G4LVG1_SCHMA Loading...

Eukaryotic peptide chain release factor subunit 1

AlphaFold DB , UniProt , Accession G4LVG1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 443 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	31.1	Very low	37.7	Very low	247 Å²	247	117.7 Å²	117.7	100%	1.217	72%	0.719	S	S	*	*				0	106.5	0	-72.5	172	173.3	0	0	106.8	S3	M1-S3 PolarHBondContact O-N 3.15Å
2	A	30.5	Very low	40.2	Very low	100 Å²	100	115.2 Å²	115.2	83%	0.826	69%	0.693	S	S	*	*			trans	-71.2	114	-176.8	0	0	0	0	0	108.1	T4	A2-T4 PolarHBondContact O-N 2.9Å
3	S	32.3	Very low	42.3	Very low	101 Å²	101	106.5 Å²	106.5	71%	0.706	64%	0.641	S	S	*	*			trans	-63.5	103.5	169.7	52.9	0	0	0	0	107.5	M1 N5	M1-S3 PolarHBondContact O-N 3.15Å; S3-N5 VanDerWaalsContact C-N 3.3Å; S3-N5 PolarHBondContact O-N 3.46Å
4	T	29.9	Very low	44.6	Very low	134 Å²	134	100.7 Å²	100.7	82%	0.822	61%	0.605	S	S	*	*			trans	-58.7	97.8	163.9	42.5	0	0	0	0	107.2	A2 G6	A2-T4 PolarHBondContact O-N 2.9Å; T4-G6 PolarHBondContact O-N 3.36Å
5	N	31.9	Very low	46.4	Very low	140 Å²	140	101 Å²	101	75%	0.749	60%	0.595	S	S	*	*			trans	-64.6	79	157.6	-82.4	-13.8	0	0	0	106.1	S3 S7	S3-N5 VanDerWaalsContact C-N 3.3Å; S3-N5 PolarHBondContact O-N 3.46Å; N5-S7 VanDerWaalsContact C-N 3.25Å; N5-S7 PolarHBondContact O-N 3.32Å
6	G	27.3	Very low	48.3	Very low	57 Å²	57	97.6 Å²	97.6	59%	0.588	57%	0.573	S	S	*	*			trans	-60.7	101.6	158.5	0	0	0	0	0	105.1	T4 T8	T4-G6 PolarHBondContact O-N 3.36Å; G6-T8 PolarHBondContact O-N 3.02Å
7	S	34	Very low	50.1	Low	105 Å²	105	91.8 Å²	91.8	73%	0.734	54%	0.54	S	S	*	.			trans	-57.3	93.4	155.1	49.1	0	0	0	0	104.8	N5 E9	N5-S7 VanDerWaalsContact C-N 3.25Å; N5-S7 PolarHBondContact O-N 3.32Å; S7-E9 PolarHBondContact O-N 3.48Å
8	T	37.5	Very low	51.8	Low	123 Å²	123	89.5 Å²	89.5	76%	0.755	52%	0.523	S	S	*	.			trans	-55.3	107.4	173.3	-35.7	0	0	0	0	104.7	G6 I10	G6-T8 PolarHBondContact O-N 3.02Å; T8-I10 VanDerWaalsContact C-N 3.33Å; T8-I10 PolarHBondContact O-N 3.3Å
9	E	43.1	Very low	53.3	Low	162 Å²	162	85.6 Å²	85.6	76%	0.757	50%	0.499	S	S	*	.			trans	-55.7	107.2	172.6	-79.8	-174.2	151.6	0	0	105.6	S7 S11 R223	S7-E9 PolarHBondContact O-N 3.48Å; E9-S11 PolarHBondContact O-N 3.1Å; E9-S11 VanDerWaalsContact O-N 3.07Å; E9-R223 IonicContact OE2-NH1 2.83Å
10	I	53.4	Low	54.8	Low	68 Å²	68	82.7 Å²	82.7	35%	0.349	48%	0.48	S	S	.	.			trans	-58.9	117.5	179.3	-61.4	175.7	0	0	0	105.6	T8 D14 K15	T8-I10 VanDerWaalsContact C-N 3.33Å; T8-I10 PolarHBondContact O-N 3.3Å; I10-D14 HydrophobicContact CG2-CB 3.35Å; I10-K15 HydrophobicContact CB-CG 4.26Å; I10-K15 HydrophobicContact CG2-CG 3.67Å; I10-K15 WeakPolarHBondContact O-CE 3.44Å
11	S	64.1	Low	56.2	Low	58 Å²	58	83.3 Å²	83.3	41%	0.406	47%	0.474	S	S	.	.			trans	-54.5	152.2	180	180	0	0	0	0	110	E9 A13 D14 K15	E9-S11 PolarHBondContact O-N 3.1Å; E9-S11 VanDerWaalsContact O-N 3.07Å; S11-A13 PolarHBondContact O-N 2.92Å; S11-D14 WeakPolarHBondContact O-CB 3.3Å; S11-D14 PolarHBondContact O-N 3.32Å; S11-K15 PolarHBondContact O-N 3.06Å
12	Q	66.8	Low	58.8	Low	87 Å²	87	71.7 Å²	71.7	41%	0.407	42%	0.417	S	S	.	.	H	α-helix	trans	-56.8	-38.1	177.4	-172.6	165.9	3.5	0	0	111.4	K15 N16 E227	Q12-K15 PolarHBondContact O-N 2.97Å; Q12-N16 VanDerWaalsContact O-CG 3.3Å; Q12-N16 PolarHBondContact O-N 3.36Å; Q12-N16 PolarHBondContact O-ND2 3.29Å; Q12-E227 PolarHBondContact NE2-OE1 3.09Å
13	A	68.3	Low	61.4	Low	3 Å²	3	71.5 Å²	71.5	3%	0.025	40%	0.397	C	S	.	.	H	α-helix	trans	-56.8	-49.6	171.5	0	0	0	0	0	111.9	S11 K15 N16 V17 E395	S11-A13 PolarHBondContact O-N 2.92Å; A13-K15 VanDerWaalsContact C-N 3.31Å; A13-K15 PolarHBondContact O-N 3.49Å; A13-N16 WeakPolarHBondContact O-CB 3.14Å; A13-N16 PolarHBondContact O-N 2.61Å; A13-V17 WeakPolarHBondContact O-CG2 3.14Å; A13-V17 PolarHBondContact O-N 2.98Å; A13-E395 WeakPolarHBondContact CB-OE1 3.33Å
