact CB-CB 3.95Å; P134-A196 HydrophobicContact CG-CB 3.67Å; P134-R198 VanDerWaalsContact CD-NH2 3.32Å; P134-R198 VanDerWaalsContact N-NH2 3.13Å
135	T	92.4	Very high	88	Confident	47 Å²	47	62.9 Å²	62.9	29%	0.288	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	0.5	168.9	61.2	0	0	0	0	117.6	Y119 D137 L138 Y139	Y119-T135 HydrophobicContact CE1-CG2 3.51Å; Y119-T135 VanDerWaalsContact OH-CG2 3.29Å; Y119-T135 WeakPolarHBondContact OH-CG2 3.35Å; Y119-T135 PolarHBondContact OH-OG1 3.26Å; T135-D137 PolarHBondContact O-N 3.09Å; T135-D137 VanDerWaalsContact O-N 3.09Å; T135-L138 WeakPolarHBondContact O-CB 3.31Å; T135-L138 WeakPolarHBondContact O-CG 3.49Å; T135-L138 PolarHBondContact O-N 3.21Å; T135-Y139 VanDerWaalsContact O-CD2 3.28Å; T135-Y139 WeakPolarHBondContact O-CD2 3.26Å; T135-Y139 WeakPolarHBondContact O-CE2 3.17Å
136	I	94.2	Very high	88.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-54.8	-32.5	-176.7	-161.5	-174.8	0	0	0	113.6	Y132 C133 P134 L138 Y139 W141 L145 F183	Y132-I136 HydrophobicContact CE1-CG2 4.32Å; C133-I136 HydrophobicContact CB-CB 4.3Å; C133-I136 HydrophobicContact CB-CD1 4.19Å; C133-I136 HydrophobicContact CB-CG2 4.39Å; C133-I136 WeakPolarHBondContact O-CG2 3.4Å; P134-I136 PolarHBondContact O-N 3.01Å; I136-L138 PolarHBondContact O-N 3.45Å; I136-L138 VanDerWaalsContact O-N 3.09Å; I136-Y139 PolarHBondContact O-N 3.42Å; I136-W141 HydrophobicContact CD1-CD2 3.67Å; I136-W141 HydrophobicContact CD1-CE3 4.11Å; I136-W141 HydrophobicContact CD1-CG 4.15Å; I136-W141 HydrophobicContact CD1-CH2 4.11Å; I136-W141 HydrophobicContact CD1-CZ2 3.63Å; I136-W141 HydrophobicContact CD1-CZ3 4.32Å; I136-W141 HydrophobicContact CG1-CD2 4.02Å; I136-W141 HydrophobicContact CG1-CG 3.98Å; I136-W141 HydrophobicContact CG1-CZ2 4.39Å; I136-L145 HydrophobicContact CD1-CD1 3.92Å; I136-L145 HydrophobicContact CD1-CD2 3.61Å; I136-L145 HydrophobicContact CD1-CG 4.33Å; I136-F183 HydrophobicContact CB-CE1 4.29Å; I136-F183 HydrophobicContact CB-CZ 4.2Å; I136-F183 HydrophobicContact CD1-CD1 4.47Å; I136-F183 HydrophobicContact CG1-CD1 4.24Å; I136-F183 HydrophobicContact CG1-CD2 4.35Å; I136-F183 HydrophobicContact CG1-CE1 3.97Å; I136-F183 HydrophobicContact CG1-CE2 4.08Å; I136-F183 HydrophobicContact CG1-CG 4.42Å; I136-F183 HydrophobicContact CG1-CZ 3.88Å
137	D	93.4	Very high	89.7	Confident	118 Å²	118	61.2 Å²	61.2	63%	0.631	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66.3	-10.8	179.2	-54.5	-36.6	0	0	0	113.7	T135	T135-D137 PolarHBondContact O-N 3.09Å; T135-D137 VanDerWaalsContact O-N 3.09Å
138	L	93.4	Very high	90.9	Very high	34 Å²	34	55.4 Å²	55.4	18%	0.178	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-84.8	-16.7	174.7	-60.6	179.8	0	0	0	113	I33 R35 L71 T135 I136	I33-L138 HydrophobicContact CB-CB 4.25Å; I33-L138 WeakPolarHBondContact CD1-O 3.22Å; I33-L138 HydrophobicContact CG2-CB 4.09Å; I33-L138 WeakPolarHBondContact O-CD1 3.22Å; R35-L138 HydrophobicContact CB-CD2 4.43Å; R35-L138 VanDerWaalsContact CZ-CD2 3.44Å; L71-L138 HydrophobicContact CD2-CD2 4.34Å; T135-L138 WeakPolarHBondContact O-CB 3.31Å; T135-L138 WeakPolarHBondContact O-CG 3.49Å; T135-L138 PolarHBondContact O-N 3.21Å; I136-L138 PolarHBondContact O-N 3.45Å; I136-L138 VanDerWaalsContact O-N 3.09Å
139	Y	94.9	Very high	91.8	Very high	19 Å²	19	53 Å²	53	8%	0.075	28%	0.278	C	S	.	.	S	Bend	trans	-106.9	152	-171.4	-59.1	-89.3	0	0	0	110.5	A31 I33 T135 I136 F183 H185 V194	A31-Y139 HydrophobicContact CB-CE1 4.25Å; A31-Y139 PolarHBondContact O-OH 2.98Å; I33-Y139 HydrophobicContact CB-CD1 4.4Å; I33-Y139 HydrophobicContact CB-CE1 3.91Å; I33-Y139 HydrophobicContact CD1-CD1 3.55Å; I33-Y139 HydrophobicContact CD1-CE1 3.86Å; I33-Y139 HydrophobicContact CD1-CG 4.25Å; I33-Y139 HydrophobicContact CG1-CD1 3.87Å; I33-Y139 HydrophobicContact CG1-CE1 3.59Å; I33-Y139 PolarHBondContact N-OH 3.13Å; I33-Y139 VanDerWaalsContact N-OH 3.13Å; T135-Y139 VanDerWaalsContact O-CD2 3.28Å; T135-Y139 WeakPolarHBondContact O-CD2 3.26Å; T135-Y139 WeakPolarHBondContact O-CE2 3.17Å; I136-Y139 PolarHBondContact O-N 3.42Å; Y139-F183 HydrophobicContact CD1-CE2 4.44Å; Y139-F183 AromaticContact CD2-CE2 3.76Å; Y139-F183 HydrophobicContact CD2-CE2 3.76Å; Y139-F183 AromaticContact CD2-CZ 3.73Å; Y139-F183 HydrophobicContact CD2-CZ 3.73Å; Y139-F183 HydrophobicContact CE2-CE2 4.49Å; Y139-F183 HydrophobicContact CE2-CZ 4.15Å; Y139-F183 AromaticContact CG-CE2 3.74Å; Y139-F183 HydrophobicContact CG-CE2 3.74Å; Y139-F183 HydrophobicContact CG-CZ 4.19Å; Y139-H185 HydrophobicContact CD1-CB 3.87Å; Y139-H185 AromaticContact CD1-CG 3.79Å; Y139-H185 HydrophobicContact CG-CB 4.45Å; Y139-V194 HydrophobicContact CD1-CG2 3.92Å; Y139-V194 HydrophobicContact CE1-CG1 4.27Å; Y139-V194 HydrophobicContact CE1-CG2 3.8Å; Y139-V194 HydrophobicContact CE2-CG1 4.15Å
140	N	94	Very high	91.8	Very high	103 Å²	103	56.5 Å²	56.5	55%	0.551	30%	0.296	S	S	*	.			trans	-87.1	106.3	165.4	-176.9	21.7	0	0	0	108.8	H185 S186	N140-H185 PolarHBondContact N-ND1 3.18Å; N140-H185 VanDerWaalsContact N-ND1 3.11Å; N140-H185 CarbonylContact O-C 3.59Å; N140-H185 VanDerWaalsContact O-CA 3.27Å; N140-H185 WeakPolarHBondContact O-CA 3.44Å; N140-H185 PolarHBondContact O-ND1 3.17Å; N140-H185 VanDerWaalsContact O-ND1 3.12Å; N140-S186 PolarHBondContact ND2-O 3.22Å; N140-S186 PolarHBondContact O-N 3.47Å
141	W	92.8	Very high	91.3	Very high	55 Å²	55	54 Å²	54	21%	0.208	29%	0.293	C	S	.	.			trans	-135.2	161.1	-173.6	67.5	-85.3	0	0	0	110.7	I136 A143 L145 K163 F183 I184	I136-W141 HydrophobicContact CD1-CD2 3.67Å; I136-W141 HydrophobicContact CD1-CE3 4.11Å; I136-W141 HydrophobicContact CD1-CG 4.15Å; I136-W141 HydrophobicContact CD1-CH2 4.11Å; I136-W141 HydrophobicContact CD1-CZ2 3.63Å; I136-W141 HydrophobicContact CD1-CZ3 4.32Å; I136-W141 HydrophobicContact CG1-CD2 4.02Å; I136-W141 HydrophobicContact CG1-CG 3.98Å; I136-W141 HydrophobicContact CG1-CZ2 4.39Å; W141-A143 HydrophobicContact CZ3-CB 3.91Å; W141-L145 HydrophobicContact CD2-CD1 4.32Å; W141-L145 HydrophobicContact CE3-CD1 3.41Å; W141-L145 VanDerWaalsContact CE3-CD1 3.41Å; W141-L145 HydrophobicContact CH2-CD1 4.12Å; W141-L145 HydrophobicContact CZ3-CD1 3.3Å; W141-K163 VanDerWaalsContact CH2-C 3.46Å; W141-K163 HydrophobicContact CH2-CB 4.41Å; W141-F183 HydrophobicContact CB-CD2 3.91Å; W141-F183 HydrophobicContact CG-CD2 4.46Å; W141-I184 WeakPolarHBondContact CA-O 3.38Å; W141-I184 WeakPolarHBondContact CB-O 3.29Å
142	T	87.6	Confident	91	Very high	116 Å²	116	61.2 Å²	61.2	71%	0.712	33%	0.327	S	S	*	.			trans	-128.3	144.8	175.8	-54.7	0	0	0	0	110.3
143	A	84.3	Confident	90.9	Very high	58 Å²	58	58.8 Å²	58.8	48%	0.479	33%	0.328	S	S	.	.	S	Bend	trans	-73.9	156.6	179.1	0	0	0	0	0	112.5	W141	W141-A143 HydrophobicContact CZ3-CB 3.91Å
144	P	84.8	Confident	90.7	Very high	112 Å²	112	60.4 Å²	60.4	73%	0.727	34%	0.336	S	S	*	.	P	Polyproline II helix	cis	-86.9	160.5	-0.7	34.8	-34.7	0	0	0	114.1
145	L	90.9	Very high	90.2	Very high	9 Å²	9	67.7 Å²	67.7	5%	0.047	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-83	143.3	171.5	-95.5	61.8	0	0	0	111.2	C133 I136 W141 W147 C181 F183	C133-L145 HydrophobicContact CB-CD2 3.67Å; I136-L145 HydrophobicContact CD1-CD1 3.92Å; I136-L145 HydrophobicContact CD1-CD2 3.61Å; I136-L145 HydrophobicContact CD1-CG 4.33Å; W141-L145 HydrophobicContact CD2-CD1 4.32Å; W141-L145 HydrophobicContact CE3-CD1 3.41Å; W141-L145 VanDerWaalsContact CE3-CD1 3.41Å; W141-L145 HydrophobicContact CH2-CD1 4.12Å; W141-L145 HydrophobicContact CZ3-CD1 3.3Å; L145-W147 HydrophobicContact CD2-CZ2 4.42Å; L145-C181 HydrophobicContact CD2-CB 4.02Å; L145-F183 HydrophobicContact CD1-CB 4.15Å; L145-F183 HydrophobicContact CD2-CD1 4.45Å; L145-F183 HydrophobicContact CG-CB 4.03Å
146	E	93.5	Very high	89.9	Confident	101 Å²	101	67.8 Å²	67.8	47%	0.472	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.2	167.3	-67.4	174.1	-162.5	0	0	109.1	F148 C181 K182	E146-F148 HydrophobicContact CB-CE2 3.72Å; E146-F148 HydrophobicContact CB-CZ 4.2Å; E146-C181 CarbonylContact O-C 3.51Å; E146-C181 WeakPolarHBondContact O-CA 3.41Å; E146-K182 HydrophobicContact CB-CB 4.22Å; E146-K182 PolarHBondContact N-O 3.07Å; E146-K182 PolarHBondContact O-N 3.35Å; E146-K182 IonicContact OE1-NZ 3.61Å; E146-K182 IonicContact OE2-NZ 2.93Å; E146-K182 PolarHBondContact OE2-NZ 3.36Å
147	W	95.1	Very high	89.5	Confident	15 Å²	15	73.1 Å²	73.1	6%	0.057	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.7	178.5	-74.6	87.8	0	0	0	111.2	I131 C133 L145 L154 L166 T180 C181	I131-W147 HydrophobicContact CB-CH2 4.37Å; I131-W147 HydrophobicContact CB-CZ3 4.41Å; I131-W147 HydrophobicContact CG2-CH2 3.97Å; I131-W147 HydrophobicContact CG2-CZ3 3.83Å; I131-W147 VanDerWaalsContact O-CH2 3.26Å; I131-W147 WeakPolarHBondContact O-CH2 3.47Å; C133-W147 HydrophobicContact CB-CH2 4.12Å; C133-W147 HydrophobicContact CB-CZ2 4.02Å; L145-W147 HydrophobicContact CD2-CZ2 4.42Å; W147-L154 HydrophobicContact CB-CD1 3.73Å; W147-L154 HydrophobicContact CB-CG 4.38Å; W147-L154 PolarHBondContact O-N 3.28Å; W147-L166 HydrophobicContact CD2-CB 3.84Å; W147-L166 HydrophobicContact CD2-CD2 4.23Å; W147-L166 HydrophobicContact CE3-CB 4.22Å; W147-L166 HydrophobicContact CE3-CD2 4.22Å; W147-L166 HydrophobicContact CG-CB 4.29Å; W147-L166 HydrophobicContact CG-CD1 4.36Å; W147-L166 HydrophobicContact CG-CD2 4.39Å; W147-L166 HydrophobicContact CH2-CB 4.29Å; W147-L166 HydrophobicContact CZ2-CB 3.94Å; W147-L166 HydrophobicContact CZ3-CB 4.43Å; W147-T180 WeakPolarHBondContact CA-O 3.45Å; W147-C181 HydrophobicContact CD2-CB 4.03Å; W147-C181 HydrophobicContact CE3-CB 3.98Å; W147-C181 HydrophobicContact CH2-CB 3.83Å; W147-C181 HydrophobicContact CZ2-CB 3.86Å; W147-C181 HydrophobicContact CZ3-CB 3.88Å
148	F	93.4	Very high	89.4	Confident	47 Å²	47	70.1 Å²	70.1	21%	0.206	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	146.7	179	-55.5	-100.1	0	0	0	109.3	E146 Q152 A153 Y179 T180 K182	E146-F148 HydrophobicContact CB-CE2 3.72Å; E146-F148 HydrophobicContact CB-CZ 4.2Å; F148-Q152 CarbonylContact C-O 3.48Å; F148-Q152 WeakPolarHBondContact CA-O 3.31Å; F148-A153 HydrophobicContact CD1-CB 4Å; F148-A153 HydrophobicContact CE1-CB 3.84Å; F148-Y179 WeakPolarHBondContact O-CA 3.45Å; F148-T180 PolarHBondContact N-O 3.12Å; F148-T180 PolarHBondContact O-N 3.44Å; F148-K182 HydrophobicContact CE2-CB 3.95Å; F148-K182 HydrophobicContact CE2-CD 4.24Å
149	K	92.3	Very high	89.4	Confident	39 Å²	39	70.9 Å²	70.9	17%	0.17	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.5	167	-176.2	-167.9	-176.8	-158.2	0	107.6	C151 Q152 L154 D174 A176 D178 Y179	K149-C151 PolarHBondContact O-N 3.35Å; K149-Q152 PolarHBondContact N-O 2.86Å; K149-Q152 PolarHBondContact O-N 2.96Å; K149-L154 HydrophobicContact CB-CD2 3.63Å; K149-L154 HydrophobicContact CB-CG 4.42Å; K149-D174 PolarHBondContact NZ-O 3.34Å; K149-A176 WeakPolarHBondContact CE-O 3.36Å; K149-A176 PolarHBondContact NZ-O 2.92Å; K149-D178 WeakPolarHBondContact CA-O 3.38Å; K149-Y179 HydrophobicContact CB-CD1 4.35Å; K149-Y179 HydrophobicContact CB-CE1 4.16Å; K149-Y179 HydrophobicContact CD-CE1 4.33Å; K149-Y179 HydrophobicContact CD-CE2 4.34Å; K149-Y179 HydrophobicContact CG-CE1 4.29Å; K149-Y179 HydrophobicContact CG-CE2 4.28Å
150	N	81.9	Confident	89.2	Confident	86 Å²	86	75.2 Å²	75.2	46%	0.46	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	46.1	-177.9	-53.2	-17.6	0	0	0	112.2	C111 Q152 D178	C111-N150 VanDerWaalsContact SG-C 3.54Å; N150-Q152 PolarHBondContact O-N 3.08Å; N150-Q152 VanDerWaalsContact O-N 3.16Å; N150-D178 PolarHBondContact N-O 3.49Å
151	C	79.5	Confident	89.1	Confident	67 Å²	67	72.7 Å²	72.7	45%	0.453	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	8.6	-175.7	-48.3	0	0	0	0	118.2	C111 K149	C111-C151 VanDerWaalsContact C-SG 3.55Å; C111-C151 WeakPolarHBondContact CA-SG 3.22Å; C111-C151 HydrophobicContact CB-CB 3.88Å; C111-C151 WeakPolarHBondContact CB-SG 3.19Å; C111-C151 PolarHBondContact O-SG 3.49Å; C111-C151 WeakPolarHBondContact SG-CB 3.46Å; C111-C151 CovalentContact SG-SG 2Å; C111-C151 PolarHBondContact SG-SG 3.08Å; K149-C151 PolarHBondContact O-N 3.35Å
152	Q	88.3	Confident	88.8	Confident	152 Å²	152	74.8 Å²	74.8	71%	0.71	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.9	170.8	-63.6	-175.4	2.6	0	0	109.2	F148 K149 N150 L154	F148-Q152 CarbonylContact C-O 3.48Å; F148-Q152 WeakPolarHBondContact CA-O 3.31Å; K149-Q152 PolarHBondContact N-O 2.86Å; K149-Q152 PolarHBondContact O-N 2.96Å; N150-Q152 PolarHBondContact O-N 3.08Å; N150-Q152 VanDerWaalsContact O-N 3.16Å; Q152-L154 PolarHBondContact O-N 3.04Å
153	A	91.6	Very high	88.8	Confident	51 Å²	51	75.6 Å²	75.6	42%	0.421	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	129.7	173.7	0	0	0	0	0	108.5	F148 Q155	F148-A153 HydrophobicContact CD1-CB 4Å; F148-A153 HydrophobicContact CE1-CB 3.84Å; A153-Q155 PolarHBondContact O-N 3.34Å
154	L	92.3	Very high	89.1	Confident	35 Å²	35	73.2 Å²	73.2	18%	0.183	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-64.6	127	-179.8	-71.2	178	0	0	0	109.9	W147 K149 Q152 Y159 L166 Y179	W147-L154 HydrophobicContact CB-CD1 3.73Å; W147-L154 HydrophobicContact CB-CG 4.38Å; W147-L154 PolarHBondContact O-N 3.28Å; K149-L154 HydrophobicContact CB-CD2 3.63Å; K149-L154 HydrophobicContact CB-CG 4.42Å; Q152-L154 PolarHBondContact O-N 3.04Å; L154-Y159 HydrophobicContact CB-CD2 4.42Å; L154-Y159 HydrophobicContact CB-CG 4.3Å; L154-Y159 HydrophobicContact CD1-CD1 4.11Å; L154-Y159 HydrophobicContact CD1-CG 4.29Å; L154-Y159 HydrophobicContact CD2-CD1 4.31Å; L154-Y159 HydrophobicContact CD2-CD2 4.42Å; L154-Y159 HydrophobicContact CD2-CE1 4.29Å; L154-Y159 HydrophobicContact CD2-CE2 4.38Å; L154-Y159 HydrophobicContact CD2-CG 4.4Å; L154-L166 HydrophobicContact CD1-CD1 4.27Å; L154-L166 HydrophobicContact CD1-CD2 3.35Å; L154-L166 HydrophobicContact CD1-CG 4.46Å; L154-Y179 HydrophobicContact CD1-CD1 4.04Å; L154-Y179 HydrophobicContact CD1-CE1 3.9Å; L154-Y179 HydrophobicContact CD2-CE1 4.35Å
155	Q	84.5	Confident	89.5	Confident	157 Å²	157	69.4 Å²	69.4	73%	0.734	37%	0.368	S	S	*	.			trans	-123.6	142.1	177.4	-64.2	-62.2	-38.1	0	0	109.3	A153 Y159	A153-Q155 PolarHBondContact O-N 3.34Å; Q155-Y159 WeakPolarHBondContact O-CD2 3.26Å
156	G	84.9	Confident	89.6	Confident	49 Å²	49	69.1 Å²	69.1	51%	0.505	37%	0.367	S	S	.	.	S	Bend	trans	119.3	150.2	175.6	0	0	0	0	0	114.2	R158 Y159	G156-R158 PolarHBondContact O-N 3.45Å; G156-Y159 PolarHBondContact O-N 3.19Å
157	S	87	Confident	89.6	Confident	112 Å²	112	65.7 Å²	65.7	78%	0.783	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.2	-174.9	53.7	0	0	0	0	114.6	K160	S157-K160 WeakPolarHBondContact O-CE 3.26Å
158	R	91.4	Very high	89.5	Confident	55 Å²	55	65 Å²	65	21%	0.208	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-22.9	176.4	60.9	-177	-72.2	96.3	0.1	113.8	G156 I168 D169 N170 D175	G156-R158 PolarHBondContact O-N 3.45Å; R158-I168 WeakPolarHBondContact O-CA 3.39Å; R158-D169 HydrophobicContact CB-CB 4.49Å; R158-D169 VanDerWaalsContact CZ-O 3.24Å; R158-D169 PolarHBondContact NH1-O 3.04Å; R158-D169 PolarHBondContact NH2-O 3.27Å; R158-D169 PolarHBondContact O-N 3.31Å; R158-N170 PolarHBondContact NH1-O 3.47Å; R158-N170 PolarHBondContact NH2-O 3.34Å; R158-D175 IonicContact CZ-OD2 3.3Å; R158-D175 IonicContact NH2-OD1 3.43Å; R158-D175 IonicContact NH2-OD2 3.09Å; R158-D175 PolarHBondContact NH2-OD2 2.93Å
159	Y	92.1	Very high	89.2	Confident	51 Å²	51	65.3 Å²	65.3	20%	0.2	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	105.3	-179.6	-60.1	-70.2	0	0	0	109.5	L154 Q155 G156 I168 D175	L154-Y159 HydrophobicContact CB-CD2 4.42Å; L154-Y159 HydrophobicContact CB-CG 4.3Å; L154-Y159 HydrophobicContact CD1-CD1 4.11Å; L154-Y159 HydrophobicContact CD1-CG 4.29Å; L154-Y159 HydrophobicContact CD2-CD1 4.31Å; L154-Y159 HydrophobicContact CD2-CD2 4.42Å; L154-Y159 HydrophobicContact CD2-CE1 4.29Å; L154-Y159 HydrophobicContact CD2-CE2 4.38Å; L154-Y159 HydrophobicContact CD2-CG 4.4Å; Q155-Y159 WeakPolarHBondContact O-CD2 3.26Å; G156-Y159 PolarHBondContact O-N 3.19Å; Y159-I168 HydrophobicContact CD1-CB 4.48Å; Y159-I168 HydrophobicContact CD1-CD1 4.4Å; Y159-I168 HydrophobicContact CD1-CG1 4Å; Y159-I168 HydrophobicContact CD1-CG2 4.05Å; Y159-I168 HydrophobicContact CE1-CD1 4.17Å; Y159-I168 HydrophobicContact CE1-CG1 4.17Å; Y159-I168 HydrophobicContact CE1-CG2 3.73Å; Y159-D175 PolarHBondContact OH-OD1 2.94Å
160	K	90.8	Very high	88.9	Confident	110 Å²	110	69 Å²	69	48%	0.478	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	105.4	-175.8	-69.1	172.8	179.5	163.9	0	110.6	S157 H162 V167 D169	S157-K160 WeakPolarHBondContact O-CE 3.26Å; K160-H162 PolarHBondContact O-N 2.78Å; K160-V167 HydrophobicContact CB-CB 4.36Å; K160-V167 PolarHBondContact N-O 2.96Å; K160-V167 PolarHBondContact O-N 3.45Å; K160-D169 VanDerWaalsContact CE-OD2 3.22Å; K160-D169 WeakPolarHBondContact CE-OD2 3.1Å; K160-D169 IonicContact NZ-OD2 3.5Å; K160-D169 PolarHBondContact NZ-OD2 3.12Å
161	A	91.1	Very high	89.2	Confident	50 Å²	50	65.9 Å²	65.9	41%	0.413	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121.3	171.1	0	0	0	0	0	109.7
162	H	86.8	Confident	89.6	Confident	98 Å²	98	67.5 Å²	67.5	45%	0.454	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	113.5	177.6	-171.4	81.9	0	0	0	110.7	K160 S164 F165	K160-H162 PolarHBondContact O-N 2.78Å; H162-S164 PolarHBondContact O-N 2.85Å; H162-S164 VanDerWaalsContact O-N 3.14Å; H162-F165 CarbonylContact C-O 3.51Å; H162-F165 HydrophobicContact CB-CE2 4.02Å; H162-F165 HydrophobicContact CB-CZ 4.21Å; H162-F165 AromaticContact CD2-CE1 3.94Å; H162-F165 AromaticContact CD2-CZ 3.49Å; H162-F165 VanDerWaalsContact CD2-CZ 3.49Å; H162-F165 WeakPolarHBondContact CD2-CZ 3.31Å; H162-F165 PolarHBondContact N-O 2.89Å; H162-F165 WeakPolarHBondContact O-CD1 3.29Å; H162-F165 PolarHBondContact O-N 2.83Å
163	K	88.2	Confident	89.5	Confident	133 Å²	133	64.6 Å²	64.6	58%	0.578	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	-119.3	-175.5	-58.5	178	-179.4	-178.5	0	110.2	W141	W141-K163 VanDerWaalsContact CH2-C 3.46Å; W141-K163 HydrophobicContact CH2-CB 4.41Å
164	S	91.2	Very high	89.4	Confident	8 Å²	8	68.1 Å²	68.1	6%	0.056	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	3.3	-176.6	47.3	0	0	0	0	114	Y132 C133 H162	Y132-S164 WeakPolarHBondContact CE2-OG 3.47Å; Y132-S164 PolarHBondContact OH-OG 3.45Å; C133-S164 VanDerWaalsContact CB-O 3.31Å; C133-S164 WeakPolarHBondContact CB-O 3.23Å; C133-S164 PolarHBondContact N-O 2.78Å; H162-S164 PolarHBondContact O-N 2.85Å; H162-S164 VanDerWaalsContact O-N 3.14Å
165	F	93.1	Very high	89.3	Confident	32 Å²	32	66.6 Å²	66.6	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.3	-177.5	60.5	-91.1	0	0	0	113.4	K130 I131 Y132 H162 V167	K130-F165 HydrophobicContact CB-CD2 4.41Å; K130-F165 HydrophobicContact CD-CD2 4.17Å; K130-F165 HydrophobicContact CD-CE2 4.01Å; K130-F165 HydrophobicContact CG-CD2 4.18Å; K130-F165 HydrophobicContact CG-CE2 4.36Å; I131-F165 CarbonylContact O-C 3.56Å; I131-F165 WeakPolarHBondContact O-CA 3.35Å; I131-F165 VanDerWaalsContact O-CB 3.31Å; I131-F165 WeakPolarHBondContact O-CB 3.5Å; Y132-F165 HydrophobicContact CD2-CB 3.79Å; Y132-F165 HydrophobicContact CD2-CD1 4.1Å; Y132-F165 HydrophobicContact CD2-CG 4.32Å; Y132-F165 HydrophobicContact CE2-CB 4.36Å; Y132-F165 AromaticContact CE2-CD1 3.87Å; Y132-F165 HydrophobicContact CE2-CD1 3.87Å; Y132-F165 HydrophobicContact CG-CB 4.34Å; H162-F165 CarbonylContact C-O 3.51Å; H162-F165 HydrophobicContact CB-CE2 4.02Å; H162-F165 HydrophobicContact CB-CZ 4.21Å; H162-F165 AromaticContact CD2-CE1 3.94Å; H162-F165 AromaticContact CD2-CZ 3.49Å; H162-F165 VanDerWaalsContact CD2-CZ 3.49Å; H162-F165 WeakPolarHBondContact CD2-CZ 3.31Å; H162-F165 PolarHBondContact N-O 2.89Å; H162-F165 WeakPolarHBondContact O-CD1 3.29Å; H162-F165 PolarHBondContact O-N 2.83Å; F165-V167 HydrophobicContact CD2-CG2 3.71Å; F165-V167 HydrophobicContact CE2-CG2 3.51Å
166	L	93.6	Very high	89.6	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.5	170.2	178	68.5	0	0	0	109.5	K130 I131 W147 L154 I168 Y179	K130-L166 CarbonylContact C-O 3.59Å; K130-L166 WeakPolarHBondContact CA-O 3.22Å; I131-L166 HydrophobicContact CB-CB 4.34Å; I131-L166 HydrophobicContact CD1-CD2 4.41Å; I131-L166 PolarHBondContact N-O 3.49Å; I131-L166 PolarHBondContact O-N 2.9Å; W147-L166 HydrophobicContact CD2-CB 3.84Å; W147-L166 HydrophobicContact CD2-CD2 4.23Å; W147-L166 HydrophobicContact CE3-CB 4.22Å; W147-L166 HydrophobicContact CE3-CD2 4.22Å; W147-L166 HydrophobicContact CG-CB 4.29Å; W147-L166 HydrophobicContact CG-CD1 4.36Å; W147-L166 HydrophobicContact CG-CD2 4.39Å; W147-L166 HydrophobicContact CH2-CB 4.29Å; W147-L166 HydrophobicContact CZ2-CB 3.94Å; W147-L166 HydrophobicContact CZ3-CB 4.43Å; L154-L166 HydrophobicContact CD1-CD1 4.27Å; L154-L166 HydrophobicContact CD1-CD2 3.35Å; L154-L166 HydrophobicContact CD1-CG 4.46Å; L166-I168 HydrophobicContact CD2-CD1 4.46Å; L166-I168 HydrophobicContact CD2-CG1 4.23Å; L166-I168 HydrophobicContact CG-CG1 4.3Å; L166-Y179 HydrophobicContact CD2-CD1 3.77Å; L166-Y179 HydrophobicContact CD2-CE1 3.82Å
167	V	92.4	Very high	90	Very high	30 Å²	30	59.7 Å²	59.7	18%	0.182	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130	169.1	-174.9	0	0	0	0	108.6	K130 K160 F165	K130-V167 HydrophobicContact CG-CG2 4.35Å; K160-V167 HydrophobicContact CB-CB 4.36Å; K160-V167 PolarHBondContact N-O 2.96Å; K160-V167 PolarHBondContact O-N 3.45Å; F165-V167 HydrophobicContact CD2-CG2 3.71Å; F165-V167 HydrophobicContact CE2-CG2 3.51Å
168	I	92.6	Very high	90.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109.7	175.5	-49	-179.7	0	0	0	108.6	S129 I131 R158 Y159 L166 V171 Y179 F200	S129-I168 WeakPolarHBondContact CB-O 3.41Å; S129-I168 PolarHBondContact O-N 3.16Å; S129-I168 VanDerWaalsContact O-N 3.1Å; S129-I168 PolarHBondContact OG-O 3.23Å; I131-I168 HydrophobicContact CD1-CD1 3.83Å; R158-I168 WeakPolarHBondContact O-CA 3.39Å; Y159-I168 HydrophobicContact CD1-CB 4.48Å; Y159-I168 HydrophobicContact CD1-CD1 4.4Å; Y159-I168 HydrophobicContact CD1-CG1 4Å; Y159-I168 HydrophobicContact CD1-CG2 4.05Å; Y159-I168 HydrophobicContact CE1-CD1 4.17Å; Y159-I168 HydrophobicContact CE1-CG1 4.17Å; Y159-I168 HydrophobicContact CE1-CG2 3.73Å; L166-I168 HydrophobicContact CD2-CD1 4.46Å; L166-I168 HydrophobicContact CD2-CG1 4.23Å; L166-I168 HydrophobicContact CG-CG1 4.3Å; I168-V171 HydrophobicContact CG2-CG2 4.35Å; I168-Y179 HydrophobicContact CD1-CE1 4.05Å; I168-Y179 WeakPolarHBondContact CD1-OH 3.19Å; I168-F200 HydrophobicContact CD1-CE1 4.18Å
169	D	87.2	Confident	90.4	Very high	54 Å²	54	54.1 Å²	54.1	29%	0.289	29%	0.291	S	S	.	.	S	Bend	trans	-74.2	137	175.7	-68.9	-18.7	0	0	0	110.1	R158 K160	R158-D169 HydrophobicContact CB-CB 4.49Å; R158-D169 VanDerWaalsContact CZ-O 3.24Å; R158-D169 PolarHBondContact NH1-O 3.04Å; R158-D169 PolarHBondContact NH2-O 3.27Å; R158-D169 PolarHBondContact O-N 3.31Å; K160-D169 VanDerWaalsContact CE-OD2 3.22Å; K160-D169 WeakPolarHBondContact CE-OD2 3.1Å; K160-D169 IonicContact NZ-OD2 3.5Å; K160-D169 PolarHBondContact NZ-OD2 3.12Å
170	N	85.6	Confident	90.5	Very high	116 Å²	116	52.8 Å²	52.8	62%	0.62	29%	0.288	S	S	*	.	S	Bend	trans	51.4	64	-178.7	-59.1	-21.8	0	0	0	112.3	R158	R158-N170 PolarHBondContact NH1-O 3.47Å; R158-N170 PolarHBondContact NH2-O 3.34Å
171	V	88.3	Confident	90.7	Very high	21 Å²	21	47.6 Å²	47.6	13%	0.127	27%	0.265	C	S	.	.			trans	-62.6	136	-177.7	79.9	0	0	0	0	111.4	I168 D175 F200 V202	I168-V171 HydrophobicContact CG2-CG2 4.35Å; V171-D175 WeakPolarHBondContact CA-OD2 3.42Å; V171-D175 HydrophobicContact CG2-CB 3.85Å; V171-F200 HydrophobicContact CG2-CE1 3.75Å; V171-F200 HydrophobicContact CG2-CZ 3.97Å; V171-V202 HydrophobicContact CG1-CG1 4.11Å; V171-V202 HydrophobicContact CG2-CG1 4.44Å; V171-V202 HydrophobicContact CG2-CG2 3.77Å
172	M	88.4	Confident	90.8	Very high	100 Å²	100	48.3 Å²	48.3	49%	0.493	26%	0.259	S	S	.	.			trans	-121.5	162.2	179.6	-62.6	179.7	-65.8	0	0	110.5	D174 D175 V202	M172-D174 PolarHBondContact O-N 2.98Å; M172-D174 VanDerWaalsContact O-N 3.09Å; M172-D175 PolarHBondContact N-OD2 3.32Å; M172-D175 VanDerWaalsContact O-CB 3.31Å; M172-D175 WeakPolarHBondContact O-CB 3.49Å; M172-D175 PolarHBondContact O-N 2.87Å; M172-V202 WeakPolarHBondContact O-CG2 3.44Å
173	T	86.8	Confident	91.2	Very high	92 Å²	92	44 Å²	44	56%	0.564	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-52.6	-34.1	176.1	48.3	0	0	0	0	112.7	D175 A176	T173-D175 PolarHBondContact O-N 3.47Å; T173-A176 VanDerWaalsContact O-CB 3.3Å; T173-A176 WeakPolarHBondContact O-CB 3.38Å; T173-A176 PolarHBondContact O-N 2.99Å; T173-A176 VanDerWaalsContact O-N 3.16Å
174	D	88.9	Confident	91.6	Very high	124 Å²	124	41.2 Å²	41.2	66%	0.663	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-69.2	-17	178.5	-62.4	-7.9	0	0	0	113.3	K149 M172 A176	K149-D174 PolarHBondContact NZ-O 3.34Å; M172-D174 PolarHBondContact O-N 2.98Å; M172-D174 VanDerWaalsContact O-N 3.09Å; D174-A176 PolarHBondContact O-N 3.09Å
175	D	90.4	Very high	91.8	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-74.5	-10.6	173.9	-70	-55	0	0	0	112.5	R158 Y159 V171 M172 T173 Y179 F200 V202	R158-D175 IonicContact CZ-OD2 3.3Å; R158-D175 IonicContact NH2-OD1 3.43Å; R158-D175 IonicContact NH2-OD2 3.09Å; R158-D175 PolarHBondContact NH2-OD2 2.93Å; Y159-D175 PolarHBondContact OH-OD1 2.94Å; V171-D175 WeakPolarHBondContact CA-OD2 3.42Å; V171-D175 HydrophobicContact CG2-CB 3.85Å; M172-D175 PolarHBondContact N-OD2 3.32Å; M172-D175 VanDerWaalsContact O-CB 3.31Å; M172-D175 WeakPolarHBondContact O-CB 3.49Å; M172-D175 PolarHBondContact O-N 2.87Å; T173-D175 PolarHBondContact O-N 3.47Å; D175-Y179 VanDerWaalsContact O-CE2 3.28Å; D175-Y179 WeakPolarHBondContact O-CE2 3.04Å; D175-Y179 PolarHBondContact O-OH 3.42Å; D175-F200 HydrophobicContact CB-CE1 4.49Å; D175-V202 HydrophobicContact CB-CG2 4.47Å
176	A	91.4	Very high	91.8	Very high	42 Å²	42	41.3 Å²	41.3	35%	0.347	23%	0.234	S	C	.	.			trans	-60.2	144.5	171.4	0	0	0	0	0	111.3	K149 T173 D174 F200	K149-A176 WeakPolarHBondContact CE-O 3.36Å; K149-A176 PolarHBondContact NZ-O 2.92Å; T173-A176 VanDerWaalsContact O-CB 3.3Å; T173-A176 WeakPolarHBondContact O-CB 3.38Å; T173-A176 PolarHBondContact O-N 2.99Å; T173-A176 VanDerWaalsContact O-N 3.16Å; D174-A176 PolarHBondContact O-N 3.09Å; A176-F200 WeakPolarHBondContact CA-O 3.33Å
177	G	91.9	Very high	91.7	Very high	19 Å²	19	42.3 Å²	42.3	20%	0.196	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.1	-170.5	-179.4	0	0	0	0	0	113.1	Y179 F200	G177-Y179 WeakPolarHBondContact O-CD2 3.46Å; G177-F200 PolarHBondContact N-O 3.18Å; G177-F200 PolarHBondContact O-N 2.7Å
178	D	92.9	Very high	91.4	Very high	51 Å²	51	46.2 Å²	46.2	27%	0.273	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.5	-174	-57.8	-37.1	0	0	0	111	M118 K149 N150 T197 P199	M118-D178 HydrophobicContact CE-CB 4.36Å; M118-D178 WeakPolarHBondContact CE-OD2 3.35Å; K149-D178 WeakPolarHBondContact CA-O 3.38Å; N150-D178 PolarHBondContact N-O 3.49Å; D178-T197 HydrophobicContact CB-CG2 4.06Å; D178-P199 WeakPolarHBondContact OD1-CA 3.42Å; D178-P199 WeakPolarHBondContact OD1-CB 3.32Å
179	Y	94.3	Very high	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.5	-177.8	-73.2	-100.7	0	0	0	110.1	I131 F148 K149 L154 L166 I168 D175 G177 T197 R198 F200	I131-Y179 HydrophobicContact CD1-CD1 3.75Å; I131-Y179 HydrophobicContact CD1-CD2 3.6Å; I131-Y179 HydrophobicContact CD1-CE1 3.89Å; I131-Y179 HydrophobicContact CD1-CE2 3.76Å; I131-Y179 HydrophobicContact CD1-CG 3.59Å; F148-Y179 WeakPolarHBondContact O-CA 3.45Å; K149-Y179 HydrophobicContact CB-CD1 4.35Å; K149-Y179 HydrophobicContact CB-CE1 4.16Å; K149-Y179 HydrophobicContact CD-CE1 4.33Å; K149-Y179 HydrophobicContact CD-CE2 4.34Å; K149-Y179 HydrophobicContact CG-CE1 4.29Å; K149-Y179 HydrophobicContact CG-CE2 4.28Å; L154-Y179 HydrophobicContact CD1-CD1 4.04Å; L154-Y179 HydrophobicContact CD1-CE1 3.9Å; L154-Y179 HydrophobicContact CD2-CE1 4.35Å; L166-Y179 HydrophobicContact CD2-CD1 3.77Å; L166-Y179 HydrophobicContact CD2-CE1 3.82Å; I168-Y179 HydrophobicContact CD1-CE1 4.05Å; I168-Y179 WeakPolarHBondContact CD1-OH 3.19Å; D175-Y179 VanDerWaalsContact O-CE2 3.28Å; D175-Y179 WeakPolarHBondContact O-CE2 3.04Å; D175-Y179 PolarHBondContact O-OH 3.42Å; G177-Y179 WeakPolarHBondContact O-CD2 3.46Å; Y179-T197 WeakPolarHBondContact O-CA 3.27Å; Y179-R198 PolarHBondContact N-O 3.03Å; Y179-R198 PolarHBondContact O-N 3.01Å; Y179-F200 HydrophobicContact CD2-CB 3.57Å; Y179-F200 HydrophobicContact CD2-CG 4.42Å; Y179-F200 HydrophobicContact CE2-CB 3.64Å; Y179-F200 AromaticContact CE2-CD1 3.93Å; Y179-F200 HydrophobicContact CE2-CD1 3.93Å; Y179-F200 HydrophobicContact CE2-CG 4.13Å
180	T	94.3	Very high	91.2	Very high	23 Å²	23	49.3 Å²	49.3	14%	0.141	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122	176.2	-54.2	0	0	0	0	109.3	W147 F148 A196 T197	W147-T180 WeakPolarHBondContact CA-O 3.45Å; F148-T180 PolarHBondContact N-O 3.12Å; F148-T180 PolarHBondContact O-N 3.44Å; T180-A196 WeakPolarHBondContact CA-O 3.3Å; T180-T197 WeakPolarHBondContact CG2-OG1 3.29Å; T180-T197 PolarHBondContact OG1-OG1 3.1Å
181	C	95	Very high	91.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139	165.1	54.4	0	0	0	0	109.7	C133 L145 E146 W147 T195 A196	C133-C181 WeakPolarHBondContact CA-SG 3.27Å; C133-C181 HydrophobicContact CB-CB 3.75Å; C133-C181 WeakPolarHBondContact CB-SG 3.41Å; C133-C181 WeakPolarHBondContact SG-CB 3.43Å; C133-C181 CovalentContact SG-SG 2.04Å; C133-C181 PolarHBondContact SG-SG 3.36Å; L145-C181 HydrophobicContact CD2-CB 4.02Å; E146-C181 CarbonylContact O-C 3.51Å; E146-C181 WeakPolarHBondContact O-CA 3.41Å; W147-C181 HydrophobicContact CD2-CB 4.03Å; W147-C181 HydrophobicContact CE3-CB 3.98Å; W147-C181 HydrophobicContact CH2-CB 3.83Å; W147-C181 HydrophobicContact CZ2-CB 3.86Å; W147-C181 HydrophobicContact CZ3-CB 3.88Å; C181-T195 WeakPolarHBondContact O-CA 3.42Å; C181-A196 PolarHBondContact N-O 3.11Å; C181-A196 PolarHBondContact O-N 2.92Å; C181-A196 PolarHBondContact SG-O 3.49Å; C181-A196 VanDerWaalsContact SG-O 3.35Å