14	D	73.6	Confident	63.9	Low	25 Å²	25	70 Å²	70	13%	0.134	38%	0.378	C	S	.	.	H	α-helix	trans	-61.2	-39	179.1	-67.3	-9.4	0	0	0	112	I10 S11 N16 V17 E18 Y387 R388	I10-D14 HydrophobicContact CG2-CB 3.35Å; S11-D14 WeakPolarHBondContact O-CB 3.3Å; S11-D14 PolarHBondContact O-N 3.32Å; D14-N16 VanDerWaalsContact C-N 3.33Å; D14-V17 PolarHBondContact O-N 3Å; D14-E18 WeakPolarHBondContact O-CG 3.5Å; D14-E18 PolarHBondContact O-N 3.01Å; D14-Y387 PolarHBondContact OD1-OH 2.9Å; D14-R388 IonicContact OD1-NH2 2.91Å; D14-R388 IonicContact OD2-CZ 3.75Å; D14-R388 IonicContact OD2-NH1 3.79Å; D14-R388 IonicContact OD2-NH2 3.75Å; D14-R388 PolarHBondContact OD2-NH2 2.94Å
15	K	72.8	Confident	66.7	Low	105 Å²	105	65.3 Å²	65.3	46%	0.457	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-39.4	174.8	-67.3	-177.8	-175.5	172.7	0	111.5	I10 S11 Q12 A13 E18 M19	I10-K15 HydrophobicContact CB-CG 4.26Å; I10-K15 HydrophobicContact CG2-CG 3.67Å; I10-K15 WeakPolarHBondContact O-CE 3.44Å; S11-K15 PolarHBondContact O-N 3.06Å; Q12-K15 PolarHBondContact O-N 2.97Å; A13-K15 VanDerWaalsContact C-N 3.31Å; A13-K15 PolarHBondContact O-N 3.49Å; K15-E18 PolarHBondContact O-N 3.47Å; K15-M19 VanDerWaalsContact O-CB 3.24Å; K15-M19 WeakPolarHBondContact O-CB 3.5Å; K15-M19 PolarHBondContact O-N 3.43Å
16	N	75.6	Confident	69.4	Low	46 Å²	46	59 Å²	59	25%	0.246	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-42.5	177.4	-69.2	-19.4	0	0	0	111.2	Q12 A13 D14 M19 W20	Q12-N16 VanDerWaalsContact O-CG 3.3Å; Q12-N16 PolarHBondContact O-N 3.36Å; Q12-N16 PolarHBondContact O-ND2 3.29Å; A13-N16 WeakPolarHBondContact O-CB 3.14Å; A13-N16 PolarHBondContact O-N 2.61Å; D14-N16 VanDerWaalsContact C-N 3.33Å; N16-M19 PolarHBondContact O-N 2.92Å; N16-W20 WeakPolarHBondContact O-CB 3.39Å; N16-W20 PolarHBondContact O-N 3.33Å
17	V	79.3	Confident	72.3	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-49	175.5	176.6	0	0	0	0	111	A13 D14 M19 W20 R21 A384 Y387 L394 I396	A13-V17 WeakPolarHBondContact O-CG2 3.14Å; A13-V17 PolarHBondContact O-N 2.98Å; D14-V17 PolarHBondContact O-N 3Å; V17-M19 VanDerWaalsContact C-N 3.33Å; V17-M19 PolarHBondContact O-N 3.15Å; V17-W20 WeakPolarHBondContact O-CB 3.46Å; V17-W20 PolarHBondContact O-N 3.35Å; V17-R21 WeakPolarHBondContact O-CG 3.47Å; V17-R21 PolarHBondContact O-N 2.95Å; V17-A384 HydrophobicContact CG1-CB 3.74Å; V17-Y387 HydrophobicContact CG1-CE1 4.44Å; V17-L394 HydrophobicContact CG1-CD2 4.23Å; V17-L394 HydrophobicContact CG2-CB 4.06Å; V17-L394 HydrophobicContact CG2-CD2 3.7Å; V17-L394 HydrophobicContact CG2-CG 3.82Å; V17-I396 HydrophobicContact CG2-CD1 4.23Å; V17-I396 HydrophobicContact CG2-CG1 4.48Å
18	E	81	Confident	74.8	Confident	50 Å²	50	62.4 Å²	62.4	23%	0.234	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-37.7	177.9	-73.6	-58.7	136.9	0	0	112.5	D14 K15 W20 R21 I22 F122	D14-E18 WeakPolarHBondContact O-CG 3.5Å; D14-E18 PolarHBondContact O-N 3.01Å; K15-E18 PolarHBondContact O-N 3.47Å; E18-W20 PolarHBondContact O-N 3.46Å; E18-R21 PolarHBondContact O-N 2.97Å; E18-R21 IonicContact OE1-CZ 3.65Å; E18-R21 IonicContact OE1-NH1 2.63Å; E18-R21 PolarHBondContact OE1-NH1 2.72Å; E18-R21 IonicContact OE2-NH1 2.63Å; E18-I22 WeakPolarHBondContact O-CG1 3.48Å; E18-I22 PolarHBondContact O-N 3.29Å; E18-F122 HydrophobicContact CB-CB 3.95Å; E18-F122 HydrophobicContact CB-CG 4.38Å
19	M	80.9	Confident	77.3	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-41.9	174.1	-171.1	-175.5	-67.6	0	0	111.6	K15 N16 V17 I22 K23 F122 L145	K15-M19 VanDerWaalsContact O-CB 3.24Å; K15-M19 WeakPolarHBondContact O-CB 3.5Å; K15-M19 PolarHBondContact O-N 3.43Å; N16-M19 PolarHBondContact O-N 2.92Å; V17-M19 VanDerWaalsContact C-N 3.33Å; V17-M19 PolarHBondContact O-N 3.15Å; M19-I22 PolarHBondContact O-N 2.92Å; M19-K23 HydrophobicContact CG-CD 4.5Å; M19-K23 WeakPolarHBondContact O-CB 3.38Å; M19-K23 WeakPolarHBondContact O-CG 3.49Å; M19-K23 PolarHBondContact O-N 2.69Å; M19-F122 HydrophobicContact CB-CZ 4.32Å; M19-F122 HydrophobicContact CE-CE2 4.21Å; M19-F122 HydrophobicContact CE-CZ 4.31Å; M19-F122 HydrophobicContact CG-CZ 4.35Å; M19-L145 HydrophobicContact CB-CD2 4.45Å; M19-L145 HydrophobicContact CG-CD2 3.51Å; M19-L145 WeakPolarHBondContact O-CD2 3.33Å
20	W	82	Confident	79.5	Confident	27 Å²	27	53.2 Å²	53.2	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-44.5	175	176.4	90.7	0	0	0	111.6	N16 V17 E18 I22 K23 K24 E329 L380 D381 A384 I396	N16-W20 WeakPolarHBondContact O-CB 3.39Å; N16-W20 PolarHBondContact O-N 3.33Å; V17-W20 WeakPolarHBondContact O-CB 3.46Å; V17-W20 PolarHBondContact O-N 3.35Å; E18-W20 PolarHBondContact O-N 3.46Å; W20-I22 VanDerWaalsContact C-N 3.32Å; W20-I22 PolarHBondContact O-N 2.82Å; W20-K23 WeakPolarHBondContact O-CB 3.47Å; W20-K23 PolarHBondContact O-N 3.01Å; W20-K24 HydrophobicContact CH2-CD 3.77Å; W20-K24 HydrophobicContact CZ2-CD 3.89Å; W20-K24 HydrophobicContact CZ3-CD 4.38Å; W20-K24 PolarHBondContact O-N 3.26Å; W20-E329 PolarHBondContact NE1-O 3.24Å; W20-L380 HydrophobicContact CD2-CD2 4.48Å; W20-L380 HydrophobicContact CH2-CB 4.23Å; W20-L380 HydrophobicContact CH2-CD2 3.78Å; W20-L380 HydrophobicContact CH2-CG 3.55Å; W20-L380 HydrophobicContact CZ2-CB 4.42Å; W20-L380 HydrophobicContact CZ2-CD2 3.23Å; W20-L380 HydrophobicContact CZ2-CG 3.6Å; W20-L380 HydrophobicContact CZ3-CG 4.16Å; W20-D381 WeakPolarHBondContact CH2-OD1 3.48Å; W20-D381 WeakPolarHBondContact CZ3-OD1 3.44Å; W20-A384 HydrophobicContact CZ3-CB 4.23Å; W20-I396 HydrophobicContact CB-CD1 3.71Å; W20-I396 HydrophobicContact CD2-CD1 3.84Å; W20-I396 HydrophobicContact CE3-CD1 4.11Å; W20-I396 HydrophobicContact CG-CD1 3.64Å; W20-I396 HydrophobicContact CG-CG2 4.44Å
21	R	84.6	Confident	81.1	Confident	95 Å²	95	54.2 Å²	54.2	36%	0.358	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-44	176.4	-69.9	177.1	73.4	-169.3	3.8	111.6	V17 E18 K24 L25 A384 L385	V17-R21 WeakPolarHBondContact O-CG 3.47Å; V17-R21 PolarHBondContact O-N 2.95Å; E18-R21 PolarHBondContact O-N 2.97Å; E18-R21 IonicContact OE1-CZ 3.65Å; E18-R21 IonicContact OE1-NH1 2.63Å; E18-R21 PolarHBondContact OE1-NH1 2.72Å; E18-R21 IonicContact OE2-NH1 2.63Å; R21-K24 PolarHBondContact O-N 2.9Å; R21-L25 WeakPolarHBondContact O-CB 3.27Å; R21-L25 PolarHBondContact O-N 2.93Å; R21-A384 HydrophobicContact CG-CB 4.44Å; R21-L385 VanDerWaalsContact NH2-CD2 3.29Å
22	I	86.2	Confident	82.1	Confident	4 Å²	4	52 Å²	52	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-69.7	-39.8	178.2	-71.8	166.3	0	0	0	111.6	E18 M19 W20 K24 L25 I26 F119 F122 L141 L145	E18-I22 WeakPolarHBondContact O-CG1 3.48Å; E18-I22 PolarHBondContact O-N 3.29Å; M19-I22 PolarHBondContact O-N 2.92Å; W20-I22 VanDerWaalsContact C-N 3.32Å; W20-I22 PolarHBondContact O-N 2.82Å; I22-K24 VanDerWaalsContact C-N 3.3Å; I22-K24 PolarHBondContact O-N 2.73Å; I22-L25 PolarHBondContact O-N 3.08Å; I22-I26 HydrophobicContact CG2-CD1 3.89Å; I22-I26 HydrophobicContact CG2-CG1 4.21Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 VanDerWaalsContact O-CG1 3.27Å; I22-I26 WeakPolarHBondContact O-CG1 3.47Å; I22-I26 PolarHBondContact O-N 2.98Å; I22-F119 HydrophobicContact CD1-CE2 4.06Å; I22-F119 HydrophobicContact CG1-CE2 4.06Å; I22-F122 HydrophobicContact CD1-CD1 3.22Å; I22-F122 HydrophobicContact CD1-CE1 3.48Å; I22-F122 VanDerWaalsContact CD1-CE1 3.48Å; I22-F122 HydrophobicContact CD1-CG 4.4Å; I22-L141 HydrophobicContact CG2-CB 4.35Å; I22-L145 HydrophobicContact CB-CD2 4.07Å; I22-L145 HydrophobicContact CG2-CD1 4.35Å; I22-L145 HydrophobicContact CG2-CD2 3.75Å; I22-L145 HydrophobicContact CG2-CG 4.05Å