182	K	94.1	Very high	92	Very high	65 Å²	65	50.7 Å²	50.7	28%	0.283	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.6	173.8	178	179.6	160.2	-130.7	0	109.1	E146 F148 V194 T195	E146-K182 HydrophobicContact CB-CB 4.22Å; E146-K182 PolarHBondContact N-O 3.07Å; E146-K182 PolarHBondContact O-N 3.35Å; E146-K182 IonicContact OE1-NZ 3.61Å; E146-K182 IonicContact OE2-NZ 2.93Å; E146-K182 PolarHBondContact OE2-NZ 3.36Å; F148-K182 HydrophobicContact CE2-CB 3.95Å; F148-K182 HydrophobicContact CE2-CD 4.24Å; K182-V194 WeakPolarHBondContact CA-O 3.3Å; K182-T195 HydrophobicContact CB-CG2 4.04Å; K182-T195 HydrophobicContact CD-CG2 4.35Å; K182-T195 HydrophobicContact CG-CG2 3.95Å
183	F	95.3	Very high	92.3	Very high	9 Å²	9	47.7 Å²	47.7	4%	0.039	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	166.2	178.1	58	-85	0	0	0	111	C133 I136 Y139 W141 L145 V194	C133-F183 VanDerWaalsContact SG-CE1 3.57Å; I136-F183 HydrophobicContact CB-CE1 4.29Å; I136-F183 HydrophobicContact CB-CZ 4.2Å; I136-F183 HydrophobicContact CD1-CD1 4.47Å; I136-F183 HydrophobicContact CG1-CD1 4.24Å; I136-F183 HydrophobicContact CG1-CD2 4.35Å; I136-F183 HydrophobicContact CG1-CE1 3.97Å; I136-F183 HydrophobicContact CG1-CE2 4.08Å; I136-F183 HydrophobicContact CG1-CG 4.42Å; I136-F183 HydrophobicContact CG1-CZ 3.88Å; Y139-F183 HydrophobicContact CD1-CE2 4.44Å; Y139-F183 AromaticContact CD2-CE2 3.76Å; Y139-F183 HydrophobicContact CD2-CE2 3.76Å; Y139-F183 AromaticContact CD2-CZ 3.73Å; Y139-F183 HydrophobicContact CD2-CZ 3.73Å; Y139-F183 HydrophobicContact CE2-CE2 4.49Å; Y139-F183 HydrophobicContact CE2-CZ 4.15Å; Y139-F183 AromaticContact CG-CE2 3.74Å; Y139-F183 HydrophobicContact CG-CE2 3.74Å; Y139-F183 HydrophobicContact CG-CZ 4.19Å; W141-F183 HydrophobicContact CB-CD2 3.91Å; W141-F183 HydrophobicContact CG-CD2 4.46Å; L145-F183 HydrophobicContact CD1-CB 4.15Å; L145-F183 HydrophobicContact CD2-CD1 4.45Å; L145-F183 HydrophobicContact CG-CB 4.03Å; F183-V194 HydrophobicContact CD1-CB 4.47Å; F183-V194 HydrophobicContact CD2-CB 4.09Å; F183-V194 HydrophobicContact CD2-CG2 4.47Å; F183-V194 HydrophobicContact CE1-CB 4.05Å; F183-V194 HydrophobicContact CE1-CG1 3.88Å; F183-V194 HydrophobicContact CE2-CB 3.63Å; F183-V194 HydrophobicContact CE2-CG1 3.9Å; F183-V194 HydrophobicContact CE2-CG2 3.94Å; F183-V194 HydrophobicContact CG-CB 4.49Å; F183-V194 HydrophobicContact CZ-CB 3.61Å; F183-V194 HydrophobicContact CZ-CG1 3.4Å; F183-V194 HydrophobicContact CZ-CG2 4.31Å; F183-V194 PolarHBondContact N-O 2.73Å; F183-V194 PolarHBondContact O-N 3.32Å
184	I	95.4	Very high	92.7	Very high	73 Å²	73	43.5 Å²	43.5	37%	0.374	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.9	177	-59.4	-55.6	0	0	0	109	W141 N191 Y192	W141-I184 WeakPolarHBondContact CA-O 3.38Å; W141-I184 WeakPolarHBondContact CB-O 3.29Å; I184-N191 HydrophobicContact CG2-CB 3.55Å; I184-Y192 WeakPolarHBondContact CA-O 3.25Å
185	H	95.4	Very high	92.9	Very high	2 Å²	2	39 Å²	39	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.5	165.1	173.8	42	0	0	0	109.6	A31 Y139 N140 E187 N191 Y192 V194	A31-H185 HydrophobicContact CB-CB 4.28Å; Y139-H185 HydrophobicContact CD1-CB 3.87Å; Y139-H185 AromaticContact CD1-CG 3.79Å; Y139-H185 HydrophobicContact CG-CB 4.45Å; N140-H185 PolarHBondContact N-ND1 3.18Å; N140-H185 VanDerWaalsContact N-ND1 3.11Å; N140-H185 CarbonylContact O-C 3.59Å; N140-H185 VanDerWaalsContact O-CA 3.27Å; N140-H185 WeakPolarHBondContact O-CA 3.44Å; N140-H185 PolarHBondContact O-ND1 3.17Å; N140-H185 VanDerWaalsContact O-ND1 3.12Å; H185-E187 IonicContact CE1-OE2 3.5Å; H185-E187 PolarHBondContact CE1-OE2 2.88Å; H185-E187 IonicContact NE2-OE2 3.76Å; H185-E187 PolarHBondContact NE2-OE2 2.84Å; H185-N191 WeakPolarHBondContact O-CA 3.29Å; H185-Y192 PolarHBondContact N-O 2.85Å; H185-Y192 PolarHBondContact O-N 3.38Å; H185-V194 HydrophobicContact CB-CG2 4.04Å
186	S	93.6	Very high	93.1	Very high	41 Å²	41	38.9 Å²	38.9	29%	0.287	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.7	178	-60.2	0	0	0	0	110.9	N140 A190 N191	N140-S186 PolarHBondContact ND2-O 3.22Å; N140-S186 PolarHBondContact O-N 3.47Å; S186-A190 WeakPolarHBondContact CA-O 3.38Å; S186-N191 WeakPolarHBondContact CB-OD1 3.25Å; S186-N191 PolarHBondContact OG-OD1 3Å
187	E	91.1	Very high	93.2	Very high	23 Å²	23	37.2 Å²	37.2	11%	0.107	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	130.8	176.6	-174.2	153	-169.6	0	0	109.8	K73 L75 H185 G189 A190	K73-E187 WeakPolarHBondContact CD-OE2 3.44Å; K73-E187 IonicContact NZ-OE1 2.69Å; K73-E187 PolarHBondContact NZ-OE1 2.64Å; K73-E187 IonicContact NZ-OE2 2.7Å; K73-E187 PolarHBondContact NZ-OE2 3.13Å; L75-E187 HydrophobicContact CD1-CB 4.12Å; L75-E187 HydrophobicContact CD1-CG 4.17Å; L75-E187 WeakPolarHBondContact CD1-OE2 3.35Å; H185-E187 IonicContact CE1-OE2 3.5Å; H185-E187 PolarHBondContact CE1-OE2 2.88Å; H185-E187 IonicContact NE2-OE2 3.76Å; H185-E187 PolarHBondContact NE2-OE2 2.84Å; E187-G189 PolarHBondContact O-N 3.09Å; E187-G189 VanDerWaalsContact O-N 3.14Å; E187-A190 PolarHBondContact N-O 3.31Å; E187-A190 PolarHBondContact O-N 3.21Å
188	N	86	Confident	93.3	Very high	112 Å²	112	37.6 Å²	37.6	60%	0.599	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.7	179.1	-65.6	-24.7	0	0	0	115.3	E61 A190	E61-N188 VanDerWaalsContact CB-ND2 3.32Å; E61-N188 WeakPolarHBondContact CB-ND2 3.44Å; E61-N188 PolarHBondContact OE2-ND2 3.26Å; E61-N188 PolarHBondContact OE2-OD1 2.89Å; N188-A190 PolarHBondContact O-N 3.28Å
189	G	85.3	Confident	93.4	Very high	85 Å²	85	36.4 Å²	36.4	88%	0.876	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	-1.4	-179.1	0	0	0	0	0	114.5	E187	E187-G189 PolarHBondContact O-N 3.09Å; E187-G189 VanDerWaalsContact O-N 3.14Å
190	A	91.6	Very high	93.3	Very high	35 Å²	35	36.6 Å²	36.6	29%	0.289	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	147.8	172	0	0	0	0	0	110.9	S186 E187 N188 Y192	S186-A190 WeakPolarHBondContact CA-O 3.38Å; E187-A190 PolarHBondContact N-O 3.31Å; E187-A190 PolarHBondContact O-N 3.21Å; N188-A190 PolarHBondContact O-N 3.28Å; A190-Y192 HydrophobicContact CB-CE2 3.61Å
191	N	94.3	Very high	93.2	Very high	112 Å²	112	38.4 Å²	38.4	60%	0.599	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.5	-177.5	-76	-21.3	0	0	0	109.5	I184 H185 S186	I184-N191 HydrophobicContact CG2-CB 3.55Å; H185-N191 WeakPolarHBondContact O-CA 3.29Å; S186-N191 WeakPolarHBondContact CB-OD1 3.25Å; S186-N191 PolarHBondContact OG-OD1 3Å
192	Y	94.8	Very high	92.9	Very high	54 Å²	54	40 Å²	40	21%	0.212	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.1	-178.4	-56.1	-85.2	0	0	0	110	A31 L75 P76 I184 H185 A190	A31-Y192 VanDerWaalsContact CB-CB 3.44Å; A31-Y192 HydrophobicContact CB-CG 4.18Å; L75-Y192 VanDerWaalsContact C-CE1 3.44Å; L75-Y192 HydrophobicContact CB-CD1 4.35Å; L75-Y192 HydrophobicContact CB-CD2 4.34Å; L75-Y192 HydrophobicContact CB-CE1 3.92Å; L75-Y192 HydrophobicContact CB-CE2 3.91Å; L75-Y192 HydrophobicContact CD1-CD2 4.49Å; L75-Y192 HydrophobicContact CD1-CE2 4.09Å; L75-Y192 HydrophobicContact CD2-CD2 4.1Å; L75-Y192 HydrophobicContact CD2-CE2 4.4Å; L75-Y192 HydrophobicContact CD2-CG 4.33Å; L75-Y192 HydrophobicContact CG-CE2 4.37Å; L75-Y192 WeakPolarHBondContact O-CE1 3.42Å; L75-Y192 PolarHBondContact O-OH 3.29Å; P76-Y192 HydrophobicContact CB-CD1 4.36Å; I184-Y192 WeakPolarHBondContact CA-O 3.25Å; H185-Y192 PolarHBondContact N-O 2.85Å; H185-Y192 PolarHBondContact O-N 3.38Å; A190-Y192 HydrophobicContact CB-CE2 3.61Å
193	S	94.8	Very high	92.1	Very high	37 Å²	37	42.9 Å²	42.9	26%	0.259	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	143	175.3	-174.5	0	0	0	0	110.4	E30 A31	E30-S193 CarbonylContact C-O 3.53Å; E30-S193 WeakPolarHBondContact CA-O 3.33Å; E30-S193 WeakPolarHBondContact CB-O 3.29Å; A31-S193 PolarHBondContact N-O 3.43Å
194	V	95.7	Very high	90.5	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.024	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.2	171.7	-174	0	0	0	0	108.6	A31 Y139 K182 F183 H185	A31-V194 HydrophobicContact CB-CG2 3.76Å; Y139-V194 HydrophobicContact CD1-CG2 3.92Å; Y139-V194 HydrophobicContact CE1-CG1 4.27Å; Y139-V194 HydrophobicContact CE1-CG2 3.8Å; Y139-V194 HydrophobicContact CE2-CG1 4.15Å; K182-V194 WeakPolarHBondContact CA-O 3.3Å; F183-V194 HydrophobicContact CD1-CB 4.47Å; F183-V194 HydrophobicContact CD2-CB 4.09Å; F183-V194 HydrophobicContact CD2-CG2 4.47Å; F183-V194 HydrophobicContact CE1-CB 4.05Å; F183-V194 HydrophobicContact CE1-CG1 3.88Å; F183-V194 HydrophobicContact CE2-CB 3.63Å; F183-V194 HydrophobicContact CE2-CG1 3.9Å; F183-V194 HydrophobicContact CE2-CG2 3.94Å; F183-V194 HydrophobicContact CG-CB 4.49Å; F183-V194 HydrophobicContact CZ-CB 3.61Å; F183-V194 HydrophobicContact CZ-CG1 3.4Å; F183-V194 HydrophobicContact CZ-CG2 4.31Å; F183-V194 PolarHBondContact N-O 2.73Å; F183-V194 PolarHBondContact O-N 3.32Å; H185-V194 HydrophobicContact CB-CG2 4.04Å
195	T	93.9	Very high	88.9	Confident	28 Å²	28	49 Å²	49	17%	0.172	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.5	173.4	62.8	0	0	0	0	111.6	E30 C181 K182	E30-T195 VanDerWaalsContact CD-OG1 3.28Å; E30-T195 WeakPolarHBondContact OE1-CG2 3.48Å; E30-T195 PolarHBondContact OE1-OG1 3.01Å; E30-T195 PolarHBondContact OE2-N 3.32Å; E30-T195 PolarHBondContact OE2-OG1 3.38Å; C181-T195 WeakPolarHBondContact O-CA 3.42Å; K182-T195 HydrophobicContact CB-CG2 4.04Å; K182-T195 HydrophobicContact CD-CG2 4.35Å; K182-T195 HydrophobicContact CG-CG2 3.95Å
196	A	94.3	Very high	87.1	Confident	2 Å²	2	55.6 Å²	55.6	2%	0.017	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	128.8	175.3	0	0	0	0	0	110.7	Y119 P134 T180 C181	Y119-A196 HydrophobicContact CD2-CB 4.26Å; Y119-A196 HydrophobicContact CE2-CB 3.77Å; P134-A196 HydrophobicContact CB-CB 3.95Å; P134-A196 HydrophobicContact CG-CB 3.67Å; T180-A196 WeakPolarHBondContact CA-O 3.3Å; C181-A196 PolarHBondContact N-O 3.11Å; C181-A196 PolarHBondContact O-N 2.92Å; C181-A196 PolarHBondContact SG-O 3.49Å; C181-A196 VanDerWaalsContact SG-O 3.35Å
197	T	93.6	Very high	85.9	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.037	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.8	-175.6	-54.8	0	0	0	0	111	V113 M118 Y119 D178 Y179 T180	V113-T197 HydrophobicContact CB-CG2 4.27Å; V113-T197 HydrophobicContact CG1-CG2 4.44Å; V113-T197 HydrophobicContact CG2-CG2 4.31Å; M118-T197 HydrophobicContact CG-CG2 4.33Å; M118-T197 HydrophobicContact SD-CG2 4.37Å; Y119-T197 WeakPolarHBondContact CD2-O 3.33Å; Y119-T197 PolarHBondContact N-O 2.86Å; D178-T197 HydrophobicContact CB-CG2 4.06Å; Y179-T197 WeakPolarHBondContact O-CA 3.27Å; T180-T197 WeakPolarHBondContact CG2-OG1 3.29Å; T180-T197 PolarHBondContact OG1-OG1 3.1Å
198	R	94.3	Very high	85.2	Confident	28 Å²	28	58.6 Å²	58.6	11%	0.106	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.7	169	63.6	175.9	64.2	-178.5	3.3	111.8	V122 I131 Y132 P134 Y179	V122-R198 HydrophobicContact CG2-CG 4.37Å; I131-R198 HydrophobicContact CG2-CG 4.16Å; Y132-R198 PolarHBondContact O-NE 3.34Å; Y132-R198 PolarHBondContact O-NH1 2.94Å; Y132-R198 VanDerWaalsContact O-NH1 3.1Å; Y132-R198 PolarHBondContact O-NH2 3.49Å; P134-R198 VanDerWaalsContact CD-NH2 3.32Å; P134-R198 VanDerWaalsContact N-NH2 3.13Å; Y179-R198 PolarHBondContact N-O 3.03Å; Y179-R198 PolarHBondContact O-N 3.01Å
199	P	94.3	Very high	85.1	Confident	26 Å²	26	55.4 Å²	55.4	17%	0.169	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	142.8	172.4	-15	29.1	0	0	0	111.7	M118 Y119 T121 V122 D178	M118-P199 HydrophobicContact SD-CG 3.67Å; Y119-P199 VanDerWaalsContact O-CD 3.29Å; Y119-P199 WeakPolarHBondContact O-CD 3.33Å; T121-P199 WeakPolarHBondContact CA-O 3.46Å; T121-P199 HydrophobicContact CG2-CB 4.07Å; V122-P199 PolarHBondContact N-O 3.22Å; D178-P199 WeakPolarHBondContact OD1-CA 3.42Å; D178-P199 WeakPolarHBondContact OD1-CB 3.32Å
200	F	92.8	Very high	85.3	Confident	3 Å²	3	55.5 Å²	55.5	1%	0.013	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.7	171.1	178.6	-107.9	0	0	0	110.7	V122 G124 I131 I168 V171 D175 A176 G177 Y179 V202	V122-F200 HydrophobicContact CG2-CD2 4.09Å; V122-F200 VanDerWaalsContact O-CA 3.31Å; V122-F200 WeakPolarHBondContact O-CA 3.4Å; G124-F200 VanDerWaalsContact N-CE2 3.32Å; I131-F200 HydrophobicContact CD1-CB 3.79Å; I131-F200 HydrophobicContact CD1-CD1 4.05Å; I131-F200 HydrophobicContact CD1-CD2 3.68Å; I131-F200 HydrophobicContact CD1-CE2 4.22Å; I131-F200 HydrophobicContact CD1-CG 3.57Å; I131-F200 HydrophobicContact CG1-CB 4.49Å; I131-F200 HydrophobicContact CG1-CD2 3.64Å; I131-F200 HydrophobicContact CG1-CE2 3.97Å; I131-F200 HydrophobicContact CG1-CG 4.09Å; I168-F200 HydrophobicContact CD1-CE1 4.18Å; V171-F200 HydrophobicContact CG2-CE1 3.75Å; V171-F200 HydrophobicContact CG2-CZ 3.97Å; D175-F200 HydrophobicContact CB-CE1 4.49Å; A176-F200 WeakPolarHBondContact CA-O 3.33Å; G177-F200 PolarHBondContact N-O 3.18Å; G177-F200 PolarHBondContact O-N 2.7Å; Y179-F200 HydrophobicContact CD2-CB 3.57Å; Y179-F200 HydrophobicContact CD2-CG 4.42Å; Y179-F200 HydrophobicContact CE2-CB 3.64Å; Y179-F200 AromaticContact CE2-CD1 3.93Å; Y179-F200 HydrophobicContact CE2-CD1 3.93Å; Y179-F200 HydrophobicContact CE2-CG 4.13Å; F200-V202 HydrophobicContact CD1-CG2 4.22Å; F200-V202 HydrophobicContact CE1-CG2 3.58Å; F200-V202 HydrophobicContact CZ-CG2 4.28Å
201	T	91.8	Very high	85.3	Confident	61 Å²	61	58.2 Å²	58.2	37%	0.374	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.4	175.8	57.1	0	0	0	0	110.8	T121 V122 S123 G124	T121-T201 HydrophobicContact CG2-CG2 3.9Å; V122-T201 PolarHBondContact O-N 2.79Å; S123-T201 CarbonylContact C-O 3.5Å; S123-T201 WeakPolarHBondContact CA-O 3.31Å; G124-T201 PolarHBondContact N-O 3.03Å
202	V	87.9	Confident	85.3	Confident	34 Å²	34	53 Å²	53	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.4	176.7	-177.6	0	0	0	0	108.4	V171 M172 D175 F200	V171-V202 HydrophobicContact CG1-CG1 4.11Å; V171-V202 HydrophobicContact CG2-CG1 4.44Å; V171-V202 HydrophobicContact CG2-CG2 3.77Å; M172-V202 WeakPolarHBondContact O-CG2 3.44Å; D175-V202 HydrophobicContact CB-CG2 4.47Å; F200-V202 HydrophobicContact CD1-CG2 4.22Å; F200-V202 HydrophobicContact CE1-CG2 3.58Å; F200-V202 HydrophobicContact CZ-CG2 4.28Å
203	K	77.6	Confident	85.2	Confident	125 Å²	125	53.7 Å²	53.7	54%	0.543	29%	0.286	S	S	.	.			trans	-95.2	129.6	173.8	-76.1	177.3	174.4	163.9	0	108.7	S123 G124 E205	S123-K203 VanDerWaalsContact CB-CE 3.49Å; S123-K203 WeakPolarHBondContact OG-CE 3.36Å; S123-K203 PolarHBondContact OG-NZ 3.16Å; G124-K203 PolarHBondContact O-N 2.86Å; K203-E205 PolarHBondContact O-N 2.77Å
204	D	63.3	Low	85.2	Confident	121 Å²	121	52.5 Å²	52.5	65%	0.647	28%	0.276	S	S	*	.			trans	-63.7	103.5	170.3	-73.1	-32.7	0	0	0	109.6	Q206	D204-Q206 PolarHBondContact O-N 2.71Å
205	E	61.1	Low	85	Confident	91 Å²	91	60.2 Å²	60.2	43%	0.425	31%	0.305	S	S	.	.			trans	-76.6	67	167.7	-92	-167.8	-167.1	0	0	110.1	S125 K127 K203 G207	S125-E205 VanDerWaalsContact CB-CG 3.46Å; S125-E205 WeakPolarHBondContact CB-OE1 3.48Å; S125-E205 PolarHBondContact OG-OE1 3Å; K127-E205 WeakPolarHBondContact CD-OE2 3.4Å; K127-E205 WeakPolarHBondContact CG-OE2 3.36Å; K203-E205 PolarHBondContact O-N 2.77Å; E205-G207 VanDerWaalsContact C-N 3.33Å
206	Q	57.9	Low	84.9	Confident	140 Å²	140	60.6 Å²	60.6	65%	0.654	31%	0.311	S	S	*	.			trans	-93	-4.3	160.5	-70.6	170	5.8	0	0	111.6	D204 K241	D204-Q206 PolarHBondContact O-N 2.71Å; Q206-K241 VanDerWaalsContact O-CD 3.32Å; Q206-K241 WeakPolarHBondContact O-CD 3.47Å; Q206-K241 WeakPolarHBondContact O-CG 3.38Å
207	G	67.1	Low	84.8	Confident	34 Å²	34	60.7 Å²	60.7	35%	0.351	31%	0.312	S	S	.	.			trans	-103	141.3	179.2	0	0	0	0	0	113.2	E205 K241	E205-G207 VanDerWaalsContact C-N 3.33Å; G207-K241 CarbonylContact C-O 3.59Å; G207-K241 WeakPolarHBondContact CA-O 3.39Å
208	F	78	Confident	84.7	Confident	93 Å²	93	63 Å²	63	41%	0.408	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152.7	170.3	58.6	-94.9	0	0	0	108.5	L210 G240 K241 Q244	F208-L210 HydrophobicContact CD2-CD1 4.23Å; F208-L210 HydrophobicContact CD2-CD2 3.93Å; F208-L210 HydrophobicContact CD2-CG 3.69Å; F208-L210 HydrophobicContact CE2-CD1 3.58Å; F208-L210 HydrophobicContact CE2-CD2 4.07Å; F208-L210 HydrophobicContact CE2-CG 3.58Å; F208-G240 CarbonylContact O-C 3.54Å; F208-G240 WeakPolarHBondContact O-CA 3.34Å; F208-K241 HydrophobicContact CD1-CB 3.97Å; F208-K241 HydrophobicContact CE1-CB 3.65Å; F208-K241 HydrophobicContact CE1-CD 4.36Å; F208-K241 HydrophobicContact CZ-CB 3.98Å; F208-K241 PolarHBondContact N-O 3.28Å; F208-K241 PolarHBondContact O-N 3.17Å; F208-K241 VanDerWaalsContact O-O 3.06Å; F208-Q244 PolarHBondContact O-NE2 3.48Å
209	S	83.9	Confident	84.5	Confident	45 Å²	45	67.1 Å²	67.1	32%	0.315	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142.1	171.6	-157.7	0	0	0	0	109.6	F239 Q244 N307	S209-F239 WeakPolarHBondContact CA-O 3.1Å; S209-F239 PolarHBondContact OG-O 2.91Å; S209-Q244 VanDerWaalsContact CB-OE1 3.27Å; S209-Q244 PolarHBondContact OG-OE1 2.81Å; S209-N307 PolarHBondContact OG-ND2 3.49Å
210	L	87.8	Confident	84.2	Confident	86 Å²	86	70.6 Å²	70.6	45%	0.45	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	163.1	174.1	-65.9	179.7	0	0	0	109.9	F208 F239 N307	F208-L210 HydrophobicContact CD2-CD1 4.23Å; F208-L210 HydrophobicContact CD2-CD2 3.93Å; F208-L210 HydrophobicContact CD2-CG 3.69Å; F208-L210 HydrophobicContact CE2-CD1 3.58Å; F208-L210 HydrophobicContact CE2-CD2 4.07Å; F208-L210 HydrophobicContact CE2-CG 3.58Å; L210-F239 PolarHBondContact N-O 3.5Å; L210-N307 PolarHBondContact O-ND2 3.03Å
211	F	91.6	Very high	84.1	Confident	93 Å²	93	74.1 Å²	74.1	41%	0.408	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	138.6	167.8	-162.5	-86.6	0	0	0	110.4	V213 H309 R312	F211-V213 WeakPolarHBondContact O-CG2 3Å; F211-V213 PolarHBondContact O-N 3.27Å; F211-H309 HydrophobicContact CB-CB 4.5Å; F211-H309 HydrophobicContact CD2-CB 3.96Å; F211-H309 WeakPolarHBondContact CE2-O 3.4Å; F211-R312 HydrophobicContact CE1-CB 4.16Å
212	P	94.4	Very high	84.1	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.013	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	130.3	-172.4	-24.1	34.9	0	0	0	112.3	F239 A305 N307 R312	P212-F239 HydrophobicContact CB-CD1 3.96Å; P212-F239 HydrophobicContact CB-CE1 3.68Å; P212-F239 HydrophobicContact CG-CD1 3.96Å; P212-F239 HydrophobicContact CG-CE1 3.81Å; P212-A305 HydrophobicContact CB-CB 3.72Å; P212-N307 VanDerWaalsContact CD-OD1 3.23Å; P212-N307 WeakPolarHBondContact CD-OD1 3.33Å; P212-N307 HydrophobicContact CG-CB 4.18Å; P212-N307 WeakPolarHBondContact CG-OD1 3.09Å; P212-R312 HydrophobicContact CB-CB 4.28Å; P212-R312 WeakPolarHBondContact O-CB 3.38Å
213	V	93.3	Very high	84.3	Confident	69 Å²	69	76.9 Å²	76.9	42%	0.418	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110	178.3	-176.6	0	0	0	0	109.4	F211 R215 A237 C238	F211-V213 WeakPolarHBondContact O-CG2 3Å; F211-V213 PolarHBondContact O-N 3.27Å; V213-R215 PolarHBondContact O-N 2.81Å; V213-A237 CarbonylContact O-C 3.47Å; V213-A237 VanDerWaalsContact O-CA 3.24Å; V213-A237 WeakPolarHBondContact O-CA 3.21Å; V213-C238 PolarHBondContact N-O 3.11Å; V213-C238 PolarHBondContact O-N 3.36Å
214	I	94.3	Very high	85	Confident	11 Å²	11	77 Å²	77	6%	0.056	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	119.6	173.6	-60.5	169.6	0	0	0	108.3	A216 S236 A237 C303 A305 R312 H314	I214-A216 VanDerWaalsContact CG2-O 3.3Å; I214-A216 WeakPolarHBondContact CG2-O 3.49Å; I214-S236 CarbonylContact C-O 3.57Å; I214-S236 WeakPolarHBondContact CA-O 3.32Å; I214-A237 HydrophobicContact CG1-CB 4.15Å; I214-C303 WeakPolarHBondContact CD1-O 3.28Å; I214-A305 HydrophobicContact CD1-CB 4.22Å; I214-A305 HydrophobicContact CG1-CB 3.76Å; I214-R312 HydrophobicContact CD1-CB 4.07Å; I214-R312 HydrophobicContact CD1-CG 3.93Å; I214-R312 HydrophobicContact CG1-CB 4.32Å; I214-R312 HydrophobicContact CG1-CG 4.18Å; I214-H314 HydrophobicContact CD1-CB 4.01Å; I214-H314 HydrophobicContact CG2-CB 4.14Å; I214-H314 WeakPolarHBondContact CG2-ND1 3.34Å
215	R	91.3	Very high	86.3	Confident	167 Å²	167	71.5 Å²	71.5	63%	0.63	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	-38.5	176.8	-70.5	-65.2	-170.1	-179.2	0.8	112	V213 S236	V213-R215 PolarHBondContact O-N 2.81Å; R215-S236 PolarHBondContact N-O 2.82Å
216	A	91.6	Very high	87.6	Confident	36 Å²	36	70.9 Å²	70.9	30%	0.298	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	140.1	175.9	0	0	0	0	0	108.6	I214 T234 C235 S236	I214-A216 VanDerWaalsContact CG2-O 3.3Å; I214-A216 WeakPolarHBondContact CG2-O 3.49Å; A216-T234 CarbonylContact C-O 3.55Å; A216-C235 CarbonylContact O-C 3.53Å; A216-C235 VanDerWaalsContact O-CA 3.28Å; A216-C235 WeakPolarHBondContact O-CA 3.44Å; A216-S236 PolarHBondContact N-O 3.19Å; A216-S236 PolarHBondContact O-N 2.9Å
217	P	93.5	Very high	89.1	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.026	35%	0.354	C	S	.	.	S	Bend	cis	-71.2	169.5	-5.8	31.9	-34.6	0	0	0	112.1	E221 W251 C303 H314 I316	P217-E221 VanDerWaalsContact CA-OE2 3.3Å; P217-E221 WeakPolarHBondContact CA-OE2 3.32Å; P217-E221 HydrophobicContact CB-CB 4.29Å; P217-E221 WeakPolarHBondContact CB-OE2 3.47Å; P217-W251 HydrophobicContact CG-CH2 4.38Å; P217-C303 HydrophobicContact CG-CB 4.21Å; P217-H314 HydrophobicContact CG-CB 4.34Å; P217-H314 PolarHBondContact O-ND1 2.85Å; P217-I316 HydrophobicContact CB-CB 4.43Å; P217-I316 HydrophobicContact CB-CD1 4.08Å; P217-I316 HydrophobicContact CG-CB 4.22Å
218	A	91.4	Very high	90.1	Very high	54 Å²	54	68 Å²	68	45%	0.446	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-66.9	161.5	169	0	0	0	0	0	110.9	N220 E221	A218-N220 PolarHBondContact O-N 3.43Å; A218-E221 HydrophobicContact CB-CB 4.24Å; A218-E221 PolarHBondContact N-OE2 3.31Å; A218-E221 PolarHBondContact O-N 3.08Å
219	H	89.9	Confident	90.6	Very high	115 Å²	115	68.9 Å²	68.9	53%	0.532	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	119	179.2	-171.9	66.7	0	0	0	110.3	H314	H219-H314 AromaticContact ND1-CD2 3.75Å
220	N	88.8	Confident	90.9	Very high	99 Å²	99	71.9 Å²	71.9	53%	0.529	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	37	-176.7	-55.2	-31.2	0	0	0	113.9	A218 T315	A218-N220 PolarHBondContact O-N 3.43Å; N220-T315 WeakPolarHBondContact CA-O 3.3Å; N220-T315 PolarHBondContact N-O 3.01Å; N220-T315 VanDerWaalsContact N-O 3.15Å
221	E	90.1	Very high	91.1	Very high	77 Å²	77	68.6 Å²	68.6	36%	0.36	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	145.5	173.2	-168.8	176.1	163.5	0	0	111.4	P217 A218 T315 I316 R317	P217-E221 VanDerWaalsContact CA-OE2 3.3Å; P217-E221 WeakPolarHBondContact CA-OE2 3.32Å; P217-E221 HydrophobicContact CB-CB 4.29Å; P217-E221 WeakPolarHBondContact CB-OE2 3.47Å; A218-E221 HydrophobicContact CB-CB 4.24Å; A218-E221 PolarHBondContact N-OE2 3.31Å; A218-E221 PolarHBondContact O-N 3.08Å; E221-T315 PolarHBondContact N-O 2.83Å; E221-I316 HydrophobicContact CB-CG1 4.42Å; E221-I316 WeakPolarHBondContact O-CA 3.4Å; E221-R317 PolarHBondContact O-N 3.22Å
222	T	92.1	Very high	91.2	Very high	83 Å²	83	67.3 Å²	67.3	51%	0.509	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.5	169.7	-48.5	0	0	0	0	108.2	R317 S319	T222-R317 CarbonylContact C-O 3.57Å; T222-R317 VanDerWaalsContact CA-O 3.28Å; T222-R317 WeakPolarHBondContact CA-O 3.46Å; T222-R317 HydrophobicContact CG2-CB 4.41Å; T222-S319 WeakPolarHBondContact CG2-OG 3.45Å
223	K	91.6	Very high	91.1	Very high	69 Å²	69	67.2 Å²	67.2	30%	0.3	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.2	-179.3	179.1	161.6	178.3	171.7	0	110.7	V225 N232 L233 I316 R317 L318 S319	K223-V225 HydrophobicContact CG-CG1 4.39Å; K223-N232 PolarHBondContact NZ-O 3.44Å; K223-L233 HydrophobicContact CD-CD2 3.72Å; K223-I316 HydrophobicContact CB-CD1 3.94Å; K223-I316 HydrophobicContact CB-CG1 4.38Å; K223-I316 HydrophobicContact CD-CD1 4.48Å; K223-R317 PolarHBondContact N-O 2.94Å; K223-L318 HydrophobicContact CB-CD2 4.22Å; K223-L318 WeakPolarHBondContact O-CA 3.44Å; K223-S319 PolarHBondContact O-N 3.33Å
224	E	91.2	Very high	91.1	Very high	128 Å²	128	67.2 Å²	67.2	60%	0.598	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	132.3	176	-66.5	-177.9	177.3	0	0	111.1	S319 K321	E224-S319 CarbonylContact C-O 3.5Å; E224-S319 VanDerWaalsContact CA-O 3.29Å; E224-S319 WeakPolarHBondContact CA-O 3.48Å; E224-S319 WeakPolarHBondContact CG-OG 3.34Å; E224-K321 HydrophobicContact CB-CB 4.13Å; E224-K321 HydrophobicContact CB-CG 4.4Å
225	V	91.3	Very high	91	Very high	6 Å²	6	66.7 Å²	66.7	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.4	-178.6	-62.9	0	0	0	0	111.2	K223 T231 V292 L297 L318 S319 K321	K223-V225 HydrophobicContact CG-CG1 4.39Å; V225-T231 HydrophobicContact CG1-CG2 4.02Å; V225-V292 HydrophobicContact CB-CG1 4.47Å; V225-V292 HydrophobicContact CG2-CG1 3.94Å; V225-L297 HydrophobicContact CG2-CD2 3.81Å; V225-L318 HydrophobicContact CG1-CD2 4.03Å; V225-L318 HydrophobicContact CG2-CB 4Å; V225-L318 HydrophobicContact CG2-CD1 4.49Å; V225-S319 PolarHBondContact N-O 2.88Å; V225-K321 PolarHBondContact O-N 3.09Å
226	E	89.1	Confident	91.1	Very high	78 Å²	78	59 Å²	59	36%	0.364	32%	0.324	S	S	.	.			trans	-91.7	137.1	172.5	-62.9	-173	-161.7	0	0	109.5	E229 K321	E226-E229 HydrophobicContact CB-CB 4.31Å; E226-E229 HydrophobicContact CB-CG 4.05Å; E226-E229 PolarHBondContact O-N 3.2Å; E226-K321 HydrophobicContact CG-CB 4.06Å; E226-K321 HydrophobicContact CG-CD 3.76Å; E226-K321 HydrophobicContact CG-CG 4.49Å; E226-K321 WeakPolarHBondContact OE1-CD 3.25Å; E226-K321 WeakPolarHBondContact OE1-CE 2.89Å; E226-K321 IonicContact OE1-NZ 3.32Å; E226-K321 PolarHBondContact OE1-NZ 3.21Å
227	I	89	Confident	91.2	Very high	74 Å²	74	57.3 Å²	57.3	38%	0.379	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	133.2	177.8	-60.5	-60.3	0	0	0	108.7	E229 V292 E294 L297	I227-E229 VanDerWaalsContact C-N 3.33Å; I227-V292 WeakPolarHBondContact CA-O 3.12Å; I227-V292 HydrophobicContact CD1-CG1 4.18Å; I227-V292 WeakPolarHBondContact CG2-O 3.35Å; I227-E294 WeakPolarHBondContact CD1-OE1 3.32Å; I227-E294 WeakPolarHBondContact CG1-OE1 3.22Å; I227-L297 HydrophobicContact CD1-CD1 3.96Å; I227-L297 HydrophobicContact CD1-CG 4.44Å
228	G	87.3	Confident	91.2	Very high	40 Å²	40	57.6 Å²	57.6	41%	0.412	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-11.5	-178.1	0	0	0	0	0	115.2	D291 V292	G228-D291 WeakPolarHBondContact CA-OD1 3.16Å; G228-V292 PolarHBondContact N-O 2.99Å
229	E	89.4	Confident	91.2	Very high	111 Å²	111	55.1 Å²	55.1	52%	0.519	29%	0.291	S	S	.	.	S	Bend	trans	-92.1	163.4	176	-67.6	-154.4	147	0	0	112.4	E226 I227 V292	E226-E229 HydrophobicContact CB-CB 4.31Å; E226-E229 HydrophobicContact CB-CG 4.05Å; E226-E229 PolarHBondContact O-N 3.2Å; I227-E229 VanDerWaalsContact C-N 3.33Å; E229-V292 VanDerWaalsContact O-CG2 3.22Å; E229-V292 WeakPolarHBondContact O-CG2 3.48Å; E229-V292 PolarHBondContact O-N 3.33Å
230	N	91.2	Very high	91.1	Very high	107 Å²	107	49.7 Å²	49.7	57%	0.572	27%	0.266	S	S	*	.			trans	-88	131.2	175.3	-64.5	-3.7	0	0	0	110.1	I289 A290 D291	N230-I289 WeakPolarHBondContact CA-O 3.3Å; N230-A290 WeakPolarHBondContact OD1-CA 3.3Å; N230-D291 PolarHBondContact OD1-N 2.93Å
231	T	91.6	Very high	90.9	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.2	177.9	-165.5	0	0	0	0	112.2	V225 I289 V292	V225-T231 HydrophobicContact CG1-CG2 4.02Å; T231-I289 HydrophobicContact CG2-CB 3.88Å; T231-I289 HydrophobicContact CG2-CD1 4.09Å; T231-I289 HydrophobicContact CG2-CG1 4.42Å; T231-I289 PolarHBondContact N-O 3.28Å; T231-I289 PolarHBondContact O-N 2.8Å; T231-V292 HydrophobicContact CG2-CG2 3.49Å; T231-V292 VanDerWaalsContact CG2-CG2 3.49Å
232	N	92.4	Very high	90.2	Very high	65 Å²	65	46.8 Å²	46.8	35%	0.348	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.1	178.9	-66.2	-15.8	0	0	0	109.9	K223 V286 L287	K223-N232 PolarHBondContact NZ-O 3.44Å; N232-V286 HydrophobicContact CB-CG1 3.94Å; N232-L287 CarbonylContact C-O 3.58Å; N232-L287 WeakPolarHBondContact CA-O 3.35Å
233	L	92.1	Very high	89.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123	173.3	-47.1	-177.5	0	0	0	109.3	K223 W251 V286 L287 I289 Y301 I316 L318	K223-L233 HydrophobicContact CD-CD2 3.72Å; L233-W251 HydrophobicContact CB-CH2 3.72Å; L233-W251 HydrophobicContact CB-CZ2 3.58Å; L233-W251 HydrophobicContact CD1-CH2 4.39Å; L233-W251 WeakPolarHBondContact O-CZ2 3.24Å; L233-V286 CarbonylContact O-C 3.54Å; L233-V286 WeakPolarHBondContact O-CA 3.28Å; L233-L287 HydrophobicContact CB-CB 4.2Å; L233-L287 HydrophobicContact CD1-CD2 4.25Å; L233-L287 PolarHBondContact N-O 2.98Å; L233-L287 PolarHBondContact O-N 3.41Å; L233-I289 HydrophobicContact CD1-CD1 4.01Å; L233-I289 HydrophobicContact CG-CD1 4.32Å; L233-Y301 HydrophobicContact CD1-CD1 3.87Å; L233-Y301 HydrophobicContact CD1-CE1 4.35Å; L233-Y301 HydrophobicContact CD1-CG 3.97Å; L233-I316 HydrophobicContact CD1-CG2 4.19Å; L233-I316 HydrophobicContact CD2-CD1 4.24Å; L233-L318 HydrophobicContact CD1-CD2 4.26Å; L233-L318 HydrophobicContact CD2-CD2 3.88Å
234	T	93.3	Very high	88.7	Confident	68 Å²	68	46.8 Å²	46.8	42%	0.417	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.5	-177.7	-54.7	0	0	0	0	110.4	A216 V286	A216-T234 CarbonylContact C-O 3.55Å; T234-V286 HydrophobicContact CG2-CG2 4.39Å
235	C	93.3	Very high	88	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.3	172.6	178.1	0	0	0	0	108	A216 V249 W251 M285 C303	A216-C235 CarbonylContact O-C 3.53Å; A216-C235 VanDerWaalsContact O-CA 3.28Å; A216-C235 WeakPolarHBondContact O-CA 3.44Å; C235-V249 HydrophobicContact CB-CG1 3.98Å; C235-V249 WeakPolarHBondContact SG-CG1 3.36Å; C235-W251 HydrophobicContact CB-CD2 4.4Å; C235-W251 HydrophobicContact CB-CH2 4.27Å; C235-W251 HydrophobicContact CB-CZ2 3.49Å; C235-W251 VanDerWaalsContact CB-CZ2 3.49Å; C235-M285 WeakPolarHBondContact CB-O 3.29Å; C235-M285 PolarHBondContact N-O 3.07Å; C235-M285 PolarHBondContact O-N 3.31Å; C235-C303 HydrophobicContact CB-CB 3.75Å; C235-C303 WeakPolarHBondContact CB-SG 3.43Å; C235-C303 WeakPolarHBondContact SG-CB 3.32Å; C235-C303 CovalentContact SG-SG 2.01Å; C235-C303 PolarHBondContact SG-SG 3.32Å