23	K	85	Confident	82.9	Confident	95 Å²	95	54.3 Å²	54.3	41%	0.413	26%	0.26	S	S	.	.	H	α-helix	trans	-55.2	-47.4	172.5	-82.3	171.7	-179.5	175.5	0	111.5	M19 W20 I26 K27 L145	M19-K23 HydrophobicContact CG-CD 4.5Å; M19-K23 WeakPolarHBondContact O-CB 3.38Å; M19-K23 WeakPolarHBondContact O-CG 3.49Å; M19-K23 PolarHBondContact O-N 2.69Å; W20-K23 WeakPolarHBondContact O-CB 3.47Å; W20-K23 PolarHBondContact O-N 3.01Å; K23-I26 PolarHBondContact O-N 3.49Å; K23-K27 PolarHBondContact O-N 2.79Å; K23-L145 HydrophobicContact CB-CD1 4.31Å; K23-L145 HydrophobicContact CG-CD1 3.44Å; K23-L145 VanDerWaalsContact CG-CD1 3.44Å; K23-L145 HydrophobicContact CG-CD2 3.82Å; K23-L145 HydrophobicContact CG-CG 4.23Å
24	K	84.8	Confident	83.5	Confident	70 Å²	70	54.9 Å²	54.9	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-65.2	-42.6	178.3	-173.4	171.7	176.5	176.9	0	112	W20 R21 I22 K27 S28 D381	W20-K24 HydrophobicContact CH2-CD 3.77Å; W20-K24 HydrophobicContact CZ2-CD 3.89Å; W20-K24 HydrophobicContact CZ3-CD 4.38Å; W20-K24 PolarHBondContact O-N 3.26Å; R21-K24 PolarHBondContact O-N 2.9Å; I22-K24 VanDerWaalsContact C-N 3.3Å; I22-K24 PolarHBondContact O-N 2.73Å; K24-K27 PolarHBondContact O-N 2.87Å; K24-S28 PolarHBondContact O-N 2.98Å; K24-D381 IonicContact NZ-OD1 3.18Å; K24-D381 PolarHBondContact NZ-OD1 2.83Å; K24-D381 IonicContact NZ-OD2 2.92Å; K24-D381 PolarHBondContact NZ-OD2 3.43Å
25	L	88.2	Confident	83.5	Confident	35 Å²	35	60.1 Å²	60.1	18%	0.183	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-47.3	176.1	-180	62.5	0	0	0	111.5	R21 I22 K27 S28 L29 I117 F119	R21-L25 WeakPolarHBondContact O-CB 3.27Å; R21-L25 PolarHBondContact O-N 2.93Å; I22-L25 PolarHBondContact O-N 3.08Å; L25-K27 VanDerWaalsContact C-N 3.34Å; L25-K27 PolarHBondContact O-N 3.32Å; L25-S28 WeakPolarHBondContact O-CB 3.12Å; L25-S28 PolarHBondContact O-N 3.36Å; L25-S28 VanDerWaalsContact O-N 3.15Å; L25-L29 HydrophobicContact CD1-CD1 4.07Å; L25-L29 HydrophobicContact CD1-CG 4.1Å; L25-L29 HydrophobicContact CD2-CD1 4.4Å; L25-L29 HydrophobicContact CG-CD1 3.79Å; L25-L29 HydrophobicContact CG-CG 4.26Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.02Å; L25-L29 PolarHBondContact O-N 3.18Å; L25-I117 HydrophobicContact CD1-CD1 3.69Å; L25-I117 HydrophobicContact CD1-CG2 4.3Å; L25-I117 HydrophobicContact CD2-CG2 4.39Å; L25-F119 HydrophobicContact CD2-CD1 3.98Å; L25-F119 HydrophobicContact CD2-CE1 3.35Å; L25-F119 HydrophobicContact CD2-CZ 3.69Å
26	I	89	Confident	83.5	Confident	9 Å²	9	56.4 Å²	56.4	5%	0.046	29%	0.286	C	S	.	.	H	α-helix	trans	-57.9	-48.2	177.2	-70.8	175.5	0	0	0	110.5	I22 K23 S28 L29 E30 T138 L141 V142 L145	I22-I26 HydrophobicContact CG2-CD1 3.89Å; I22-I26 HydrophobicContact CG2-CG1 4.21Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 VanDerWaalsContact O-CG1 3.27Å; I22-I26 WeakPolarHBondContact O-CG1 3.47Å; I22-I26 PolarHBondContact O-N 2.98Å; K23-I26 PolarHBondContact O-N 3.49Å; I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 3.01Å; I26-L29 PolarHBondContact O-N 3.41Å; I26-E30 HydrophobicContact CG2-CG 4.1Å; I26-E30 WeakPolarHBondContact CG2-OE1 3.26Å; I26-E30 WeakPolarHBondContact O-CB 3.12Å; I26-E30 WeakPolarHBondContact O-CG 3.47Å; I26-E30 PolarHBondContact O-N 2.96Å; I26-T138 HydrophobicContact CG1-CG2 4.45Å; I26-T138 HydrophobicContact CG2-CG2 4.3Å; I26-L141 HydrophobicContact CD1-CB 3.58Å; I26-L141 HydrophobicContact CG1-CB 3.97Å; I26-L141 HydrophobicContact CG1-CD1 4.17Å; I26-V142 HydrophobicContact CD1-CG2 3.83Å; I26-V142 HydrophobicContact CG2-CG2 4.03Å; I26-L145 HydrophobicContact CD1-CD1 3.39Å; I26-L145 HydrophobicContact CD1-CG 4.12Å
27	K	87.9	Confident	83.6	Confident	161 Å²	161	57 Å²	57	70%	0.7	29%	0.291	S	S	*	.	H	α-helix	trans	-56.8	-41.3	177.4	-170.2	179.6	-178.7	-177.8	0	112	K23 K24 L25 S31	K23-K27 PolarHBondContact O-N 2.79Å; K24-K27 PolarHBondContact O-N 2.87Å; L25-K27 VanDerWaalsContact C-N 3.34Å; L25-K27 PolarHBondContact O-N 3.32Å; K27-S31 PolarHBondContact O-N 3.32Å; K27-S31 VanDerWaalsContact O-N 3.16Å; K27-S31 PolarHBondContact O-OG 3.3Å