236	S	93.4	Very high	87.6	Confident	7 Å²	7	52.8 Å²	52.8	5%	0.049	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.1	-179.7	-176.7	0	0	0	0	109.4	I214 R215 A216 N284	I214-S236 CarbonylContact C-O 3.57Å; I214-S236 WeakPolarHBondContact CA-O 3.32Å; R215-S236 PolarHBondContact N-O 2.82Å; A216-S236 PolarHBondContact N-O 3.19Å; A216-S236 PolarHBondContact O-N 2.9Å; S236-N284 WeakPolarHBondContact CB-OD1 3.45Å; S236-N284 PolarHBondContact OG-OD1 3.44Å
237	A	93.9	Very high	87.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.9	178.5	0	0	0	0	0	112.4	V213 I214 F239 V249 C282 V283 A305	V213-A237 CarbonylContact O-C 3.47Å; V213-A237 VanDerWaalsContact O-CA 3.24Å; V213-A237 WeakPolarHBondContact O-CA 3.21Å; I214-A237 HydrophobicContact CG1-CB 4.15Å; A237-F239 HydrophobicContact CB-CE2 4.1Å; A237-F239 HydrophobicContact CB-CZ 4.07Å; A237-F239 WeakPolarHBondContact O-CE2 3.44Å; A237-V249 HydrophobicContact CB-CG2 3.8Å; A237-C282 CarbonylContact O-C 3.55Å; A237-C282 VanDerWaalsContact O-CA 3.23Å; A237-C282 WeakPolarHBondContact O-CA 3.43Å; A237-V283 PolarHBondContact N-O 3.25Å; A237-V283 PolarHBondContact O-N 2.93Å; A237-A305 HydrophobicContact CB-CB 3.37Å
238	C	92.2	Very high	87.7	Confident	10 Å²	10	49 Å²	49	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143	179.7	-56.7	0	0	0	0	111	V213 C282	V213-C238 PolarHBondContact N-O 3.11Å; V213-C238 PolarHBondContact O-N 3.36Å; C238-C282 HydrophobicContact CB-CB 4.07Å; C238-C282 WeakPolarHBondContact CB-SG 3.32Å; C238-C282 WeakPolarHBondContact SG-CB 3.5Å; C238-C282 CovalentContact SG-SG 2.05Å; C238-C282 PolarHBondContact SG-SG 3.49Å
239	F	91.8	Very high	88	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	4.2	-168.9	-62.2	-86	0	0	0	114	S209 L210 P212 A237 Q244 A247 V249 A281 V283 A305 L306 N307	S209-F239 WeakPolarHBondContact CA-O 3.1Å; S209-F239 PolarHBondContact OG-O 2.91Å; L210-F239 PolarHBondContact N-O 3.5Å; P212-F239 HydrophobicContact CB-CD1 3.96Å; P212-F239 HydrophobicContact CB-CE1 3.68Å; P212-F239 HydrophobicContact CG-CD1 3.96Å; P212-F239 HydrophobicContact CG-CE1 3.81Å; A237-F239 HydrophobicContact CB-CE2 4.1Å; A237-F239 HydrophobicContact CB-CZ 4.07Å; A237-F239 WeakPolarHBondContact O-CE2 3.44Å; F239-Q244 HydrophobicContact CB-CG 3.98Å; F239-Q244 PolarHBondContact O-OE1 3.35Å; F239-A247 HydrophobicContact CB-CB 4.16Å; F239-A247 HydrophobicContact CD1-CB 3.98Å; F239-A247 HydrophobicContact CD2-CB 3.72Å; F239-A247 HydrophobicContact CE1-CB 4.28Å; F239-A247 HydrophobicContact CE2-CB 4.06Å; F239-A247 HydrophobicContact CG-CB 3.67Å; F239-A247 HydrophobicContact CZ-CB 4.31Å; F239-V249 HydrophobicContact CE2-CG2 3.79Å; F239-V249 HydrophobicContact CZ-CG2 3.65Å; F239-A281 PolarHBondContact N-O 2.96Å; F239-V283 HydrophobicContact CD2-CG2 4.25Å; F239-V283 HydrophobicContact CE2-CB 4.05Å; F239-V283 HydrophobicContact CE2-CG2 3.94Å; F239-A305 HydrophobicContact CE1-CB 4.27Å; F239-A305 HydrophobicContact CZ-CB 4.06Å; F239-L306 VanDerWaalsContact CE1-O 3.26Å; F239-L306 WeakPolarHBondContact CE1-O 3.34Å; F239-N307 HydrophobicContact CD1-CB 3.92Å; F239-N307 HydrophobicContact CE1-CB 4.36Å
240	G	87.6	Confident	88.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.5	-152.7	-174.5	0	0	0	0	0	111.2	F208 L280 A281	F208-G240 CarbonylContact O-C 3.54Å; F208-G240 WeakPolarHBondContact O-CA 3.34Å; G240-L280 CarbonylContact O-C 3.59Å; G240-L280 WeakPolarHBondContact O-CA 3.23Å; G240-L280 WeakPolarHBondContact O-CD2 3.37Å; G240-A281 PolarHBondContact O-N 2.69Å
241	K	84.8	Confident	88.2	Confident	81 Å²	81	39.5 Å²	39.5	35%	0.352	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146	-177.1	-175.5	166.7	179.2	-179.9	0	110.3	Q206 G207 F208 Q244 G279	Q206-K241 VanDerWaalsContact O-CD 3.32Å; Q206-K241 WeakPolarHBondContact O-CD 3.47Å; Q206-K241 WeakPolarHBondContact O-CG 3.38Å; G207-K241 CarbonylContact C-O 3.59Å; G207-K241 WeakPolarHBondContact CA-O 3.39Å; F208-K241 HydrophobicContact CD1-CB 3.97Å; F208-K241 HydrophobicContact CE1-CB 3.65Å; F208-K241 HydrophobicContact CE1-CD 4.36Å; F208-K241 HydrophobicContact CZ-CB 3.98Å; F208-K241 PolarHBondContact N-O 3.28Å; F208-K241 PolarHBondContact O-N 3.17Å; F208-K241 VanDerWaalsContact O-O 3.06Å; K241-Q244 PolarHBondContact O-NE2 3.12Å; K241-G279 WeakPolarHBondContact CG-O 3.46Å
242	G	75.9	Confident	88.1	Confident	35 Å²	35	39.8 Å²	39.8	36%	0.361	23%	0.234	S	C	.	.	S	Bend	trans	76.5	-175.5	179.3	0	0	0	0	0	114.2	Q244	G242-Q244 PolarHBondContact O-N 2.89Å; G242-Q244 PolarHBondContact O-NE2 3.25Å
243	A	73.9	Confident	88	Confident	110 Å²	110	37.8 Å²	37.8	91%	0.909	22%	0.223	S	C	*	.			trans	-63.8	125	-176	0	0	0	0	0	111.5
244	Q	77.6	Confident	87.6	Confident	42 Å²	42	42.9 Å²	42.9	20%	0.196	25%	0.251	C	S	.	.			trans	-99	127.7	179.5	-57.1	-60.6	-49.4	0	0	109.6	F208 S209 F239 K241 G242 L246 A247 A281	F208-Q244 PolarHBondContact O-NE2 3.48Å; S209-Q244 VanDerWaalsContact CB-OE1 3.27Å; S209-Q244 PolarHBondContact OG-OE1 2.81Å; F239-Q244 HydrophobicContact CB-CG 3.98Å; F239-Q244 PolarHBondContact O-OE1 3.35Å; K241-Q244 PolarHBondContact O-NE2 3.12Å; G242-Q244 PolarHBondContact O-N 2.89Å; G242-Q244 PolarHBondContact O-NE2 3.25Å; Q244-L246 VanDerWaalsContact C-N 3.29Å; Q244-L246 PolarHBondContact O-N 3.3Å; Q244-A247 HydrophobicContact CB-CB 3.71Å; Q244-A247 HydrophobicContact CG-CB 4.18Å; Q244-A281 HydrophobicContact CG-CB 4.24Å
245	F	77.5	Confident	86.8	Confident	185 Å²	185	41.2 Å²	41.2	81%	0.811	25%	0.246	S	C	*	.	S	Bend	trans	-62.7	-38.2	176.4	179.1	-95.8	0	0	0	112.2	L308	F245-L308 HydrophobicContact CD1-CD1 3.97Å; F245-L308 HydrophobicContact CD1-CD2 4.5Å; F245-L308 HydrophobicContact CD1-CG 4.48Å
246	L	83.1	Confident	86.2	Confident	74 Å²	74	45.9 Å²	45.9	39%	0.387	27%	0.272	S	S	.	.	S	Bend	trans	-141.3	110.5	176.5	-170.4	89.1	0	0	0	108.5	Q244 L306 N307 L308	Q244-L246 VanDerWaalsContact C-N 3.29Å; Q244-L246 PolarHBondContact O-N 3.3Å; L246-L306 HydrophobicContact CD2-CD1 3.76Å; L246-L306 HydrophobicContact CG-CD1 4.2Å; L246-N307 WeakPolarHBondContact O-CA 3.46Å; L246-N307 WeakPolarHBondContact O-CB 3.42Å; L246-L308 HydrophobicContact CB-CD2 4.36Å; L246-L308 HydrophobicContact CB-CG 4.17Å; L246-L308 HydrophobicContact CD2-CD2 4.21Å
247	A	89.5	Confident	85.1	Confident	35 Å²	35	51.4 Å²	51.4	29%	0.289	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	114.8	171.6	0	0	0	0	0	107.8	F239 Q244	F239-A247 HydrophobicContact CB-CB 4.16Å; F239-A247 HydrophobicContact CD1-CB 3.98Å; F239-A247 HydrophobicContact CD2-CB 3.72Å; F239-A247 HydrophobicContact CE1-CB 4.28Å; F239-A247 HydrophobicContact CE2-CB 4.06Å; F239-A247 HydrophobicContact CG-CB 3.67Å; F239-A247 HydrophobicContact CZ-CB 4.31Å; Q244-A247 HydrophobicContact CB-CB 3.71Å; Q244-A247 HydrophobicContact CG-CB 4.18Å
248	A	90.5	Very high	84	Confident	38 Å²	38	53.3 Å²	53.3	31%	0.314	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142.3	180	0	0	0	0	0	111.3	A305 L306	A248-A305 WeakPolarHBondContact O-CA 3.38Å; A248-L306 HydrophobicContact CB-CD1 4.07Å; A248-L306 HydrophobicContact CB-CD2 4.19Å; A248-L306 HydrophobicContact CB-CG 3.92Å; A248-L306 PolarHBondContact N-O 3.38Å; A248-L306 PolarHBondContact O-N 2.96Å
249	V	92.8	Very high	82.1	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.042	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.9	175.4	-178.2	0	0	0	0	107.6	C235 A237 F239 V283 M285 L304 A305	C235-V249 HydrophobicContact CB-CG1 3.98Å; C235-V249 WeakPolarHBondContact SG-CG1 3.36Å; A237-V249 HydrophobicContact CB-CG2 3.8Å; F239-V249 HydrophobicContact CE2-CG2 3.79Å; F239-V249 HydrophobicContact CZ-CG2 3.65Å; V249-V283 HydrophobicContact CB-CG1 4.16Å; V249-V283 HydrophobicContact CG2-CB 3.81Å; V249-V283 HydrophobicContact CG2-CG1 4.01Å; V249-M285 HydrophobicContact CB-CB 4.12Å; V249-M285 HydrophobicContact CG1-CB 3.7Å; V249-L304 VanDerWaalsContact CA-O 3.3Å; V249-L304 WeakPolarHBondContact CA-O 3.32Å; V249-A305 HydrophobicContact CG2-CB 4.44Å
250	Q	92.1	Very high	80.2	Confident	48 Å²	48	66.9 Å²	66.9	22%	0.224	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	153	-178.7	65.9	-172.8	-6.8	0	0	111.1	L304	Q250-L304 HydrophobicContact CG-CB 3.92Å; Q250-L304 HydrophobicContact CG-CD1 4.19Å; Q250-L304 PolarHBondContact N-O 3.06Å; Q250-L304 PolarHBondContact O-N 3.44Å
251	W	92.1	Very high	78.4	Confident	3 Å²	3	72 Å²	72	1%	0.011	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	146.3	171.3	-74.6	98.6	0	0	0	110.9	P217 L233 C235 I258 M285 L287 C303 I316	P217-W251 HydrophobicContact CG-CH2 4.38Å; L233-W251 HydrophobicContact CB-CH2 3.72Å; L233-W251 HydrophobicContact CB-CZ2 3.58Å; L233-W251 HydrophobicContact CD1-CH2 4.39Å; L233-W251 WeakPolarHBondContact O-CZ2 3.24Å; C235-W251 HydrophobicContact CB-CD2 4.4Å; C235-W251 HydrophobicContact CB-CH2 4.27Å; C235-W251 HydrophobicContact CB-CZ2 3.49Å; C235-W251 VanDerWaalsContact CB-CZ2 3.49Å; W251-I258 HydrophobicContact CB-CD1 3.6Å; W251-M285 PolarHBondContact NE1-O 3.26Å; W251-M285 VanDerWaalsContact NE1-O 3.11Å; W251-L287 HydrophobicContact CB-CD1 4.19Å; W251-L287 HydrophobicContact CB-CD2 4.39Å; W251-L287 HydrophobicContact CD2-CB 4.03Å; W251-L287 HydrophobicContact CD2-CD2 4.24Å; W251-L287 HydrophobicContact CE3-CD2 4.44Å; W251-L287 HydrophobicContact CG-CB 3.91Å; W251-L287 HydrophobicContact CG-CD1 4.28Å; W251-L287 HydrophobicContact CG-CD2 4.24Å; W251-L287 HydrophobicContact CG-CG 4.39Å; W251-C303 HydrophobicContact CE3-CB 4.2Å; W251-C303 HydrophobicContact CH2-CB 3.98Å; W251-C303 HydrophobicContact CZ2-CB 4.43Å; W251-C303 HydrophobicContact CZ3-CB 3.84Å; W251-I316 HydrophobicContact CH2-CG2 3.84Å; W251-I316 HydrophobicContact CZ3-CG2 3.65Å
252	Q	90.8	Very high	76.7	Confident	24 Å²	24	72.1 Å²	72.1	11%	0.112	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.1	175.6	-176.3	179.8	35.1	0	0	108.5	G255 N256 D302 L304	Q252-G255 PolarHBondContact NE2-O 2.89Å; Q252-N256 VanDerWaalsContact CG-O 3.32Å; Q252-N256 WeakPolarHBondContact CG-O 3.32Å; Q252-D302 HydrophobicContact CB-CB 4.12Å; Q252-D302 PolarHBondContact N-O 3.17Å; Q252-D302 PolarHBondContact O-N 3.48Å; Q252-L304 HydrophobicContact CB-CD1 3.98Å; Q252-L304 HydrophobicContact CB-CG 4.32Å
253	L	89.1	Confident	75.7	Confident	23 Å²	23	75.2 Å²	75.2	12%	0.12	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.3	-178.9	-70.9	164.5	0	0	0	108.7	G255 N256 I258 I266 L287 Y301	L253-G255 PolarHBondContact O-N 3Å; L253-N256 PolarHBondContact N-O 3.19Å; L253-N256 PolarHBondContact O-N 3.41Å; L253-I258 HydrophobicContact CD1-CD1 3.78Å; L253-I258 HydrophobicContact CD1-CG1 3.78Å; L253-I258 HydrophobicContact CG-CD1 3.97Å; L253-I258 HydrophobicContact CG-CG1 4.03Å; L253-I266 HydrophobicContact CD1-CD1 4.5Å; L253-I266 HydrophobicContact CD1-CG2 4.29Å; L253-L287 HydrophobicContact CD2-CD2 4.44Å; L253-Y301 HydrophobicContact CD2-CD1 3.28Å; L253-Y301 HydrophobicContact CD2-CE1 3.26Å; L253-Y301 HydrophobicContact CD2-CG 4.25Å
254	N	84.8	Confident	75.4	Confident	109 Å²	109	75.1 Å²	75.1	58%	0.583	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	35.8	178.9	-157.9	20.3	0	0	0	114.6	R300	N254-R300 PolarHBondContact N-O 3.31Å
255	G	77.3	Confident	75.5	Confident	32 Å²	32	74.6 Å²	74.6	33%	0.33	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-6.1	-177.8	0	0	0	0	0	115.7	Q252 L253	Q252-G255 PolarHBondContact NE2-O 2.89Å; L253-G255 PolarHBondContact O-N 3Å
256	N	80.4	Confident	75.7	Confident	99 Å²	99	67 Å²	67	53%	0.529	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.7	174.6	-69.1	-14	0	0	0	111.1	Q252 L253 F261	Q252-N256 VanDerWaalsContact CG-O 3.32Å; Q252-N256 WeakPolarHBondContact CG-O 3.32Å; L253-N256 PolarHBondContact N-O 3.19Å; L253-N256 PolarHBondContact O-N 3.41Å; N256-F261 HydrophobicContact CB-CE2 4.4Å; N256-F261 HydrophobicContact CB-CZ 4.08Å
257	K	70.4	Confident	75.7	Confident	122 Å²	122	68 Å²	68	53%	0.53	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	141.4	172.4	-69.6	-173.2	179.7	-176.9	0	108.9	T259 F261	K257-T259 HydrophobicContact CB-CG2 4.21Å; K257-T259 PolarHBondContact O-N 3.38Å; K257-F261 VanDerWaalsContact O-CE2 3.25Å; K257-F261 WeakPolarHBondContact O-CE2 3.41Å
258	I	69.4	Low	75.5	Confident	40 Å²	40	69.3 Å²	69.3	21%	0.205	38%	0.382	C	S	.	.			trans	-72.6	79.3	175.9	-49.8	-177.4	0	0	0	108.3	W251 L253 L287	W251-I258 HydrophobicContact CB-CD1 3.6Å; L253-I258 HydrophobicContact CD1-CD1 3.78Å; L253-I258 HydrophobicContact CD1-CG1 3.78Å; L253-I258 HydrophobicContact CG-CD1 3.97Å; L253-I258 HydrophobicContact CG-CG1 4.03Å; I258-L287 HydrophobicContact CD1-CD1 3.48Å; I258-L287 VanDerWaalsContact CD1-CD1 3.48Å
259	T	53.3	Low	75.2	Confident	99 Å²	99	70.8 Å²	70.8	61%	0.607	38%	0.382	S	S	*	.	S	Bend	trans	-100.1	97.9	173.6	49.4	0	0	0	0	107.2	K257 F261	K257-T259 HydrophobicContact CB-CG2 4.21Å; K257-T259 PolarHBondContact O-N 3.38Å; T259-F261 PolarHBondContact O-N 2.95Å
260	H	52.3	Low	74.7	Confident	197 Å²	197	77.3 Å²	77.3	91%	0.912	41%	0.412	S	S	*	.			trans	26.1	58.5	175.5	-76.3	-83.4	0	0	0	112.9	G262	H260-G262 PolarHBondContact O-N 2.91Å
261	F	49	Very low	73.7	Confident	109 Å²	109	75.8 Å²	75.8	48%	0.478	41%	0.409	S	S	.	.			trans	-62.9	131.1	168.2	-77.9	-78.5	0	0	0	105.1	N256 K257 T259 E263	N256-F261 HydrophobicContact CB-CE2 4.4Å; N256-F261 HydrophobicContact CB-CZ 4.08Å; K257-F261 VanDerWaalsContact O-CE2 3.25Å; K257-F261 WeakPolarHBondContact O-CE2 3.41Å; T259-F261 PolarHBondContact O-N 2.95Å; F261-E263 PolarHBondContact O-N 3.47Å
262	G	48.4	Very low	72.5	Confident	84 Å²	84	84.1 Å²	84.1	87%	0.866	45%	0.448	S	S	*	.	S	Bend	trans	-62.1	23	-174.4	0	0	0	0	0	115.9	H260	H260-G262 PolarHBondContact O-N 2.91Å
263	E	56.5	Low	71.3	Confident	99 Å²	99	87.5 Å²	87.5	46%	0.463	47%	0.467	S	S	.	.			trans	-105.5	107.1	171.4	-69.5	-171.3	-169.3	0	0	109.5	F261 R265	F261-E263 PolarHBondContact O-N 3.47Å; E263-R265 PolarHBondContact O-N 3.15Å; E263-R265 IonicContact OE2-NE 3.64Å; E263-R265 IonicContact OE2-NH2 2.66Å
264	P	65.9	Low	69.7	Low	109 Å²	109	91.4 Å²	91.4	71%	0.708	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	1.6	176.8	26.8	-34	0	0	0	113.8	Q267	P264-Q267 PolarHBondContact O-NE2 3.44Å
265	R	80.3	Confident	68.3	Low	31 Å²	31	91.5 Å²	91.5	12%	0.117	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-35.1	-172.5	-169.6	-179.5	66.7	87.1	-0.9	113.5	E263 A290 D291 D296	E263-R265 PolarHBondContact O-N 3.15Å; E263-R265 IonicContact OE2-NE 3.64Å; E263-R265 IonicContact OE2-NH2 2.66Å; R265-A290 WeakPolarHBondContact CD-O 3.08Å; R265-A290 HydrophobicContact CG-CB 3.95Å; R265-A290 WeakPolarHBondContact CG-O 3.1Å; R265-A290 PolarHBondContact NH1-O 3.44Å; R265-A290 PolarHBondContact O-N 3.09Å; R265-D291 PolarHBondContact NH1-O 3.05Å; R265-D296 IonicContact CZ-OD1 3.18Å; R265-D296 IonicContact CZ-OD2 3.6Å; R265-D296 IonicContact NH1-OD1 3.35Å; R265-D296 IonicContact NH1-OD2 3.4Å; R265-D296 PolarHBondContact NH1-OD2 3.45Å; R265-D296 IonicContact NH2-OD1 2.74Å; R265-D296 PolarHBondContact NH2-OD1 3.48Å; R265-D296 IonicContact NH2-OD2 3.49Å; R265-D296 PolarHBondContact NH2-OD2 3.03Å
266	I	82.7	Confident	67.3	Low	25 Å²	25	94.2 Å²	94.2	13%	0.128	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	110.9	178.4	-57.6	179.1	0	0	0	109	L253 L287 R288 I289	L253-I266 HydrophobicContact CD1-CD1 4.5Å; L253-I266 HydrophobicContact CD1-CG2 4.29Å; I266-L287 HydrophobicContact CG2-CD1 3.61Å; I266-L287 HydrophobicContact CG2-CD2 4.24Å; I266-L287 HydrophobicContact CG2-CG 3.96Å; I266-R288 CarbonylContact C-O 3.57Å; I266-R288 VanDerWaalsContact CA-O 3.3Å; I266-R288 WeakPolarHBondContact CA-O 3.49Å; I266-I289 HydrophobicContact CG1-CG1 4.36Å; I266-I289 HydrophobicContact CG1-CG2 4.28Å; I266-I289 HydrophobicContact CG2-CG1 4.4Å
267	Q	81.7	Confident	65.9	Low	94 Å²	94	95.7 Å²	95.7	44%	0.439	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.7	-175.6	-61.2	-175	24.9	0	0	110.8	P264 L287 R288	P264-Q267 PolarHBondContact O-NE2 3.44Å; Q267-L287 CarbonylContact O-C 3.6Å; Q267-L287 WeakPolarHBondContact O-CA 3.42Å; Q267-R288 PolarHBondContact N-O 3.47Å; Q267-R288 PolarHBondContact O-N 3.02Å
268	Q	85.6	Confident	65.4	Low	64 Å²	64	96 Å²	96	30%	0.299	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.1	173.6	-178.2	174.5	-40.8	0	0	108.5	M285 V286 L287	Q268-M285 HydrophobicContact CG-CE 4.09Å; Q268-M285 HydrophobicContact CG-CG 3.61Å; Q268-M285 HydrophobicContact CG-SD 3.33Å; Q268-M285 WeakPolarHBondContact CG-SD 3.3Å; Q268-M285 VanDerWaalsContact NE2-CG 3.33Å; Q268-M285 PolarHBondContact NE2-SD 3.35Å; Q268-V286 WeakPolarHBondContact CA-O 3.45Å; Q268-L287 HydrophobicContact CB-CD1 4.28Å
269	E	84.6	Confident	65.3	Low	69 Å²	69	96 Å²	96	32%	0.322	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.2	-178	-70.2	171.2	-158.4	0	0	109.5	G271 M285 V286 R288	E269-G271 PolarHBondContact O-N 3.01Å; E269-M285 VanDerWaalsContact C-SD 3.56Å; E269-V286 PolarHBondContact N-O 3.44Å; E269-V286 PolarHBondContact O-N 2.91Å; E269-R288 IonicContact OE1-CZ 3.45Å; E269-R288 IonicContact OE1-NE 2.66Å; E269-R288 PolarHBondContact OE1-NE 2.94Å; E269-R288 IonicContact OE1-NH2 2.9Å; E269-R288 PolarHBondContact OE1-NH2 3.38Å; E269-R288 IonicContact OE2-CZ 3.42Å; E269-R288 IonicContact OE2-NE 2.83Å; E269-R288 IonicContact OE2-NH2 3.15Å; E269-R288 PolarHBondContact OE2-NH2 2.95Å
270	E	83.3	Confident	66.7	Low	144 Å²	144	93.2 Å²	93.2	67%	0.673	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	119.4	172.5	-165.3	169.4	-169.9	0	0	108.9
271	G	71	Confident	68.2	Low	15 Å²	15	85.4 Å²	85.4	16%	0.155	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-76.9	160.6	179	0	0	0	0	0	110.8	E269 N273 N284	E269-G271 PolarHBondContact O-N 3.01Å; G271-N273 PolarHBondContact O-N 3.42Å; G271-N284 PolarHBondContact N-O 2.94Å
272	Q	66.3	Low	70.1	Confident	178 Å²	178	80.6 Å²	80.6	83%	0.832	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-59.5	126	176.1	-159.4	172.1	8.1	0	0	110.1	Q274 N284	Q272-Q274 PolarHBondContact O-N 3.02Å; Q272-N284 PolarHBondContact O-ND2 3.47Å
273	N	64.6	Low	72.1	Confident	95 Å²	95	77.9 Å²	77.9	51%	0.508	43%	0.43	S	S	.	.			trans	-61.8	110.5	177.9	-72.8	-26.1	0	0	0	109.2	G271 S275	G271-N273 PolarHBondContact O-N 3.42Å; N273-S275 PolarHBondContact O-N 3.23Å
274	Q	56	Low	73.7	Confident	105 Å²	105	73.7 Å²	73.7	49%	0.491	41%	0.41	S	S	.	.			trans	-84.4	109.1	176.2	-78.2	177.8	-7.3	0	0	109.1	Q272 F276	Q272-Q274 PolarHBondContact O-N 3.02Å; Q274-F276 HydrophobicContact CB-CD2 4.24Å; Q274-F276 HydrophobicContact CB-CE2 3.82Å; Q274-F276 HydrophobicContact CB-CZ 4.23Å; Q274-F276 WeakPolarHBondContact O-CD2 3.35Å; Q274-F276 PolarHBondContact O-N 2.89Å; Q274-F276 VanDerWaalsContact O-N 3.16Å; Q274-F276 VanDerWaalsContact OE1-CZ 3.25Å
275	S	55.8	Low	74.9	Confident	112 Å²	112	69.8 Å²	69.8	78%	0.783	38%	0.383	S	S	*	.			trans	-73.8	96.2	161.5	45.1	0	0	0	0	108.3	N273	N273-S275 PolarHBondContact O-N 3.23Å
276	F	56.3	Low	75.5	Confident	88 Å²	88	69.4 Å²	69.4	39%	0.386	38%	0.384	S	S	.	.			trans	-65.1	148.7	170.7	-71.5	-87.1	0	0	0	109.7	Q274 N278 G279 C282	Q274-F276 HydrophobicContact CB-CD2 4.24Å; Q274-F276 HydrophobicContact CB-CE2 3.82Å; Q274-F276 HydrophobicContact CB-CZ 4.23Å; Q274-F276 WeakPolarHBondContact O-CD2 3.35Å; Q274-F276 PolarHBondContact O-N 2.89Å; Q274-F276 VanDerWaalsContact O-N 3.16Å; Q274-F276 VanDerWaalsContact OE1-CZ 3.25Å; F276-N278 PolarHBondContact O-N 3.06Å; F276-G279 PolarHBondContact O-N 3.27Å; F276-C282 HydrophobicContact CD2-CB 4.29Å; F276-C282 HydrophobicContact CE2-CB 4.31Å
277	S	51	Low	75.9	Confident	130 Å²	130	68.2 Å²	68.2	91%	0.909	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-14.7	-175.4	-64.7	0	0	0	0	116.1
278	N	59.9	Low	76.3	Confident	128 Å²	128	68 Å²	68	68%	0.684	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.8	-179.3	-58.7	1.9	0	0	0	113.7	F276 L280	F276-N278 PolarHBondContact O-N 3.06Å; N278-L280 VanDerWaalsContact C-N 3.31Å; N278-L280 HydrophobicContact CB-CD1 4.21Å; N278-L280 PolarHBondContact O-N 3.39Å
279	G	67.3	Low	76.5	Confident	41 Å²	41	65 Å²	65	42%	0.423	36%	0.359	S	S	.	.			trans	72.3	19.2	-179.4	0	0	0	0	0	114.7	K241 F276	K241-G279 WeakPolarHBondContact CG-O 3.46Å; F276-G279 PolarHBondContact O-N 3.27Å
280	L	81.6	Confident	76.8	Confident	40 Å²	40	63 Å²	63	21%	0.209	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.4	173.9	-76.7	152.6	0	0	0	110.3	G240 N278 C282	G240-L280 CarbonylContact O-C 3.59Å; G240-L280 WeakPolarHBondContact O-CA 3.23Å; G240-L280 WeakPolarHBondContact O-CD2 3.37Å; N278-L280 VanDerWaalsContact C-N 3.31Å; N278-L280 HydrophobicContact CB-CD1 4.21Å; N278-L280 PolarHBondContact O-N 3.39Å; L280-C282 PolarHBondContact O-N 3.49Å
281	A	85	Confident	77	Confident	33 Å²	33	60.1 Å²	60.1	27%	0.273	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	103.1	171.9	0	0	0	0	0	109.2	F239 G240 Q244	F239-A281 PolarHBondContact N-O 2.96Å; G240-A281 PolarHBondContact O-N 2.69Å; Q244-A281 HydrophobicContact CG-CB 4.24Å
282	C	88.6	Confident	77.9	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.4	178.2	-49.7	0	0	0	0	110.1	A237 C238 F276 L280	A237-C282 CarbonylContact O-C 3.55Å; A237-C282 VanDerWaalsContact O-CA 3.23Å; A237-C282 WeakPolarHBondContact O-CA 3.43Å; C238-C282 HydrophobicContact CB-CB 4.07Å; C238-C282 WeakPolarHBondContact CB-SG 3.32Å; C238-C282 WeakPolarHBondContact SG-CB 3.5Å; C238-C282 CovalentContact SG-SG 2.05Å; C238-C282 PolarHBondContact SG-SG 3.49Å; F276-C282 HydrophobicContact CD2-CB 4.29Å; F276-C282 HydrophobicContact CE2-CB 4.31Å; L280-C282 PolarHBondContact O-N 3.49Å
283	V	90	Very high	79.1	Confident	27 Å²	27	54.7 Å²	54.7	16%	0.164	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.3	178.7	-179.9	0	0	0	0	108.1	A237 F239 V249	A237-V283 PolarHBondContact N-O 3.25Å; A237-V283 PolarHBondContact O-N 2.93Å; F239-V283 HydrophobicContact CD2-CG2 4.25Å; F239-V283 HydrophobicContact CE2-CB 4.05Å; F239-V283 HydrophobicContact CE2-CG2 3.94Å; V249-V283 HydrophobicContact CB-CG1 4.16Å; V249-V283 HydrophobicContact CG2-CB 3.81Å; V249-V283 HydrophobicContact CG2-CG1 4.01Å
284	N	90.8	Very high	80.2	Confident	10 Å²	10	54.3 Å²	54.3	5%	0.053	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.1	-178.8	-69.8	-19.9	0	0	0	109.7	S236 G271 Q272	S236-N284 WeakPolarHBondContact CB-OD1 3.45Å; S236-N284 PolarHBondContact OG-OD1 3.44Å; G271-N284 PolarHBondContact N-O 2.94Å; Q272-N284 PolarHBondContact O-ND2 3.47Å
285	M	91.4	Very high	81.7	Confident	27 Å²	27	54 Å²	54	13%	0.133	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.2	177.2	-170.1	59.2	93.3	0	0	109.9	C235 V249 W251 Q268 E269	C235-M285 WeakPolarHBondContact CB-O 3.29Å; C235-M285 PolarHBondContact N-O 3.07Å; C235-M285 PolarHBondContact O-N 3.31Å; V249-M285 HydrophobicContact CB-CB 4.12Å; V249-M285 HydrophobicContact CG1-CB 3.7Å; W251-M285 PolarHBondContact NE1-O 3.26Å; W251-M285 VanDerWaalsContact NE1-O 3.11Å; Q268-M285 HydrophobicContact CG-CE 4.09Å; Q268-M285 HydrophobicContact CG-CG 3.61Å; Q268-M285 HydrophobicContact CG-SD 3.33Å; Q268-M285 WeakPolarHBondContact CG-SD 3.3Å; Q268-M285 VanDerWaalsContact NE2-CG 3.33Å; Q268-M285 PolarHBondContact NE2-SD 3.35Å; E269-M285 VanDerWaalsContact C-SD 3.56Å
286	V	91.9	Very high	83.2	Confident	23 Å²	23	48.7 Å²	48.7	14%	0.139	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.6	-176.2	-177	0	0	0	0	109.4	N232 L233 T234 Q268 E269	N232-V286 HydrophobicContact CB-CG1 3.94Å; L233-V286 CarbonylContact O-C 3.54Å; L233-V286 WeakPolarHBondContact O-CA 3.28Å; T234-V286 HydrophobicContact CG2-CG2 4.39Å; Q268-V286 WeakPolarHBondContact CA-O 3.45Å; E269-V286 PolarHBondContact N-O 3.44Å; E269-V286 PolarHBondContact O-N 2.91Å
287	L	91.4	Very high	84.8	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	110.9	169.9	-168.3	70.2	0	0	0	108.7	N232 L233 W251 L253 I258 I266 Q267 Q268 I289 Y301	N232-L287 CarbonylContact C-O 3.58Å; N232-L287 WeakPolarHBondContact CA-O 3.35Å; L233-L287 HydrophobicContact CB-CB 4.2Å; L233-L287 HydrophobicContact CD1-CD2 4.25Å; L233-L287 PolarHBondContact N-O 2.98Å; L233-L287 PolarHBondContact O-N 3.41Å; W251-L287 HydrophobicContact CB-CD1 4.19Å; W251-L287 HydrophobicContact CB-CD2 4.39Å; W251-L287 HydrophobicContact CD2-CB 4.03Å; W251-L287 HydrophobicContact CD2-CD2 4.24Å; W251-L287 HydrophobicContact CE3-CD2 4.44Å; W251-L287 HydrophobicContact CG-CB 3.91Å; W251-L287 HydrophobicContact CG-CD1 4.28Å; W251-L287 HydrophobicContact CG-CD2 4.24Å; W251-L287 HydrophobicContact CG-CG 4.39Å; L253-L287 HydrophobicContact CD2-CD2 4.44Å; I258-L287 HydrophobicContact CD1-CD1 3.48Å; I258-L287 VanDerWaalsContact CD1-CD1 3.48Å; I266-L287 HydrophobicContact CG2-CD1 3.61Å; I266-L287 HydrophobicContact CG2-CD2 4.24Å; I266-L287 HydrophobicContact CG2-CG 3.96Å; Q267-L287 CarbonylContact O-C 3.6Å; Q267-L287 WeakPolarHBondContact O-CA 3.42Å; Q268-L287 HydrophobicContact CB-CD1 4.28Å; L287-I289 HydrophobicContact CD2-CD1 4.46Å; L287-I289 HydrophobicContact CD2-CG1 4.45Å; L287-I289 HydrophobicContact CG-CG1 4.41Å; L287-Y301 HydrophobicContact CD2-CD1 3.67Å; L287-Y301 HydrophobicContact CD2-CE1 4.01Å
288	R	90	Very high	86.6	Confident	90 Å²	90	47.2 Å²	47.2	34%	0.34	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.4	173.7	-176.4	-172.4	-59.9	-95.8	-3.1	108.7	I266 Q267 E269	I266-R288 CarbonylContact C-O 3.57Å; I266-R288 VanDerWaalsContact CA-O 3.3Å; I266-R288 WeakPolarHBondContact CA-O 3.49Å; Q267-R288 PolarHBondContact N-O 3.47Å; Q267-R288 PolarHBondContact O-N 3.02Å; E269-R288 IonicContact OE1-CZ 3.45Å; E269-R288 IonicContact OE1-NE 2.66Å; E269-R288 PolarHBondContact OE1-NE 2.94Å; E269-R288 IonicContact OE1-NH2 2.9Å; E269-R288 PolarHBondContact OE1-NH2 3.38Å; E269-R288 IonicContact OE2-CZ 3.42Å; E269-R288 IonicContact OE2-NE 2.83Å; E269-R288 IonicContact OE2-NH2 3.15Å; E269-R288 PolarHBondContact OE2-NH2 2.95Å
289	I	90.6	Very high	88	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	105.7	173.3	-55.5	167.9	0	0	0	105.7	N230 T231 L233 I266 L287 V292 Y301 L318	N230-I289 WeakPolarHBondContact CA-O 3.3Å; T231-I289 HydrophobicContact CG2-CB 3.88Å; T231-I289 HydrophobicContact CG2-CD1 4.09Å; T231-I289 HydrophobicContact CG2-CG1 4.42Å; T231-I289 PolarHBondContact N-O 3.28Å; T231-I289 PolarHBondContact O-N 2.8Å; L233-I289 HydrophobicContact CD1-CD1 4.01Å; L233-I289 HydrophobicContact CG-CD1 4.32Å; I266-I289 HydrophobicContact CG1-CG1 4.36Å; I266-I289 HydrophobicContact CG1-CG2 4.28Å; I266-I289 HydrophobicContact CG2-CG1 4.4Å; L287-I289 HydrophobicContact CD2-CD1 4.46Å; L287-I289 HydrophobicContact CD2-CG1 4.45Å; L287-I289 HydrophobicContact CG-CG1 4.41Å; I289-V292 HydrophobicContact CB-CG2 4.49Å; I289-V292 HydrophobicContact CG2-CG2 3.94Å; I289-Y301 HydrophobicContact CD1-CD1 4.45Å; I289-Y301 HydrophobicContact CD1-CE1 3.61Å; I289-L318 HydrophobicContact CD1-CD1 4.06Å
290	A	89.3	Confident	89.1	Confident	27 Å²	27	45.9 Å²	45.9	22%	0.223	23%	0.231	C	C	.	.	S	Bend	trans	-78.3	149	172.2	0	0	0	0	0	110.2	N230 R265 V292	N230-A290 WeakPolarHBondContact OD1-CA 3.3Å; R265-A290 WeakPolarHBondContact CD-O 3.08Å; R265-A290 HydrophobicContact CG-CB 3.95Å; R265-A290 WeakPolarHBondContact CG-O 3.1Å; R265-A290 PolarHBondContact NH1-O 3.44Å; R265-A290 PolarHBondContact O-N 3.09Å; A290-V292 PolarHBondContact O-N 3.29Å
291	D	88.4	Confident	89.6	Confident	85 Å²	85	44 Å²	44	46%	0.455	22%	0.221	S	C	.	.	S	Bend	trans	45.4	71.1	173.7	-174.9	28.7	0	0	0	112.4	G228 N230 R265 K293	G228-D291 WeakPolarHBondContact CA-OD1 3.16Å; N230-D291 PolarHBondContact OD1-N 2.93Å; R265-D291 PolarHBondContact NH1-O 3.05Å; D291-K293 PolarHBondContact O-N 3.48Å
292	V	90.7	Very high	90	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.208	C	C	.	.			trans	-60.9	127.3	-175.3	172.9	0	0	0	0	110.5	V225 I227 G228 E229 T231 I289 A290 D296	V225-V292 HydrophobicContact CB-CG1 4.47Å; V225-V292 HydrophobicContact CG2-CG1 3.94Å; I227-V292 WeakPolarHBondContact CA-O 3.12Å; I227-V292 HydrophobicContact CD1-CG1 4.18Å; I227-V292 WeakPolarHBondContact CG2-O 3.35Å; G228-V292 PolarHBondContact N-O 2.99Å; E229-V292 VanDerWaalsContact O-CG2 3.22Å; E229-V292 WeakPolarHBondContact O-CG2 3.48Å; E229-V292 PolarHBondContact O-N 3.33Å; T231-V292 HydrophobicContact CG2-CG2 3.49Å; T231-V292 VanDerWaalsContact CG2-CG2 3.49Å; I289-V292 HydrophobicContact CB-CG2 4.49Å; I289-V292 HydrophobicContact CG2-CG2 3.94Å; A290-V292 PolarHBondContact O-N 3.29Å; V292-D296 HydrophobicContact CG1-CB 4.39Å
293	K	89.8	Confident	90.3	Very high	77 Å²	77	42 Å²	42	34%	0.335	21%	0.205	S	C	.	.			trans	-107.1	166.7	-179.9	-65	176.2	-178.3	-178.9	0	112.1	D291 E295 D296	D291-K293 PolarHBondContact O-N 3.48Å; K293-E295 VanDerWaalsContact C-N 3.26Å; K293-E295 HydrophobicContact CB-CG 3.81Å; K293-E295 HydrophobicContact CD-CG 4.03Å; K293-E295 WeakPolarHBondContact CD-OE1 3.39Å; K293-E295 IonicContact NZ-OE1 2.79Å; K293-E295 PolarHBondContact NZ-OE1 3.24Å; K293-E295 PolarHBondContact O-N 3.04Å; K293-D296 PolarHBondContact N-OD2 3.43Å; K293-D296 WeakPolarHBondContact O-CB 3.43Å; K293-D296 PolarHBondContact O-N 3.42Å; K293-D296 VanDerWaalsContact O-N 3.11Å
294	E	88.4	Confident	90.5	Very high	87 Å²	87	41 Å²	41	41%	0.407	20%	0.199	S	C	.	.	H	α-helix	trans	-60.3	-34.9	173.1	-74.7	-62.8	138.6	0	0	113.4	I227 D296 L297 R320	I227-E294 WeakPolarHBondContact CD1-OE1 3.32Å; I227-E294 WeakPolarHBondContact CG1-OE1 3.22Å; E294-D296 PolarHBondContact O-N 3.45Å; E294-L297 WeakPolarHBondContact O-CB 3.48Å; E294-L297 PolarHBondContact O-N 3.36Å; E294-R320 IonicContact OE1-CZ 3.86Å; E294-R320 IonicContact OE1-NE 3.9Å; E294-R320 PolarHBondContact OE1-NE 2.62Å; E294-R320 IonicContact OE1-NH2 2.71Å; E294-R320 PolarHBondContact OE1-NH2 2.9Å; E294-R320 IonicContact OE2-NH2 3.01Å; E294-R320 PolarHBondContact OE2-NH2 3.35Å
295	E	87.4	Confident	90.8	Very high	98 Å²	98	40.5 Å²	40.5	46%	0.458	20%	0.196	S	C	.	.	H	α-helix	trans	-62.4	-30.2	176.6	61.5	-165.9	-174.6	0	0	112.5	K293 L297 L298	K293-E295 VanDerWaalsContact C-N 3.26Å; K293-E295 HydrophobicContact CB-CG 3.81Å; K293-E295 HydrophobicContact CD-CG 4.03Å; K293-E295 WeakPolarHBondContact CD-OE1 3.39Å; K293-E295 IonicContact NZ-OE1 2.79Å; K293-E295 PolarHBondContact NZ-OE1 3.24Å; K293-E295 PolarHBondContact O-N 3.04Å; E295-L297 VanDerWaalsContact C-N 3.32Å; E295-L297 PolarHBondContact O-N 3.14Å; E295-L298 PolarHBondContact O-N 3.38Å
296	D	87.8	Confident	90.9	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.011	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-30.7	178.4	-64.1	-42.3	0	0	0	112.5	R265 V292 K293 E294 L298 L299 Y301 L318	R265-D296 IonicContact CZ-OD1 3.18Å; R265-D296 IonicContact CZ-OD2 3.6Å; R265-D296 IonicContact NH1-OD1 3.35Å; R265-D296 IonicContact NH1-OD2 3.4Å; R265-D296 PolarHBondContact NH1-OD2 3.45Å; R265-D296 IonicContact NH2-OD1 2.74Å; R265-D296 PolarHBondContact NH2-OD1 3.48Å; R265-D296 IonicContact NH2-OD2 3.49Å; R265-D296 PolarHBondContact NH2-OD2 3.03Å; V292-D296 HydrophobicContact CG1-CB 4.39Å; K293-D296 PolarHBondContact N-OD2 3.43Å; K293-D296 WeakPolarHBondContact O-CB 3.43Å; K293-D296 PolarHBondContact O-N 3.42Å; K293-D296 VanDerWaalsContact O-N 3.11Å; E294-D296 PolarHBondContact O-N 3.45Å; D296-L298 PolarHBondContact O-N 3.43Å; D296-L299 PolarHBondContact O-N 3.5Å; D296-Y301 WeakPolarHBondContact CB-OH 2.99Å; D296-Y301 WeakPolarHBondContact O-CE2 3.37Å; D296-Y301 PolarHBondContact O-OH 3.06Å; D296-L318 HydrophobicContact CB-CD1 4.45Å
297	L	90.3	Very high	91	Very high	31 Å²	31	40.7 Å²	40.7	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-25.5	177.3	-64.9	170.8	0	0	0	112.5	V225 I227 E294 E295 L318 R320	V225-L297 HydrophobicContact CG2-CD2 3.81Å; I227-L297 HydrophobicContact CD1-CD1 3.96Å; I227-L297 HydrophobicContact CD1-CG 4.44Å; E294-L297 WeakPolarHBondContact O-CB 3.48Å; E294-L297 PolarHBondContact O-N 3.36Å; E295-L297 VanDerWaalsContact C-N 3.32Å; E295-L297 PolarHBondContact O-N 3.14Å; L297-L318 HydrophobicContact CD2-CB 3.82Å; L297-R320 HydrophobicContact CD1-CB 4.26Å
298	L	88.9	Confident	90.9	Very high	156 Å²	156	46.7 Å²	46.7	82%	0.817	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-15.1	179.1	-58.9	176.1	0	0	0	112.4	E295 D296	E295-L298 PolarHBondContact O-N 3.38Å; D296-L298 PolarHBondContact O-N 3.43Å
299	L	88.8	Confident	90.9	Very high	53 Å²	53	47.8 Å²	47.8	28%	0.277	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-77.8	147.2	-177.3	-62.7	179.7	0	0	0	111.8	D296 Y301	D296-L299 PolarHBondContact O-N 3.5Å; L299-Y301 HydrophobicContact CB-CD2 4.49Å; L299-Y301 HydrophobicContact CB-CE2 3.8Å
300	R	90.2	Very high	91	Very high	88 Å²	88	49 Å²	49	33%	0.332	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-98.8	120.1	170.7	-167.4	-179	85	-156.2	-3	109.6	N254 D302 T315	N254-R300 PolarHBondContact N-O 3.31Å; R300-D302 IonicContact CZ-OD2 3.33Å; R300-D302 VanDerWaalsContact CZ-OD2 3.27Å; R300-D302 IonicContact NE-OD1 3.54Å; R300-D302 PolarHBondContact NE-OD1 3.02Å; R300-D302 IonicContact NE-OD2 2.75Å; R300-D302 PolarHBondContact NE-OD2 3.01Å; R300-D302 IonicContact NH2-OD2 2.89Å; R300-D302 PolarHBondContact NH2-OD2 2.94Å; R300-T315 HydrophobicContact CG-CG2 3.41Å; R300-T315 VanDerWaalsContact CG-CG2 3.41Å
301	Y	92.1	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.4	178.7	-59.2	-95	0	0	0	108.9	L233 L253 L287 I289 D296 L299 T315 I316 L318	L233-Y301 HydrophobicContact CD1-CD1 3.87Å; L233-Y301 HydrophobicContact CD1-CE1 4.35Å; L233-Y301 HydrophobicContact CD1-CG 3.97Å; L253-Y301 HydrophobicContact CD2-CD1 3.28Å; L253-Y301 HydrophobicContact CD2-CE1 3.26Å; L253-Y301 HydrophobicContact CD2-CG 4.25Å; L287-Y301 HydrophobicContact CD2-CD1 3.67Å; L287-Y301 HydrophobicContact CD2-CE1 4.01Å; I289-Y301 HydrophobicContact CD1-CD1 4.45Å; I289-Y301 HydrophobicContact CD1-CE1 3.61Å; D296-Y301 WeakPolarHBondContact CB-OH 2.99Å; D296-Y301 WeakPolarHBondContact O-CE2 3.37Å; D296-Y301 PolarHBondContact O-OH 3.06Å; L299-Y301 HydrophobicContact CB-CD2 4.49Å; L299-Y301 HydrophobicContact CB-CE2 3.8Å; Y301-T315 WeakPolarHBondContact O-CA 3.38Å; Y301-I316 VanDerWaalsContact CB-CG2 3.44Å; Y301-I316 HydrophobicContact CG-CG2 4.39Å; Y301-I316 PolarHBondContact N-O 3.04Å; Y301-I316 PolarHBondContact O-N 3.15Å; Y301-L318 HydrophobicContact CD2-CD1 4.44Å; Y301-L318 HydrophobicContact CD2-CG 4.15Å; Y301-L318 HydrophobicContact CE2-CD1 3.58Å; Y301-L318 HydrophobicContact CE2-CG 3.67Å
302	D	93.9	Very high	91.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.9	-179	-69.3	-40.9	0	0	0	109.7	Q252 R300 R313 T315	Q252-D302 HydrophobicContact CB-CB 4.12Å; Q252-D302 PolarHBondContact N-O 3.17Å; Q252-D302 PolarHBondContact O-N 3.48Å; R300-D302 IonicContact CZ-OD2 3.33Å; R300-D302 VanDerWaalsContact CZ-OD2 3.27Å; R300-D302 IonicContact NE-OD1 3.54Å; R300-D302 PolarHBondContact NE-OD1 3.02Å; R300-D302 IonicContact NE-OD2 2.75Å; R300-D302 PolarHBondContact NE-OD2 3.01Å; R300-D302 IonicContact NH2-OD2 2.89Å; R300-D302 PolarHBondContact NH2-OD2 2.94Å; D302-R313 HydrophobicContact CB-CG 4.2Å; D302-T315 WeakPolarHBondContact OD1-CB 3.49Å; D302-T315 WeakPolarHBondContact OD1-CG2 3.4Å; D302-T315 PolarHBondContact OD1-OG1 3.43Å
303	C	94.8	Very high	91.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.1	170	159.9	0	0	0	0	108.4	I214 P217 C235 W251 R313 H314	I214-C303 WeakPolarHBondContact CD1-O 3.28Å; P217-C303 HydrophobicContact CG-CB 4.21Å; C235-C303 HydrophobicContact CB-CB 3.75Å; C235-C303 WeakPolarHBondContact CB-SG 3.43Å; C235-C303 WeakPolarHBondContact SG-CB 3.32Å; C235-C303 CovalentContact SG-SG 2.01Å; C235-C303 PolarHBondContact SG-SG 3.32Å; W251-C303 HydrophobicContact CE3-CB 4.2Å; W251-C303 HydrophobicContact CH2-CB 3.98Å; W251-C303 HydrophobicContact CZ2-CB 4.43Å; W251-C303 HydrophobicContact CZ3-CB 3.84Å; C303-R313 WeakPolarHBondContact O-CA 3.47Å; C303-H314 PolarHBondContact N-O 3.45Å; C303-H314 PolarHBondContact O-N 3.45Å
304	L	94.8	Very high	92	Very high	6 Å²	6	56.1 Å²	56.1	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.2	-177.9	-60.7	-177.5	0	0	0	110.8	V249 Q250 Q252 L311 R312 R313	V249-L304 VanDerWaalsContact CA-O 3.3Å; V249-L304 WeakPolarHBondContact CA-O 3.32Å; Q250-L304 HydrophobicContact CG-CB 3.92Å; Q250-L304 HydrophobicContact CG-CD1 4.19Å; Q250-L304 PolarHBondContact N-O 3.06Å; Q250-L304 PolarHBondContact O-N 3.44Å; Q252-L304 HydrophobicContact CB-CD1 3.98Å; Q252-L304 HydrophobicContact CB-CG 4.32Å; L304-L311 HydrophobicContact CB-CD1 4.11Å; L304-L311 HydrophobicContact CD2-CD1 4.43Å; L304-R312 WeakPolarHBondContact CA-O 3.26Å; L304-R313 HydrophobicContact CD2-CB 3.72Å; L304-R313 HydrophobicContact CD2-CG 3.67Å
305	A	95.2	Very high	92.3	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.4	172.3	0	0	0	0	0	110	P212 I214 A237 F239 A248 V249 L311 R312	P212-A305 HydrophobicContact CB-CB 3.72Å; I214-A305 HydrophobicContact CD1-CB 4.22Å; I214-A305 HydrophobicContact CG1-CB 3.76Å; A237-A305 HydrophobicContact CB-CB 3.37Å; F239-A305 HydrophobicContact CE1-CB 4.27Å; F239-A305 HydrophobicContact CZ-CB 4.06Å; A248-A305 WeakPolarHBondContact O-CA 3.38Å; V249-A305 HydrophobicContact CG2-CB 4.44Å; A305-L311 CarbonylContact O-C 3.59Å; A305-L311 WeakPolarHBondContact O-CA 3.11Å; A305-R312 PolarHBondContact N-O 3.47Å; A305-R312 PolarHBondContact O-N 3.39Å
306	L	94.6	Very high	92.6	Very high	43 Å²	43	48.6 Å²	48.6	23%	0.225	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143.5	-173.9	72.6	95.8	0	0	0	113.1	F239 L246 A248 G310 L311	F239-L306 VanDerWaalsContact CE1-O 3.26Å; F239-L306 WeakPolarHBondContact CE1-O 3.34Å; L246-L306 HydrophobicContact CD2-CD1 3.76Å; L246-L306 HydrophobicContact CG-CD1 4.2Å; A248-L306 HydrophobicContact CB-CD1 4.07Å; A248-L306 HydrophobicContact CB-CD2 4.19Å; A248-L306 HydrophobicContact CB-CG 3.92Å; A248-L306 PolarHBondContact N-O 3.38Å; A248-L306 PolarHBondContact O-N 2.96Å; L306-G310 WeakPolarHBondContact CA-O 3.18Å; L306-L311 HydrophobicContact CB-CD1 3.75Å
307	N	93.1	Very high	92.8	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.053	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	-169.8	167.9	70.9	-4.2	0	0	0	110.7	S209 L210 P212 F239 L246 H309 G310	S209-N307 PolarHBondContact OG-ND2 3.49Å; L210-N307 PolarHBondContact O-ND2 3.03Å; P212-N307 VanDerWaalsContact CD-OD1 3.23Å; P212-N307 WeakPolarHBondContact CD-OD1 3.33Å; P212-N307 HydrophobicContact CG-CB 4.18Å; P212-N307 WeakPolarHBondContact CG-OD1 3.09Å; F239-N307 HydrophobicContact CD1-CB 3.92Å; F239-N307 HydrophobicContact CE1-CB 4.36Å; L246-N307 WeakPolarHBondContact O-CA 3.46Å; L246-N307 WeakPolarHBondContact O-CB 3.42Å; N307-H309 PolarHBondContact O-N 2.92Å; N307-H309 WeakPolarHBondContact OD1-CA 3.23Å; N307-H309 VanDerWaalsContact OD1-CB 3.32Å; N307-H309 WeakPolarHBondContact OD1-CB 3.14Å; N307-H309 PolarHBondContact OD1-N 3.29Å; N307-G310 PolarHBondContact N-O 3.42Å; N307-G310 PolarHBondContact O-N 3.38Å; N307-G310 PolarHBondContact OD1-N 2.91Å; N307-G310 VanDerWaalsContact OD1-N 3.1Å; N307-G310 PolarHBondContact OD1-O 3.07Å
308	L	89.4	Confident	92.9	Very high	127 Å²	127	54.7 Å²	54.7	67%	0.665	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.8	177.3	-66.7	178	0	0	0	114.1	F245 L246	F245-L308 HydrophobicContact CD1-CD1 3.97Å; F245-L308 HydrophobicContact CD1-CD2 4.5Å; F245-L308 HydrophobicContact CD1-CG 4.48Å; L246-L308 HydrophobicContact CB-CD2 4.36Å; L246-L308 HydrophobicContact CB-CG 4.17Å; L246-L308 HydrophobicContact CD2-CD2 4.21Å
309	H	90.9	Very high	93	Very high	112 Å²	112	49 Å²	49	52%	0.519	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-27	177.3	-68	-83.8	0	0	0	112.7	F211 N307	F211-H309 HydrophobicContact CB-CB 4.5Å; F211-H309 HydrophobicContact CD2-CB 3.96Å; F211-H309 WeakPolarHBondContact CE2-O 3.4Å; N307-H309 PolarHBondContact O-N 2.92Å; N307-H309 WeakPolarHBondContact OD1-CA 3.23Å; N307-H309 VanDerWaalsContact OD1-CB 3.32Å; N307-H309 WeakPolarHBondContact OD1-CB 3.14Å; N307-H309 PolarHBondContact OD1-N 3.29Å
310	G	92.4	Very high	93	Very high	25 Å²	25	52.8 Å²	52.8	26%	0.258	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	154.3	-157.8	174.1	0	0	0	0	0	114.4	L306 N307	L306-G310 WeakPolarHBondContact CA-O 3.18Å; N307-G310 PolarHBondContact N-O 3.42Å; N307-G310 PolarHBondContact O-N 3.38Å; N307-G310 PolarHBondContact OD1-N 2.91Å; N307-G310 VanDerWaalsContact OD1-N 3.1Å; N307-G310 PolarHBondContact OD1-O 3.07Å
311	L	94.5	Very high	92.6	Very high	86 Å²	86	53 Å²	53	45%	0.45	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.6	-174.1	178.7	73.6	0	0	0	110.3	L304 A305 L306	L304-L311 HydrophobicContact CB-CD1 4.11Å; L304-L311 HydrophobicContact CD2-CD1 4.43Å; A305-L311 CarbonylContact O-C 3.59Å; A305-L311 WeakPolarHBondContact O-CA 3.11Å; L306-L311 HydrophobicContact CB-CD1 3.75Å
312	R	95.1	Very high	91.7	Very high	123 Å²	123	58.7 Å²	58.7	46%	0.464	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.6	169.7	-162.9	72.7	-176.7	-175.8	-0.9	109.9	F211 P212 I214 L304 A305	F211-R312 HydrophobicContact CE1-CB 4.16Å; P212-R312 HydrophobicContact CB-CB 4.28Å; P212-R312 WeakPolarHBondContact O-CB 3.38Å; I214-R312 HydrophobicContact CD1-CB 4.07Å; I214-R312 HydrophobicContact CD1-CG 3.93Å; I214-R312 HydrophobicContact CG1-CB 4.32Å; I214-R312 HydrophobicContact CG1-CG 4.18Å; L304-R312 WeakPolarHBondContact CA-O 3.26Å; A305-R312 PolarHBondContact N-O 3.47Å; A305-R312 PolarHBondContact O-N 3.39Å
313	R	94.9	Very high	90.2	Very high	112 Å²	112	64.1 Å²	64.1	42%	0.423	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.3	179.8	178.8	-179.3	-57.5	163.8	1.5	111.1	D302 C303 L304	D302-R313 HydrophobicContact CB-CG 4.2Å; C303-R313 WeakPolarHBondContact O-CA 3.47Å; L304-R313 HydrophobicContact CD2-CB 3.72Å; L304-R313 HydrophobicContact CD2-CG 3.67Å
314	H	95.4	Very high	88.3	Confident	20 Å²	20	71.4 Å²	71.4	9%	0.093	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.7	164.9	-75.4	-169.4	0	0	0	109.3	I214 P217 H219 C303	I214-H314 HydrophobicContact CD1-CB 4.01Å; I214-H314 HydrophobicContact CG2-CB 4.14Å; I214-H314 WeakPolarHBondContact CG2-ND1 3.34Å; P217-H314 HydrophobicContact CG-CB 4.34Å; P217-H314 PolarHBondContact O-ND1 2.85Å; H219-H314 AromaticContact ND1-CD2 3.75Å; C303-H314 PolarHBondContact N-O 3.45Å; C303-H314 PolarHBondContact O-N 3.45Å
315	T	93.8	Very high	86.3	Confident	21 Å²	21	75.4 Å²	75.4	13%	0.129	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.2	179.3	-59.7	0	0	0	0	109.4	N220 E221 R300 Y301 D302	N220-T315 WeakPolarHBondContact CA-O 3.3Å; N220-T315 PolarHBondContact N-O 3.01Å; N220-T315 VanDerWaalsContact N-O 3.15Å; E221-T315 PolarHBondContact N-O 2.83Å; R300-T315 HydrophobicContact CG-CG2 3.41Å; R300-T315 VanDerWaalsContact CG-CG2 3.41Å; Y301-T315 WeakPolarHBondContact O-CA 3.38Å; D302-T315 WeakPolarHBondContact OD1-CB 3.49Å; D302-T315 WeakPolarHBondContact OD1-CG2 3.4Å; D302-T315 PolarHBondContact OD1-OG1 3.43Å
316	I	93.9	Very high	84.6	Confident	5 Å²	5	81.6 Å²	81.6	3%	0.026	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.4	172.1	-171.4	172.4	0	0	0	109.6	P217 E221 K223 L233 W251 Y301	P217-I316 HydrophobicContact CB-CB 4.43Å; P217-I316 HydrophobicContact CB-CD1 4.08Å; P217-I316 HydrophobicContact CG-CB 4.22Å; E221-I316 HydrophobicContact CB-CG1 4.42Å; E221-I316 WeakPolarHBondContact O-CA 3.4Å; K223-I316 HydrophobicContact CB-CD1 3.94Å; K223-I316 HydrophobicContact CB-CG1 4.38Å; K223-I316 HydrophobicContact CD-CD1 4.48Å; L233-I316 HydrophobicContact CD1-CG2 4.19Å; L233-I316 HydrophobicContact CD2-CD1 4.24Å; W251-I316 HydrophobicContact CH2-CG2 3.84Å; W251-I316 HydrophobicContact CZ3-CG2 3.65Å; Y301-I316 VanDerWaalsContact CB-CG2 3.44Å; Y301-I316 HydrophobicContact CG-CG2 4.39Å; Y301-I316 PolarHBondContact N-O 3.04Å; Y301-I316 PolarHBondContact O-N 3.15Å
317	R	92.7	Very high	82.9	Confident	154 Å²	154	86.1 Å²	86.1	58%	0.581	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.1	172.7	-71.7	-176.8	175.2	138.2	-2.7	109.9	E221 T222 K223	E221-R317 PolarHBondContact O-N 3.22Å; T222-R317 CarbonylContact C-O 3.57Å; T222-R317 VanDerWaalsContact CA-O 3.28Å; T222-R317 WeakPolarHBondContact CA-O 3.46Å; T222-R317 HydrophobicContact CG2-CB 4.41Å; K223-R317 PolarHBondContact N-O 2.94Å
318	L	92.5	Very high	81.4	Confident	8 Å²	8	88.5 Å²	88.5	4%	0.042	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138	174.2	-56	-177.6	0	0	0	108.9	K223 V225 L233 I289 D296 L297 Y301	K223-L318 HydrophobicContact CB-CD2 4.22Å; K223-L318 WeakPolarHBondContact O-CA 3.44Å; V225-L318 HydrophobicContact CG1-CD2 4.03Å; V225-L318 HydrophobicContact CG2-CB 4Å; V225-L318 HydrophobicContact CG2-CD1 4.49Å; L233-L318 HydrophobicContact CD1-CD2 4.26Å; L233-L318 HydrophobicContact CD2-CD2 3.88Å; I289-L318 HydrophobicContact CD1-CD1 4.06Å; D296-L318 HydrophobicContact CB-CD1 4.45Å; L297-L318 HydrophobicContact CD2-CB 3.82Å; Y301-L318 HydrophobicContact CD2-CD1 4.44Å; Y301-L318 HydrophobicContact CD2-CG 4.15Å; Y301-L318 HydrophobicContact CE2-CD1 3.58Å; Y301-L318 HydrophobicContact CE2-CG 3.67Å
319	S	90.1	Very high	80.4	Confident	36 Å²	36	85.7 Å²	85.7	25%	0.252	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.9	171.7	57.3	0	0	0	0	109.6	T222 K223 E224 V225 K321	T222-S319 WeakPolarHBondContact CG2-OG 3.45Å; K223-S319 PolarHBondContact O-N 3.33Å; E224-S319 CarbonylContact C-O 3.5Å; E224-S319 VanDerWaalsContact CA-O 3.29Å; E224-S319 WeakPolarHBondContact CA-O 3.48Å; E224-S319 WeakPolarHBondContact CG-OG 3.34Å; V225-S319 PolarHBondContact N-O 2.88Å; S319-K321 PolarHBondContact O-N 2.88Å
320	R	88.8	Confident	79.8	Confident	132 Å²	132	87.3 Å²	87.3	50%	0.498	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	125.7	172.4	-172.6	-174.3	-70.7	171.8	0.9	108.4	E294 L297 N322	E294-R320 IonicContact OE1-CZ 3.86Å; E294-R320 IonicContact OE1-NE 3.9Å; E294-R320 PolarHBondContact OE1-NE 2.62Å; E294-R320 IonicContact OE1-NH2 2.71Å; E294-R320 PolarHBondContact OE1-NH2 2.9Å; E294-R320 IonicContact OE2-NH2 3.01Å; E294-R320 PolarHBondContact OE2-NH2 3.35Å; L297-R320 HydrophobicContact CD1-CB 4.26Å; R320-N322 PolarHBondContact O-N 3.31Å; R320-N322 VanDerWaalsContact O-N 3.09Å
321	K	82.9	Confident	79.1	Confident	94 Å²	94	89.6 Å²	89.6	41%	0.409	44%	0.436	S	S	.	.			trans	-65.3	109.6	168.7	-172.5	176.7	172.2	-165.3	0	107.2	E224 V225 E226 S319	E224-K321 HydrophobicContact CB-CB 4.13Å; E224-K321 HydrophobicContact CB-CG 4.4Å; V225-K321 PolarHBondContact O-N 3.09Å; E226-K321 HydrophobicContact CG-CB 4.06Å; E226-K321 HydrophobicContact CG-CD 3.76Å; E226-K321 HydrophobicContact CG-CG 4.49Å; E226-K321 WeakPolarHBondContact OE1-CD 3.25Å; E226-K321 WeakPolarHBondContact OE1-CE 2.89Å; E226-K321 IonicContact OE1-NZ 3.32Å; E226-K321 PolarHBondContact OE1-NZ 3.21Å; S319-K321 PolarHBondContact O-N 2.88Å
322	N	71.4	Confident	78.4	Confident	119 Å²	119	90.5 Å²	90.5	64%	0.636	44%	0.44	S	S	*	.			trans	-68.5	127.5	173	-74.7	-29.7	0	0	0	107	R320 I324	R320-N322 PolarHBondContact O-N 3.31Å; R320-N322 VanDerWaalsContact O-N 3.09Å; N322-I324 PolarHBondContact O-N 3.27Å
323	P	63.1	Low	77.8	Confident	114 Å²	114	89.6 Å²	89.6	74%	0.74	44%	0.443	S	S	*	.			trans	-57.7	115.9	166.9	25.3	-30.4	0	0	0	105.3	D325	P323-D325 VanDerWaalsContact C-N 3.33Å; P323-D325 PolarHBondContact O-N 2.62Å
324	I	55.6	Low	77.3	Confident	152 Å²	152	86.7 Å²	86.7	78%	0.779	44%	0.443	S	S	*	.			trans	-55.5	110.6	171	-67.4	171.1	0	0	0	104.6	N322 H326	N322-I324 PolarHBondContact O-N 3.27Å; I324-H326 PolarHBondContact O-N 3.22Å
325	D	52.8	Low	76.9	Confident	90 Å²	90	90.5 Å²	90.5	48%	0.481	47%	0.468	S	S	.	.			trans	-55.7	102.7	-168.3	-176.5	25.9	0	0	0	108.4	P323 Q327 S328 T329	P323-D325 VanDerWaalsContact C-N 3.33Å; P323-D325 PolarHBondContact O-N 2.62Å; D325-Q327 PolarHBondContact O-N 3.18Å; D325-Q327 WeakPolarHBondContact OD1-CB 3.12Å; D325-Q327 PolarHBondContact OD1-N 2.74Å; D325-S328 WeakPolarHBondContact O-CB 3.05Å; D325-S328 PolarHBondContact O-N 3.29Å; D325-S328 PolarHBondContact OD2-N 3.37Å; D325-T329 PolarHBondContact O-N 2.8Å
326	H	58.2	Low	76.5	Confident	130 Å²	130	92.8 Å²	92.8	60%	0.602	48%	0.484	S	S	*	.	H	α-helix	trans	-53.1	-28.9	178.2	-139.5	43.2	0	0	0	109.2	I324 T329 Y330	I324-H326 PolarHBondContact O-N 3.22Å; H326-T329 PolarHBondContact O-N 2.82Å; H326-Y330 HydrophobicContact CB-CE2 4.46Å; H326-Y330 AromaticContact CD2-CE2 3.4Å; H326-Y330 WeakPolarHBondContact CD2-CE2 3.22Å; H326-Y330 AromaticContact CG-CE2 3.88Å; H326-Y330 AromaticContact NE2-CE2 3.77Å; H326-Y330 WeakPolarHBondContact O-CD2 3.47Å; H326-Y330 PolarHBondContact O-N 2.82Å; H326-Y330 VanDerWaalsContact O-N 3.07Å
327	Q	59.5	Low	76.2	Confident	139 Å²	139	95.4 Å²	95.4	65%	0.65	50%	0.502	S	S	*	.	H	α-helix	trans	-62.4	-39.5	174	-157.8	130.8	-3.9	0	0	113.8	D325 Y330 C331	D325-Q327 PolarHBondContact O-N 3.18Å; D325-Q327 WeakPolarHBondContact OD1-CB 3.12Å; D325-Q327 PolarHBondContact OD1-N 2.74Å; Q327-Y330 PolarHBondContact O-N 2.98Å; Q327-C331 WeakPolarHBondContact O-CB 3.49Å; Q327-C331 PolarHBondContact O-N 2.85Å; Q327-C331 PolarHBondContact O-SG 2.93Å
328	S	61.3	Low	76.1	Confident	60 Å²	60	92.2 Å²	92.2	42%	0.42	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-40.9	176.6	-175.5	0	0	0	0	111.8	D325 C331 I332	D325-S328 WeakPolarHBondContact O-CB 3.05Å; D325-S328 PolarHBondContact O-N 3.29Å; D325-S328 PolarHBondContact OD2-N 3.37Å; S328-C331 PolarHBondContact O-N 2.84Å; S328-I332 WeakPolarHBondContact O-CG1 3.32Å; S328-I332 PolarHBondContact O-N 2.69Å
329	T	69.6	Low	76.1	Confident	67 Å²	67	96.9 Å²	96.9	41%	0.411	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-40.6	176.9	-41.2	0	0	0	0	111.7	D325 H326 I332 I333	D325-T329 PolarHBondContact O-N 2.8Å; H326-T329 PolarHBondContact O-N 2.82Å; T329-I332 PolarHBondContact O-N 2.79Å; T329-I333 HydrophobicContact CG2-CD1 4.34Å; T329-I333 VanDerWaalsContact O-CG1 3.31Å; T329-I333 WeakPolarHBondContact O-CG1 3.32Å; T329-I333 PolarHBondContact O-N 3.04Å; T329-I333 VanDerWaalsContact O-N 3.14Å
330	Y	77.5	Confident	76	Confident	146 Å²	146	100.1 Å²	100.1	57%	0.573	54%	0.538	S	S	*	.	H	α-helix	trans	-66.6	-37.9	174.3	-77.3	-66.1	0	0	0	112.8	H326 Q327 I333 A334	H326-Y330 HydrophobicContact CB-CE2 4.46Å; H326-Y330 AromaticContact CD2-CE2 3.4Å; H326-Y330 WeakPolarHBondContact CD2-CE2 3.22Å; H326-Y330 AromaticContact CG-CE2 3.88Å; H326-Y330 AromaticContact NE2-CE2 3.77Å; H326-Y330 WeakPolarHBondContact O-CD2 3.47Å; H326-Y330 PolarHBondContact O-N 2.82Å; H326-Y330 VanDerWaalsContact O-N 3.07Å; Q327-Y330 PolarHBondContact O-N 2.98Å; Y330-I333 PolarHBondContact O-N 2.88Å; Y330-A334 WeakPolarHBondContact O-CB 3.47Å; Y330-A334 PolarHBondContact O-N 3.18Å
331	C	77.6	Confident	76.1	Confident	73 Å²	73	99.5 Å²	99.5	49%	0.493	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-42.3	175.4	-77.3	0	0	0	0	111.9	Q327 S328 A334 V335	Q327-C331 WeakPolarHBondContact O-CB 3.49Å; Q327-C331 PolarHBondContact O-N 2.85Å; Q327-C331 PolarHBondContact O-SG 2.93Å; S328-C331 PolarHBondContact O-N 2.84Å; C331-A334 PolarHBondContact O-N 3.31Å; C331-V335 VanDerWaalsContact O-CG2 3.27Å; C331-V335 WeakPolarHBondContact O-CG2 2.94Å; C331-V335 PolarHBondContact O-N 3.45Å
332	I	79.1	Confident	76.6	Confident	106 Å²	106	100 Å²	100	54%	0.544	55%	0.549	S	S	.	.	H	α-helix	trans	-64	-43.4	177.3	-66.7	167	0	0	0	110.8	S328 T329 A334 V335 C336	S328-I332 WeakPolarHBondContact O-CG1 3.32Å; S328-I332 PolarHBondContact O-N 2.69Å; T329-I332 PolarHBondContact O-N 2.79Å; I332-A334 PolarHBondContact O-N 2.84Å; I332-V335 PolarHBondContact O-N 3.25Å; I332-C336 WeakPolarHBondContact O-CB 3.11Å; I332-C336 PolarHBondContact O-N 2.88Å; I332-C336 PolarHBondContact O-SG 3.47Å; I332-C336 VanDerWaalsContact O-SG 3.36Å
333	I	82.3	Confident	77.5	Confident	104 Å²	104	98.5 Å²	98.5	53%	0.533	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-41.6	178.1	-66.2	166.6	0	0	0	111.2	T329 Y330 C336 S337	T329-I333 HydrophobicContact CG2-CD1 4.34Å; T329-I333 VanDerWaalsContact O-CG1 3.31Å; T329-I333 WeakPolarHBondContact O-CG1 3.32Å; T329-I333 PolarHBondContact O-N 3.04Å; T329-I333 VanDerWaalsContact O-N 3.14Å; Y330-I333 PolarHBondContact O-N 2.88Å; I333-C336 PolarHBondContact O-N 3.02Å; I333-S337 PolarHBondContact O-N 2.79Å; I333-S337 PolarHBondContact O-OG 3.19Å
334	A	84.6	Confident	78.5	Confident	50 Å²	50	97.5 Å²	97.5	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-39.8	178.2	0	0	0	0	0	112.7	Y330 C331 I332 S337 V338	Y330-A334 WeakPolarHBondContact O-CB 3.47Å; Y330-A334 PolarHBondContact O-N 3.18Å; C331-A334 PolarHBondContact O-N 3.31Å; I332-A334 PolarHBondContact O-N 2.84Å; A334-S337 PolarHBondContact O-OG 3.11Å; A334-V338 WeakPolarHBondContact O-CG2 3.38Å; A334-V338 PolarHBondContact O-N 3.22Å; A334-V338 VanDerWaalsContact O-N 3.17Å
335	V	87.7	Confident	80.1	Confident	101 Å²	101	94.1 Å²	94.1	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-67.4	-42.9	176.7	171.9	0	0	0	0	110.8	C331 I332 S337 V338 L339	C331-V335 VanDerWaalsContact O-CG2 3.27Å; C331-V335 WeakPolarHBondContact O-CG2 2.94Å; C331-V335 PolarHBondContact O-N 3.45Å; I332-V335 PolarHBondContact O-N 3.25Å; V335-S337 PolarHBondContact O-N 3.34Å; V335-V338 PolarHBondContact O-N 3.34Å; V335-L339 WeakPolarHBondContact O-CB 3.48Å; V335-L339 PolarHBondContact O-N 2.67Å
336	C	86	Confident	81.7	Confident	68 Å²	68	94.7 Å²	94.7	46%	0.459	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-39.8	177.1	-74.8	0	0	0	0	112.6	I332 I333 L339 L340	I332-C336 WeakPolarHBondContact O-CB 3.11Å; I332-C336 PolarHBondContact O-N 2.88Å; I332-C336 PolarHBondContact O-SG 3.47Å; I332-C336 VanDerWaalsContact O-SG 3.36Å; I333-C336 PolarHBondContact O-N 3.02Å; C336-L339 PolarHBondContact O-N 2.91Å; C336-L340 WeakPolarHBondContact O-CG 3.44Å; C336-L340 PolarHBondContact O-N 3.4Å
337	S	86.3	Confident	83	Confident	60 Å²	60	92 Å²	92	42%	0.42	51%	0.507	S	S	.	.	H	α-helix	trans	-68.4	-39.3	179.1	65.1	0	0	0	0	112.6	I333 A334 V335 L340 M341	I333-S337 PolarHBondContact O-N 2.79Å; I333-S337 PolarHBondContact O-OG 3.19Å; A334-S337 PolarHBondContact O-OG 3.11Å; V335-S337 PolarHBondContact O-N 3.34Å; S337-L340 PolarHBondContact O-N 3.23Å; S337-M341 WeakPolarHBondContact O-CG 3.33Å; S337-M341 PolarHBondContact O-N 3.25Å
338	V	91.4	Very high	84.3	Confident	87 Å²	87	90.3 Å²	90.3	53%	0.527	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-42.8	174.3	173.6	0	0	0	0	111.2	A334 V335 L340 M341 L342	A334-V338 WeakPolarHBondContact O-CG2 3.38Å; A334-V338 PolarHBondContact O-N 3.22Å; A334-V338 VanDerWaalsContact O-N 3.17Å; V335-V338 PolarHBondContact O-N 3.34Å; V338-L340 VanDerWaalsContact C-N 3.34Å; V338-L340 PolarHBondContact O-N 3.1Å; V338-M341 PolarHBondContact O-N 2.9Å; V338-L342 HydrophobicContact CG1-CD1 4.19Å; V338-L342 WeakPolarHBondContact O-CG 3.33Å; V338-L342 PolarHBondContact O-N 2.99Å
339	L	91.5	Very high	85.3	Confident	106 Å²	106	91.4 Å²	91.4	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-61.3	-43.6	177.9	-165.5	80.2	0	0	0	111.5	V335 C336 M341 L342 I343	V335-L339 WeakPolarHBondContact O-CB 3.48Å; V335-L339 PolarHBondContact O-N 2.67Å; C336-L339 PolarHBondContact O-N 2.91Å; L339-M341 VanDerWaalsContact C-N 3.35Å; L339-M341 PolarHBondContact O-N 3.47Å; L339-L342 PolarHBondContact O-N 2.81Å; L339-I343 HydrophobicContact CG-CD1 4.34Å; L339-I343 WeakPolarHBondContact O-CG1 3.43Å; L339-I343 PolarHBondContact O-N 2.96Å
340	L	89.8	Confident	85.9	Confident	104 Å²	104	92.7 Å²	92.7	55%	0.545	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-39.1	176.6	-72.4	170.8	0	0	0	112.1	C336 S337 V338 I343 N344	C336-L340 WeakPolarHBondContact O-CG 3.44Å; C336-L340 PolarHBondContact O-N 3.4Å; S337-L340 PolarHBondContact O-N 3.23Å; V338-L340 VanDerWaalsContact C-N 3.34Å; V338-L340 PolarHBondContact O-N 3.1Å; L340-I343 PolarHBondContact O-N 2.9Å; L340-N344 PolarHBondContact O-N 2.71Å; L340-N344 PolarHBondContact O-ND2 2.75Å
341	M	91	Very high	86	Confident	120 Å²	120	93.7 Å²	93.7	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-62.3	-43.8	174.3	-77.9	-66.7	-70.1	0	0	112	S337 V338 L339 I343 N344 I345	S337-M341 WeakPolarHBondContact O-CG 3.33Å; S337-M341 PolarHBondContact O-N 3.25Å; V338-M341 PolarHBondContact O-N 2.9Å; L339-M341 VanDerWaalsContact C-N 3.35Å; L339-M341 PolarHBondContact O-N 3.47Å; M341-I343 PolarHBondContact O-N 2.01Å; M341-N344 PolarHBondContact O-N 2.96Å; M341-I345 VanDerWaalsContact O-CG1 3.29Å; M341-I345 WeakPolarHBondContact O-CG1 3.16Å; M341-I345 PolarHBondContact O-N 2.87Å
342	L	91.7	Very high	86	Confident	104 Å²	104	94.7 Å²	94.7	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-40.9	177.5	-71.2	171	0	0	0	112.3	V338 L339 I345 L346	V338-L342 HydrophobicContact CG1-CD1 4.19Å; V338-L342 WeakPolarHBondContact O-CG 3.33Å; V338-L342 PolarHBondContact O-N 2.99Å; L339-L342 PolarHBondContact O-N 2.81Å; L342-I345 PolarHBondContact O-N 2.93Å; L342-L346 WeakPolarHBondContact O-CB 3.26Å; L342-L346 PolarHBondContact O-N 2.9Å
343	I	89.9	Confident	86	Confident	87 Å²	87	94.7 Å²	94.7	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-45	175.8	-67.6	165.4	0	0	0	110.5	L339 L340 M341 I345 L346 V347	L339-I343 HydrophobicContact CG-CD1 4.34Å; L339-I343 WeakPolarHBondContact O-CG1 3.43Å; L339-I343 PolarHBondContact O-N 2.96Å; L340-I343 PolarHBondContact O-N 2.9Å; M341-I343 PolarHBondContact O-N 2.01Å; I343-I345 PolarHBondContact O-N 2.74Å; I343-L346 PolarHBondContact O-N 2.85Å; I343-V347 WeakPolarHBondContact O-CG2 3.48Å; I343-V347 PolarHBondContact O-N 3.46Å
344	N	85.2	Confident	85.8	Confident	93 Å²	93	96.4 Å²	96.4	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-43.7	177.7	-80.2	-71.7	0	0	0	112	L340 M341 L346 V347 I348	L340-N344 PolarHBondContact O-N 2.71Å; L340-N344 PolarHBondContact O-ND2 2.75Å; M341-N344 PolarHBondContact O-N 2.96Å; N344-L346 VanDerWaalsContact C-N 3.32Å; N344-L346 PolarHBondContact O-N 2.84Å; N344-V347 PolarHBondContact O-N 3.32Å; N344-I348 VanDerWaalsContact O-CG1 3.25Å; N344-I348 WeakPolarHBondContact O-CG1 3.31Å; N344-I348 PolarHBondContact O-N 3.03Å
345	I	88.4	Confident	85.5	Confident	82 Å²	82	96.1 Å²	96.1	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-60.2	-43.7	175.7	-68.1	165.7	0	0	0	110.7	M341 L342 I343 V347 I348 I349	M341-I345 VanDerWaalsContact O-CG1 3.29Å; M341-I345 WeakPolarHBondContact O-CG1 3.16Å; M341-I345 PolarHBondContact O-N 2.87Å; L342-I345 PolarHBondContact O-N 2.93Å; I343-I345 PolarHBondContact O-N 2.74Å; I345-V347 PolarHBondContact O-N 3.5Å; I345-I348 PolarHBondContact O-N 2.87Å; I345-I349 HydrophobicContact CG2-CD1 3.75Å; I345-I349 HydrophobicContact CG2-CG1 4.39Å; I345-I349 VanDerWaalsContact O-CG1 3.29Å; I345-I349 WeakPolarHBondContact O-CG1 3.31Å; I345-I349 PolarHBondContact O-N 2.69Å
346	L	87.5	Confident	85.1	Confident	101 Å²	101	95.3 Å²	95.3	53%	0.529	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-43.4	177.3	-177.9	63.8	0	0	0	111.8	L342 I343 N344 I348 I349 L350	L342-L346 WeakPolarHBondContact O-CB 3.26Å; L342-L346 PolarHBondContact O-N 2.9Å; I343-L346 PolarHBondContact O-N 2.85Å; N344-L346 VanDerWaalsContact C-N 3.32Å; N344-L346 PolarHBondContact O-N 2.84Å; L346-I348 VanDerWaalsContact C-N 3.34Å; L346-I348 PolarHBondContact O-N 2.9Å; L346-I349 PolarHBondContact O-N 3.21Å; L346-L350 HydrophobicContact CD1-CD1 4.4Å; L346-L350 HydrophobicContact CD1-CG 4.45Å; L346-L350 HydrophobicContact CG-CD1 4.11Å; L346-L350 WeakPolarHBondContact O-CB 3.41Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.45Å; L346-L350 PolarHBondContact O-N 3.43Å