28	S	87.4	Confident	83.7	Confident	72 Å²	72	57.3 Å²	57.3	50%	0.503	29%	0.293	S	S	.	.	H	α-helix	trans	-69.9	-32.7	176.2	-176.3	0	0	0	0	113.7	K24 L25 I26 S31 A32	K24-S28 PolarHBondContact O-N 2.98Å; L25-S28 WeakPolarHBondContact O-CB 3.12Å; L25-S28 PolarHBondContact O-N 3.36Å; L25-S28 VanDerWaalsContact O-N 3.15Å; I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 3.01Å; S28-S31 PolarHBondContact O-OG 2.97Å; S28-S31 VanDerWaalsContact O-OG 3.12Å; S28-A32 PolarHBondContact O-N 3.49Å
29	L	89.5	Confident	84.1	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-77.5	-35.9	178.8	-69.5	170.5	0	0	0	111.3	L25 I26 A32 Y101 I117 F136 T138	L25-L29 HydrophobicContact CD1-CD1 4.07Å; L25-L29 HydrophobicContact CD1-CG 4.1Å; L25-L29 HydrophobicContact CD2-CD1 4.4Å; L25-L29 HydrophobicContact CG-CD1 3.79Å; L25-L29 HydrophobicContact CG-CG 4.26Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.02Å; L25-L29 PolarHBondContact O-N 3.18Å; I26-L29 PolarHBondContact O-N 3.41Å; L29-A32 WeakPolarHBondContact O-CB 3.29Å; L29-A32 PolarHBondContact O-N 3.39Å; L29-Y101 HydrophobicContact CD1-CD1 4.48Å; L29-Y101 HydrophobicContact CD1-CD2 3.48Å; L29-Y101 VanDerWaalsContact CD1-CD2 3.48Å; L29-Y101 HydrophobicContact CD1-CE1 4.39Å; L29-Y101 HydrophobicContact CD1-CE2 3.36Å; L29-Y101 HydrophobicContact CD1-CG 4.05Å; L29-Y101 HydrophobicContact CD2-CD2 4.19Å; L29-Y101 HydrophobicContact CD2-CG 4.11Å; L29-I117 HydrophobicContact CD2-CD1 4.29Å; L29-F136 HydrophobicContact CB-CB 4.24Å; L29-F136 HydrophobicContact CB-CD2 4.16Å; L29-F136 HydrophobicContact CD2-CB 4.45Å; L29-F136 HydrophobicContact CD2-CD2 3.32Å; L29-F136 HydrophobicContact CD2-CE2 3.67Å; L29-F136 HydrophobicContact CD2-CG 4.02Å; L29-F136 HydrophobicContact CG-CD2 4.31Å; L29-T138 HydrophobicContact CB-CG2 3.76Å; L29-T138 HydrophobicContact CD1-CG2 3.97Å
30	E	88.6	Confident	84.8	Confident	88 Å²	88	54.1 Å²	54.1	41%	0.411	28%	0.278	S	S	.	.	H	α-helix	trans	-74.5	-29.5	178.7	-74.4	177.8	-180	0	0	113.2	I26 A32 R33 T138	I26-E30 HydrophobicContact CG2-CG 4.1Å; I26-E30 WeakPolarHBondContact CG2-OE1 3.26Å; I26-E30 WeakPolarHBondContact O-CB 3.12Å; I26-E30 WeakPolarHBondContact O-CG 3.47Å; I26-E30 PolarHBondContact O-N 2.96Å; E30-A32 VanDerWaalsContact C-N 3.34Å; E30-R33 PolarHBondContact O-NH1 2.87Å; E30-R33 PolarHBondContact O-NH2 2.96Å; E30-T138 HydrophobicContact CG-CG2 4.25Å; E30-T138 WeakPolarHBondContact CG-OG1 3.48Å; E30-T138 PolarHBondContact OE1-OG1 2.81Å
31	S	87.3	Confident	85.4	Confident	90 Å²	90	52.9 Å²	52.9	63%	0.629	27%	0.273	S	S	*	.	H	α-helix	trans	-75.6	-24.7	171.9	64.8	0	0	0	0	112.4	K27 S28	K27-S31 PolarHBondContact O-N 3.32Å; K27-S31 VanDerWaalsContact O-N 3.16Å; K27-S31 PolarHBondContact O-OG 3.3Å; S28-S31 PolarHBondContact O-OG 2.97Å; S28-S31 VanDerWaalsContact O-OG 3.12Å
32	A	85.8	Confident	85.9	Confident	10 Å²	10	48.4 Å²	48.4	8%	0.083	26%	0.257	C	S	.	.			trans	-68.5	136.2	178.4	0	0	0	0	0	112	S28 L29 E30 M39 I105	S28-A32 PolarHBondContact O-N 3.49Å; L29-A32 WeakPolarHBondContact O-CB 3.29Å; L29-A32 PolarHBondContact O-N 3.39Å; E30-A32 VanDerWaalsContact C-N 3.34Å; A32-M39 HydrophobicContact CB-CE 4.18Å; A32-I105 HydrophobicContact CB-CB 4.29Å; A32-I105 HydrophobicContact CB-CD1 4.43Å; A32-I105 HydrophobicContact CB-CG2 3.75Å
33	R	83.8	Confident	86.3	Confident	136 Å²	136	48.2 Å²	48.2	51%	0.513	26%	0.256	S	S	.	.			trans	-130.8	137.7	175.4	-68.2	-70.3	177.8	-89.1	-5	110.2	E30 V106	E30-R33 PolarHBondContact O-NH1 2.87Å; E30-R33 PolarHBondContact O-NH2 2.96Å; R33-V106 PolarHBondContact O-N 3.22Å