347	V	86.1	Confident	84.6	Confident	75 Å²	75	94.1 Å²	94.1	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-41.6	176.3	172.6	0	0	0	0	111.1	I343 N344 I345 L350 K351	I343-V347 WeakPolarHBondContact O-CG2 3.48Å; I343-V347 PolarHBondContact O-N 3.46Å; N344-V347 PolarHBondContact O-N 3.32Å; I345-V347 PolarHBondContact O-N 3.5Å; V347-L350 PolarHBondContact O-N 3.18Å; V347-K351 WeakPolarHBondContact O-CB 3.04Å; V347-K351 WeakPolarHBondContact O-CG 3.33Å; V347-K351 PolarHBondContact O-N 2.84Å
348	I	85.3	Confident	84	Confident	103 Å²	103	92.4 Å²	92.4	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-47.1	176.7	-67.8	163.4	0	0	0	110.4	N344 I345 L346 L350 K351 T352	N344-I348 VanDerWaalsContact O-CG1 3.25Å; N344-I348 WeakPolarHBondContact O-CG1 3.31Å; N344-I348 PolarHBondContact O-N 3.03Å; I345-I348 PolarHBondContact O-N 2.87Å; L346-I348 VanDerWaalsContact C-N 3.34Å; L346-I348 PolarHBondContact O-N 2.9Å; I348-L350 PolarHBondContact O-N 2.73Å; I348-K351 PolarHBondContact O-N 3.33Å; I348-T352 HydrophobicContact CG2-CG2 4.33Å; I348-T352 WeakPolarHBondContact O-CG2 3.43Å; I348-T352 PolarHBondContact O-N 3.49Å; I348-T352 PolarHBondContact O-OG1 3.43Å; I348-T352 VanDerWaalsContact O-OG1 3.09Å
349	I	83.5	Confident	83.3	Confident	83 Å²	83	88.9 Å²	88.9	43%	0.426	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-45.1	177.7	-68.4	167.6	0	0	0	110.9	I345 L346 K351 T352 F353	I345-I349 HydrophobicContact CG2-CD1 3.75Å; I345-I349 HydrophobicContact CG2-CG1 4.39Å; I345-I349 VanDerWaalsContact O-CG1 3.29Å; I345-I349 WeakPolarHBondContact O-CG1 3.31Å; I345-I349 PolarHBondContact O-N 2.69Å; L346-I349 PolarHBondContact O-N 3.21Å; I349-K351 VanDerWaalsContact C-N 3.27Å; I349-K351 PolarHBondContact O-N 2.77Å; I349-T352 PolarHBondContact O-N 2.74Å; I349-T352 PolarHBondContact O-OG1 3.32Å; I349-F353 HydrophobicContact CG2-CD2 4.11Å; I349-F353 PolarHBondContact O-N 2.92Å
350	L	80.8	Confident	82.6	Confident	94 Å²	94	88.8 Å²	88.8	49%	0.492	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-33.7	178.1	-73.8	171.6	0	0	0	112.2	L346 V347 I348 W354	L346-L350 HydrophobicContact CD1-CD1 4.4Å; L346-L350 HydrophobicContact CD1-CG 4.45Å; L346-L350 HydrophobicContact CG-CD1 4.11Å; L346-L350 WeakPolarHBondContact O-CB 3.41Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.45Å; L346-L350 PolarHBondContact O-N 3.43Å; V347-L350 PolarHBondContact O-N 3.18Å; I348-L350 PolarHBondContact O-N 2.73Å; L350-W354 WeakPolarHBondContact O-CA 3.15Å; L350-W354 VanDerWaalsContact O-CB 3.27Å; L350-W354 WeakPolarHBondContact O-CB 3.44Å; L350-W354 PolarHBondContact O-N 2.99Å
351	K	80.3	Confident	81.8	Confident	166 Å²	166	92.8 Å²	92.8	72%	0.722	46%	0.46	S	S	*	.	H	α-helix	trans	-74.2	-43.4	176	-78.1	-71	-173.9	177.8	0	112.7	V347 I348 I349	V347-K351 WeakPolarHBondContact O-CB 3.04Å; V347-K351 WeakPolarHBondContact O-CG 3.33Å; V347-K351 PolarHBondContact O-N 2.84Å; I348-K351 PolarHBondContact O-N 3.33Å; I349-K351 VanDerWaalsContact C-N 3.27Å; I349-K351 PolarHBondContact O-N 2.77Å
352	T	78.2	Confident	81	Confident	94 Å²	94	91 Å²	91	58%	0.577	45%	0.447	S	S	*	.	H	α-helix	trans	-70.9	-39.1	-178.2	52.3	0	0	0	0	112.3	I348 I349	I348-T352 HydrophobicContact CG2-CG2 4.33Å; I348-T352 WeakPolarHBondContact O-CG2 3.43Å; I348-T352 PolarHBondContact O-N 3.49Å; I348-T352 PolarHBondContact O-OG1 3.43Å; I348-T352 VanDerWaalsContact O-OG1 3.09Å; I349-T352 PolarHBondContact O-N 2.74Å; I349-T352 PolarHBondContact O-OG1 3.32Å
353	F	78.9	Confident	79.9	Confident	107 Å²	107	89.7 Å²	89.7	47%	0.469	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	17.5	-177.2	-65.7	-79.7	0	0	0	113.8	I349 I355 E356 A357	I349-F353 HydrophobicContact CG2-CD2 4.11Å; I349-F353 PolarHBondContact O-N 2.92Å; F353-I355 VanDerWaalsContact C-N 3.35Å; F353-I355 PolarHBondContact O-N 2.87Å; F353-E356 PolarHBondContact O-N 2.05Å; F353-A357 WeakPolarHBondContact O-CB 3.46Å; F353-A357 PolarHBondContact O-N 3.07Å
354	W	78.6	Confident	78.9	Confident	140 Å²	140	91 Å²	91	53%	0.53	45%	0.447	S	S	.	.	H	α-helix	trans	-59.2	-40.2	-172.7	-164.4	57.6	0	0	0	113.9	L350 E356 T358 Y533	L350-W354 WeakPolarHBondContact O-CA 3.15Å; L350-W354 VanDerWaalsContact O-CB 3.27Å; L350-W354 WeakPolarHBondContact O-CB 3.44Å; L350-W354 PolarHBondContact O-N 2.99Å; W354-E356 VanDerWaalsContact C-N 3.34Å; W354-E356 PolarHBondContact O-N 2.65Å; W354-T358 HydrophobicContact CD2-CG2 4.3Å; W354-T358 HydrophobicContact CG-CG2 4.45Å; W354-T358 HydrophobicContact CZ2-CG2 4.38Å; W354-T358 WeakPolarHBondContact O-CB 3.28Å; W354-T358 VanDerWaalsContact O-CG2 3.23Å; W354-T358 WeakPolarHBondContact O-CG2 3.31Å; W354-T358 PolarHBondContact O-N 2.82Å; W354-T358 PolarHBondContact O-OG1 2.79Å; W354-Y533 VanDerWaalsContact CH2-OH 3.29Å; W354-Y533 WeakPolarHBondContact CH2-OH 3.32Å; W354-Y533 HydrophobicContact CZ3-CE2 4.37Å; W354-Y533 AromaticContact CZ3-CZ 3.95Å; W354-Y533 WeakPolarHBondContact CZ3-OH 3.47Å
355	I	76.7	Confident	77.8	Confident	44 Å²	44	89.2 Å²	89.2	23%	0.226	45%	0.445	C	S	.	.	H	α-helix	trans	-64.1	-41.4	176.1	-61.6	175.5	0	0	0	110.4	F353 T358 L359 K529 Y533	F353-I355 VanDerWaalsContact C-N 3.35Å; F353-I355 PolarHBondContact O-N 2.87Å; I355-T358 WeakPolarHBondContact CA-OG1 3.39Å; I355-T358 PolarHBondContact O-OG1 2.85Å; I355-L359 HydrophobicContact CG2-CD1 3.94Å; I355-L359 HydrophobicContact CG2-CG 4.47Å; I355-L359 WeakPolarHBondContact O-CB 3.3Å; I355-L359 VanDerWaalsContact O-CG 3.22Å; I355-L359 WeakPolarHBondContact O-CG 3.45Å; I355-L359 PolarHBondContact O-N 2.85Å; I355-K529 HydrophobicContact CG2-CB 4.25Å; I355-Y533 HydrophobicContact CG2-CD2 4.49Å
356	E	79.9	Confident	76.5	Confident	84 Å²	84	92.6 Å²	92.6	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-70.7	-43.8	179.6	-58.3	-163.9	164.1	0	0	111.6	F353 W354 T358 L359 L360 K529	F353-E356 PolarHBondContact O-N 2.05Å; W354-E356 VanDerWaalsContact C-N 3.34Å; W354-E356 PolarHBondContact O-N 2.65Å; E356-T358 PolarHBondContact O-N 3.05Å; E356-L359 PolarHBondContact O-N 3.11Å; E356-L360 WeakPolarHBondContact O-CB 3.45Å; E356-L360 PolarHBondContact O-N 2.85Å; E356-K529 HydrophobicContact CG-CD 4.48Å; E356-K529 IonicContact OE1-NZ 2.91Å; E356-K529 PolarHBondContact OE1-NZ 3.2Å
357	A	74.8	Confident	75	Confident	42 Å²	42	90.9 Å²	90.9	35%	0.347	45%	0.452	S	S	.	.	H	α-helix	trans	-62.5	-41.1	176.9	0	0	0	0	0	111.9	F353 W361	F353-A357 WeakPolarHBondContact O-CB 3.46Å; F353-A357 PolarHBondContact O-N 3.07Å; A357-W361 VanDerWaalsContact O-CB 3.26Å; A357-W361 WeakPolarHBondContact O-CB 3.47Å; A357-W361 PolarHBondContact O-N 2.8Å
358	T	74.9	Confident	73.7	Confident	25 Å²	25	90.8 Å²	90.8	15%	0.153	44%	0.444	C	S	.	.	H	α-helix	trans	-70.4	-40.7	177.7	51.7	0	0	0	0	112.6	W354 I355 E356 W361 R362	W354-T358 HydrophobicContact CD2-CG2 4.3Å; W354-T358 HydrophobicContact CG-CG2 4.45Å; W354-T358 HydrophobicContact CZ2-CG2 4.38Å; W354-T358 WeakPolarHBondContact O-CB 3.28Å; W354-T358 VanDerWaalsContact O-CG2 3.23Å; W354-T358 WeakPolarHBondContact O-CG2 3.31Å; W354-T358 PolarHBondContact O-N 2.82Å; W354-T358 PolarHBondContact O-OG1 2.79Å; I355-T358 WeakPolarHBondContact CA-OG1 3.39Å; I355-T358 PolarHBondContact O-OG1 2.85Å; E356-T358 PolarHBondContact O-N 3.05Å; T358-W361 PolarHBondContact O-N 2.84Å; T358-R362 WeakPolarHBondContact O-CG 3.48Å; T358-R362 PolarHBondContact O-N 3.01Å
359	L	77.1	Confident	72.2	Confident	12 Å²	12	94.8 Å²	94.8	6%	0.063	46%	0.458	C	S	.	.	H	α-helix	trans	-65.3	-43.8	173.9	-71.4	173.8	0	0	0	111.5	I355 E356 W361 R362 D363 K529 R532	I355-L359 HydrophobicContact CG2-CD1 3.94Å; I355-L359 HydrophobicContact CG2-CG 4.47Å; I355-L359 WeakPolarHBondContact O-CB 3.3Å; I355-L359 VanDerWaalsContact O-CG 3.22Å; I355-L359 WeakPolarHBondContact O-CG 3.45Å; I355-L359 PolarHBondContact O-N 2.85Å; E356-L359 PolarHBondContact O-N 3.11Å; L359-W361 VanDerWaalsContact C-N 3.32Å; L359-W361 PolarHBondContact O-N 2.83Å; L359-R362 PolarHBondContact O-N 3.05Å; L359-D363 PolarHBondContact O-N 2.8Å; L359-K529 HydrophobicContact CD1-CB 4.09Å; L359-K529 HydrophobicContact CD1-CG 4.11Å; L359-R532 HydrophobicContact CD2-CB 3.95Å
360	L	76.9	Confident	70.8	Confident	104 Å²	104	96.5 Å²	96.5	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-61.4	-42.1	175.8	-174.7	70.6	0	0	0	111.1	E356 D363 I364	E356-L360 WeakPolarHBondContact O-CB 3.45Å; E356-L360 PolarHBondContact O-N 2.85Å; L360-D363 PolarHBondContact O-N 2.88Å; L360-I364 HydrophobicContact CD1-CD1 4.11Å; L360-I364 HydrophobicContact CD2-CD1 4.28Å; L360-I364 HydrophobicContact CG-CD1 3.74Å; L360-I364 HydrophobicContact CG-CG1 4.48Å; L360-I364 WeakPolarHBondContact O-CB 3.45Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.22Å; L360-I364 PolarHBondContact O-N 2.96Å
361	W	72	Confident	69.8	Low	189 Å²	189	100.5 Å²	100.5	72%	0.716	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-37.9	177.1	-167.4	38.9	0	0	0	112.3	A357 T358 L359 D363 I364 A365	A357-W361 VanDerWaalsContact O-CB 3.26Å; A357-W361 WeakPolarHBondContact O-CB 3.47Å; A357-W361 PolarHBondContact O-N 2.8Å; T358-W361 PolarHBondContact O-N 2.84Å; L359-W361 VanDerWaalsContact C-N 3.32Å; L359-W361 PolarHBondContact O-N 2.83Å; W361-D363 VanDerWaalsContact C-N 3.34Å; W361-D363 PolarHBondContact O-N 2.89Å; W361-I364 PolarHBondContact O-N 2.83Å; W361-A365 WeakPolarHBondContact O-CB 3.06Å; W361-A365 PolarHBondContact O-N 2.66Å
362	R	74.8	Confident	68.9	Low	83 Å²	83	100.5 Å²	100.5	31%	0.313	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-39	172.6	-74.5	179.7	-175.8	-179.8	6.7	112.4	T358 L359 Y533 M535	T358-R362 WeakPolarHBondContact O-CG 3.48Å; T358-R362 PolarHBondContact O-N 3.01Å; L359-R362 PolarHBondContact O-N 3.05Å; R362-Y533 PolarHBondContact NH1-O 3.49Å; R362-M535 PolarHBondContact NH1-O 3.04Å
363	D	69.3	Low	68.6	Low	75 Å²	75	98.5 Å²	98.5	40%	0.401	47%	0.474	S	S	.	.	H	α-helix	trans	-70.9	-34.2	177.9	-69.7	-19.3	0	0	0	111.7	L359 L360 W361 R532	L359-D363 PolarHBondContact O-N 2.8Å; L360-D363 PolarHBondContact O-N 2.88Å; W361-D363 VanDerWaalsContact C-N 3.34Å; W361-D363 PolarHBondContact O-N 2.89Å; D363-R532 IonicContact OD1-NH2 3.23Å; D363-R532 PolarHBondContact OD1-NH2 3.03Å; D363-R532 IonicContact OD2-NH2 3.75Å; D363-R532 PolarHBondContact OD2-NH2 2.97Å
364	I	67.5	Low	68.4	Low	115 Å²	115	96.7 Å²	96.7	59%	0.59	49%	0.486	S	S	*	.	H	α-helix	trans	-81.7	-41.5	179.8	-66	169.8	0	0	0	112.6	L360 W361 K366	L360-I364 HydrophobicContact CD1-CD1 4.11Å; L360-I364 HydrophobicContact CD2-CD1 4.28Å; L360-I364 HydrophobicContact CG-CD1 3.74Å; L360-I364 HydrophobicContact CG-CG1 4.48Å; L360-I364 WeakPolarHBondContact O-CB 3.45Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.22Å; L360-I364 PolarHBondContact O-N 2.96Å; W361-I364 PolarHBondContact O-N 2.83Å; I364-K366 PolarHBondContact O-N 2.87Å; I364-K366 VanDerWaalsContact O-N 3.08Å
365	A	61.8	Low	68.6	Low	55 Å²	55	92.2 Å²	92.2	46%	0.455	47%	0.47	S	S	.	.	S	Bend	trans	-74.5	3.2	-168.9	0	0	0	0	0	115.2	W361 P367	W361-A365 WeakPolarHBondContact O-CB 3.06Å; W361-A365 PolarHBondContact O-N 2.66Å; A365-P367 VanDerWaalsContact C-CD 3.46Å; A365-P367 WeakPolarHBondContact O-CD 3.48Å
366	K	62.3	Low	68.9	Low	153 Å²	153	95.3 Å²	95.3	67%	0.665	49%	0.486	S	S	*	.			trans	34.1	61.5	175.1	-75.2	-172.5	177.5	179.1	0	116.5	I364 Y368	I364-K366 PolarHBondContact O-N 2.87Å; I364-K366 VanDerWaalsContact O-N 3.08Å; K366-Y368 HydrophobicContact CG-CE2 4.48Å; K366-Y368 PolarHBondContact O-N 2.64Å
367	P	56.4	Low	69.3	Low	66 Å²	66	93.3 Å²	93.3	43%	0.429	48%	0.476	S	S	.	.			trans	-97.4	56	165.6	37.9	-26.3	0	0	0	110	A365 K369 V537	A365-P367 VanDerWaalsContact C-CD 3.46Å; A365-P367 WeakPolarHBondContact O-CD 3.48Å; P367-K369 PolarHBondContact O-N 2.83Å; P367-V537 HydrophobicContact CG-CG1 4.4Å
368	Y	57.8	Low	70	Confident	73 Å²	73	91.3 Å²	91.3	29%	0.286	46%	0.459	S	S	.	.			trans	-79.3	57.7	168.1	-59.2	-76	0	0	0	109.6	K366 M541	K366-Y368 HydrophobicContact CG-CE2 4.48Å; K366-Y368 PolarHBondContact O-N 2.64Å; Y368-M541 HydrophobicContact CD2-CE 4.09Å; Y368-M541 HydrophobicContact CD2-CG 4.3Å; Y368-M541 HydrophobicContact CE1-CG 4.29Å; Y368-M541 HydrophobicContact CE2-CE 3.9Å; Y368-M541 HydrophobicContact CE2-CG 4.01Å
369	K	53.4	Low	70.8	Confident	187 Å²	187	90.1 Å²	90.1	81%	0.813	45%	0.452	S	S	*	.			trans	-90.4	127.3	166.5	-87.4	-176.1	175.3	179.6	0	107.2	P367 R371	P367-K369 PolarHBondContact O-N 2.83Å; K369-R371 PolarHBondContact O-N 3.41Å
370	T	55.1	Low	71.5	Confident	118 Å²	118	89.6 Å²	89.6	72%	0.724	45%	0.449	S	S	*	.			trans	-53.7	108.7	165.5	38	0	0	0	0	108	N372	T370-N372 PolarHBondContact O-N 3.32Å; T370-N372 VanDerWaalsContact O-N 3.14Å
371	R	59.2	Low	72.2	Confident	179 Å²	179	84.6 Å²	84.6	68%	0.675	42%	0.423	S	S	*	.			trans	-70.8	108.3	176.8	-170.7	173.4	154.6	154.4	1	106.1	K369 D373	K369-R371 PolarHBondContact O-N 3.41Å; R371-D373 VanDerWaalsContact CD-OD2 3.3Å; R371-D373 WeakPolarHBondContact CD-OD2 3.07Å; R371-D373 HydrophobicContact CG-CB 4.07Å; R371-D373 IonicContact CZ-OD2 3.38Å; R371-D373 IonicContact NE-OD2 3.61Å; R371-D373 PolarHBondContact NE-OD2 3.49Å; R371-D373 PolarHBondContact O-N 3.04Å
372	N	60.6	Low	73	Confident	166 Å²	166	75.6 Å²	75.6	89%	0.888	39%	0.389	S	S	*	.			trans	-73.8	53.5	178.5	-102.8	4.9	0	0	0	110.8	T370	T370-N372 PolarHBondContact O-N 3.32Å; T370-N372 VanDerWaalsContact O-N 3.14Å
373	D	72.6	Confident	73.5	Confident	52 Å²	52	72 Å²	72	28%	0.278	38%	0.375	S	S	.	.	S	Bend	trans	-95.5	6.5	-179.4	60.6	3	0	0	0	113.3	R371 K375 R442	R371-D373 VanDerWaalsContact CD-OD2 3.3Å; R371-D373 WeakPolarHBondContact CD-OD2 3.07Å; R371-D373 HydrophobicContact CG-CB 4.07Å; R371-D373 IonicContact CZ-OD2 3.38Å; R371-D373 IonicContact NE-OD2 3.61Å; R371-D373 PolarHBondContact NE-OD2 3.49Å; R371-D373 PolarHBondContact O-N 3.04Å; D373-K375 PolarHBondContact O-N 3.26Å; D373-K375 VanDerWaalsContact O-N 3.09Å; D373-K375 PolarHBondContact OD1-N 2.92Å; D373-R442 IonicContact OD1-CZ 3.85Å; D373-R442 IonicContact OD1-NE 2.69Å; D373-R442 IonicContact OD1-NH2 3.6Å; D373-R442 PolarHBondContact OD1-NH2 3.19Å; D373-R442 IonicContact OD2-CZ 3.7Å; D373-R442 IonicContact OD2-NE 3.51Å; D373-R442 PolarHBondContact OD2-NE 2.53Å; D373-R442 IonicContact OD2-NH2 2.82Å
374	G	74.4	Confident	73.9	Confident	69 Å²	69	69.5 Å²	69.5	71%	0.711	36%	0.363	S	S	*	.	S	Bend	trans	68.3	1.8	-178.7	0	0	0	0	0	114.5
375	K	83.1	Confident	74.4	Confident	45 Å²	45	64.5 Å²	64.5	20%	0.196	34%	0.337	C	S	.	.			trans	-87.9	125	178.1	-67.7	-170	168.6	-161.7	0	110.3	D373 K440 S441 R442 D474 S475	D373-K375 PolarHBondContact O-N 3.26Å; D373-K375 VanDerWaalsContact O-N 3.09Å; D373-K375 PolarHBondContact OD1-N 2.92Å; K375-K440 CarbonylContact C-O 3.44Å; K375-K440 VanDerWaalsContact CA-O 3.31Å; K375-K440 WeakPolarHBondContact CA-O 3.21Å; K375-K440 VanDerWaalsContact CB-O 3.3Å; K375-K440 WeakPolarHBondContact CB-O 3.34Å; K375-S441 PolarHBondContact NZ-O 2.91Å; K375-R442 HydrophobicContact CB-CG 3.91Å; K375-R442 HydrophobicContact CD-CB 4.34Å; K375-R442 HydrophobicContact CD-CG 3.58Å; K375-R442 HydrophobicContact CG-CG 4.35Å; K375-R442 PolarHBondContact O-NH2 2.63Å; K375-D474 PolarHBondContact NZ-O 3.04Å; K375-S475 PolarHBondContact NZ-OG 3.14Å
376	L	84	Confident	74.6	Confident	109 Å²	109	64.6 Å²	64.6	57%	0.571	33%	0.33	S	S	*	.			trans	-85.6	-28.3	-177.2	-68.4	176.6	0	0	0	112.7	K440	L376-K440 HydrophobicContact CD1-CD 4.01Å; L376-K440 PolarHBondContact N-O 2.86Å
377	Y	88	Confident	74.4	Confident	43 Å²	43	65.4 Å²	65.4	17%	0.169	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-119	141.6	-173.6	-57.1	-80.5	0	0	0	111.8	C418 K440 S441 R442	Y377-C418 HydrophobicContact CD1-CB 3.61Å; Y377-C418 HydrophobicContact CD2-CB 3.77Å; Y377-C418 HydrophobicContact CE1-CB 3.84Å; Y377-C418 HydrophobicContact CE2-CB 4.01Å; Y377-C418 HydrophobicContact CG-CB 3.57Å; Y377-K440 HydrophobicContact CD2-CB 4.33Å; Y377-K440 PolarHBondContact N-O 2.91Å; Y377-K440 VanDerWaalsContact N-O 3.13Å; Y377-S441 WeakPolarHBondContact CB-OG 3.43Å; Y377-S441 WeakPolarHBondContact O-CA 2.88Å; Y377-R442 PolarHBondContact O-N 2.91Å
378	D	88.8	Confident	74.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-74.8	-32.2	174.5	-67.6	-51.3	0	0	0	111.7	Y415 T416 R442 R443 M535 P536 S539	D378-Y415 HydrophobicContact CB-CD1 3.95Å; D378-Y415 WeakPolarHBondContact OD2-CA 3.5Å; D378-T416 WeakPolarHBondContact CB-O 3.45Å; D378-T416 PolarHBondContact N-O 3.29Å; D378-T416 PolarHBondContact N-OG1 3.05Å; D378-T416 PolarHBondContact OD2-N 2.87Å; D378-T416 PolarHBondContact OD2-OG1 2.81Å; D378-R442 IonicContact OD1-CZ 3.63Å; D378-R442 IonicContact OD1-NH1 3.05Å; D378-R442 PolarHBondContact OD1-NH1 3.27Å; D378-R443 PolarHBondContact O-N 2.95Å; D378-M535 HydrophobicContact CB-CE 4.19Å; D378-P536 HydrophobicContact CB-CG 3.98Å; D378-S539 PolarHBondContact OD2-OG 2.81Å
379	A	91.9	Very high	74	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147.8	170	0	0	0	0	0	113.5	T416 L417 C418 R443 I445 M535	A379-T416 PolarHBondContact N-O 3.09Å; A379-L417 HydrophobicContact CB-CD2 3.82Å; A379-L417 CarbonylContact O-C 3.57Å; A379-L417 WeakPolarHBondContact O-CA 3.31Å; A379-C418 PolarHBondContact O-N 2.72Å; A379-R443 CarbonylContact C-O 3.43Å; A379-R443 WeakPolarHBondContact CA-O 3.17Å; A379-R443 HydrophobicContact CB-CB 3.92Å; A379-I445 HydrophobicContact CB-CD1 3.63Å; A379-I445 HydrophobicContact CB-CG1 3.96Å; A379-M535 HydrophobicContact CB-CE 4Å; A379-M535 HydrophobicContact CB-SD 4.06Å
380	Y	92	Very high	73.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136	166.2	-171.1	-95.2	0	0	0	109.3	I382 C418 N437 I438 S441 R443 H444 I445 E461	Y380-I382 HydrophobicContact CD1-CD1 4.2Å; Y380-I382 HydrophobicContact CD1-CG1 3.59Å; Y380-I382 HydrophobicContact CE1-CG1 3.7Å; Y380-C418 HydrophobicContact CD2-CB 3.72Å; Y380-C418 HydrophobicContact CE2-CB 4.37Å; Y380-N437 HydrophobicContact CD2-CB 4.1Å; Y380-N437 HydrophobicContact CE2-CB 3.91Å; Y380-I438 HydrophobicContact CD1-CD1 4.45Å; Y380-I438 HydrophobicContact CD1-CG1 3.73Å; Y380-I438 HydrophobicContact CD2-CG1 4.25Å; Y380-I438 HydrophobicContact CE1-CD1 4.23Å; Y380-I438 HydrophobicContact CE1-CG1 3.84Å; Y380-I438 HydrophobicContact CE2-CG1 4.35Å; Y380-I438 HydrophobicContact CG-CG1 3.98Å; Y380-S441 WeakPolarHBondContact CB-OG 3.43Å; Y380-R443 PolarHBondContact N-O 2.88Å; Y380-H444 WeakPolarHBondContact O-CA 3.4Å; Y380-I445 PolarHBondContact O-N 3.21Å; Y380-E461 VanDerWaalsContact CE1-OE2 3.31Å; Y380-E461 WeakPolarHBondContact CE1-OE2 3.21Å; Y380-E461 PolarHBondContact OH-OE2 3.27Å
381	V	91.6	Very high	74	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.4	-175.4	-173.8	0	0	0	0	111.1	Y383 V401 L405 L417 C418 I419 I445 I447	V381-Y383 HydrophobicContact CG1-CD1 4.45Å; V381-V401 HydrophobicContact CG1-CG1 4Å; V381-V401 HydrophobicContact CG1-CG2 4.39Å; V381-L405 HydrophobicContact CB-CD2 4.49Å; V381-L405 HydrophobicContact CG1-CD2 3.95Å; V381-L405 HydrophobicContact CG2-CD2 3.69Å; V381-L417 HydrophobicContact CG2-CB 4.45Å; V381-C418 PolarHBondContact N-O 2.04Å; V381-I419 HydrophobicContact CB-CG1 4.36Å; V381-I419 HydrophobicContact CG2-CG1 4.18Å; V381-I445 HydrophobicContact CG2-CB 4.49Å; V381-I445 HydrophobicContact CG2-CD1 4.38Å; V381-I447 HydrophobicContact CG1-CG1 4.34Å
382	I	88.6	Confident	73.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	119.8	-177.9	-56.2	161.6	0	0	0	107.4	Y380 H444 I445 F446 I447 F458 E461 A465	Y380-I382 HydrophobicContact CD1-CD1 4.2Å; Y380-I382 HydrophobicContact CD1-CG1 3.59Å; Y380-I382 HydrophobicContact CE1-CG1 3.7Å; I382-H444 HydrophobicContact CD1-CB 4.33Å; I382-I445 PolarHBondContact N-O 3.16Å; I382-F446 HydrophobicContact CB-CD1 4.11Å; I382-F446 HydrophobicContact CB-CE1 4.33Å; I382-F446 HydrophobicContact CB-CG 4.44Å; I382-F446 HydrophobicContact CD1-CD1 4.09Å; I382-F446 HydrophobicContact CD1-CD2 4.16Å; I382-F446 HydrophobicContact CD1-CE1 3.58Å; I382-F446 HydrophobicContact CD1-CE2 3.71Å; I382-F446 HydrophobicContact CD1-CG 4.38Å; I382-F446 HydrophobicContact CD1-CZ 3.41Å; I382-F446 VanDerWaalsContact CD1-CZ 3.41Å; I382-F446 HydrophobicContact CG2-CD1 3.97Å; I382-F446 HydrophobicContact CG2-CE1 4.06Å; I382-F446 WeakPolarHBondContact O-CA 3.46Å; I382-I447 PolarHBondContact O-N 2.81Å; I382-F458 HydrophobicContact CG2-CD2 4.19Å; I382-F458 HydrophobicContact CG2-CE2 3.66Å; I382-F458 HydrophobicContact CG2-CZ 4.46Å; I382-E461 HydrophobicContact CG2-CB 4.43Å; I382-A465 HydrophobicContact CD1-CB 3.21Å
383	Y	84.9	Confident	73.6	Confident	8 Å²	8	52 Å²	52	3%	0.031	30%	0.303	C	S	.	.			trans	-147.5	146.5	-176.8	71.6	-82.1	0	0	0	110.6	V381 R385 V397 E398 V401 H402 I419 F458	V381-Y383 HydrophobicContact CG1-CD1 4.45Å; Y383-R385 HydrophobicContact CD2-CG 4.07Å; Y383-R385 HydrophobicContact CE2-CG 3.52Å; Y383-R385 PolarHBondContact OH-NE 3.42Å; Y383-V397 HydrophobicContact CD2-CG1 4.08Å; Y383-E398 HydrophobicContact CE2-CG 4.35Å; Y383-V401 HydrophobicContact CD1-CB 4.48Å; Y383-V401 HydrophobicContact CD1-CG1 3.78Å; Y383-V401 HydrophobicContact CD1-CG2 4.2Å; Y383-V401 HydrophobicContact CD2-CG2 4.28Å; Y383-V401 HydrophobicContact CE1-CG1 3.8Å; Y383-V401 HydrophobicContact CG-CB 4.49Å; Y383-V401 HydrophobicContact CG-CG1 4.26Å; Y383-V401 HydrophobicContact CG-CG2 3.88Å; Y383-H402 AromaticContact CZ-NE2 3.76Å; Y383-H402 PolarHBondContact OH-NE2 2.85Å; Y383-I419 HydrophobicContact CE1-CG2 4.19Å; Y383-F458 VanDerWaalsContact C-CD2 3.41Å; Y383-F458 WeakPolarHBondContact O-CD2 3.27Å; Y383-F458 WeakPolarHBondContact O-CE2 3.28Å
384	P	78.6	Confident	72.9	Confident	22 Å²	22	50.6 Å²	50.6	14%	0.143	30%	0.299	C	S	.	.			trans	-68.6	134.6	-179	25.7	-32.1	0	0	0	110.6	I447 T449 F458	P384-I447 WeakPolarHBondContact CD-O 3.16Å; P384-T449 HydrophobicContact CG-CG2 4.22Å; P384-T449 WeakPolarHBondContact CG-OG1 3.5Å; P384-F458 HydrophobicContact CB-CD2 4.48Å; P384-F458 HydrophobicContact CB-CE1 4.31Å; P384-F458 HydrophobicContact CB-CE2 4.26Å; P384-F458 HydrophobicContact CB-CZ 4.17Å; P384-F458 VanDerWaalsContact N-CE2 3.28Å
385	R	76.8	Confident	72.5	Confident	9 Å²	9	50.3 Å²	50.3	3%	0.034	29%	0.286	C	S	.	.			trans	-114.7	113.7	177.9	-60.7	179	-155.2	101	14.6	108.4	Y383 Y387 E461	Y383-R385 HydrophobicContact CD2-CG 4.07Å; Y383-R385 HydrophobicContact CE2-CG 3.52Å; Y383-R385 PolarHBondContact OH-NE 3.42Å; R385-Y387 HydrophobicContact CB-CE2 3.93Å; R385-E461 IonicContact CZ-OE1 3.79Å; R385-E461 VanDerWaalsContact CZ-OE1 3.23Å; R385-E461 IonicContact NH1-OE1 3.02Å; R385-E461 PolarHBondContact NH1-OE1 2.87Å; R385-E461 IonicContact NH2-OE1 2.79Å; R385-E461 PolarHBondContact NH2-OE1 2.81Å; R385-E461 IonicContact NH2-OE2 3.95Å; R385-E461 PolarHBondContact NH2-OE2 2.83Å; R385-E461 VanDerWaalsContact NH2-OE2 3.15Å
386	N	66.3	Low	72.1	Confident	58 Å²	58	52.6 Å²	52.6	31%	0.31	29%	0.293	S	S	.	.			trans	-113.1	104.8	177.4	-173.1	-9.6	0	0	0	109	T388 S389	N386-T388 VanDerWaalsContact C-N 3.31Å; N386-T388 PolarHBondContact OD1-N 2.89Å; N386-T388 PolarHBondContact OD1-OG1 3.36Å; N386-T388 VanDerWaalsContact OD1-OG1 3.07Å; N386-S389 PolarHBondContact ND2-OG 3.06Å
387	Y	58.3	Low	71.9	Confident	169 Å²	169	48 Å²	48	66%	0.663	27%	0.269	S	S	*	.	S	Bend	trans	-82.5	-8.3	-179.7	-65.6	-78.7	0	0	0	113.1	R385	R385-Y387 HydrophobicContact CB-CE2 3.93Å
388	T	54	Low	71.5	Confident	134 Å²	134	49.6 Å²	49.6	82%	0.822	28%	0.279	S	S	*	.	S	Bend	trans	-116.8	3.4	-162	44.3	0	0	0	0	116.4	N386	N386-T388 VanDerWaalsContact C-N 3.31Å; N386-T388 PolarHBondContact OD1-N 2.89Å; N386-T388 PolarHBondContact OD1-OG1 3.36Å; N386-T388 VanDerWaalsContact OD1-OG1 3.07Å
389	S	51.8	Low	71.3	Confident	46 Å²	46	55.2 Å²	55.2	32%	0.322	30%	0.301	S	S	.	.			trans	-139.1	115.5	174.8	61.3	0	0	0	0	113.5	N386 T391	N386-S389 PolarHBondContact ND2-OG 3.06Å; S389-T391 VanDerWaalsContact C-N 3.27Å; S389-T391 PolarHBondContact O-N 3.05Å
390	S	51.9	Low	71	Confident	130 Å²	130	55.3 Å²	55.3	91%	0.909	30%	0.301	S	S	*	.			trans	-71.7	76.1	170.3	56.5	0	0	0	0	111.1
391	T	56.1	Low	70.8	Confident	76 Å²	76	55.3 Å²	55.3	47%	0.466	30%	0.301	S	S	.	.			trans	-129.9	147.1	170	41.9	0	0	0	0	110.2	S389 G393 A394	S389-T391 VanDerWaalsContact C-N 3.27Å; S389-T391 PolarHBondContact O-N 3.05Å; T391-G393 PolarHBondContact O-N 3.45Å; T391-A394 PolarHBondContact O-N 3.33Å
392	D	56	Low	70.5	Confident	105 Å²	105	58.1 Å²	58.1	56%	0.561	31%	0.314	S	S	*	.	H	α-helix	trans	-56.2	-9	-170.7	-162.1	32.3	0	0	0	115.2	S395 R396	D392-S395 PolarHBondContact O-OG 2.89Å; D392-S395 VanDerWaalsContact O-OG 3.11Å; D392-R396 WeakPolarHBondContact O-CD 3.36Å; D392-R396 WeakPolarHBondContact O-CG 3.37Å; D392-R396 PolarHBondContact O-NE 2.89Å; D392-R396 VanDerWaalsContact O-NE 3.16Å; D392-R396 IonicContact OD2-CZ 3.8Å; D392-R396 IonicContact OD2-NE 3.58Å; D392-R396 IonicContact OD2-NH2 2.92Å; D392-R396 PolarHBondContact OD2-NH2 2.8Å
393	G	55.2	Low	70.4	Confident	17 Å²	17	63.6 Å²	63.6	18%	0.175	34%	0.34	C	S	.	.	H	α-helix	trans	-82.6	-38.7	177.3	0	0	0	0	0	114.7	T391 R396 V397	T391-G393 PolarHBondContact O-N 3.45Å; G393-R396 PolarHBondContact O-N 3.38Å; G393-V397 PolarHBondContact O-N 3.31Å
394	A	58.8	Low	70.4	Confident	23 Å²	23	63.9 Å²	63.9	19%	0.19	34%	0.342	C	S	.	.	H	α-helix	trans	-67.8	-38.6	-179.3	0	0	0	0	0	111.7	T391 R396 V397 E398	T391-A394 PolarHBondContact O-N 3.33Å; A394-R396 VanDerWaalsContact C-N 3.29Å; A394-R396 PolarHBondContact O-N 3.28Å; A394-V397 PolarHBondContact O-N 2.7Å; A394-E398 PolarHBondContact O-N 3.21Å
395	S	66	Low	70.9	Confident	63 Å²	63	62.9 Å²	62.9	44%	0.441	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-30.2	174.9	60.4	0	0	0	0	112.9	D392 Y399	D392-S395 PolarHBondContact O-OG 2.89Å; D392-S395 VanDerWaalsContact O-OG 3.11Å; S395-Y399 WeakPolarHBondContact O-CB 3.49Å; S395-Y399 PolarHBondContact O-N 2.69Å
396	R	73.9	Confident	71.4	Confident	92 Å²	92	63 Å²	63	35%	0.347	34%	0.337	S	S	.	.	H	α-helix	trans	-72.7	-42.2	179.1	-73.4	169.2	-168.8	-158	7.6	112.7	D392 G393 A394 Y399 F400 E514	D392-R396 WeakPolarHBondContact O-CD 3.36Å; D392-R396 WeakPolarHBondContact O-CG 3.37Å; D392-R396 PolarHBondContact O-NE 2.89Å; D392-R396 VanDerWaalsContact O-NE 3.16Å; D392-R396 IonicContact OD2-CZ 3.8Å; D392-R396 IonicContact OD2-NE 3.58Å; D392-R396 IonicContact OD2-NH2 2.92Å; D392-R396 PolarHBondContact OD2-NH2 2.8Å; G393-R396 PolarHBondContact O-N 3.38Å; A394-R396 VanDerWaalsContact C-N 3.29Å; A394-R396 PolarHBondContact O-N 3.28Å; R396-Y399 PolarHBondContact O-N 2.77Å; R396-F400 WeakPolarHBondContact O-CB 3.35Å; R396-F400 PolarHBondContact O-N 2.82Å; R396-E514 IonicContact NH1-OE1 3.55Å; R396-E514 PolarHBondContact NH1-OE1 2.94Å; R396-E514 VanDerWaalsContact NH1-OE1 3.09Å; R396-E514 IonicContact NH1-OE2 3.7Å
397	V	79.8	Confident	72.4	Confident	12 Å²	12	61.9 Å²	61.9	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-47	177.9	-179.9	0	0	0	0	110.1	Y383 G393 A394 Y399 F400 V401 I447 T449 M482	Y383-V397 HydrophobicContact CD2-CG1 4.08Å; G393-V397 PolarHBondContact O-N 3.31Å; A394-V397 PolarHBondContact O-N 2.7Å; V397-Y399 PolarHBondContact O-N 2.88Å; V397-F400 PolarHBondContact O-N 2.88Å; V397-V401 HydrophobicContact CG1-CG2 4.42Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.24Å; V397-I447 HydrophobicContact CG1-CG2 4.16Å; V397-T449 HydrophobicContact CG2-CG2 3.55Å; V397-M482 HydrophobicContact CB-CE 4.43Å; V397-M482 HydrophobicContact CG2-CE 4.02Å
398	E	81	Confident	73.8	Confident	78 Å²	78	53.8 Å²	53.8	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-42.6	176.8	-71.5	-172.6	163	0	0	111.9	Y383 A394 F400 V401 H402	Y383-E398 HydrophobicContact CE2-CG 4.35Å; A394-E398 PolarHBondContact O-N 3.21Å; E398-F400 VanDerWaalsContact C-N 3.34Å; E398-F400 PolarHBondContact O-N 3.17Å; E398-V401 PolarHBondContact O-N 3.3Å; E398-H402 WeakPolarHBondContact O-CB 3.21Å; E398-H402 PolarHBondContact O-CD2 3.1Å; E398-H402 PolarHBondContact O-N 2.85Å
399	Y	83	Confident	75.4	Confident	117 Å²	117	47.4 Å²	47.4	46%	0.459	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-42.9	174.1	-178.4	-101.3	0	0	0	111.9	S395 R396 V397 Q403 I404	S395-Y399 WeakPolarHBondContact O-CB 3.49Å; S395-Y399 PolarHBondContact O-N 2.69Å; R396-Y399 PolarHBondContact O-N 2.77Å; V397-Y399 PolarHBondContact O-N 2.88Å; Y399-Q403 HydrophobicContact CD2-CB 4.05Å; Y399-Q403 HydrophobicContact CD2-CG 3.77Å; Y399-Q403 HydrophobicContact CE2-CB 3.92Å; Y399-Q403 HydrophobicContact CE2-CG 3.85Å; Y399-Q403 WeakPolarHBondContact O-CA 3.43Å; Y399-Q403 WeakPolarHBondContact O-CB 3.21Å; Y399-Q403 PolarHBondContact O-N 2.86Å; Y399-I404 HydrophobicContact CD1-CD1 3.94Å; Y399-I404 HydrophobicContact CD1-CG1 4.17Å; Y399-I404 HydrophobicContact CE1-CD1 3.74Å; Y399-I404 HydrophobicContact CE1-CG1 3.85Å; Y399-I404 PolarHBondContact O-N 2.87Å
400	F	85.9	Confident	77.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.009	26%	0.255	C	S	.	.	I	π-helix	trans	-62.6	-48.2	177	178.1	-96.5	0	0	0	111.9	R396 V397 E398 I404 L405 I447 I480 M482 W512 F527 W528	R396-F400 WeakPolarHBondContact O-CB 3.35Å; R396-F400 PolarHBondContact O-N 2.82Å; V397-F400 PolarHBondContact O-N 2.88Å; E398-F400 VanDerWaalsContact C-N 3.34Å; E398-F400 PolarHBondContact O-N 3.17Å; F400-I404 HydrophobicContact CD2-CB 4.02Å; F400-I404 HydrophobicContact CD2-CD1 4.01Å; F400-I404 HydrophobicContact CD2-CG2 4.02Å; F400-I404 HydrophobicContact CE2-CB 4.49Å; F400-I404 HydrophobicContact CE2-CG2 4.05Å; F400-I404 WeakPolarHBondContact O-CB 3.45Å; F400-I404 PolarHBondContact O-N 2.84Å; F400-L405 HydrophobicContact CE1-CD1 4.33Å; F400-L405 HydrophobicContact CZ-CD1 4.35Å; F400-L405 WeakPolarHBondContact O-CB 3.38Å; F400-L405 PolarHBondContact O-N 2.9Å; F400-I447 HydrophobicContact CD1-CD1 4.4Å; F400-I447 HydrophobicContact CE1-CD1 3.89Å; F400-I480 HydrophobicContact CE1-CG2 4.49Å; F400-I480 HydrophobicContact CZ-CG2 4.47Å; F400-M482 HydrophobicContact CB-CE 3.84Å; F400-M482 HydrophobicContact CB-SD 3.95Å; F400-M482 HydrophobicContact CD1-SD 3.73Å; F400-M482 HydrophobicContact CD2-SD 4.01Å; F400-M482 HydrophobicContact CE1-SD 4.23Å; F400-M482 HydrophobicContact CE2-SD 4.49Å; F400-M482 HydrophobicContact CG-CE 4.21Å; F400-M482 HydrophobicContact CG-SD 3.61Å; F400-W512 HydrophobicContact CD2-CD2 4.31Å; F400-W512 AromaticContact CD2-CE2 3.91Å; F400-W512 HydrophobicContact CD2-CH2 4.25Å; F400-W512 AromaticContact CD2-CZ2 3.88Å; F400-W512 HydrophobicContact CD2-CZ2 3.88Å; F400-W512 AromaticContact CE2-CD2 3.8Å; F400-W512 HydrophobicContact CE2-CD2 3.8Å; F400-W512 AromaticContact CE2-CE2 3.82Å; F400-W512 AromaticContact CE2-CE3 3.77Å; F400-W512 HydrophobicContact CE2-CE3 3.77Å; F400-W512 AromaticContact CE2-CH2 3.8Å; F400-W512 HydrophobicContact CE2-CH2 3.8Å; F400-W512 AromaticContact CE2-CZ2 3.82Å; F400-W512 HydrophobicContact CE2-CZ2 3.82Å; F400-W512 AromaticContact CE2-CZ3 3.78Å; F400-W512 HydrophobicContact CE2-CZ3 3.78Å; F400-W512 HydrophobicContact CZ-CE3 4.42Å; F400-F527 HydrophobicContact CZ-CE1 4.37Å; F400-F527 HydrophobicContact CZ-CZ 4.11Å; F400-W528 HydrophobicContact CZ-CH2 4.48Å