34	G	79.5	Confident	86.8	Confident	15 Å²	15	43.7 Å²	43.7	16%	0.155	24%	0.236	C	C	.	.			trans	-92.9	150.2	173.6	0	0	0	0	0	111.5	G36 M39 N134	G34-G36 PolarHBondContact O-N 3.02Å; G34-M39 PolarHBondContact N-SD 2.89Å; G34-N134 PolarHBondContact N-O 3.38Å
35	N	73.7	Confident	87.1	Confident	136 Å²	136	41.5 Å²	41.5	73%	0.727	23%	0.229	S	C	*	.	S	Bend	trans	-74.6	-0.4	172.2	-152.2	5.3	0	0	0	112.8	V106	N35-V106 HydrophobicContact CB-CG2 3.68Å
36	G	73.1	Confident	87.1	Confident	27 Å²	27	41.4 Å²	41.4	28%	0.278	23%	0.23	S	C	.	.	S	Bend	trans	-175.4	-173.6	-176	0	0	0	0	0	111.1	G34 S38 N134	G34-G36 PolarHBondContact O-N 3.02Å; G36-S38 VanDerWaalsContact C-N 3.28Å; G36-S38 PolarHBondContact O-N 2.83Å; G36-N134 VanDerWaalsContact O-CA 3.29Å; G36-N134 WeakPolarHBondContact O-CA 3.3Å; G36-N134 WeakPolarHBondContact O-CB 3.35Å
37	T	76.9	Confident	87	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.35	27%	0.271	S	S	.	.	S	Bend	trans	-83.4	64.9	-176.9	59	0	0	0	0	111.8	N72 V76 C132 D133	T37-N72 PolarHBondContact OG1-ND2 3.49Å; T37-N72 PolarHBondContact OG1-OD1 3.36Å; T37-V76 WeakPolarHBondContact O-CG2 3.32Å; T37-C132 PolarHBondContact O-SG 3.19Å; T37-D133 CarbonylContact C-O 3.55Å; T37-D133 WeakPolarHBondContact CA-O 3.01Å
38	S	81.9	Confident	87.1	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.049	24%	0.244	C	C	.	.			trans	-121.4	9.5	-176.6	62.7	0	0	0	0	113.8	G36 G103 D133	G36-S38 VanDerWaalsContact C-N 3.28Å; G36-S38 PolarHBondContact O-N 2.83Å; S38-G103 WeakPolarHBondContact O-CA 3.44Å; S38-D133 PolarHBondContact N-O 3.01Å
39	M	90.5	Very high	87.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.1	-178	-55.8	-175.7	70.8	0	0	109.4	A32 G34 I105 C132 D133 N134 F136	A32-M39 HydrophobicContact CB-CE 4.18Å; G34-M39 PolarHBondContact N-SD 2.89Å; M39-I105 HydrophobicContact CE-CG2 3.55Å; M39-I105 HydrophobicContact SD-CG2 4.47Å; M39-C132 CarbonylContact O-C 3.57Å; M39-C132 WeakPolarHBondContact O-CA 3.48Å; M39-D133 WeakPolarHBondContact CA-O 3.27Å; M39-D133 VanDerWaalsContact CB-O 3.31Å; M39-D133 WeakPolarHBondContact CB-O 3.32Å; M39-D133 PolarHBondContact N-O 3.28Å; M39-D133 PolarHBondContact O-N 3.33Å; M39-N134 VanDerWaalsContact SD-C 3.57Å; M39-F136 HydrophobicContact CB-CD1 3.92Å; M39-F136 HydrophobicContact CB-CE1 3.77Å; M39-F136 HydrophobicContact CB-CZ 4.35Å; M39-F136 HydrophobicContact CE-CD1 3.97Å; M39-F136 HydrophobicContact CE-CD2 3.18Å; M39-F136 HydrophobicContact CE-CE1 3.87Å; M39-F136 HydrophobicContact CE-CE2 3.07Å; M39-F136 HydrophobicContact CE-CG 3.66Å; M39-F136 HydrophobicContact CE-CZ 3.44Å; M39-F136 VanDerWaalsContact CE-CZ 3.44Å; M39-F136 HydrophobicContact CG-CE1 4.47Å
40	I	94	Very high	87.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.7	-179.6	-58.4	175.8	0	0	0	109.2	L42 A79 I80 V83 Y101 C102 Y130 L131 C132 F136	I40-L42 HydrophobicContact CG2-CB 4.45Å; I40-A79 HydrophobicContact CD1-CB 3.6Å; I40-A79 HydrophobicContact CG1-CB 4.08Å; I40-I80 HydrophobicContact CD1-CB 4.3Å; I40-I80 HydrophobicContact CD1-CG1 3.58Å; I40-V83 HydrophobicContact CB-CG2 4.4Å; I40-V83 HydrophobicContact CD1-CG2 4.18Å; I40-V83 HydrophobicContact CG2-CG2 4.2Å; I40-Y101 WeakPolarHBondContact O-CA 3.37Å; I40-C102 WeakPolarHBondContact CB-O 3.33Å; I40-C102 PolarHBondContact N-O 3.39Å; I40-C102 PolarHBondContact O-N 3.13Å; I40-Y130 HydrophobicContact CG2-CD2 4.18Å; I40-Y130 HydrophobicContact CG2-CE2 3.82Å; I40-L131 CarbonylContact C-O 3.5Å; I40-L131 VanDerWaalsContact CA-O 3.31Å; I40-L131 WeakPolarHBondContact CA-O 3.49Å; I40-C132 HydrophobicContact CG1-CB 4.27Å; I40-F136 WeakPolarHBondContact O-CE1 3.48Å
41	S	95.2	Very high	87.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	112.3	167.7	-65.5	0	0	0	0	108.5	Y101 Y130 L131 F136 H137	S41-Y101 WeakPolarHBondContact OG-CD1 3.3Å; S41-Y101 VanDerWaalsContact OG-CE1 3.31Å; S41-Y101 WeakPolarHBondContact OG-CE1 3.45Å; S41-Y130 WeakPolarHBondContact O-CA 3.31Å; S41-L131 PolarHBondContact N-O 2.96Å; S41-L131 PolarHBondContact O-N 3.11Å; S41-F136 WeakPolarHBondContact OG-CA 3.26Å; S41-H137 PolarHBondContact OG-N 3.48Å
42	L	95.6	Very high	87.8	Confident	2 Å²	2	51 Å²	51	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.6	179.6	173.9	65.2	0	0	0	109.6	I40 I44 I53 L57 V83 L87 V99 V100 L129 Y130	I40-L42 HydrophobicContact CG2-CB 4.45Å; L42-I44 HydrophobicContact CD1-CG1 4.06Å; L42-I44 HydrophobicContact CD2-CD1 4.12Å; L42-I44 HydrophobicContact CD2-CG1 4.44Å; L42-I44 HydrophobicContact CG-CD1 4.24Å; L42-I44 HydrophobicContact CG-CG1 4.03Å; L42-I53 HydrophobicContact CD1-CG2 4.08Å; L42-I53 HydrophobicContact CD2-CG2 3.95Å; L42-L57 HydrophobicContact CD2-CD1 4.43Å; L42-V83 HydrophobicContact CD2-CG1 3.53Å; L42-L87 HydrophobicContact CD2-CD1 4.2Å; L42-V99 WeakPolarHBondContact O-CA 3.3Å; L42-V100 HydrophobicContact CB-CB 4.26Å; L42-V100 HydrophobicContact CD2-CB 4.47Å; L42-V100 PolarHBondContact N-O 3.39Å; L42-V100 PolarHBondContact O-N 3.35Å; L42-L129 CarbonylContact C-O 3.59Å; L42-L129 WeakPolarHBondContact CA-O 3.5Å; L42-Y130 HydrophobicContact CD1-CD2 4.23Å
43	I	95	Very high	88.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.8	177.2	-53.8	-177.6	0	0	0	108	V99 V125 T127 S128 L129 A140	I43-V99 HydrophobicContact CG1-CG1 4.42Å; I43-V99 HydrophobicContact CG1-CG2 4.28Å; I43-V99 HydrophobicContact CG2-CG2 4.15Å; I43-V125 HydrophobicContact CG2-CB 4Å; I43-V125 HydrophobicContact CG2-CG1 4.23Å; I43-V125 HydrophobicContact CG2-CG2 3.82Å; I43-T127 VanDerWaalsContact CG2-O 3.29Å; I43-T127 WeakPolarHBondContact CG2-O 3.2Å; I43-S128 WeakPolarHBondContact O-CA 3.46Å; I43-L129 HydrophobicContact CB-CB 3.92Å; I43-L129 HydrophobicContact CD1-CB 4.22Å; I43-L129 HydrophobicContact CD1-CD2 3.98Å; I43-L129 HydrophobicContact CG1-CB 4.09Å; I43-L129 HydrophobicContact CG1-CD2 4.39Å; I43-L129 PolarHBondContact N-O 3.26Å; I43-L129 PolarHBondContact O-N 3.45Å; I43-A140 HydrophobicContact CD1-CB 3.35Å
44	I	94.7	Very high	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.8	-175.4	-52.9	169.5	0	0	0	107.7	L42 D48 I53 L87 V93 G97 L98	L42-I44 HydrophobicContact CD1-CG1 4.06Å; L42-I44 HydrophobicContact CD2-CD1 4.12Å; L42-I44 HydrophobicContact CD2-CG1 4.44Å; L42-I44 HydrophobicContact CG-CD1 4.24Å; L42-I44 HydrophobicContact CG-CG1 4.03Å; I44-D48 HydrophobicContact CG2-CB 3.72Å; I44-I53 HydrophobicContact CD1-CB 4.34Å; I44-I53 HydrophobicContact CD1-CG1 3.99Å; I44-I53 HydrophobicContact CD1-CG2 3.91Å; I44-I53 HydrophobicContact CG1-CD1 4.34Å; I44-I53 HydrophobicContact CG1-CG1 4.08Å; I44-I53 HydrophobicContact CG1-CG2 4.37Å; I44-I53 HydrophobicContact CG2-CD1 4.4Å; I44-I53 HydrophobicContact CG2-CG1 4.04Å; I44-L87 HydrophobicContact CD1-CD2 3.7Å; I44-V93 HydrophobicContact CB-CG1 4.47Å; I44-V93 HydrophobicContact CG2-CB 4.5Å; I44-V93 HydrophobicContact CG2-CG1 3.94Å; I44-V93 HydrophobicContact CG2-CG2 3.68Å; I44-G97 CarbonylContact O-C 3.57Å; I44-G97 WeakPolarHBondContact O-CA 3.24Å; I44-L98 HydrophobicContact CB-CB 4.32Å; I44-L98 HydrophobicContact CD1-CB 4.34Å; I44-L98 HydrophobicContact CD1-CD2 4.22Å; I44-L98 PolarHBondContact N-O 3.17Å; I44-L98 PolarHBondContact O-N 2.87Å
45	P	91.9	Very high	89.4	Confident	23 Å²	23	52.1 Å²	52.1	15%	0.149	27%	0.27	C	S	.	.			trans	-68.6	158.9	179.5	29.4	-33.9	0	0	0	111.3	D48 V125	P45-D48 HydrophobicContact CG-CB 4.29Å; P45-D48 WeakPolarHBondContact O-CB 3.46Å; P45-D48 PolarHBondContact O-N 2.87Å; P45-V125 VanDerWaalsContact CA-O 3.32Å; P45-V125 WeakPolarHBondContact CA-O 3.48Å; P45-V125 VanDerWaalsContact CB-O 3.27Å; P45-V125 WeakPolarHBondContact CB-O 3.31Å