401	V	87.4	Confident	78.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	I	π-helix	trans	-70.3	-42.6	-176.2	171.5	0	0	0	0	112.4	V381 Y383 V397 E398 P406 I419 I447	V381-V401 HydrophobicContact CG1-CG1 4Å; V381-V401 HydrophobicContact CG1-CG2 4.39Å; Y383-V401 HydrophobicContact CD1-CB 4.48Å; Y383-V401 HydrophobicContact CD1-CG1 3.78Å; Y383-V401 HydrophobicContact CD1-CG2 4.2Å; Y383-V401 HydrophobicContact CD2-CG2 4.28Å; Y383-V401 HydrophobicContact CE1-CG1 3.8Å; Y383-V401 HydrophobicContact CG-CB 4.49Å; Y383-V401 HydrophobicContact CG-CG1 4.26Å; Y383-V401 HydrophobicContact CG-CG2 3.88Å; V397-V401 HydrophobicContact CG1-CG2 4.42Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.24Å; E398-V401 PolarHBondContact O-N 3.3Å; V401-P406 VanDerWaalsContact O-CD 3.24Å; V401-P406 WeakPolarHBondContact O-CD 3.39Å; V401-I419 HydrophobicContact CG1-CD1 4.37Å; V401-I419 HydrophobicContact CG1-CG2 3.8Å; V401-I419 WeakPolarHBondContact O-CD1 3.39Å; V401-I447 HydrophobicContact CG2-CG1 4Å
402	H	86.8	Confident	80	Confident	60 Å²	60	44.8 Å²	44.8	28%	0.278	23%	0.225	S	C	.	.	I	π-helix	trans	-91.9	-23.4	-173.9	-71.5	-73.7	0	0	0	114.1	Y383 E398	Y383-H402 AromaticContact CZ-NE2 3.76Å; Y383-H402 PolarHBondContact OH-NE2 2.85Å; E398-H402 WeakPolarHBondContact O-CB 3.21Å; E398-H402 PolarHBondContact O-CD2 3.1Å; E398-H402 PolarHBondContact O-N 2.85Å
403	Q	84.9	Confident	81.2	Confident	114 Å²	114	40 Å²	40	53%	0.533	20%	0.2	S	C	.	.	I	π-helix	trans	-111.4	-53.5	-178.5	-58.1	-66.6	-33.2	0	0	112.7	Y399 D407	Y399-Q403 HydrophobicContact CD2-CB 4.05Å; Y399-Q403 HydrophobicContact CD2-CG 3.77Å; Y399-Q403 HydrophobicContact CE2-CB 3.92Å; Y399-Q403 HydrophobicContact CE2-CG 3.85Å; Y399-Q403 WeakPolarHBondContact O-CA 3.43Å; Y399-Q403 WeakPolarHBondContact O-CB 3.21Å; Y399-Q403 PolarHBondContact O-N 2.86Å; Q403-D407 VanDerWaalsContact O-CB 3.22Å; Q403-D407 WeakPolarHBondContact O-CB 3.39Å; Q403-D407 PolarHBondContact O-N 2.81Å
404	I	86.1	Confident	82.6	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.077	19%	0.194	C	C	.	.	I	π-helix	trans	-74.4	-47.1	-171.9	-61.9	179.4	0	0	0	111.4	Y399 F400 D407 V408 W512 W528	Y399-I404 HydrophobicContact CD1-CD1 3.94Å; Y399-I404 HydrophobicContact CD1-CG1 4.17Å; Y399-I404 HydrophobicContact CE1-CD1 3.74Å; Y399-I404 HydrophobicContact CE1-CG1 3.85Å; Y399-I404 PolarHBondContact O-N 2.87Å; F400-I404 HydrophobicContact CD2-CB 4.02Å; F400-I404 HydrophobicContact CD2-CD1 4.01Å; F400-I404 HydrophobicContact CD2-CG2 4.02Å; F400-I404 HydrophobicContact CE2-CB 4.49Å; F400-I404 HydrophobicContact CE2-CG2 4.05Å; F400-I404 WeakPolarHBondContact O-CB 3.45Å; F400-I404 PolarHBondContact O-N 2.84Å; I404-D407 PolarHBondContact O-N 2.94Å; I404-V408 WeakPolarHBondContact O-CG2 3.41Å; I404-V408 PolarHBondContact O-N 3.04Å; I404-V408 VanDerWaalsContact O-N 3.09Å; I404-W512 HydrophobicContact CD1-CZ2 4.17Å; I404-W512 HydrophobicContact CG2-CH2 4.18Å; I404-W528 HydrophobicContact CG2-CH2 4.27Å; I404-W528 HydrophobicContact CG2-CZ2 3.75Å
405	L	88.3	Confident	84	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-45.2	-175.1	-163	70.5	0	0	0	112	V381 F400 V408 L409 L417 W528	V381-L405 HydrophobicContact CB-CD2 4.49Å; V381-L405 HydrophobicContact CG1-CD2 3.95Å; V381-L405 HydrophobicContact CG2-CD2 3.69Å; F400-L405 HydrophobicContact CE1-CD1 4.33Å; F400-L405 HydrophobicContact CZ-CD1 4.35Å; F400-L405 WeakPolarHBondContact O-CB 3.38Å; F400-L405 PolarHBondContact O-N 2.9Å; L405-V408 PolarHBondContact O-N 2.98Å; L405-L409 HydrophobicContact CD1-CD1 3.54Å; L405-L409 HydrophobicContact CD1-CG 4.18Å; L405-L409 HydrophobicContact CG-CD1 3.96Å; L405-L409 WeakPolarHBondContact O-CB 3.35Å; L405-L409 PolarHBondContact O-N 3.19Å; L405-L417 HydrophobicContact CD2-CD1 3.95Å; L405-L417 HydrophobicContact CG-CD1 3.77Å; L405-W528 HydrophobicContact CD1-CH2 3.94Å; L405-W528 HydrophobicContact CD1-CZ3 4.01Å
406	P	88.6	Confident	85.1	Confident	11 Å²	11	36.9 Å²	36.9	7%	0.071	17%	0.172	C	C	.	.	I	π-helix	trans	-67.4	-39.8	173.9	-24.8	39.8	0	0	0	113.1	V401 V408 E410 N411 I419	V401-P406 VanDerWaalsContact O-CD 3.24Å; V401-P406 WeakPolarHBondContact O-CD 3.39Å; P406-V408 PolarHBondContact O-N 2.87Å; P406-E410 HydrophobicContact CB-CG 4.46Å; P406-E410 WeakPolarHBondContact CB-OE2 3.33Å; P406-E410 WeakPolarHBondContact O-CB 3.35Å; P406-E410 PolarHBondContact O-N 3.08Å; P406-N411 PolarHBondContact O-N 3.28Å; P406-I419 HydrophobicContact CG-CD1 3.94Å
407	D	86.1	Confident	85.9	Confident	35 Å²	35	32.6 Å²	32.6	19%	0.187	16%	0.156	C	C	.	.	I	π-helix	trans	-58.9	-35.3	177.8	-178.2	65.6	0	0	0	112.4	Q403 I404 N411 K412 R521	Q403-D407 VanDerWaalsContact O-CB 3.22Å; Q403-D407 WeakPolarHBondContact O-CB 3.39Å; Q403-D407 PolarHBondContact O-N 2.81Å; I404-D407 PolarHBondContact O-N 2.94Å; D407-N411 WeakPolarHBondContact O-CB 3.29Å; D407-K412 WeakPolarHBondContact O-CG 3.48Å; D407-K412 IonicContact OD2-NZ 3.5Å; D407-K412 PolarHBondContact OD2-NZ 3Å; D407-R521 WeakPolarHBondContact OD2-CD 3.4Å; D407-R521 IonicContact OD2-NH1 2.62Å
408	V	87	Confident	86.5	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-92.1	-53.9	-179.3	-176.8	0	0	0	0	111.9	I404 L405 P406 K412 C413 L523 W528	I404-V408 WeakPolarHBondContact O-CG2 3.41Å; I404-V408 PolarHBondContact O-N 3.04Å; I404-V408 VanDerWaalsContact O-N 3.09Å; L405-V408 PolarHBondContact O-N 2.98Å; P406-V408 PolarHBondContact O-N 2.87Å; V408-K412 WeakPolarHBondContact O-CB 3.41Å; V408-K412 PolarHBondContact O-N 2.65Å; V408-C413 PolarHBondContact O-N 3.4Å; V408-L523 HydrophobicContact CG1-CD2 3.71Å; V408-W528 HydrophobicContact CB-CD2 4.3Å; V408-W528 HydrophobicContact CB-CE3 4.29Å; V408-W528 HydrophobicContact CB-CH2 3.88Å; V408-W528 HydrophobicContact CB-CZ2 3.88Å; V408-W528 HydrophobicContact CB-CZ3 4.08Å; V408-W528 HydrophobicContact CG1-CD2 3.6Å; V408-W528 HydrophobicContact CG1-CE3 3.68Å; V408-W528 HydrophobicContact CG1-CG 4.1Å; V408-W528 HydrophobicContact CG1-CH2 4.19Å; V408-W528 HydrophobicContact CG1-CZ2 4.11Å; V408-W528 HydrophobicContact CG1-CZ3 3.97Å; V408-W528 HydrophobicContact CG2-CH2 4.16Å; V408-W528 HydrophobicContact CG2-CZ2 3.68Å
409	L	88.3	Confident	86.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	I	π-helix	trans	-77.9	-42.9	-171.8	-64.3	-175.8	0	0	0	112.7	L405 C413 G414 Y415 L417 I445 W528 V531 M535	L405-L409 HydrophobicContact CD1-CD1 3.54Å; L405-L409 HydrophobicContact CD1-CG 4.18Å; L405-L409 HydrophobicContact CG-CD1 3.96Å; L405-L409 WeakPolarHBondContact O-CB 3.35Å; L405-L409 PolarHBondContact O-N 3.19Å; L409-C413 CarbonylContact O-C 3.58Å; L409-C413 VanDerWaalsContact O-CB 3.31Å; L409-C413 WeakPolarHBondContact O-CB 3.49Å; L409-C413 PolarHBondContact O-N 3.49Å; L409-G414 PolarHBondContact O-N 2.98Å; L409-G414 VanDerWaalsContact O-N 3.13Å; L409-Y415 HydrophobicContact CB-CD2 3.94Å; L409-Y415 HydrophobicContact CD2-CD2 3.88Å; L409-Y415 HydrophobicContact CD2-CE2 4.08Å; L409-Y415 HydrophobicContact CG-CD2 4.45Å; L409-Y415 WeakPolarHBondContact O-CB 3.38Å; L409-Y415 WeakPolarHBondContact O-CD2 3.32Å; L409-Y415 PolarHBondContact O-N 3.16Å; L409-L417 HydrophobicContact CB-CD1 4.13Å; L409-L417 HydrophobicContact CD1-CD1 4.21Å; L409-L417 HydrophobicContact CD1-CD2 4.19Å; L409-I445 HydrophobicContact CD1-CD1 4.35Å; L409-W528 HydrophobicContact CD1-CZ3 4.44Å; L409-W528 HydrophobicContact CD2-CE3 4.18Å; L409-W528 HydrophobicContact CD2-CZ3 4Å; L409-W528 HydrophobicContact CG-CZ3 3.99Å; L409-V531 HydrophobicContact CD1-CG1 4.34Å; L409-V531 HydrophobicContact CD2-CG1 4.19Å; L409-M535 HydrophobicContact CD1-CE 4.48Å
410	E	88.4	Confident	87	Confident	47 Å²	47	23.9 Å²	23.9	22%	0.22	12%	0.118	C	C	.	.	I	π-helix	trans	-81.6	-55.4	-178.8	-56.6	-175.2	147.7	0	0	110.9	P406 G414 Y415 L417 R422	P406-E410 HydrophobicContact CB-CG 4.46Å; P406-E410 WeakPolarHBondContact CB-OE2 3.33Å; P406-E410 WeakPolarHBondContact O-CB 3.35Å; P406-E410 PolarHBondContact O-N 3.08Å; E410-G414 WeakPolarHBondContact O-CA 3.44Å; E410-G414 PolarHBondContact O-N 3.25Å; E410-G414 VanDerWaalsContact O-N 3.14Å; E410-Y415 WeakPolarHBondContact CA-O 3.29Å; E410-L417 HydrophobicContact CG-CB 4.42Å; E410-L417 HydrophobicContact CG-CD1 4.13Å; E410-L417 HydrophobicContact CG-CG 3.96Å; E410-L417 WeakPolarHBondContact OE1-CB 3.46Å; E410-L417 PolarHBondContact OE1-N 3.17Å; E410-R422 IonicContact OE1-CZ 3.99Å; E410-R422 IonicContact OE1-NH1 2.89Å; E410-R422 IonicContact OE1-NH2 2.66Å; E410-R422 PolarHBondContact OE1-NH2 3.44Å; E410-R422 IonicContact OE2-CZ 3.21Å; E410-R422 IonicContact OE2-NH1 2.9Å; E410-R422 PolarHBondContact OE2-NH1 3.01Å; E410-R422 IonicContact OE2-NH2 3.93Å
411	N	85.4	Confident	86.7	Confident	84 Å²	84	26.9 Å²	26.9	45%	0.449	15%	0.149	S	C	.	.	I	π-helix	trans	-71.8	-43.6	-173.2	-72.1	-25.7	0	0	0	113.4	P406 D407	P406-N411 PolarHBondContact O-N 3.28Å; D407-N411 WeakPolarHBondContact O-CB 3.29Å
412	K	83.7	Confident	86.6	Confident	66 Å²	66	31.1 Å²	31.1	29%	0.287	17%	0.165	S	C	.	.	I	π-helix	trans	-97.4	-27.5	-174.6	-62.8	173.3	-171.6	160.7	0	114.2	D407 V408 R521 L523 P542	D407-K412 WeakPolarHBondContact O-CG 3.48Å; D407-K412 IonicContact OD2-NZ 3.5Å; D407-K412 PolarHBondContact OD2-NZ 3Å; V408-K412 WeakPolarHBondContact O-CB 3.41Å; V408-K412 PolarHBondContact O-N 2.65Å; K412-R521 PolarHBondContact NZ-O 2.67Å; K412-R521 VanDerWaalsContact NZ-O 3.08Å; K412-L523 HydrophobicContact CB-CD1 4.17Å; K412-L523 HydrophobicContact CB-CD2 4.18Å; K412-L523 HydrophobicContact CB-CG 4.43Å; K412-P542 WeakPolarHBondContact O-CB 3.4Å
413	C	81.4	Confident	86.5	Confident	5 Å²	5	30.6 Å²	30.6	3%	0.034	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-10.7	-179.5	-66.2	0	0	0	0	114.7	V408 L409 Y415 L523 P538	V408-C413 PolarHBondContact O-N 3.4Å; L409-C413 CarbonylContact O-C 3.58Å; L409-C413 VanDerWaalsContact O-CB 3.31Å; L409-C413 WeakPolarHBondContact O-CB 3.49Å; L409-C413 PolarHBondContact O-N 3.49Å; C413-Y415 HydrophobicContact CB-CD2 3.48Å; C413-Y415 VanDerWaalsContact CB-CD2 3.48Å; C413-Y415 HydrophobicContact CB-CE2 3.49Å; C413-Y415 VanDerWaalsContact CB-CE2 3.49Å; C413-L523 WeakPolarHBondContact SG-CD2 3.39Å; C413-P538 WeakPolarHBondContact O-CB 3.34Å; C413-P538 WeakPolarHBondContact O-CG 3.17Å
414	G	83.1	Confident	86.3	Confident	5 Å²	5	26.8 Å²	26.8	5%	0.052	15%	0.147	C	C	.	.			trans	74.8	21.9	177.4	0	0	0	0	0	114.7	L409 E410 K540	L409-G414 PolarHBondContact O-N 2.98Å; L409-G414 VanDerWaalsContact O-N 3.13Å; E410-G414 WeakPolarHBondContact O-CA 3.44Å; E410-G414 PolarHBondContact O-N 3.25Å; E410-G414 VanDerWaalsContact O-N 3.14Å; G414-K540 WeakPolarHBondContact O-CB 3.34Å; G414-K540 PolarHBondContact O-N 2.92Å
415	Y	88.2	Confident	86	Confident	10 Å²	10	32.2 Å²	32.2	4%	0.039	18%	0.175	C	C	.	.			trans	-79.8	165.4	171.8	-64.7	-64.1	0	0	0	112	D378 L409 E410 C413 M535 P536 P538	D378-Y415 HydrophobicContact CB-CD1 3.95Å; D378-Y415 WeakPolarHBondContact OD2-CA 3.5Å; L409-Y415 HydrophobicContact CB-CD2 3.94Å; L409-Y415 HydrophobicContact CD2-CD2 3.88Å; L409-Y415 HydrophobicContact CD2-CE2 4.08Å; L409-Y415 HydrophobicContact CG-CD2 4.45Å; L409-Y415 WeakPolarHBondContact O-CB 3.38Å; L409-Y415 WeakPolarHBondContact O-CD2 3.32Å; L409-Y415 PolarHBondContact O-N 3.16Å; E410-Y415 WeakPolarHBondContact CA-O 3.29Å; C413-Y415 HydrophobicContact CB-CD2 3.48Å; C413-Y415 VanDerWaalsContact CB-CD2 3.48Å; C413-Y415 HydrophobicContact CB-CE2 3.49Å; C413-Y415 VanDerWaalsContact CB-CE2 3.49Å; Y415-M535 HydrophobicContact CD1-CE 3.63Å; Y415-M535 HydrophobicContact CD2-CE 3.93Å; Y415-M535 HydrophobicContact CE1-CB 3.95Å; Y415-M535 HydrophobicContact CE1-CE 4.01Å; Y415-M535 HydrophobicContact CE2-CB 4.15Å; Y415-M535 HydrophobicContact CE2-CE 4.27Å; Y415-M535 HydrophobicContact CE2-CG 4.3Å; Y415-M535 HydrophobicContact CG-CE 3.59Å; Y415-M535 WeakPolarHBondContact OH-CB 3.35Å; Y415-P536 HydrophobicContact CE1-CG 4.5Å; Y415-P536 WeakPolarHBondContact CE1-O 3.47Å; Y415-P536 PolarHBondContact OH-O 2.96Å; Y415-P538 HydrophobicContact CD1-CB 4.1Å; Y415-P538 HydrophobicContact CD1-CG 4.24Å; Y415-P538 HydrophobicContact CE1-CB 3.89Å; Y415-P538 HydrophobicContact CE1-CG 3.57Å; Y415-P538 HydrophobicContact CE2-CG 4.41Å
416	T	89.4	Confident	85.5	Confident	22 Å²	22	38.7 Å²	38.7	14%	0.135	22%	0.217	C	C	.	.			trans	-121.4	112.5	173.1	47	0	0	0	0	109.3	D378 A379 K540	D378-T416 WeakPolarHBondContact CB-O 3.45Å; D378-T416 PolarHBondContact N-O 3.29Å; D378-T416 PolarHBondContact N-OG1 3.05Å; D378-T416 PolarHBondContact OD2-N 2.87Å; D378-T416 PolarHBondContact OD2-OG1 2.81Å; A379-T416 PolarHBondContact N-O 3.09Å; T416-K540 HydrophobicContact CG2-CD 4.42Å
417	L	91.2	Very high	84.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	145.4	179.7	-55.6	176.1	0	0	0	110.1	A379 V381 L405 L409 E410 I419 R422 I445 M535	A379-L417 HydrophobicContact CB-CD2 3.82Å; A379-L417 CarbonylContact O-C 3.57Å; A379-L417 WeakPolarHBondContact O-CA 3.31Å; V381-L417 HydrophobicContact CG2-CB 4.45Å; L405-L417 HydrophobicContact CD2-CD1 3.95Å; L405-L417 HydrophobicContact CG-CD1 3.77Å; L409-L417 HydrophobicContact CB-CD1 4.13Å; L409-L417 HydrophobicContact CD1-CD1 4.21Å; L409-L417 HydrophobicContact CD1-CD2 4.19Å; E410-L417 HydrophobicContact CG-CB 4.42Å; E410-L417 HydrophobicContact CG-CD1 4.13Å; E410-L417 HydrophobicContact CG-CG 3.96Å; E410-L417 WeakPolarHBondContact OE1-CB 3.46Å; E410-L417 PolarHBondContact OE1-N 3.17Å; L417-I419 HydrophobicContact CB-CG1 4.3Å; L417-R422 PolarHBondContact O-NH2 2.86Å; L417-R422 VanDerWaalsContact O-NH2 3.14Å; L417-I445 HydrophobicContact CD2-CD1 4.33Å; L417-M535 HydrophobicContact CD2-CE 4.27Å
418	C	91.5	Very high	84.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117	164.7	-174	0	0	0	0	108.3	Y377 A379 Y380 V381	Y377-C418 HydrophobicContact CD1-CB 3.61Å; Y377-C418 HydrophobicContact CD2-CB 3.77Å; Y377-C418 HydrophobicContact CE1-CB 3.84Å; Y377-C418 HydrophobicContact CE2-CB 4.01Å; Y377-C418 HydrophobicContact CG-CB 3.57Å; A379-C418 PolarHBondContact O-N 2.72Å; Y380-C418 HydrophobicContact CD2-CB 3.72Å; Y380-C418 HydrophobicContact CE2-CB 4.37Å; V381-C418 PolarHBondContact N-O 2.04Å
419	I	89.3	Confident	84.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.1	178.9	-52.6	179.9	0	0	0	108.1	V381 Y383 V401 P406 L417 G421 R422 D423	V381-I419 HydrophobicContact CB-CG1 4.36Å; V381-I419 HydrophobicContact CG2-CG1 4.18Å; Y383-I419 HydrophobicContact CE1-CG2 4.19Å; V401-I419 HydrophobicContact CG1-CD1 4.37Å; V401-I419 HydrophobicContact CG1-CG2 3.8Å; V401-I419 WeakPolarHBondContact O-CD1 3.39Å; P406-I419 HydrophobicContact CG-CD1 3.94Å; L417-I419 HydrophobicContact CB-CG1 4.3Å; I419-G421 PolarHBondContact O-N 3.18Å; I419-R422 HydrophobicContact CB-CB 4.3Å; I419-R422 PolarHBondContact O-N 3.35Å; I419-R422 VanDerWaalsContact O-N 3.15Å; I419-D423 PolarHBondContact N-OD2 2.96Å; I419-D423 PolarHBondContact O-N 3.01Å; I419-D423 VanDerWaalsContact O-N 3.09Å
420	Y	85.4	Confident	84.2	Confident	24 Å²	24	52.2 Å²	52.2	9%	0.094	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	138.1	175.8	-172.6	-89.3	0	0	0	111.9	R422 M424 V430 V434 E457 E461	Y420-R422 PolarHBondContact O-N 3.1Å; Y420-R422 VanDerWaalsContact O-N 3.12Å; Y420-M424 HydrophobicContact CD2-CE 3.3Å; Y420-M424 HydrophobicContact CD2-SD 3.62Å; Y420-M424 HydrophobicContact CE2-CE 3.76Å; Y420-M424 HydrophobicContact CE2-SD 3.75Å; Y420-M424 HydrophobicContact CG-CE 4.2Å; Y420-M424 HydrophobicContact CG-SD 4.27Å; Y420-V430 HydrophobicContact CE2-CG1 4.01Å; Y420-V430 VanDerWaalsContact OH-CG1 3.3Å; Y420-V430 WeakPolarHBondContact OH-CG1 3.42Å; Y420-V434 HydrophobicContact CD2-CG2 4.09Å; Y420-V434 HydrophobicContact CE2-CG2 3.81Å; Y420-E457 PolarHBondContact OH-OE2 3.02Å; Y420-E461 WeakPolarHBondContact CD2-OE1 3.5Å; Y420-E461 WeakPolarHBondContact CE2-OE1 3.46Å
421	G	80.3	Confident	84	Confident	64 Å²	64	53.4 Å²	53.4	66%	0.66	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-20.6	-178.2	0	0	0	0	0	115.7	I419	I419-G421 PolarHBondContact O-N 3.18Å
422	R	85.3	Confident	83.9	Confident	90 Å²	90	52.8 Å²	52.8	34%	0.34	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-46.5	174.7	-173.5	-174.1	73.4	161.8	4	112	E410 L417 I419 Y420	E410-R422 IonicContact OE1-CZ 3.99Å; E410-R422 IonicContact OE1-NH1 2.89Å; E410-R422 IonicContact OE1-NH2 2.66Å; E410-R422 PolarHBondContact OE1-NH2 3.44Å; E410-R422 IonicContact OE2-CZ 3.21Å; E410-R422 IonicContact OE2-NH1 2.9Å; E410-R422 PolarHBondContact OE2-NH1 3.01Å; E410-R422 IonicContact OE2-NH2 3.93Å; L417-R422 PolarHBondContact O-NH2 2.86Å; L417-R422 VanDerWaalsContact O-NH2 3.14Å; I419-R422 HydrophobicContact CB-CB 4.3Å; I419-R422 PolarHBondContact O-N 3.35Å; I419-R422 VanDerWaalsContact O-N 3.15Å; Y420-R422 PolarHBondContact O-N 3.1Å; Y420-R422 VanDerWaalsContact O-N 3.12Å
423	D	84.6	Confident	84.1	Confident	49 Å²	49	49.7 Å²	49.7	26%	0.262	31%	0.306	S	S	.	.	S	Bend	trans	-104.2	5.7	-168.7	-61.4	-59	0	0	0	113.4	I419	I419-D423 PolarHBondContact N-OD2 2.96Å; I419-D423 PolarHBondContact O-N 3.01Å; I419-D423 VanDerWaalsContact O-N 3.09Å
424	M	81.8	Confident	84.4	Confident	34 Å²	34	49.6 Å²	49.6	17%	0.167	31%	0.305	C	S	.	.	S	Bend	trans	-95.3	144.9	177.3	-67.7	-179	173.3	0	0	111.6	Y420 A433 V434	Y420-M424 HydrophobicContact CD2-CE 3.3Å; Y420-M424 HydrophobicContact CD2-SD 3.62Å; Y420-M424 HydrophobicContact CE2-CE 3.76Å; Y420-M424 HydrophobicContact CE2-SD 3.75Å; Y420-M424 HydrophobicContact CG-CE 4.2Å; Y420-M424 HydrophobicContact CG-SD 4.27Å; M424-A433 HydrophobicContact SD-CB 4.44Å; M424-V434 HydrophobicContact CE-CG2 3.64Å
425	L	79.1	Confident	84.6	Confident	129 Å²	129	52.5 Å²	52.5	68%	0.675	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-79.2	133.9	179.8	-66.2	174.1	0	0	0	110.7	G427 E428	L425-G427 PolarHBondContact O-N 2.98Å; L425-E428 PolarHBondContact O-N 3.14Å
426	P	77.9	Confident	84.6	Confident	136 Å²	136	54.1 Å²	54.1	88%	0.883	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	126.3	175.9	-20.4	30.9	0	0	0	111.4
427	G	74.6	Confident	84.6	Confident	90 Å²	90	53.6 Å²	53.6	93%	0.928	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	0.8	177.5	0	0	0	0	0	115.9	L425	L425-G427 PolarHBondContact O-N 2.98Å
428	E	82.1	Confident	84.5	Confident	84 Å²	84	53.5 Å²	53.5	39%	0.393	33%	0.325	S	S	.	.	S	Bend	trans	-74.8	150.4	170.1	-165.2	172.3	-167.6	0	0	111.2	L425 V430 A433	L425-E428 PolarHBondContact O-N 3.14Å; E428-V430 PolarHBondContact O-N 3.11Å; E428-A433 HydrophobicContact CG-CB 4.03Å
429	D	83.3	Confident	84.3	Confident	92 Å²	92	60.1 Å²	60.1	49%	0.492	35%	0.35	S	S	.	.			trans	-65.1	117.2	172.9	173.5	61.8	0	0	0	110	V431 T432 A433	D429-V431 VanDerWaalsContact C-N 3.27Å; D429-V431 PolarHBondContact O-N 2.99Å; D429-T432 PolarHBondContact O-N 2.92Å; D429-T432 VanDerWaalsContact OD2-CB 3.31Å; D429-T432 WeakPolarHBondContact OD2-CB 3.11Å; D429-T432 PolarHBondContact OD2-N 3.12Å; D429-T432 PolarHBondContact OD2-OG1 3.09Å; D429-A433 VanDerWaalsContact O-CB 3.29Å; D429-A433 WeakPolarHBondContact O-CB 3.48Å; D429-A433 PolarHBondContact O-N 3.5Å
430	V	82.2	Confident	84.2	Confident	64 Å²	64	64.1 Å²	64.1	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-58.4	-40.4	-172.1	177.1	0	0	0	0	111.5	Y420 E428 A433 V434	Y420-V430 HydrophobicContact CE2-CG1 4.01Å; Y420-V430 VanDerWaalsContact OH-CG1 3.3Å; Y420-V430 WeakPolarHBondContact OH-CG1 3.42Å; E428-V430 PolarHBondContact O-N 3.11Å; V430-A433 PolarHBondContact O-N 2.76Å; V430-V434 HydrophobicContact CG1-CG2 4.38Å; V430-V434 WeakPolarHBondContact O-CB 3.4Å; V430-V434 VanDerWaalsContact O-CG2 3.26Å; V430-V434 WeakPolarHBondContact O-CG2 3.06Å; V430-V434 PolarHBondContact O-N 2.62Å
431	V	83.6	Confident	84.5	Confident	72 Å²	72	63 Å²	63	44%	0.436	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-50.9	-179	-179.9	0	0	0	0	110.3	D429 V434 E435 Y460	D429-V431 VanDerWaalsContact C-N 3.27Å; D429-V431 PolarHBondContact O-N 2.99Å; V431-V434 PolarHBondContact O-N 3.09Å; V431-E435 PolarHBondContact O-N 3.05Å; V431-E435 VanDerWaalsContact O-N 3.13Å; V431-Y460 HydrophobicContact CB-CE1 4.46Å; V431-Y460 HydrophobicContact CG1-CE1 3.91Å; V431-Y460 HydrophobicContact CG1-CE2 4.31Å; V431-Y460 WeakPolarHBondContact CG1-OH 3.45Å
432	T	84.7	Confident	84.9	Confident	70 Å²	70	61.2 Å²	61.2	43%	0.429	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-38.1	178.1	-52.5	0	0	0	0	111.9	D429 T436	D429-T432 PolarHBondContact O-N 2.92Å; D429-T432 VanDerWaalsContact OD2-CB 3.31Å; D429-T432 WeakPolarHBondContact OD2-CB 3.11Å; D429-T432 PolarHBondContact OD2-N 3.12Å; D429-T432 PolarHBondContact OD2-OG1 3.09Å; T432-T436 HydrophobicContact CG2-CG2 4.2Å; T432-T436 WeakPolarHBondContact O-CB 3.44Å; T432-T436 WeakPolarHBondContact O-CG2 3.32Å; T432-T436 PolarHBondContact O-N 3.25Å; T432-T436 PolarHBondContact O-OG1 3.4Å
433	A	86.6	Confident	85.1	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-44.2	178.3	0	0	0	0	0	111.7	M424 E428 D429 V430 T436 N437	M424-A433 HydrophobicContact SD-CB 4.44Å; E428-A433 HydrophobicContact CG-CB 4.03Å; D429-A433 VanDerWaalsContact O-CB 3.29Å; D429-A433 WeakPolarHBondContact O-CB 3.48Å; D429-A433 PolarHBondContact O-N 3.5Å; V430-A433 PolarHBondContact O-N 2.76Å; A433-T436 PolarHBondContact O-OG1 2.89Å; A433-T436 VanDerWaalsContact O-OG1 3.11Å; A433-N437 VanDerWaalsContact O-CB 3.24Å; A433-N437 WeakPolarHBondContact O-CB 3.49Å; A433-N437 PolarHBondContact O-N 3.05Å; A433-N437 PolarHBondContact O-ND2 3.32Å
434	V	88.4	Confident	85.4	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.012	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-53.6	175.2	163.9	0	0	0	0	110.7	Y420 M424 V430 V431 T436 N437 I438 Y460 E461	Y420-V434 HydrophobicContact CD2-CG2 4.09Å; Y420-V434 HydrophobicContact CE2-CG2 3.81Å; M424-V434 HydrophobicContact CE-CG2 3.64Å; V430-V434 HydrophobicContact CG1-CG2 4.38Å; V430-V434 WeakPolarHBondContact O-CB 3.4Å; V430-V434 VanDerWaalsContact O-CG2 3.26Å; V430-V434 WeakPolarHBondContact O-CG2 3.06Å; V430-V434 PolarHBondContact O-N 2.62Å; V431-V434 PolarHBondContact O-N 3.09Å; V434-T436 VanDerWaalsContact C-N 3.35Å; V434-T436 PolarHBondContact O-N 3.21Å; V434-N437 PolarHBondContact O-N 2.94Å; V434-I438 HydrophobicContact CG1-CD1 3.59Å; V434-I438 HydrophobicContact CG1-CG1 4.42Å; V434-I438 WeakPolarHBondContact O-CB 3.36Å; V434-I438 VanDerWaalsContact O-CG1 3.29Å; V434-I438 WeakPolarHBondContact O-CG1 3.41Å; V434-I438 PolarHBondContact O-N 2.74Å; V434-Y460 HydrophobicContact CB-CE1 4.31Å; V434-Y460 HydrophobicContact CG1-CD1 4.22Å; V434-Y460 HydrophobicContact CG1-CE1 4Å; V434-E461 HydrophobicContact CB-CG 4.42Å; V434-E461 HydrophobicContact CG1-CB 4.41Å; V434-E461 HydrophobicContact CG1-CG 3.57Å; V434-E461 HydrophobicContact CG2-CG 3.88Å
435	E	88.1	Confident	85.9	Confident	66 Å²	66	55.5 Å²	55.5	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-43.9	-176.6	-171.8	-178	-175	0	0	111.7	V431 R439 V464	V431-E435 PolarHBondContact O-N 3.05Å; V431-E435 VanDerWaalsContact O-N 3.13Å; E435-R439 WeakPolarHBondContact O-CG 3.32Å; E435-R439 PolarHBondContact O-N 2.98Å; E435-R439 IonicContact OE1-CZ 3.8Å; E435-R439 IonicContact OE1-NE 2.74Å; E435-R439 PolarHBondContact OE1-NE 3.02Å; E435-R439 IonicContact OE1-NH2 2.92Å; E435-R439 PolarHBondContact OE1-NH2 2.97Å; E435-V464 HydrophobicContact CB-CG1 4.48Å; E435-V464 HydrophobicContact CG-CG1 4.18Å
436	T	88	Confident	86.4	Confident	44 Å²	44	49.4 Å²	49.4	27%	0.27	28%	0.277	S	S	.	.	H	α-helix	trans	-67	-39.7	179.5	57.2	0	0	0	0	112.4	T432 A433 V434 R439 K440	T432-T436 HydrophobicContact CG2-CG2 4.2Å; T432-T436 WeakPolarHBondContact O-CB 3.44Å; T432-T436 WeakPolarHBondContact O-CG2 3.32Å; T432-T436 PolarHBondContact O-N 3.25Å; T432-T436 PolarHBondContact O-OG1 3.4Å; A433-T436 PolarHBondContact O-OG1 2.89Å; A433-T436 VanDerWaalsContact O-OG1 3.11Å; V434-T436 VanDerWaalsContact C-N 3.35Å; V434-T436 PolarHBondContact O-N 3.21Å; T436-R439 PolarHBondContact O-N 2.88Å; T436-K440 WeakPolarHBondContact O-CB 2.94Å; T436-K440 WeakPolarHBondContact O-CD 2.84Å; T436-K440 VanDerWaalsContact O-CG 3.25Å; T436-K440 WeakPolarHBondContact O-CG 3.25Å; T436-K440 PolarHBondContact O-N 3.22Å
437	N	88.9	Confident	86.8	Confident	12 Å²	12	43 Å²	43	6%	0.064	24%	0.235	C	C	.	.	H	α-helix	trans	-71.2	-35.6	178.5	-73.9	-33.6	0	0	0	112.8	Y380 A433 V434 K440 S441	Y380-N437 HydrophobicContact CD2-CB 4.1Å; Y380-N437 HydrophobicContact CE2-CB 3.91Å; A433-N437 VanDerWaalsContact O-CB 3.24Å; A433-N437 WeakPolarHBondContact O-CB 3.49Å; A433-N437 PolarHBondContact O-N 3.05Å; A433-N437 PolarHBondContact O-ND2 3.32Å; V434-N437 PolarHBondContact O-N 2.94Å; N437-K440 PolarHBondContact O-N 3.31Å; N437-S441 WeakPolarHBondContact O-CB 3.22Å; N437-S441 PolarHBondContact O-N 2.96Å; N437-S441 PolarHBondContact O-OG 3.41Å
438	I	88.6	Confident	87.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-44.5	171.9	-72.2	171.7	0	0	0	110.5	Y380 V434 S441 H444 V464 A465	Y380-I438 HydrophobicContact CD1-CD1 4.45Å; Y380-I438 HydrophobicContact CD1-CG1 3.73Å; Y380-I438 HydrophobicContact CD2-CG1 4.25Å; Y380-I438 HydrophobicContact CE1-CD1 4.23Å; Y380-I438 HydrophobicContact CE1-CG1 3.84Å; Y380-I438 HydrophobicContact CE2-CG1 4.35Å; Y380-I438 HydrophobicContact CG-CG1 3.98Å; V434-I438 HydrophobicContact CG1-CD1 3.59Å; V434-I438 HydrophobicContact CG1-CG1 4.42Å; V434-I438 WeakPolarHBondContact O-CB 3.36Å; V434-I438 VanDerWaalsContact O-CG1 3.29Å; V434-I438 WeakPolarHBondContact O-CG1 3.41Å; V434-I438 PolarHBondContact O-N 2.74Å; I438-S441 PolarHBondContact O-N 3.2Å; I438-H444 WeakPolarHBondContact CG2-NE2 2.81Å; I438-H444 PolarHBondContact O-NE2 2.83Å; I438-H444 VanDerWaalsContact O-NE2 3.12Å; I438-V464 HydrophobicContact CD1-CB 4.04Å; I438-V464 HydrophobicContact CD1-CG1 3.84Å; I438-V464 HydrophobicContact CG2-CG1 4.34Å; I438-A465 HydrophobicContact CD1-CB 4.14Å; I438-A465 HydrophobicContact CG2-CB 4.31Å
439	R	87.1	Confident	86.6	Confident	138 Å²	138	35.7 Å²	35.7	52%	0.521	18%	0.178	S	C	.	.	H	α-helix	trans	-65.6	-37	176.3	-73	-178	-174.7	-166.5	3.9	112.9	E435 T436 S441	E435-R439 WeakPolarHBondContact O-CG 3.32Å; E435-R439 PolarHBondContact O-N 2.98Å; E435-R439 IonicContact OE1-CZ 3.8Å; E435-R439 IonicContact OE1-NE 2.74Å; E435-R439 PolarHBondContact OE1-NE 3.02Å; E435-R439 IonicContact OE1-NH2 2.92Å; E435-R439 PolarHBondContact OE1-NH2 2.97Å; T436-R439 PolarHBondContact O-N 2.88Å; R439-S441 PolarHBondContact O-N 2.79Å
440	K	88.6	Confident	85.5	Confident	84 Å²	84	32.9 Å²	32.9	37%	0.365	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1.4	176.5	-74.2	166.2	174	175.2	0	113.8	K375 L376 Y377 T436 N437	K375-K440 CarbonylContact C-O 3.44Å; K375-K440 VanDerWaalsContact CA-O 3.31Å; K375-K440 WeakPolarHBondContact CA-O 3.21Å; K375-K440 VanDerWaalsContact CB-O 3.3Å; K375-K440 WeakPolarHBondContact CB-O 3.34Å; L376-K440 HydrophobicContact CD1-CD 4.01Å; L376-K440 PolarHBondContact N-O 2.86Å; Y377-K440 HydrophobicContact CD2-CB 4.33Å; Y377-K440 PolarHBondContact N-O 2.91Å; Y377-K440 VanDerWaalsContact N-O 3.13Å; T436-K440 WeakPolarHBondContact O-CB 2.94Å; T436-K440 WeakPolarHBondContact O-CD 2.84Å; T436-K440 VanDerWaalsContact O-CG 3.25Å; T436-K440 WeakPolarHBondContact O-CG 3.25Å; T436-K440 PolarHBondContact O-N 3.22Å; N437-K440 PolarHBondContact O-N 3.31Å
441	S	90.2	Very high	84.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-105	142.8	-177.7	-63	0	0	0	0	113	K375 Y377 Y380 N437 I438 R439 S475	K375-S441 PolarHBondContact NZ-O 2.91Å; Y377-S441 WeakPolarHBondContact CB-OG 3.43Å; Y377-S441 WeakPolarHBondContact O-CA 2.88Å; Y380-S441 WeakPolarHBondContact CB-OG 3.43Å; N437-S441 WeakPolarHBondContact O-CB 3.22Å; N437-S441 PolarHBondContact O-N 2.96Å; N437-S441 PolarHBondContact O-OG 3.41Å; I438-S441 PolarHBondContact O-N 3.2Å; R439-S441 PolarHBondContact O-N 2.79Å; S441-S475 PolarHBondContact O-OG 3.24Å
442	R	88.4	Confident	83.2	Confident	28 Å²	28	33.6 Å²	33.6	11%	0.106	16%	0.16	C	C	.	.	S	Bend	trans	-85	-24	-178.7	-65.6	179.1	-177.7	106	14.7	114.3	D373 K375 Y377 D378 S475 P536	D373-R442 IonicContact OD1-CZ 3.85Å; D373-R442 IonicContact OD1-NE 2.69Å; D373-R442 IonicContact OD1-NH2 3.6Å; D373-R442 PolarHBondContact OD1-NH2 3.19Å; D373-R442 IonicContact OD2-CZ 3.7Å; D373-R442 IonicContact OD2-NE 3.51Å; D373-R442 PolarHBondContact OD2-NE 2.53Å; D373-R442 IonicContact OD2-NH2 2.82Å; K375-R442 HydrophobicContact CB-CG 3.91Å; K375-R442 HydrophobicContact CD-CB 4.34Å; K375-R442 HydrophobicContact CD-CG 3.58Å; K375-R442 HydrophobicContact CG-CG 4.35Å; K375-R442 PolarHBondContact O-NH2 2.63Å; Y377-R442 PolarHBondContact O-N 2.91Å; D378-R442 IonicContact OD1-CZ 3.63Å; D378-R442 IonicContact OD1-NH1 3.05Å; D378-R442 PolarHBondContact OD1-NH1 3.27Å; R442-S475 PolarHBondContact O-OG 3.45Å; R442-P536 HydrophobicContact CB-CG 4.36Å
443	R	90.9	Very high	81.7	Confident	52 Å²	52	34.5 Å²	34.5	20%	0.196	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.8	177.8	-65.7	-64.9	-171.1	-126.9	3.8	109.9	D378 A379 Y380 K476 I478 Q534 P536	D378-R443 PolarHBondContact O-N 2.95Å; A379-R443 CarbonylContact C-O 3.43Å; A379-R443 WeakPolarHBondContact CA-O 3.17Å; A379-R443 HydrophobicContact CB-CB 3.92Å; Y380-R443 PolarHBondContact N-O 2.88Å; R443-K476 WeakPolarHBondContact CA-O 3.42Å; R443-K476 WeakPolarHBondContact CD-O 3.33Å; R443-K476 VanDerWaalsContact NH1-CB 3.33Å; R443-K476 VanDerWaalsContact NH1-CG 3.28Å; R443-I478 HydrophobicContact CB-CD1 4.23Å; R443-I478 HydrophobicContact CG-CD1 4.25Å; R443-Q534 PolarHBondContact NE-O 3.04Å; R443-Q534 PolarHBondContact NH2-O 2.97Å; R443-P536 HydrophobicContact CG-CG 4.48Å
444	H	91.2	Very high	80.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.1	174.1	-52	138.5	0	0	0	108.2	Y380 I382 I438 F446 A465 S475 K476 V477 I478	Y380-H444 WeakPolarHBondContact O-CA 3.4Å; I382-H444 HydrophobicContact CD1-CB 4.33Å; I438-H444 WeakPolarHBondContact CG2-NE2 2.81Å; I438-H444 PolarHBondContact O-NE2 2.83Å; I438-H444 VanDerWaalsContact O-NE2 3.12Å; H444-F446 HydrophobicContact CB-CE2 3.96Å; H444-A465 HydrophobicContact CB-CB 4.47Å; H444-S475 WeakPolarHBondContact CE1-CB 3.44Å; H444-K476 PolarHBondContact N-O 3.04Å; H444-K476 VanDerWaalsContact N-O 3.12Å; H444-V477 CarbonylContact O-C 3.51Å; H444-V477 WeakPolarHBondContact O-CA 3.45Å; H444-I478 PolarHBondContact O-N 3.44Å
445	I	91.8	Very high	78.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.9	-179.5	-62.4	169	0	0	0	107.6	A379 Y380 V381 I382 L409 L417 I447 I478 I480 M535	A379-I445 HydrophobicContact CB-CD1 3.63Å; A379-I445 HydrophobicContact CB-CG1 3.96Å; Y380-I445 PolarHBondContact O-N 3.21Å; V381-I445 HydrophobicContact CG2-CB 4.49Å; V381-I445 HydrophobicContact CG2-CD1 4.38Å; I382-I445 PolarHBondContact N-O 3.16Å; L409-I445 HydrophobicContact CD1-CD1 4.35Å; L417-I445 HydrophobicContact CD2-CD1 4.33Å; I445-I447 HydrophobicContact CG2-CD1 3.86Å; I445-I478 CarbonylContact C-O 3.49Å; I445-I478 WeakPolarHBondContact CA-O 3.45Å; I445-I478 HydrophobicContact CG1-CB 4.06Å; I445-I478 HydrophobicContact CG1-CD1 4.14Å; I445-I478 HydrophobicContact CG1-CG2 4.47Å; I445-I480 HydrophobicContact CG2-CD1 3.65Å; I445-I480 HydrophobicContact CG2-CG1 4.25Å; I445-M535 HydrophobicContact CD1-SD 4.2Å
446	F	88.6	Confident	77.9	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127	173.9	-69.7	-104.8	0	0	0	109.4	I382 H444 L448 Q462 A465 V477 I478 L479 I480	I382-F446 HydrophobicContact CB-CD1 4.11Å; I382-F446 HydrophobicContact CB-CE1 4.33Å; I382-F446 HydrophobicContact CB-CG 4.44Å; I382-F446 HydrophobicContact CD1-CD1 4.09Å; I382-F446 HydrophobicContact CD1-CD2 4.16Å; I382-F446 HydrophobicContact CD1-CE1 3.58Å; I382-F446 HydrophobicContact CD1-CE2 3.71Å; I382-F446 HydrophobicContact CD1-CG 4.38Å; I382-F446 HydrophobicContact CD1-CZ 3.41Å; I382-F446 VanDerWaalsContact CD1-CZ 3.41Å; I382-F446 HydrophobicContact CG2-CD1 3.97Å; I382-F446 HydrophobicContact CG2-CE1 4.06Å; I382-F446 WeakPolarHBondContact O-CA 3.46Å; H444-F446 HydrophobicContact CB-CE2 3.96Å; F446-L448 HydrophobicContact CB-CD2 4.44Å; F446-Q462 HydrophobicContact CE1-CB 4.19Å; F446-Q462 HydrophobicContact CE1-CG 3.97Å; F446-A465 HydrophobicContact CE2-CB 4.33Å; F446-A465 HydrophobicContact CZ-CB 3.73Å; F446-V477 HydrophobicContact CD2-CG1 3.4Å; F446-V477 VanDerWaalsContact CD2-CG1 3.4Å; F446-V477 HydrophobicContact CE2-CB 4.44Å; F446-V477 HydrophobicContact CE2-CG1 3.58Å; F446-V477 HydrophobicContact CE2-CG2 4.07Å; F446-V477 HydrophobicContact CG-CG1 4.45Å; F446-I478 PolarHBondContact N-O 3.05Å; F446-L479 HydrophobicContact CB-CD2 3.82Å; F446-L479 HydrophobicContact CD2-CD2 4.25Å; F446-L479 HydrophobicContact CG-CD2 4.19Å; F446-I480 PolarHBondContact O-N 2.85Å
447	I	86.2	Confident	77.1	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	111.7	171.7	-51.4	-54.9	0	0	0	108.2	V381 I382 P384 V397 F400 V401 I445 I480 M482	V381-I447 HydrophobicContact CG1-CG1 4.34Å; I382-I447 PolarHBondContact O-N 2.81Å; P384-I447 WeakPolarHBondContact CD-O 3.16Å; V397-I447 HydrophobicContact CG1-CG2 4.16Å; F400-I447 HydrophobicContact CD1-CD1 4.4Å; F400-I447 HydrophobicContact CE1-CD1 3.89Å; V401-I447 HydrophobicContact CG2-CG1 4Å; I445-I447 HydrophobicContact CG2-CD1 3.86Å; I447-I480 HydrophobicContact CD1-CB 3.85Å; I447-I480 HydrophobicContact CD1-CD1 3.98Å; I447-I480 HydrophobicContact CD1-CG1 4.38Å; I447-I480 HydrophobicContact CD1-CG2 4.19Å; I447-M482 HydrophobicContact CG2-CG 3.48Å; I447-M482 VanDerWaalsContact CG2-CG 3.48Å; I447-M482 HydrophobicContact CG2-SD 4.45Å
448	L	80.8	Confident	76.5	Confident	8 Å²	8	52.6 Å²	52.6	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.8	-178.7	-55.1	176.2	0	0	0	109.9	F446 L479 I480 M482 L500 M504 T509	F446-L448 HydrophobicContact CB-CD2 4.44Å; L448-L479 HydrophobicContact CD1-CB 4.27Å; L448-I480 PolarHBondContact N-O 2.89Å; L448-M482 PolarHBondContact O-N 3.16Å; L448-L500 HydrophobicContact CD2-CD2 4.08Å; L448-M504 HydrophobicContact CD1-CE 4.22Å; L448-M504 HydrophobicContact CD1-CG 4.38Å; L448-M504 HydrophobicContact CD1-SD 4.08Å; L448-T509 HydrophobicContact CD1-CG2 4.15Å
449	T	72.4	Confident	75.9	Confident	12 Å²	12	55 Å²	55	7%	0.074	27%	0.269	C	S	.	.			trans	-133.9	158.7	177.6	62.1	0	0	0	0	109.8	P384 V397 Q451 I452 M482	P384-T449 HydrophobicContact CG-CG2 4.22Å; P384-T449 WeakPolarHBondContact CG-OG1 3.5Å; V397-T449 HydrophobicContact CG2-CG2 3.55Å; T449-Q451 PolarHBondContact O-N 2.84Å; T449-I452 WeakPolarHBondContact O-CD1 3.13Å; T449-I452 VanDerWaalsContact O-CG1 3.22Å; T449-I452 WeakPolarHBondContact O-CG1 3.33Å; T449-M482 HydrophobicContact CG2-CB 4.17Å
450	P	61.4	Low	75.7	Confident	33 Å²	33	52.1 Å²	52.1	21%	0.214	26%	0.259	C	S	.	.	S	Bend	trans	-69	-16.7	178.8	21.6	-30	0	0	0	114.1	I452 E483 L485	P450-I452 PolarHBondContact O-N 2.99Å; P450-E483 HydrophobicContact CG-CB 4.18Å; P450-E483 VanDerWaalsContact CG-OE2 3.26Å; P450-E483 WeakPolarHBondContact CG-OE2 3.44Å; P450-L485 HydrophobicContact CB-CD2 4.07Å
451	Q	57.5	Low	75.5	Confident	105 Å²	105	48.2 Å²	48.2	49%	0.491	24%	0.242	S	C	.	.			trans	-100.2	48.9	-175.7	-64	170.2	2	0	0	112.6	T449 T453	T449-Q451 PolarHBondContact O-N 2.84Å; Q451-T453 PolarHBondContact O-N 3.01Å
452	I	59.5	Low	75.2	Confident	45 Å²	45	48.9 Å²	48.9	23%	0.231	25%	0.245	C	C	.	.			trans	-85.6	89.6	178.2	-60.8	156.4	0	0	0	108.7	T449 P450 F458 L496	T449-I452 WeakPolarHBondContact O-CD1 3.13Å; T449-I452 VanDerWaalsContact O-CG1 3.22Å; T449-I452 WeakPolarHBondContact O-CG1 3.33Å; P450-I452 PolarHBondContact O-N 2.99Å; I452-F458 HydrophobicContact CG2-CE1 4.09Å; I452-L496 HydrophobicContact CD1-CD1 4.26Å; I452-L496 HydrophobicContact CG2-CD1 4.22Å
453	T	52.3	Low	75	Confident	90 Å²	90	52.4 Å²	52.4	55%	0.552	26%	0.263	S	S	*	.			trans	-166	136.8	158.6	30	0	0	0	0	113.2	Q451	Q451-T453 PolarHBondContact O-N 3.01Å
454	H	55.1	Low	74.8	Confident	186 Å²	186	51.1 Å²	51.1	86%	0.861	26%	0.261	S	S	*	.			trans	97.9	28.3	162.8	-51.9	-65.6	0	0	0	120.6
455	S	62.4	Low	74.5	Confident	30 Å²	30	51.1 Å²	51.1	21%	0.21	26%	0.261	C	S	.	.			trans	-116.1	117.5	160.2	175.6	0	0	0	0	110.7	E457 F458 A459	S455-E457 VanDerWaalsContact C-N 3.3Å; S455-E457 PolarHBondContact O-N 3.3Å; S455-F458 PolarHBondContact O-N 3.26Å; S455-F458 PolarHBondContact OG-N 3.43Å; S455-A459 PolarHBondContact O-N 2.82Å
456	E	67.1	Low	74.2	Confident	181 Å²	181	51.3 Å²	51.3	85%	0.846	26%	0.262	S	S	*	.	H	α-helix	trans	-62.6	-36.2	176.4	-67.9	-174.7	169.5	0	0	111.9	A459 Y460	E456-A459 PolarHBondContact O-N 2.97Å; E456-Y460 PolarHBondContact O-N 2.89Å; E456-Y460 VanDerWaalsContact O-N 3.15Å
457	E	70.1	Confident	74	Confident	91 Å²	91	55.4 Å²	55.4	43%	0.425	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-41.6	177.9	-66.4	-177.9	-172.1	0	0	112.2	Y420 S455 Y460 E461	Y420-E457 PolarHBondContact OH-OE2 3.02Å; S455-E457 VanDerWaalsContact C-N 3.3Å; S455-E457 PolarHBondContact O-N 3.3Å; E457-Y460 PolarHBondContact O-N 2.94Å; E457-E461 PolarHBondContact O-N 3.13Å; E457-E461 VanDerWaalsContact O-N 3.14Å
458	F	75.7	Confident	73.9	Confident	17 Å²	17	55.5 Å²	55.5	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-66.8	-40.7	177.9	176	-106.4	0	0	0	112.1	I382 Y383 P384 I452 S455 Y460 E461 Q462	I382-F458 HydrophobicContact CG2-CD2 4.19Å; I382-F458 HydrophobicContact CG2-CE2 3.66Å; I382-F458 HydrophobicContact CG2-CZ 4.46Å; Y383-F458 VanDerWaalsContact C-CD2 3.41Å; Y383-F458 WeakPolarHBondContact O-CD2 3.27Å; Y383-F458 WeakPolarHBondContact O-CE2 3.28Å; P384-F458 HydrophobicContact CB-CD2 4.48Å; P384-F458 HydrophobicContact CB-CE1 4.31Å; P384-F458 HydrophobicContact CB-CE2 4.26Å; P384-F458 HydrophobicContact CB-CZ 4.17Å; P384-F458 VanDerWaalsContact N-CE2 3.28Å; I452-F458 HydrophobicContact CG2-CE1 4.09Å; S455-F458 PolarHBondContact O-N 3.26Å; S455-F458 PolarHBondContact OG-N 3.43Å; F458-Y460 VanDerWaalsContact C-N 3.33Å; F458-Y460 PolarHBondContact O-N 3.46Å; F458-E461 PolarHBondContact O-N 3.11Å; F458-Q462 WeakPolarHBondContact O-CB 3.16Å; F458-Q462 PolarHBondContact O-N 2.8Å
459	A	76.6	Confident	74	Confident	52 Å²	52	55.6 Å²	55.6	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-41.6	177.8	0	0	0	0	0	111.6	S455 E456 Q462 E463	S455-A459 PolarHBondContact O-N 2.82Å; E456-A459 PolarHBondContact O-N 2.97Å; A459-Q462 PolarHBondContact O-N 2.84Å; A459-E463 PolarHBondContact O-N 2.81Å
460	Y	82.1	Confident	74.5	Confident	77 Å²	77	58.2 Å²	58.2	30%	0.302	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-48.6	176.1	179.2	-101.4	0	0	0	112.8	V431 V434 E456 E457 F458 Q462 E463 V464	V431-Y460 HydrophobicContact CB-CE1 4.46Å; V431-Y460 HydrophobicContact CG1-CE1 3.91Å; V431-Y460 HydrophobicContact CG1-CE2 4.31Å; V431-Y460 WeakPolarHBondContact CG1-OH 3.45Å; V434-Y460 HydrophobicContact CB-CE1 4.31Å; V434-Y460 HydrophobicContact CG1-CD1 4.22Å; V434-Y460 HydrophobicContact CG1-CE1 4Å; E456-Y460 PolarHBondContact O-N 2.89Å; E456-Y460 VanDerWaalsContact O-N 3.15Å; E457-Y460 PolarHBondContact O-N 2.94Å; F458-Y460 VanDerWaalsContact C-N 3.33Å; F458-Y460 PolarHBondContact O-N 3.46Å; Y460-Q462 VanDerWaalsContact C-N 3.28Å; Y460-Q462 PolarHBondContact O-N 3.02Å; Y460-E463 PolarHBondContact O-N 3.04Å; Y460-V464 HydrophobicContact CD1-CG2 4.44Å; Y460-V464 HydrophobicContact CD2-CG2 4.3Å; Y460-V464 HydrophobicContact CE1-CG2 3.96Å; Y460-V464 HydrophobicContact CE2-CG2 3.8Å; Y460-V464 WeakPolarHBondContact O-CG2 3.32Å; Y460-V464 PolarHBondContact O-N 2.82Å; Y460-V464 VanDerWaalsContact O-N 3.08Å
461	E	85.6	Confident	75.3	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-43.1	176.2	-82.1	-176.5	-118	0	0	112.4	Y380 I382 R385 Y420 V434 E457 F458 A465	Y380-E461 VanDerWaalsContact CE1-OE2 3.31Å; Y380-E461 WeakPolarHBondContact CE1-OE2 3.21Å; Y380-E461 PolarHBondContact OH-OE2 3.27Å; I382-E461 HydrophobicContact CG2-CB 4.43Å; R385-E461 IonicContact CZ-OE1 3.79Å; R385-E461 VanDerWaalsContact CZ-OE1 3.23Å; R385-E461 IonicContact NH1-OE1 3.02Å; R385-E461 PolarHBondContact NH1-OE1 2.87Å; R385-E461 IonicContact NH2-OE1 2.79Å; R385-E461 PolarHBondContact NH2-OE1 2.81Å; R385-E461 IonicContact NH2-OE2 3.95Å; R385-E461 PolarHBondContact NH2-OE2 2.83Å; R385-E461 VanDerWaalsContact NH2-OE2 3.15Å; Y420-E461 WeakPolarHBondContact CD2-OE1 3.5Å; Y420-E461 WeakPolarHBondContact CE2-OE1 3.46Å; V434-E461 HydrophobicContact CB-CG 4.42Å; V434-E461 HydrophobicContact CG1-CB 4.41Å; V434-E461 HydrophobicContact CG1-CG 3.57Å; V434-E461 HydrophobicContact CG2-CG 3.88Å; E457-E461 PolarHBondContact O-N 3.13Å; E457-E461 VanDerWaalsContact O-N 3.14Å; F458-E461 PolarHBondContact O-N 3.11Å; E461-A465 VanDerWaalsContact O-CB 3.29Å; E461-A465 WeakPolarHBondContact O-CB 3.34Å; E461-A465 PolarHBondContact O-N 3.27Å; E461-A465 VanDerWaalsContact O-N 3.08Å
462	Q	83.6	Confident	76.1	Confident	14 Å²	14	61 Å²	61	7%	0.065	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-47	178.9	166.7	168.6	-16.4	0	0	111.7	F446 F458 A459 Y460 A465 L466	F446-Q462 HydrophobicContact CE1-CB 4.19Å; F446-Q462 HydrophobicContact CE1-CG 3.97Å; F458-Q462 WeakPolarHBondContact O-CB 3.16Å; F458-Q462 PolarHBondContact O-N 2.8Å; A459-Q462 PolarHBondContact O-N 2.84Å; Y460-Q462 VanDerWaalsContact C-N 3.28Å; Y460-Q462 PolarHBondContact O-N 3.02Å; Q462-A465 PolarHBondContact O-N 3.33Å; Q462-L466 WeakPolarHBondContact O-CB 3.37Å; Q462-L466 PolarHBondContact O-N 2.74Å
463	E	83.9	Confident	76.7	Confident	102 Å²	102	65 Å²	65	48%	0.477	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-45.1	-178.9	-177.6	164.6	-142.8	0	0	112.1	A459 Y460 A465 L466 H467 Q497	A459-E463 PolarHBondContact O-N 2.81Å; Y460-E463 PolarHBondContact O-N 3.04Å; E463-A465 PolarHBondContact O-N 2.89Å; E463-L466 PolarHBondContact O-N 3.18Å; E463-H467 VanDerWaalsContact O-CB 3.31Å; E463-H467 WeakPolarHBondContact O-CB 3.45Å; E463-H467 PolarHBondContact O-N 2.04Å; E463-Q497 PolarHBondContact OE1-NE2 3.06Å; E463-Q497 VanDerWaalsContact OE1-NE2 3.09Å
464	V	86.8	Confident	77.5	Confident	26 Å²	26	65.5 Å²	65.5	16%	0.158	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-44.3	179.1	175.5	0	0	0	0	111.3	E435 I438 Y460 S468	E435-V464 HydrophobicContact CB-CG1 4.48Å; E435-V464 HydrophobicContact CG-CG1 4.18Å; I438-V464 HydrophobicContact CD1-CB 4.04Å; I438-V464 HydrophobicContact CD1-CG1 3.84Å; I438-V464 HydrophobicContact CG2-CG1 4.34Å; Y460-V464 HydrophobicContact CD1-CG2 4.44Å; Y460-V464 HydrophobicContact CD2-CG2 4.3Å; Y460-V464 HydrophobicContact CE1-CG2 3.96Å; Y460-V464 HydrophobicContact CE2-CG2 3.8Å; Y460-V464 WeakPolarHBondContact O-CG2 3.32Å; Y460-V464 PolarHBondContact O-N 2.82Å; Y460-V464 VanDerWaalsContact O-N 3.08Å; V464-S468 WeakPolarHBondContact O-CB 3.5Å; V464-S468 PolarHBondContact O-N 3.17Å
465	A	85.9	Confident	78.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.2	-40	178	0	0	0	0	0	112.1	I382 I438 H444 F446 E461 Q462 E463 S468 A469	I382-A465 HydrophobicContact CD1-CB 3.21Å; I438-A465 HydrophobicContact CD1-CB 4.14Å; I438-A465 HydrophobicContact CG2-CB 4.31Å; H444-A465 HydrophobicContact CB-CB 4.47Å; F446-A465 HydrophobicContact CE2-CB 4.33Å; F446-A465 HydrophobicContact CZ-CB 3.73Å; E461-A465 VanDerWaalsContact O-CB 3.29Å; E461-A465 WeakPolarHBondContact O-CB 3.34Å; E461-A465 PolarHBondContact O-N 3.27Å; E461-A465 VanDerWaalsContact O-N 3.08Å; Q462-A465 PolarHBondContact O-N 3.33Å; E463-A465 PolarHBondContact O-N 2.89Å; A465-S468 PolarHBondContact O-N 3.28Å; A465-A469 WeakPolarHBondContact O-CB 3.45Å; A465-A469 PolarHBondContact O-N 2.78Å
466	L	85.3	Confident	79.6	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-41.9	178.5	-170.1	59.1	0	0	0	111.7	Q462 E463 A469 L470 L500 L503	Q462-L466 WeakPolarHBondContact O-CB 3.37Å; Q462-L466 PolarHBondContact O-N 2.74Å; E463-L466 PolarHBondContact O-N 3.18Å; L466-A469 PolarHBondContact O-N 2.84Å; L466-L470 HydrophobicContact CD1-CD1 3.48Å; L466-L470 VanDerWaalsContact CD1-CD1 3.48Å; L466-L470 HydrophobicContact CD1-CG 3.94Å; L466-L470 HydrophobicContact CG-CD1 3.83Å; L466-L470 HydrophobicContact CG-CG 4.48Å; L466-L470 WeakPolarHBondContact O-CB 3.18Å; L466-L470 PolarHBondContact O-N 3.16Å; L466-L500 HydrophobicContact CD2-CB 4.38Å; L466-L503 HydrophobicContact CD1-CD1 3.37Å; L466-L503 HydrophobicContact CD1-CG 4.49Å
467	H	84.1	Confident	80.6	Confident	87 Å²	87	53 Å²	53	40%	0.403	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-46.3	172.1	179.5	-80	0	0	0	111.3	E463 A469 I471 Q472	E463-H467 VanDerWaalsContact O-CB 3.31Å; E463-H467 WeakPolarHBondContact O-CB 3.45Å; E463-H467 PolarHBondContact O-N 2.04Å; H467-A469 VanDerWaalsContact C-N 3.29Å; H467-A469 PolarHBondContact O-N 2Å; H467-I471 WeakPolarHBondContact CD2-CD1 3.27Å; H467-I471 WeakPolarHBondContact O-CB 3.39Å; H467-I471 PolarHBondContact O-N 3Å; H467-Q472 PolarHBondContact O-N 2.88Å
468	S	83.5	Confident	81.5	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.028	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-36.3	177.1	-175.9	0	0	0	0	112.6	V464 A465 Q472 N473 D474	V464-S468 WeakPolarHBondContact O-CB 3.5Å; V464-S468 PolarHBondContact O-N 3.17Å; A465-S468 PolarHBondContact O-N 3.28Å; S468-Q472 WeakPolarHBondContact O-CB 3.4Å; S468-N473 PolarHBondContact O-N 3.48Å; S468-D474 PolarHBondContact O-N 2.89Å
469	A	83.6	Confident	82.1	Confident	11 Å²	11	48 Å²	48	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-78.8	-45.6	-179.8	0	0	0	0	0	114.2	A465 L466 H467 N473 S475 V477	A465-A469 WeakPolarHBondContact O-CB 3.45Å; A465-A469 PolarHBondContact O-N 2.78Å; L466-A469 PolarHBondContact O-N 2.84Å; H467-A469 VanDerWaalsContact C-N 3.29Å; H467-A469 PolarHBondContact O-N 2Å; A469-N473 WeakPolarHBondContact O-CA 3.34Å; A469-S475 WeakPolarHBondContact CA-O 3.47Å; A469-V477 HydrophobicContact CB-CG2 3.33Å
470	L	81.6	Confident	82.6	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.346	22%	0.224	S	C	.	.	H	α-helix	trans	-87.6	-37.9	-172.2	-71.2	179.4	0	0	0	113.4	L466 L503	L466-L470 HydrophobicContact CD1-CD1 3.48Å; L466-L470 VanDerWaalsContact CD1-CD1 3.48Å; L466-L470 HydrophobicContact CD1-CG 3.94Å; L466-L470 HydrophobicContact CG-CD1 3.83Å; L466-L470 HydrophobicContact CG-CG 4.48Å; L466-L470 WeakPolarHBondContact O-CB 3.18Å; L466-L470 PolarHBondContact O-N 3.16Å; L470-L503 HydrophobicContact CD1-CD1 4.24Å; L470-L503 HydrophobicContact CD1-CG 4.41Å; L470-L503 HydrophobicContact CD2-CD1 4Å; L470-L503 HydrophobicContact CD2-CD2 3.64Å; L470-L503 HydrophobicContact CD2-CG 3.81Å; L470-L503 HydrophobicContact CG-CD1 4.13Å; L470-L503 HydrophobicContact CG-CG 4.41Å
471	I	79.6	Confident	82.7	Confident	124 Å²	124	42.4 Å²	42.4	64%	0.636	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-48.4	-173.7	-65.1	164.9	0	0	0	110.4	H467	H467-I471 WeakPolarHBondContact CD2-CD1 3.27Å; H467-I471 WeakPolarHBondContact O-CB 3.39Å; H467-I471 PolarHBondContact O-N 3Å
472	Q	74.3	Confident	82.1	Confident	73 Å²	73	43 Å²	43	34%	0.341	22%	0.216	S	C	.	.	S	Bend	trans	-82	-20.8	-179.3	-64	174.7	-21.1	0	0	112.8	H467 S468 D474	H467-Q472 PolarHBondContact O-N 2.88Å; S468-Q472 WeakPolarHBondContact O-CB 3.4Å; Q472-D474 HydrophobicContact CB-CB 4.35Å; Q472-D474 PolarHBondContact O-N 2.9Å; Q472-D474 VanDerWaalsContact O-N 3.12Å
473	N	71.8	Confident	81.3	Confident	130 Å²	130	45.7 Å²	45.7	70%	0.695	23%	0.228	S	C	*	.			trans	54.1	25.3	-176.9	-160.7	19.9	0	0	0	113.6	S468 A469	S468-N473 PolarHBondContact O-N 3.48Å; A469-N473 WeakPolarHBondContact O-CA 3.34Å
474	D	68.4	Low	80.1	Confident	100 Å²	100	44.7 Å²	44.7	54%	0.535	24%	0.237	S	C	.	.			trans	-82.2	-18.7	-173.2	-82.5	-26.6	0	0	0	113.1	K375 S468 Q472	K375-D474 PolarHBondContact NZ-O 3.04Å; S468-D474 PolarHBondContact O-N 2.89Å; Q472-D474 HydrophobicContact CB-CB 4.35Å; Q472-D474 PolarHBondContact O-N 2.9Å; Q472-D474 VanDerWaalsContact O-N 3.12Å
475	S	78.7	Confident	78.6	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.028	24%	0.24	C	C	.	.	S	Bend	trans	-150.5	147.2	-177.3	-74.1	0	0	0	0	110.7	K375 S441 R442 H444 A469	K375-S475 PolarHBondContact NZ-OG 3.14Å; S441-S475 PolarHBondContact O-OG 3.24Å; R442-S475 PolarHBondContact O-OG 3.45Å; H444-S475 WeakPolarHBondContact CE1-CB 3.44Å; A469-S475 WeakPolarHBondContact CA-O 3.47Å
476	K	84.4	Confident	77	Confident	127 Å²	127	48.6 Å²	48.6	55%	0.552	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	147.3	173.2	-61.7	-174.3	179.7	-168	0	110.7	R443 H444	R443-K476 WeakPolarHBondContact CA-O 3.42Å; R443-K476 WeakPolarHBondContact CD-O 3.33Å; R443-K476 VanDerWaalsContact NH1-CB 3.33Å; R443-K476 VanDerWaalsContact NH1-CG 3.28Å; H444-K476 PolarHBondContact N-O 3.04Å; H444-K476 VanDerWaalsContact N-O 3.12Å
477	V	87.3	Confident	75.4	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	147.4	178.8	179.4	0	0	0	0	110.5	H444 F446 A469 L479 L503 Q507	H444-V477 CarbonylContact O-C 3.51Å; H444-V477 WeakPolarHBondContact O-CA 3.45Å; F446-V477 HydrophobicContact CD2-CG1 3.4Å; F446-V477 VanDerWaalsContact CD2-CG1 3.4Å; F446-V477 HydrophobicContact CE2-CB 4.44Å; F446-V477 HydrophobicContact CE2-CG1 3.58Å; F446-V477 HydrophobicContact CE2-CG2 4.07Å; F446-V477 HydrophobicContact CG-CG1 4.45Å; A469-V477 HydrophobicContact CB-CG2 3.33Å; V477-L479 HydrophobicContact CG1-CD2 3.52Å; V477-L479 HydrophobicContact CG1-CG 4.01Å; V477-L503 HydrophobicContact CB-CD1 4.4Å; V477-L503 HydrophobicContact CG1-CD1 4.5Å; V477-L503 HydrophobicContact CG2-CD1 4.08Å; V477-Q507 PolarHBondContact O-NE2 3.27Å
478	I	89.6	Confident	73.6	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	115.7	171.5	-59.7	177.6	0	0	0	106.6	R443 H444 I445 F446 I480 I510 Q534 M535	R443-I478 HydrophobicContact CB-CD1 4.23Å; R443-I478 HydrophobicContact CG-CD1 4.25Å; H444-I478 PolarHBondContact O-N 3.44Å; I445-I478 CarbonylContact C-O 3.49Å; I445-I478 WeakPolarHBondContact CA-O 3.45Å; I445-I478 HydrophobicContact CG1-CB 4.06Å; I445-I478 HydrophobicContact CG1-CD1 4.14Å; I445-I478 HydrophobicContact CG1-CG2 4.47Å; F446-I478 PolarHBondContact N-O 3.05Å; I478-I480 HydrophobicContact CG2-CG1 4.24Å; I478-I510 HydrophobicContact CG2-CD1 4.13Å; I478-Q534 HydrophobicContact CD1-CB 3.96Å; I478-Q534 HydrophobicContact CG1-CB 3.96Å; I478-M535 HydrophobicContact CD1-CG 4.06Å; I478-M535 HydrophobicContact CD1-SD 3.66Å
479	L	88	Confident	72.2	Confident	1 Å²	1	60 Å²	60	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.4	-178.2	-57.9	176.7	0	0	0	109.7	F446 L448 V477 L500 L503 M504 T509 I510	F446-L479 HydrophobicContact CB-CD2 3.82Å; F446-L479 HydrophobicContact CD2-CD2 4.25Å; F446-L479 HydrophobicContact CG-CD2 4.19Å; L448-L479 HydrophobicContact CD1-CB 4.27Å; V477-L479 HydrophobicContact CG1-CD2 3.52Å; V477-L479 HydrophobicContact CG1-CG 4.01Å; L479-L500 HydrophobicContact CD2-CD1 3.83Å; L479-L503 HydrophobicContact CD1-CB 4.35Å; L479-M504 HydrophobicContact CD1-CB 4.4Å; L479-M504 HydrophobicContact CD1-CG 3.71Å; L479-T509 HydrophobicContact CB-CG2 4.12Å; L479-T509 HydrophobicContact CD1-CG2 4.33Å; L479-I510 PolarHBondContact O-N 2.9Å
480	I	87.6	Confident	70.5	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.7	177.7	-60.6	177.9	0	0	0	108.7	F400 I445 F446 I447 L448 I478 I510 F527 V531	F400-I480 HydrophobicContact CE1-CG2 4.49Å; F400-I480 HydrophobicContact CZ-CG2 4.47Å; I445-I480 HydrophobicContact CG2-CD1 3.65Å; I445-I480 HydrophobicContact CG2-CG1 4.25Å; F446-I480 PolarHBondContact O-N 2.85Å; I447-I480 HydrophobicContact CD1-CB 3.85Å; I447-I480 HydrophobicContact CD1-CD1 3.98Å; I447-I480 HydrophobicContact CD1-CG1 4.38Å; I447-I480 HydrophobicContact CD1-CG2 4.19Å; L448-I480 PolarHBondContact N-O 2.89Å; I478-I480 HydrophobicContact CG2-CG1 4.24Å; I480-I510 WeakPolarHBondContact CA-O 3.41Å; I480-F527 HydrophobicContact CD1-CZ 4.22Å; I480-F527 HydrophobicContact CG2-CE2 3.95Å; I480-F527 HydrophobicContact CG2-CZ 3.88Å; I480-V531 HydrophobicContact CD1-CG2 4.38Å
481	E	83.8	Confident	68.8	Low	12 Å²	12	65.7 Å²	65.7	6%	0.056	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	114.3	179.2	-176.8	-177.3	169.9	0	0	108.8	E483 L485 T509 I510 K511 W512	E481-E483 VanDerWaalsContact CG-O 3.26Å; E481-E483 WeakPolarHBondContact CG-O 3.4Å; E481-L485 PolarHBondContact OE1-N 2.86Å; E481-T509 PolarHBondContact OE2-OG1 2.85Å; E481-I510 PolarHBondContact N-O 3.07Å; E481-K511 IonicContact OE1-NZ 3.73Å; E481-K511 VanDerWaalsContact OE2-CE 3.29Å; E481-K511 WeakPolarHBondContact OE2-CE 3.45Å; E481-K511 IonicContact OE2-NZ 2.81Å; E481-W512 WeakPolarHBondContact O-CB 3.38Å; E481-W512 PolarHBondContact O-N 3.35Å
482	M	73.5	Confident	67.2	Low	14 Å²	14	66.9 Å²	66.9	7%	0.069	35%	0.35	C	S	.	.	S	Bend	trans	-81.1	-30.3	-175.2	-78.9	-90.2	-65.5	0	0	113.7	V397 F400 I447 L448 T449 W512	V397-M482 HydrophobicContact CB-CE 4.43Å; V397-M482 HydrophobicContact CG2-CE 4.02Å; F400-M482 HydrophobicContact CB-CE 3.84Å; F400-M482 HydrophobicContact CB-SD 3.95Å; F400-M482 HydrophobicContact CD1-SD 3.73Å; F400-M482 HydrophobicContact CD2-SD 4.01Å; F400-M482 HydrophobicContact CE1-SD 4.23Å; F400-M482 HydrophobicContact CE2-SD 4.49Å; F400-M482 HydrophobicContact CG-CE 4.21Å; F400-M482 HydrophobicContact CG-SD 3.61Å; I447-M482 HydrophobicContact CG2-CG 3.48Å; I447-M482 VanDerWaalsContact CG2-CG 3.48Å; I447-M482 HydrophobicContact CG2-SD 4.45Å; L448-M482 PolarHBondContact O-N 3.16Å; T449-M482 HydrophobicContact CG2-CB 4.17Å; M482-W512 HydrophobicContact SD-CG 4.26Å
483	E	66.6	Low	66	Low	71 Å²	71	64.6 Å²	64.6	33%	0.332	34%	0.343	S	S	.	.	S	Bend	trans	-141.7	147.4	179.7	-68.6	176.9	176.9	0	0	108.3	P450 E481 L485	P450-E483 HydrophobicContact CG-CB 4.18Å; P450-E483 VanDerWaalsContact CG-OE2 3.26Å; P450-E483 WeakPolarHBondContact CG-OE2 3.44Å; E481-E483 VanDerWaalsContact CG-O 3.26Å; E481-E483 WeakPolarHBondContact CG-O 3.4Å; E483-L485 PolarHBondContact O-N 2.93Å
484	A	57.5	Low	64.7	Low	80 Å²	80	65.7 Å²	65.7	66%	0.661	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-66.3	117.2	-178.7	0	0	0	0	0	110.1	S486	A484-S486 PolarHBondContact O-N 3.28Å
485	L	56.4	Low	63.8	Low	43 Å²	43	65.1 Å²	65.1	23%	0.225	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-67	122.8	175.6	-69.8	162.6	0	0	0	109.7	P450 E481 E483 D489 M504	P450-L485 HydrophobicContact CB-CD2 4.07Å; E481-L485 PolarHBondContact OE1-N 2.86Å; E483-L485 PolarHBondContact O-N 2.93Å; L485-D489 HydrophobicContact CD2-CB 4.36Å; L485-M504 HydrophobicContact CD1-CE 4.14Å
486	S	52.5	Low	62.6	Low	65 Å²	65	66.1 Å²	66.1	46%	0.455	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-69.6	150.5	171.9	-31.6	0	0	0	0	109.4	A484 L488 D489 M490	A484-S486 PolarHBondContact O-N 3.28Å; S486-L488 PolarHBondContact O-N 3.16Å; S486-D489 WeakPolarHBondContact CB-OD2 3.46Å; S486-D489 PolarHBondContact N-OD2 2.79Å; S486-D489 WeakPolarHBondContact O-CB 3.5Å; S486-D489 PolarHBondContact O-N 3.09Å; S486-D489 PolarHBondContact OG-OD2 2.93Å; S486-M490 PolarHBondContact O-N 2.82Å
487	E	51.6	Low	61.7	Low	167 Å²	167	63.4 Å²	63.4	78%	0.78	35%	0.347	S	S	*	.	H	α-helix	trans	-56	-26.9	174.1	-75	-177.2	161.8	0	0	112.7	M490	E487-M490 HydrophobicContact CG-CE 4.42Å
488	L	46	Very low	60.8	Low	128 Å²	128	69.5 Å²	69.5	67%	0.67	38%	0.38	S	S	*	.	H	α-helix	trans	-74.6	-28.3	175.1	-161.3	66.2	0	0	0	113.3	S486 L491 Q492	S486-L488 PolarHBondContact O-N 3.16Å; L488-L491 HydrophobicContact CD1-CD1 4.45Å; L488-L491 PolarHBondContact O-N 2.92Å; L488-Q492 PolarHBondContact O-N 2.83Å
489	D	52.8	Low	60.1	Low	40 Å²	40	71.8 Å²	71.8	21%	0.214	40%	0.396	C	S	.	.	H	α-helix	trans	-77.9	-29.3	176.9	-60.5	-37.1	0	0	0	111.2	L485 S486 L491 Q492 A493	L485-D489 HydrophobicContact CD2-CB 4.36Å; S486-D489 WeakPolarHBondContact CB-OD2 3.46Å; S486-D489 PolarHBondContact N-OD2 2.79Å; S486-D489 WeakPolarHBondContact O-CB 3.5Å; S486-D489 PolarHBondContact O-N 3.09Å; S486-D489 PolarHBondContact OG-OD2 2.93Å; D489-L491 VanDerWaalsContact C-N 3.27Å; D489-L491 PolarHBondContact O-N 3Å; D489-Q492 PolarHBondContact O-N 2.82Å; D489-A493 PolarHBondContact O-N 2.83Å
490	M	49.4	Very low	59.5	Low	93 Å²	93	71.8 Å²	71.8	46%	0.458	40%	0.396	S	S	.	.	H	α-helix	trans	-68.5	-23.8	171.3	-76.4	-160.4	-70.8	0	0	113.4	S486 E487	S486-M490 PolarHBondContact O-N 2.82Å; E487-M490 HydrophobicContact CG-CE 4.42Å
491	L	44.3	Very low	58.8	Low	104 Å²	104	76.7 Å²	76.7	55%	0.545	41%	0.414	S	S	.	.	H	α-helix	trans	-78.1	-31.9	172.8	-80.8	157.5	0	0	0	111.9	L488 D489 A493 E494	L488-L491 HydrophobicContact CD1-CD1 4.45Å; L488-L491 PolarHBondContact O-N 2.92Å; D489-L491 VanDerWaalsContact C-N 3.27Å; D489-L491 PolarHBondContact O-N 3Å; L491-A493 VanDerWaalsContact C-N 3.3Å; L491-E494 VanDerWaalsContact O-CG 3.25Å; L491-E494 WeakPolarHBondContact O-CG 3.19Å; L491-E494 PolarHBondContact O-N 2.86Å
492	Q	47.5	Very low	58.5	Low	149 Å²	149	81.1 Å²	81.1	70%	0.696	44%	0.435	S	S	*	.	H	α-helix	trans	-75.9	-20.9	170.8	-72.2	-177.2	-5.7	0	0	112.7	L488 D489 E494	L488-Q492 PolarHBondContact O-N 2.83Å; D489-Q492 PolarHBondContact O-N 2.82Å; Q492-E494 PolarHBondContact O-N 3.42Å; Q492-E494 VanDerWaalsContact O-N 3.08Å
493	A	48.1	Very low	58.7	Low	24 Å²	24	81.2 Å²	81.2	20%	0.198	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-72.3	20.3	167.7	0	0	0	0	0	113.7	D489 L491 A495 L496	D489-A493 PolarHBondContact O-N 2.83Å; L491-A493 VanDerWaalsContact C-N 3.3Å; A493-A495 PolarHBondContact O-N 2.81Å; A493-L496 HydrophobicContact CB-CB 3.79Å; A493-L496 HydrophobicContact CB-CD2 4.02Å; A493-L496 WeakPolarHBondContact O-CA 3.36Å; A493-L496 WeakPolarHBondContact O-CB 3.44Å; A493-L496 PolarHBondContact O-N 3.05Å
494	E	44.9	Very low	59.2	Low	154 Å²	154	79.8 Å²	79.8	72%	0.72	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-63.8	-18.2	167.8	-84.7	176.4	178.7	0	0	112.8	L491 Q492 L496	L491-E494 VanDerWaalsContact O-CG 3.25Å; L491-E494 WeakPolarHBondContact O-CG 3.19Å; L491-E494 PolarHBondContact O-N 2.86Å; Q492-E494 PolarHBondContact O-N 3.42Å; Q492-E494 VanDerWaalsContact O-N 3.08Å; E494-L496 VanDerWaalsContact C-N 3.31Å
495	A	48.9	Very low	60	Low	88 Å²	88	83 Å²	83	73%	0.727	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-82.2	-6.4	167.2	0	0	0	0	0	113.6	A493 Q497	A493-A495 PolarHBondContact O-N 2.81Å; A495-Q497 PolarHBondContact O-N 3.44Å
496	L	54.5	Low	61.1	Low	24 Å²	24	86 Å²	86	13%	0.126	45%	0.451	C	S	.	.	S	Bend	trans	-87.6	88.4	-175.7	-162.6	75.9	0	0	0	109.7	I452 A493 E494 D498 L500	I452-L496 HydrophobicContact CD1-CD1 4.26Å; I452-L496 HydrophobicContact CG2-CD1 4.22Å; A493-L496 HydrophobicContact CB-CB 3.79Å; A493-L496 HydrophobicContact CB-CD2 4.02Å; A493-L496 WeakPolarHBondContact O-CA 3.36Å; A493-L496 WeakPolarHBondContact O-CB 3.44Å; A493-L496 PolarHBondContact O-N 3.05Å; E494-L496 VanDerWaalsContact C-N 3.31Å; L496-D498 PolarHBondContact O-N 3.3Å; L496-L500 HydrophobicContact CD1-CD2 3.78Å; L496-L500 HydrophobicContact CD2-CD2 3.89Å; L496-L500 HydrophobicContact CG-CD2 3.84Å
497	Q	64.6	Low	62.3	Low	70 Å²	70	86.5 Å²	86.5	33%	0.327	45%	0.446	S	S	.	.			trans	-11.7	114.3	171.4	-148.3	164.7	10.6	0	0	114.1	E463 A495 S499 L500	E463-Q497 PolarHBondContact OE1-NE2 3.06Å; E463-Q497 VanDerWaalsContact OE1-NE2 3.09Å; A495-Q497 PolarHBondContact O-N 3.44Å; Q497-S499 PolarHBondContact O-N 2.91Å; Q497-L500 PolarHBondContact O-N 3.25Å
498	D	68.3	Low	63.6	Low	131 Å²	131	80 Å²	80	70%	0.701	42%	0.424	S	S	*	.	H	α-helix	trans	-43.7	-30.2	-174.3	-68.4	-42.8	0	0	0	114.9	L496 L500 R501 H502	L496-D498 PolarHBondContact O-N 3.3Å; D498-L500 PolarHBondContact O-N 2.82Å; D498-R501 PolarHBondContact O-N 2.85Å; D498-H502 PolarHBondContact O-N 3.36Å
499	S	74.5	Confident	65.3	Low	50 Å²	50	75.9 Å²	75.9	35%	0.35	40%	0.404	S	S	.	.	H	α-helix	trans	-58.7	-37.8	175.7	-69.9	0	0	0	0	114.1	Q497 L503	Q497-S499 PolarHBondContact O-N 2.91Å; S499-L503 PolarHBondContact O-N 3.06Å
500	L	76.5	Confident	66.9	Low	1 Å²	1	74.6 Å²	74.6	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-76	-37.3	177.7	-174.6	64.2	0	0	0	111.4	L448 L466 L479 L496 Q497 D498 L503 M504	L448-L500 HydrophobicContact CD2-CD2 4.08Å; L466-L500 HydrophobicContact CD2-CB 4.38Å; L479-L500 HydrophobicContact CD2-CD1 3.83Å; L496-L500 HydrophobicContact CD1-CD2 3.78Å; L496-L500 HydrophobicContact CD2-CD2 3.89Å; L496-L500 HydrophobicContact CG-CD2 3.84Å; Q497-L500 PolarHBondContact O-N 3.25Å; D498-L500 PolarHBondContact O-N 2.82Å; L500-L503 WeakPolarHBondContact O-CB 3.4Å; L500-L503 PolarHBondContact O-N 2.79Å; L500-M504 WeakPolarHBondContact O-CG 3.34Å; L500-M504 PolarHBondContact O-N 2.92Å
501	R	73.1	Confident	68.5	Low	103 Å²	103	76.3 Å²	76.3	39%	0.389	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-47	174.2	-173.8	-176.9	-62.1	-145.2	-1.6	111	D498 L503 M504 E505	D498-R501 PolarHBondContact O-N 2.85Å; R501-L503 VanDerWaalsContact C-N 3.28Å; R501-L503 PolarHBondContact O-N 2.83Å; R501-M504 WeakPolarHBondContact O-CB 3.23Å; R501-M504 PolarHBondContact O-N 3.45Å; R501-M504 VanDerWaalsContact O-N 3.11Å; R501-E505 PolarHBondContact O-N 2.69Å
502	H	76.6	Confident	70.2	Confident	104 Å²	104	72.7 Å²	72.7	48%	0.481	38%	0.381	S	S	.	.	H	α-helix	trans	-57.4	-40.9	174.5	177.3	-91	0	0	0	112	D498 E505 V506	D498-H502 PolarHBondContact O-N 3.36Å; H502-E505 PolarHBondContact O-N 3Å; H502-V506 WeakPolarHBondContact O-CB 3.44Å; H502-V506 VanDerWaalsContact O-CG2 3.29Å; H502-V506 WeakPolarHBondContact O-CG2 3.46Å; H502-V506 PolarHBondContact O-N 2.93Å
503	L	78.4	Confident	71.2	Confident	16 Å²	16	74.5 Å²	74.5	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-38.7	175	-80.3	176.3	0	0	0	113.4	L466 L470 V477 L479 S499 L500 R501 E505 V506 Q507	L466-L503 HydrophobicContact CD1-CD1 3.37Å; L466-L503 HydrophobicContact CD1-CG 4.49Å; L470-L503 HydrophobicContact CD1-CD1 4.24Å; L470-L503 HydrophobicContact CD1-CG 4.41Å; L470-L503 HydrophobicContact CD2-CD1 4Å; L470-L503 HydrophobicContact CD2-CD2 3.64Å; L470-L503 HydrophobicContact CD2-CG 3.81Å; L470-L503 HydrophobicContact CG-CD1 4.13Å; L470-L503 HydrophobicContact CG-CG 4.41Å; V477-L503 HydrophobicContact CB-CD1 4.4Å; V477-L503 HydrophobicContact CG1-CD1 4.5Å; V477-L503 HydrophobicContact CG2-CD1 4.08Å; L479-L503 HydrophobicContact CD1-CB 4.35Å; S499-L503 PolarHBondContact O-N 3.06Å; L500-L503 WeakPolarHBondContact O-CB 3.4Å; L500-L503 PolarHBondContact O-N 2.79Å; R501-L503 VanDerWaalsContact C-N 3.28Å; R501-L503 PolarHBondContact O-N 2.83Å; L503-E505 VanDerWaalsContact C-N 3.33Å; L503-V506 PolarHBondContact O-N 3.42Å; L503-Q507 WeakPolarHBondContact O-CB 3.4Å; L503-Q507 PolarHBondContact O-N 2.9Å
504	M	75.9	Confident	71.7	Confident	41 Å²	41	77.7 Å²	77.7	20%	0.202	39%	0.392	C	S	.	.	H	α-helix	trans	-61.9	-41.4	175.8	-71.9	173.1	67.1	0	0	111.5	L448 L479 L485 L500 R501 G508 T509	L448-M504 HydrophobicContact CD1-CE 4.22Å; L448-M504 HydrophobicContact CD1-CG 4.38Å; L448-M504 HydrophobicContact CD1-SD 4.08Å; L479-M504 HydrophobicContact CD1-CB 4.4Å; L479-M504 HydrophobicContact CD1-CG 3.71Å; L485-M504 HydrophobicContact CD1-CE 4.14Å; L500-M504 WeakPolarHBondContact O-CG 3.34Å; L500-M504 PolarHBondContact O-N 2.92Å; R501-M504 WeakPolarHBondContact O-CB 3.23Å; R501-M504 PolarHBondContact O-N 3.45Å; R501-M504 VanDerWaalsContact O-N 3.11Å; M504-G508 VanDerWaalsContact O-CA 3.3Å; M504-G508 WeakPolarHBondContact O-CA 3.31Å; M504-G508 PolarHBondContact O-N 2.95Å; M504-G508 VanDerWaalsContact O-N 3.12Å; M504-T509 HydrophobicContact CB-CG2 4.47Å; M504-T509 HydrophobicContact CE-CG2 4.15Å; M504-T509 HydrophobicContact CG-CG2 4.1Å
505	E	76.1	Confident	72	Confident	149 Å²	149	75.2 Å²	75.2	70%	0.696	38%	0.384	S	S	*	.	H	α-helix	trans	-69.7	-41.9	178	-70.9	177.9	-175.5	0	0	112.9	R501 H502 L503	R501-E505 PolarHBondContact O-N 2.69Å; H502-E505 PolarHBondContact O-N 3Å; L503-E505 VanDerWaalsContact C-N 3.33Å
506	V	78.6	Confident	72	Confident	106 Å²	106	77.6 Å²	77.6	64%	0.642	38%	0.38	S	S	*	.	H	α-helix	trans	-82	-41.6	-173.9	174.2	0	0	0	0	112.8	H502 L503	H502-V506 WeakPolarHBondContact O-CB 3.44Å; H502-V506 VanDerWaalsContact O-CG2 3.29Å; H502-V506 WeakPolarHBondContact O-CG2 3.46Å; H502-V506 PolarHBondContact O-N 2.93Å; L503-V506 PolarHBondContact O-N 3.42Å
507	Q	78.3	Confident	71.8	Confident	74 Å²	74	83.5 Å²	83.5	35%	0.346	41%	0.41	S	S	.	.	H	α-helix	trans	-98.4	-24.3	-173.4	-169.3	173.8	-31.5	0	0	113.2	V477 L503	V477-Q507 PolarHBondContact O-NE2 3.27Å; L503-Q507 WeakPolarHBondContact O-CB 3.4Å; L503-Q507 PolarHBondContact O-N 2.9Å
508	G	78.9	Confident	71	Confident	32 Å²	32	85 Å²	85	33%	0.33	44%	0.435	S	S	.	.			trans	74.7	160.6	-172.2	0	0	0	0	0	113.6	M504	M504-G508 VanDerWaalsContact O-CA 3.3Å; M504-G508 WeakPolarHBondContact O-CA 3.31Å; M504-G508 PolarHBondContact O-N 2.95Å; M504-G508 VanDerWaalsContact O-N 3.12Å
509	T	81.2	Confident	70.5	Confident	40 Å²	40	83.5 Å²	83.5	25%	0.245	43%	0.427	C	S	.	.			trans	-103.7	148.2	179.7	61.8	0	0	0	0	112.3	L448 L479 E481 M504	L448-T509 HydrophobicContact CD1-CG2 4.15Å; L479-T509 HydrophobicContact CB-CG2 4.12Å; L479-T509 HydrophobicContact CD1-CG2 4.33Å; E481-T509 PolarHBondContact OE2-OG1 2.85Å; M504-T509 HydrophobicContact CB-CG2 4.47Å; M504-T509 HydrophobicContact CE-CG2 4.15Å; M504-T509 HydrophobicContact CG-CG2 4.1Å
510	I	85.4	Confident	69.9	Low	14 Å²	14	83.8 Å²	83.8	7%	0.072	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.8	170.9	-53.4	178.3	0	0	0	108.3	I478 L479 I480 E481 F527 H530 V531	I478-I510 HydrophobicContact CG2-CD1 4.13Å; L479-I510 PolarHBondContact O-N 2.9Å; I480-I510 WeakPolarHBondContact CA-O 3.41Å; E481-I510 PolarHBondContact N-O 3.07Å; I510-F527 HydrophobicContact CB-CE2 4.45Å; I510-F527 HydrophobicContact CG2-CD2 3.47Å; I510-F527 VanDerWaalsContact CG2-CD2 3.47Å; I510-F527 HydrophobicContact CG2-CE2 3.53Å; I510-F527 HydrophobicContact CG2-CG 4.39Å; I510-F527 HydrophobicContact CG2-CZ 4.5Å; I510-H530 HydrophobicContact CD1-CB 4.19Å; I510-H530 HydrophobicContact CG2-CB 4.39Å; I510-V531 HydrophobicContact CD1-CG2 3.85Å; I510-V531 HydrophobicContact CG2-CG2 4.25Å
511	K	83.4	Confident	69.4	Low	129 Å²	129	89.7 Å²	89.7	56%	0.561	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.8	-178.3	-56.5	-165.9	177.6	-154	0	112	E481 F527	E481-K511 IonicContact OE1-NZ 3.73Å; E481-K511 VanDerWaalsContact OE2-CE 3.29Å; E481-K511 WeakPolarHBondContact OE2-CE 3.45Å; E481-K511 IonicContact OE2-NZ 2.81Å; K511-F527 WeakPolarHBondContact O-CD2 3.32Å
512	W	80.4	Confident	69.4	Low	28 Å²	28	86.7 Å²	86.7	11%	0.106	44%	0.438	C	S	.	.			trans	-85.1	118.3	165.7	-179.6	-104.8	0	0	0	108.5	F400 I404 E481 M482 K520 F527 W528	F400-W512 HydrophobicContact CD2-CD2 4.31Å; F400-W512 AromaticContact CD2-CE2 3.91Å; F400-W512 HydrophobicContact CD2-CH2 4.25Å; F400-W512 AromaticContact CD2-CZ2 3.88Å; F400-W512 HydrophobicContact CD2-CZ2 3.88Å; F400-W512 AromaticContact CE2-CD2 3.8Å; F400-W512 HydrophobicContact CE2-CD2 3.8Å; F400-W512 AromaticContact CE2-CE2 3.82Å; F400-W512 AromaticContact CE2-CE3 3.77Å; F400-W512 HydrophobicContact CE2-CE3 3.77Å; F400-W512 AromaticContact CE2-CH2 3.8Å; F400-W512 HydrophobicContact CE2-CH2 3.8Å; F400-W512 AromaticContact CE2-CZ2 3.82Å; F400-W512 HydrophobicContact CE2-CZ2 3.82Å; F400-W512 AromaticContact CE2-CZ3 3.78Å; F400-W512 HydrophobicContact CE2-CZ3 3.78Å; F400-W512 HydrophobicContact CZ-CE3 4.42Å; I404-W512 HydrophobicContact CD1-CZ2 4.17Å; I404-W512 HydrophobicContact CG2-CH2 4.18Å; E481-W512 WeakPolarHBondContact O-CB 3.38Å; E481-W512 PolarHBondContact O-N 3.35Å; M482-W512 HydrophobicContact SD-CG 4.26Å; W512-K520 HydrophobicContact CH2-CB 4.13Å; W512-K520 HydrophobicContact CH2-CG 4.34Å; W512-K520 HydrophobicContact CZ2-CB 4.46Å; W512-K520 HydrophobicContact CZ2-CD 4.03Å; W512-K520 HydrophobicContact CZ2-CG 4.33Å; W512-F527 HydrophobicContact CB-CD2 4.48Å; W512-F527 HydrophobicContact CB-CE2 3.96Å; W512-F527 HydrophobicContact CB-CZ 4.48Å; W512-F527 HydrophobicContact CD2-CZ 4.42Å; W512-F527 AromaticContact CE3-CD1 3.57Å; W512-F527 HydrophobicContact CE3-CD1 3.57Å; W512-F527 AromaticContact CE3-CD2 3.89Å; W512-F527 HydrophobicContact CE3-CD2 3.89Å; W512-F527 AromaticContact CE3-CE1 3.4Å; W512-F527 HydrophobicContact CE3-CE1 3.4Å; W512-F527 VanDerWaalsContact CE3-CE1 3.4Å; W512-F527 AromaticContact CE3-CE2 3.74Å; W512-F527 HydrophobicContact CE3-CE2 3.74Å; W512-F527 AromaticContact CE3-CG 3.81Å; W512-F527 HydrophobicContact CE3-CG 3.81Å; W512-F527 AromaticContact CE3-CZ 3.5Å; W512-F527 HydrophobicContact CE3-CZ 3.5Å; W512-F527 VanDerWaalsContact CE3-CZ 3.5Å; W512-F527 AromaticContact CZ3-CD1 3.55Å; W512-F527 HydrophobicContact CZ3-CD1 3.55Å; W512-F527 AromaticContact CZ3-CE1 3.53Å; W512-F527 HydrophobicContact CZ3-CE1 3.53Å; W512-F527 HydrophobicContact CZ3-CG 4.15Å; W512-F527 HydrophobicContact CZ3-CZ 4.11Å; W512-W528 HydrophobicContact CH2-CZ2 4.35Å; W512-W528 HydrophobicContact CZ3-CZ2 4.03Å
513	R	68.5	Low	69.1	Low	186 Å²	186	84 Å²	84	70%	0.702	43%	0.427	S	S	*	.			trans	-114.8	135.2	-176.6	-174.6	-176	-86.2	-123.8	7.1	109.7	D515	R513-D515 WeakPolarHBondContact CD-OD2 3.46Å; R513-D515 HydrophobicContact CG-CB 4.3Å; R513-D515 WeakPolarHBondContact CG-OD2 3.35Å; R513-D515 IonicContact NH1-OD2 3.58Å; R513-D515 PolarHBondContact NH1-OD2 2.87Å; R513-D515 PolarHBondContact O-N 2.85Å
514	E	58.9	Low	68.6	Low	91 Å²	91	88.8 Å²	88.8	43%	0.425	45%	0.453	S	S	.	.			trans	-76.7	-20.1	-172.1	-69.9	-167.5	147.3	0	0	114.7	R396 H516 K520	R396-E514 IonicContact NH1-OE1 3.55Å; R396-E514 PolarHBondContact NH1-OE1 2.94Å; R396-E514 VanDerWaalsContact NH1-OE1 3.09Å; R396-E514 IonicContact NH1-OE2 3.7Å; E514-H516 PolarHBondContact O-N 2.88Å; E514-K520 VanDerWaalsContact O-CE 3.22Å; E514-K520 WeakPolarHBondContact O-CE 3.41Å; E514-K520 PolarHBondContact O-NZ 2.8Å
515	D	51.9	Low	68.9	Low	103 Å²	103	88.1 Å²	88.1	55%	0.551	45%	0.453	S	S	*	.	S	Bend	trans	-62.8	-5	-158.1	-52.5	-11.6	0	0	0	117.4	R513	R513-D515 WeakPolarHBondContact CD-OD2 3.46Å; R513-D515 HydrophobicContact CG-CB 4.3Å; R513-D515 WeakPolarHBondContact CG-OD2 3.35Å; R513-D515 IonicContact NH1-OD2 3.58Å; R513-D515 PolarHBondContact NH1-OD2 2.87Å; R513-D515 PolarHBondContact O-N 2.85Å
516	H	48.5	Very low	69	Low	138 Å²	138	88.8 Å²	88.8	64%	0.639	45%	0.453	S	S	*	.			trans	-138.7	84.5	-177.4	-60	-45.2	0	0	0	113.6	E514 A518 N519 K520	E514-H516 PolarHBondContact O-N 2.88Å; H516-A518 VanDerWaalsContact C-N 3.3Å; H516-A518 PolarHBondContact O-N 3.43Å; H516-N519 PolarHBondContact O-N 2.9Å; H516-K520 WeakPolarHBondContact O-CG 3.18Å
517	I	50.9	Low	69.3	Low	147 Å²	147	84.9 Å²	84.9	75%	0.754	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-59.8	-32.9	-176.4	-62.3	172.7	0	0	0	113.1	N519	I517-N519 VanDerWaalsContact C-N 3.34Å; I517-N519 PolarHBondContact O-N 3.44Å
518	A	47.7	Very low	69.7	Low	103 Å²	103	81.3 Å²	81.3	85%	0.851	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-73.6	-17.1	-176.2	0	0	0	0	0	115.1	H516	H516-A518 VanDerWaalsContact C-N 3.3Å; H516-A518 PolarHBondContact O-N 3.43Å
519	N	57.2	Low	69.9	Low	99 Å²	99	81.6 Å²	81.6	53%	0.529	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-114.8	2.7	-172.9	-89.2	-25.6	0	0	0	114.8	H516 I517 R521 S522	H516-N519 PolarHBondContact O-N 2.9Å; I517-N519 VanDerWaalsContact C-N 3.34Å; I517-N519 PolarHBondContact O-N 3.44Å; N519-R521 VanDerWaalsContact C-N 3.29Å; N519-R521 PolarHBondContact O-N 3.11Å; N519-S522 WeakPolarHBondContact O-CB 3.35Å; N519-S522 PolarHBondContact O-N 3.21Å; N519-S522 VanDerWaalsContact O-N 3.13Å
520	K	62.1	Low	70.1	Confident	55 Å²	55	82.7 Å²	82.7	24%	0.239	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.8	-172.3	-70.9	-173.8	179.1	179.5	0	114.5	W512 E514 H516 W528	W512-K520 HydrophobicContact CH2-CB 4.13Å; W512-K520 HydrophobicContact CH2-CG 4.34Å; W512-K520 HydrophobicContact CZ2-CB 4.46Å; W512-K520 HydrophobicContact CZ2-CD 4.03Å; W512-K520 HydrophobicContact CZ2-CG 4.33Å; E514-K520 VanDerWaalsContact O-CE 3.22Å; E514-K520 WeakPolarHBondContact O-CE 3.41Å; E514-K520 PolarHBondContact O-NZ 2.8Å; H516-K520 WeakPolarHBondContact O-CG 3.18Å; K520-W528 PolarHBondContact O-NE1 3.06Å
521	R	65.3	Low	70.1	Confident	125 Å²	125	82 Å²	82	47%	0.472	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	4.8	178.9	-63.6	-173.5	-175.2	-165.9	5.7	114.2	D407 K412 N519	D407-R521 WeakPolarHBondContact OD2-CD 3.4Å; D407-R521 IonicContact OD2-NH1 2.62Å; K412-R521 PolarHBondContact NZ-O 2.67Å; K412-R521 VanDerWaalsContact NZ-O 3.08Å; N519-R521 VanDerWaalsContact C-N 3.29Å; N519-R521 PolarHBondContact O-N 3.11Å
522	S	73.2	Confident	70.3	Confident	40 Å²	40	77.5 Å²	77.5	28%	0.28	38%	0.381	S	S	.	.			trans	-82.8	124.4	179.8	-179.8	0	0	0	0	110.6	N519 N524 S525 W528	N519-S522 WeakPolarHBondContact O-CB 3.35Å; N519-S522 PolarHBondContact O-N 3.21Å; N519-S522 VanDerWaalsContact O-N 3.13Å; S522-N524 PolarHBondContact O-N 3.44Å; S522-N524 VanDerWaalsContact O-N 3.09Å; S522-N524 PolarHBondContact OG-N 2.74Å; S522-S525 PolarHBondContact O-N 3.17Å; S522-W528 VanDerWaalsContact O-CD1 3.31Å
523	L	71.3	Confident	70.6	Confident	47 Å²	47	79.7 Å²	79.7	25%	0.246	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.4	176.1	-68.9	175.3	0	0	0	113.5	V408 K412 C413 S525	V408-L523 HydrophobicContact CG1-CD2 3.71Å; K412-L523 HydrophobicContact CB-CD1 4.17Å; K412-L523 HydrophobicContact CB-CD2 4.18Å; K412-L523 HydrophobicContact CB-CG 4.43Å; C413-L523 WeakPolarHBondContact SG-CD2 3.39Å; L523-S525 VanDerWaalsContact C-N 3.33Å
524	N	67.4	Low	71.4	Confident	118 Å²	118	72.9 Å²	72.9	63%	0.631	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.3	-176.9	-73.4	-25.3	0	0	0	113.8	S522 K529	S522-N524 PolarHBondContact O-N 3.44Å; S522-N524 VanDerWaalsContact O-N 3.09Å; S522-N524 PolarHBondContact OG-N 2.74Å; N524-K529 WeakPolarHBondContact O-CE 3.47Å; N524-K529 PolarHBondContact O-NZ 2.9Å
525	S	80.8	Confident	72.8	Confident	27 Å²	27	68.6 Å²	68.6	19%	0.189	35%	0.346	C	S	.	.	S	Bend	trans	-64.5	149	176.2	85.2	0	0	0	0	111.2	S522 L523 F527 W528 K529	S522-S525 PolarHBondContact O-N 3.17Å; L523-S525 VanDerWaalsContact C-N 3.33Å; S525-F527 PolarHBondContact O-N 3.23Å; S525-W528 PolarHBondContact O-N 3.4Å; S525-W528 PolarHBondContact OG-N 3.5Å; S525-K529 WeakPolarHBondContact O-CG 3.4Å; S525-K529 PolarHBondContact O-N 3.17Å; S525-K529 VanDerWaalsContact O-N 3.07Å
526	K	78.9	Confident	74.3	Confident	163 Å²	163	64.4 Å²	64.4	71%	0.709	33%	0.325	S	S	*	.	H	α-helix	trans	-54.9	-42	176.2	-171.7	178.3	178.9	-178.1	0	110.6	K529 H530	K526-K529 PolarHBondContact O-N 2.82Å; K526-H530 VanDerWaalsContact CG-CE1 3.5Å; K526-H530 WeakPolarHBondContact CG-CE1 3.23Å; K526-H530 PolarHBondContact O-N 3.25Å; K526-H530 VanDerWaalsContact O-N 3.11Å; K526-H530 PolarHBondContact O-ND1 2.84Å
527	F	85	Confident	75.8	Confident	23 Å²	23	60.8 Å²	60.8	10%	0.101	31%	0.312	C	S	.	.	H	α-helix	trans	-55.8	-57.9	177.4	178	-94.1	0	0	0	112.4	F400 I480 I510 K511 W512 S525 K529 H530 V531	F400-F527 HydrophobicContact CZ-CE1 4.37Å; F400-F527 HydrophobicContact CZ-CZ 4.11Å; I480-F527 HydrophobicContact CD1-CZ 4.22Å; I480-F527 HydrophobicContact CG2-CE2 3.95Å; I480-F527 HydrophobicContact CG2-CZ 3.88Å; I510-F527 HydrophobicContact CB-CE2 4.45Å; I510-F527 HydrophobicContact CG2-CD2 3.47Å; I510-F527 VanDerWaalsContact CG2-CD2 3.47Å; I510-F527 HydrophobicContact CG2-CE2 3.53Å; I510-F527 HydrophobicContact CG2-CG 4.39Å; I510-F527 HydrophobicContact CG2-CZ 4.5Å; K511-F527 WeakPolarHBondContact O-CD2 3.32Å; W512-F527 HydrophobicContact CB-CD2 4.48Å; W512-F527 HydrophobicContact CB-CE2 3.96Å; W512-F527 HydrophobicContact CB-CZ 4.48Å; W512-F527 HydrophobicContact CD2-CZ 4.42Å; W512-F527 AromaticContact CE3-CD1 3.57Å; W512-F527 HydrophobicContact CE3-CD1 3.57Å; W512-F527 AromaticContact CE3-CD2 3.89Å; W512-F527 HydrophobicContact CE3-CD2 3.89Å; W512-F527 AromaticContact CE3-CE1 3.4Å; W512-F527 HydrophobicContact CE3-CE1 3.4Å; W512-F527 VanDerWaalsContact CE3-CE1 3.4Å; W512-F527 AromaticContact CE3-CE2 3.74Å; W512-F527 HydrophobicContact CE3-CE2 3.74Å; W512-F527 AromaticContact CE3-CG 3.81Å; W512-F527 HydrophobicContact CE3-CG 3.81Å; W512-F527 AromaticContact CE3-CZ 3.5Å; W512-F527 HydrophobicContact CE3-CZ 3.5Å; W512-F527 VanDerWaalsContact CE3-CZ 3.5Å; W512-F527 AromaticContact CZ3-CD1 3.55Å; W512-F527 HydrophobicContact CZ3-CD1 3.55Å; W512-F527 AromaticContact CZ3-CE1 3.53Å; W512-F527 HydrophobicContact CZ3-CE1 3.53Å; W512-F527 HydrophobicContact CZ3-CG 4.15Å; W512-F527 HydrophobicContact CZ3-CZ 4.11Å; S525-F527 PolarHBondContact O-N 3.23Å; F527-K529 VanDerWaalsContact C-N 3.33Å; F527-K529 PolarHBondContact O-N 2.99Å; F527-H530 PolarHBondContact O-N 3.1Å; F527-H530 VanDerWaalsContact O-N 3.1Å; F527-V531 HydrophobicContact CD1-CG2 4.25Å; F527-V531 HydrophobicContact CE1-CG2 3.84Å; F527-V531 HydrophobicContact CE2-CG2 4.33Å; F527-V531 HydrophobicContact CZ-CG2 3.89Å; F527-V531 WeakPolarHBondContact O-CG2 3.44Å; F527-V531 PolarHBondContact O-N 3.11Å
528	W	85.8	Confident	76.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.5	-30.7	-175.8	-69.6	119.8	0	0	0	113	F400 I404 L405 V408 L409 W512 K520 S522 S525 V531 R532	F400-W528 HydrophobicContact CZ-CH2 4.48Å; I404-W528 HydrophobicContact CG2-CH2 4.27Å; I404-W528 HydrophobicContact CG2-CZ2 3.75Å; L405-W528 HydrophobicContact CD1-CH2 3.94Å; L405-W528 HydrophobicContact CD1-CZ3 4.01Å; V408-W528 HydrophobicContact CB-CD2 4.3Å; V408-W528 HydrophobicContact CB-CE3 4.29Å; V408-W528 HydrophobicContact CB-CH2 3.88Å; V408-W528 HydrophobicContact CB-CZ2 3.88Å; V408-W528 HydrophobicContact CB-CZ3 4.08Å; V408-W528 HydrophobicContact CG1-CD2 3.6Å; V408-W528 HydrophobicContact CG1-CE3 3.68Å; V408-W528 HydrophobicContact CG1-CG 4.1Å; V408-W528 HydrophobicContact CG1-CH2 4.19Å; V408-W528 HydrophobicContact CG1-CZ2 4.11Å; V408-W528 HydrophobicContact CG1-CZ3 3.97Å; V408-W528 HydrophobicContact CG2-CH2 4.16Å; V408-W528 HydrophobicContact CG2-CZ2 3.68Å; L409-W528 HydrophobicContact CD1-CZ3 4.44Å; L409-W528 HydrophobicContact CD2-CE3 4.18Å; L409-W528 HydrophobicContact CD2-CZ3 4Å; L409-W528 HydrophobicContact CG-CZ3 3.99Å; W512-W528 HydrophobicContact CH2-CZ2 4.35Å; W512-W528 HydrophobicContact CZ3-CZ2 4.03Å; K520-W528 PolarHBondContact O-NE1 3.06Å; S522-W528 VanDerWaalsContact O-CD1 3.31Å; S525-W528 PolarHBondContact O-N 3.4Å; S525-W528 PolarHBondContact OG-N 3.5Å; W528-V531 HydrophobicContact CE3-CB 4.27Å; W528-V531 HydrophobicContact CE3-CG1 4.35Å; W528-V531 HydrophobicContact CE3-CG2 4.47Å; W528-V531 HydrophobicContact CZ3-CG1 4.42Å; W528-V531 PolarHBondContact O-N 3.42Å; W528-R532 VanDerWaalsContact O-CB 3.31Å; W528-R532 WeakPolarHBondContact O-CB 3.41Å; W528-R532 VanDerWaalsContact O-CG 3.27Å; W528-R532 WeakPolarHBondContact O-CG 3.15Å; W528-R532 PolarHBondContact O-N 3.33Å
529	K	84.3	Confident	77.6	Confident	38 Å²	38	52 Å²	52	17%	0.165	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-42.6	170.7	-74.9	174.4	172.8	167.3	0	111.8	I355 E356 L359 N524 S525 K526 F527 Y533	I355-K529 HydrophobicContact CG2-CB 4.25Å; E356-K529 HydrophobicContact CG-CD 4.48Å; E356-K529 IonicContact OE1-NZ 2.91Å; E356-K529 PolarHBondContact OE1-NZ 3.2Å; L359-K529 HydrophobicContact CD1-CB 4.09Å; L359-K529 HydrophobicContact CD1-CG 4.11Å; N524-K529 WeakPolarHBondContact O-CE 3.47Å; N524-K529 PolarHBondContact O-NZ 2.9Å; S525-K529 WeakPolarHBondContact O-CG 3.4Å; S525-K529 PolarHBondContact O-N 3.17Å; S525-K529 VanDerWaalsContact O-N 3.07Å; K526-K529 PolarHBondContact O-N 2.82Å; F527-K529 VanDerWaalsContact C-N 3.33Å; F527-K529 PolarHBondContact O-N 2.99Å; K529-Y533 VanDerWaalsContact O-CB 3.31Å; K529-Y533 WeakPolarHBondContact O-CB 3.37Å; K529-Y533 PolarHBondContact O-N 3.48Å
530	H	84.4	Confident	78.2	Confident	62 Å²	62	53.2 Å²	53.2	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-69	-42	177.5	-73.4	66.6	0	0	0	111.7	I510 K526 F527 Y533 Q534	I510-H530 HydrophobicContact CD1-CB 4.19Å; I510-H530 HydrophobicContact CG2-CB 4.39Å; K526-H530 VanDerWaalsContact CG-CE1 3.5Å; K526-H530 WeakPolarHBondContact CG-CE1 3.23Å; K526-H530 PolarHBondContact O-N 3.25Å; K526-H530 VanDerWaalsContact O-N 3.11Å; K526-H530 PolarHBondContact O-ND1 2.84Å; F527-H530 PolarHBondContact O-N 3.1Å; F527-H530 VanDerWaalsContact O-N 3.1Å; H530-Y533 PolarHBondContact O-N 3.02Å; H530-Q534 PolarHBondContact O-N 2.98Å
531	V	87.3	Confident	78.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-49.9	175	176.1	0	0	0	0	110.7	L409 I480 I510 F527 W528 Y533 Q534 M535	L409-V531 HydrophobicContact CD1-CG1 4.34Å; L409-V531 HydrophobicContact CD2-CG1 4.19Å; I480-V531 HydrophobicContact CD1-CG2 4.38Å; I510-V531 HydrophobicContact CD1-CG2 3.85Å; I510-V531 HydrophobicContact CG2-CG2 4.25Å; F527-V531 HydrophobicContact CD1-CG2 4.25Å; F527-V531 HydrophobicContact CE1-CG2 3.84Å; F527-V531 HydrophobicContact CE2-CG2 4.33Å; F527-V531 HydrophobicContact CZ-CG2 3.89Å; F527-V531 WeakPolarHBondContact O-CG2 3.44Å; F527-V531 PolarHBondContact O-N 3.11Å; W528-V531 HydrophobicContact CE3-CB 4.27Å; W528-V531 HydrophobicContact CE3-CG1 4.35Å; W528-V531 HydrophobicContact CE3-CG2 4.47Å; W528-V531 HydrophobicContact CZ3-CG1 4.42Å; W528-V531 PolarHBondContact O-N 3.42Å; V531-Y533 VanDerWaalsContact C-N 3.28Å; V531-Y533 PolarHBondContact O-N 2.98Å; V531-Q534 PolarHBondContact O-N 3.46Å; V531-Q534 VanDerWaalsContact O-N 3.16Å; V531-M535 HydrophobicContact CG1-CG 4.27Å; V531-M535 VanDerWaalsContact O-CG 3.3Å; V531-M535 WeakPolarHBondContact O-CG 3.45Å; V531-M535 PolarHBondContact O-N 3.47Å
532	R	86.9	Confident	78.2	Confident	35 Å²	35	52.9 Å²	52.9	13%	0.132	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-33.8	177.9	-75	177.9	68.8	-162.1	-1.4	113.1	L359 D363 W528 Q534	L359-R532 HydrophobicContact CD2-CB 3.95Å; D363-R532 IonicContact OD1-NH2 3.23Å; D363-R532 PolarHBondContact OD1-NH2 3.03Å; D363-R532 IonicContact OD2-NH2 3.75Å; D363-R532 PolarHBondContact OD2-NH2 2.97Å; W528-R532 VanDerWaalsContact O-CB 3.31Å; W528-R532 WeakPolarHBondContact O-CB 3.41Å; W528-R532 VanDerWaalsContact O-CG 3.27Å; W528-R532 WeakPolarHBondContact O-CG 3.15Å; W528-R532 PolarHBondContact O-N 3.33Å; R532-Q534 VanDerWaalsContact C-N 3.34Å
533	Y	86.1	Confident	77.5	Confident	74 Å²	74	60.9 Å²	60.9	29%	0.29	29%	0.292	S	S	.	.	H	α-helix	trans	-64.3	-39.6	177	177.5	-98.2	0	0	0	111.8	W354 I355 R362 K529 H530 V531	W354-Y533 VanDerWaalsContact CH2-OH 3.29Å; W354-Y533 WeakPolarHBondContact CH2-OH 3.32Å; W354-Y533 HydrophobicContact CZ3-CE2 4.37Å; W354-Y533 AromaticContact CZ3-CZ 3.95Å; W354-Y533 WeakPolarHBondContact CZ3-OH 3.47Å; I355-Y533 HydrophobicContact CG2-CD2 4.49Å; R362-Y533 PolarHBondContact NH1-O 3.49Å; K529-Y533 VanDerWaalsContact O-CB 3.31Å; K529-Y533 WeakPolarHBondContact O-CB 3.37Å; K529-Y533 PolarHBondContact O-N 3.48Å; H530-Y533 PolarHBondContact O-N 3.02Å; V531-Y533 VanDerWaalsContact C-N 3.28Å; V531-Y533 PolarHBondContact O-N 2.98Å
534	Q	86.4	Confident	76.3	Confident	42 Å²	42	68.4 Å²	68.4	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-80.4	-27.3	178.6	-62.7	-172.7	6.7	0	0	113.7	R443 I478 H530 V531 R532	R443-Q534 PolarHBondContact NE-O 3.04Å; R443-Q534 PolarHBondContact NH2-O 2.97Å; I478-Q534 HydrophobicContact CD1-CB 3.96Å; I478-Q534 HydrophobicContact CG1-CB 3.96Å; H530-Q534 PolarHBondContact O-N 2.98Å; V531-Q534 PolarHBondContact O-N 3.46Å; V531-Q534 VanDerWaalsContact O-N 3.16Å; R532-Q534 VanDerWaalsContact C-N 3.34Å
535	M	86.5	Confident	75	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	33%	0.328	C	S	.	.	S	Bend	trans	-61.4	155	172.6	-75.8	-65.3	-78.9	0	0	112.4	R362 D378 A379 L409 Y415 L417 I445 I478 V531	R362-M535 PolarHBondContact NH1-O 3.04Å; D378-M535 HydrophobicContact CB-CE 4.19Å; A379-M535 HydrophobicContact CB-CE 4Å; A379-M535 HydrophobicContact CB-SD 4.06Å; L409-M535 HydrophobicContact CD1-CE 4.48Å; Y415-M535 HydrophobicContact CD1-CE 3.63Å; Y415-M535 HydrophobicContact CD2-CE 3.93Å; Y415-M535 HydrophobicContact CE1-CB 3.95Å; Y415-M535 HydrophobicContact CE1-CE 4.01Å; Y415-M535 HydrophobicContact CE2-CB 4.15Å; Y415-M535 HydrophobicContact CE2-CE 4.27Å; Y415-M535 HydrophobicContact CE2-CG 4.3Å; Y415-M535 HydrophobicContact CG-CE 3.59Å; Y415-M535 WeakPolarHBondContact OH-CB 3.35Å; L417-M535 HydrophobicContact CD2-CE 4.27Å; I445-M535 HydrophobicContact CD1-SD 4.2Å; I478-M535 HydrophobicContact CD1-CG 4.06Å; I478-M535 HydrophobicContact CD1-SD 3.66Å; V531-M535 HydrophobicContact CG1-CG 4.27Å; V531-M535 VanDerWaalsContact O-CG 3.3Å; V531-M535 WeakPolarHBondContact O-CG 3.45Å; V531-M535 PolarHBondContact O-N 3.47Å
536	P	85.1	Confident	72.7	Confident	16 Å²	16	71.7 Å²	71.7	10%	0.104	36%	0.36	C	S	.	.			trans	-66.2	176.3	172.7	31.4	-35.3	0	0	0	110.6	D378 Y415 R442 R443	D378-P536 HydrophobicContact CB-CG 3.98Å; Y415-P536 HydrophobicContact CE1-CG 4.5Å; Y415-P536 WeakPolarHBondContact CE1-O 3.47Å; Y415-P536 PolarHBondContact OH-O 2.96Å; R442-P536 HydrophobicContact CB-CG 4.36Å; R443-P536 HydrophobicContact CG-CG 4.48Å
537	V	78.5	Confident	70.4	Confident	62 Å²	62	69.1 Å²	69.1	38%	0.376	36%	0.363	S	S	.	.			trans	-68.6	131.1	168.5	-179.7	0	0	0	0	108.1	P367	P367-V537 HydrophobicContact CG-CG1 4.4Å
538	P	73.4	Confident	67.7	Low	21 Å²	21	76.3 Å²	76.3	14%	0.136	40%	0.401	C	S	.	.			trans	-57.9	139.9	-178.4	-18.7	25.3	0	0	0	112.4	C413 Y415	C413-P538 WeakPolarHBondContact O-CB 3.34Å; C413-P538 WeakPolarHBondContact O-CG 3.17Å; Y415-P538 HydrophobicContact CD1-CB 4.1Å; Y415-P538 HydrophobicContact CD1-CG 4.24Å; Y415-P538 HydrophobicContact CE1-CB 3.89Å; Y415-P538 HydrophobicContact CE1-CG 3.57Å; Y415-P538 HydrophobicContact CE2-CG 4.41Å
539	S	64.8	Low	65.1	Low	43 Å²	43	82.4 Å²	82.4	30%	0.301	44%	0.439	S	S	.	.	S	Bend	trans	-77.6	-23.5	176.7	57.1	0	0	0	0	113	D378	D378-S539 PolarHBondContact OD2-OG 2.81Å
540	K	67.9	Low	62.4	Low	126 Å²	126	85.5 Å²	85.5	55%	0.548	47%	0.465	S	S	.	.	S	Bend	trans	-119	152.3	-179.2	-59.7	174.7	-176.1	171.9	0	111	G414 T416	G414-K540 WeakPolarHBondContact O-CB 3.34Å; G414-K540 PolarHBondContact O-N 2.92Å; T416-K540 HydrophobicContact CG2-CD 4.42Å
541	M	63.3	Low	59.8	Low	125 Å²	125	91 Å²	91	62%	0.616	50%	0.496	S	S	*	.			trans	-65.6	135.5	170.9	-97.2	-169.3	178.7	0	0	110.3	Y368 R543	Y368-M541 HydrophobicContact CD2-CE 4.09Å; Y368-M541 HydrophobicContact CD2-CG 4.3Å; Y368-M541 HydrophobicContact CE1-CG 4.29Å; Y368-M541 HydrophobicContact CE2-CE 3.9Å; Y368-M541 HydrophobicContact CE2-CG 4.01Å; M541-R543 PolarHBondContact O-N 3.43Å
542	P	64.3	Low	57.1	Low	47 Å²	47	96 Å²	96	31%	0.305	54%	0.537	S	S	.	.			trans	-61.6	133.6	171.1	23.3	-30.3	0	0	0	110.1	K412 K544	K412-P542 WeakPolarHBondContact O-CB 3.4Å; P542-K544 PolarHBondContact O-N 3.18Å; P542-K544 VanDerWaalsContact O-N 3.1Å
543	R	58.3	Low	54.6	Low	208 Å²	208	98.5 Å²	98.5	79%	0.785	57%	0.565	S	S	*	*			trans	-67.5	109.6	174.3	-80.1	179.2	171.3	168	-3.2	108.2	M541 A545	M541-R543 PolarHBondContact O-N 3.43Å; R543-A545 PolarHBondContact O-N 2.99Å
544	K	47.4	Very low	52	Low	205 Å²	205	104 Å²	104	89%	0.891	59%	0.593	S	S	*	*			trans	-62.7	118.9	174.9	-78.5	-174.9	176.4	-177.8	0	109.5	P542 S546	P542-K544 PolarHBondContact O-N 3.18Å; P542-K544 VanDerWaalsContact O-N 3.1Å; K544-S546 PolarHBondContact O-N 3.42Å
545	A	39.5	Very low	49.5	Very low	91 Å²	91	112.1 Å²	112.1	75%	0.752	63%	0.628	S	S	*	*			trans	-68.4	121.7	157.6	0	0	0	0	0	107.9	R543 S547	R543-A545 PolarHBondContact O-N 2.99Å; A545-S547 PolarHBondContact O-N 3.41Å
546	S	33.3	Very low	47	Very low	124 Å²	124	124.7 Å²	124.7	87%	0.867	69%	0.687	S	S	*	*			trans	-69.6	106.6	174.9	49.2	0	0	0	0	110.2	K544	K544-S546 PolarHBondContact O-N 3.42Å
547	S	30.2	Very low	45.1	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	72%	0.716	S	S	*	*			trans	-134.9	90.5	163.4	63.3	0	0	0	0	109.6	A545	A545-S547 PolarHBondContact O-N 3.41Å
548	L	28.6	Very low	43.3	Very low	174 Å²	174	133.7 Å²	133.7	91%	0.911	73%	0.734	S	S	*	*			trans	-97.7	109.6	167.8	-120.6	148.9	0	0	0	106
549	T	30.2	Very low	41.6	Very low	128 Å²	128	140 Å²	140	79%	0.785	77%	0.767	S	S	*	*			trans	-145.8	112.2	162.7	4.4	0	0	0	0	111.4
550	S	29	Very low	40.3	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	79%	0.794	S	S	*	*			trans	-18.2	131.8	160.9	55	0	0	0	0	118.6
551	L	28.8	Very low	38.6	Very low	179 Å²	179	146.9 Å²	146.9	94%	0.937	81%	0.81	S	S	*	*			trans	-144.5	91.8	148.4	-102.1	123.5	0	0	0	109.5
552	A	31.2	Very low	36.9	Very low	104 Å²	104	148.4 Å²	148.4	86%	0.86	82%	0.823	S	S	*	*			trans	-143.4	83.8	161.7	0	0	0	0	0	108
553	A	33.3	Very low	34.9	Very low	87 Å²	87	155.6 Å²	155.6	72%	0.719	86%	0.86	S	S	*	*			trans	-162.7	143.8	157.4	0	0	0	0	0	109.6
554	Q	32.6	Very low	33.1	Very low	191 Å²	191	151.6 Å²	151.6	89%	0.893	87%	0.865	S	S	*	*			trans	86.2	98.6	173.8	-63.3	175.4	-63.1	0	0	118.1
555	K	34	Very low	32	Very low	211 Å²	211	147.2 Å²	147.2	92%	0.917	86%	0.863	S	S	*	*				-161.7	118.4	100.3	-103.4	172.7	178.6	-178	0	111.4
556	Q	32.9	Very low	31.3	Very low	266 Å²	266	152.3 Å²	152.3	100%	1.243	87%	0.873	S	S	*	*			trans	-65.7	0	139.9	-89.5	171.6	-37.9	0	0	109

Retrieved 556 of 556 residues in 1814.9 ms (Link to these results)

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