46	P	88.3	Confident	90.3	Very high	33 Å²	33	48.1 Å²	48.1	21%	0.214	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	150.3	177.3	30.6	-37.2	0	0	0	110.5	D48 T95 P124 V125	P46-D48 PolarHBondContact O-N 3.38Å; P46-T95 WeakPolarHBondContact CB-O 3.43Å; P46-P124 HydrophobicContact CG-CB 4.28Å; P46-V125 WeakPolarHBondContact CD-O 3.39Å
47	K	86.7	Confident	91.3	Very high	206 Å²	206	46.8 Å²	46.8	90%	0.896	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	-1.8	-176.8	-48	173	179.8	175	0	115.7
48	D	89.6	Confident	92.2	Very high	28 Å²	28	46.6 Å²	46.6	15%	0.15	24%	0.24	C	C	.	.			trans	-68.3	162.6	168.5	-153.9	-12.1	0	0	0	110.7	I44 P45 P46 R52 V93	I44-D48 HydrophobicContact CG2-CB 3.72Å; P45-D48 HydrophobicContact CG-CB 4.29Å; P45-D48 WeakPolarHBondContact O-CB 3.46Å; P45-D48 PolarHBondContact O-N 2.87Å; P46-D48 PolarHBondContact O-N 3.38Å; D48-R52 IonicContact OD1-CZ 2.78Å; D48-R52 IonicContact OD1-NE 3.43Å; D48-R52 PolarHBondContact OD1-NE 2.84Å; D48-R52 IonicContact OD1-NH2 3.46Å; D48-R52 IonicContact OD2-CZ 3.53Å; D48-R52 IonicContact OD2-NE 3.78Å; D48-R52 PolarHBondContact OD2-NE 2.93Å; D48-R52 IonicContact OD2-NH2 3.47Å; D48-R52 PolarHBondContact OD2-NH2 2.57Å; D48-V93 HydrophobicContact CB-CG2 4.48Å; D48-V93 WeakPolarHBondContact O-CG2 3.45Å
49	Q	90.6	Very high	92.8	Very high	135 Å²	135	51.5 Å²	51.5	63%	0.631	26%	0.262	S	S	*	.			trans	-103.6	127.6	-178.4	-65.5	-175.9	-7.6	0	0	110.8	T51 R52 I53	Q49-T51 PolarHBondContact O-N 3.32Å; Q49-R52 HydrophobicContact CB-CB 4.22Å; Q49-R52 VanDerWaalsContact O-CB 3.31Å; Q49-R52 WeakPolarHBondContact O-CB 2.98Å; Q49-R52 PolarHBondContact O-N 3.2Å; Q49-I53 PolarHBondContact O-N 2.68Å
50	I	91.9	Very high	92.9	Very high	23 Å²	23	54.7 Å²	54.7	12%	0.118	28%	0.276	C	S	.	.	H	α-helix	trans	-56.9	-36.8	175.5	-64.9	-176.7	0	0	0	111	R52 I53 A54 L87 Y90 R92 V93	I50-R52 VanDerWaalsContact C-N 3.3Å; I50-R52 PolarHBondContact O-N 3.16Å; I50-I53 PolarHBondContact O-N 3.02Å; I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.42Å; I50-L87 HydrophobicContact CG2-CB 4.4Å; I50-Y90 VanDerWaalsContact CD1-C 3.48Å; I50-Y90 WeakPolarHBondContact CD1-O 3.36Å; I50-R92 VanDerWaalsContact CD1-C 3.41Å; I50-V93 HydrophobicContact CG1-CG2 3.73Å
51	T	92.2	Very high	92.9	Very high	111 Å²	111	59 Å²	59	68%	0.681	29%	0.293	S	S	*	.	H	α-helix	trans	-59	-39.1	175.7	-45.7	0	0	0	0	112.7	Q49 A54 K55	Q49-T51 PolarHBondContact O-N 3.32Å; T51-A54 PolarHBondContact O-N 2.89Å; T51-K55 PolarHBondContact O-N 3.18Å
52	R	93.2	Very high	92.8	Very high	123 Å²	123	60.6 Å²	60.6	46%	0.464	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-46.1	176.5	-172.1	-177	86.4	104.5	1.2	110.6	D48 Q49 I50 K55 L56	D48-R52 IonicContact OD1-CZ 2.78Å; D48-R52 IonicContact OD1-NE 3.43Å; D48-R52 PolarHBondContact OD1-NE 2.84Å; D48-R52 IonicContact OD1-NH2 3.46Å; D48-R52 IonicContact OD2-CZ 3.53Å; D48-R52 IonicContact OD2-NE 3.78Å; D48-R52 PolarHBondContact OD2-NE 2.93Å; D48-R52 IonicContact OD2-NH2 3.47Å; D48-R52 PolarHBondContact OD2-NH2 2.57Å; Q49-R52 HydrophobicContact CB-CB 4.22Å; Q49-R52 VanDerWaalsContact O-CB 3.31Å; Q49-R52 WeakPolarHBondContact O-CB 2.98Å; Q49-R52 PolarHBondContact O-N 3.2Å; I50-R52 VanDerWaalsContact C-N 3.3Å; I50-R52 PolarHBondContact O-N 3.16Å; R52-K55 WeakPolarHBondContact O-CB 3.41Å; R52-K55 PolarHBondContact O-N 3.37Å; R52-L56 PolarHBondContact O-N 2.77Å
53	I	93.4	Very high	92.6	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-68	-39.2	179.3	-56	-58.6	0	0	0	111.5	L42 I44 Q49 I50 K55 L56 L57 L87	L42-I53 HydrophobicContact CD1-CG2 4.08Å; L42-I53 HydrophobicContact CD2-CG2 3.95Å; I44-I53 HydrophobicContact CD1-CB 4.34Å; I44-I53 HydrophobicContact CD1-CG1 3.99Å; I44-I53 HydrophobicContact CD1-CG2 3.91Å; I44-I53 HydrophobicContact CG1-CD1 4.34Å; I44-I53 HydrophobicContact CG1-CG1 4.08Å; I44-I53 HydrophobicContact CG1-CG2 4.37Å; I44-I53 HydrophobicContact CG2-CD1 4.4Å; I44-I53 HydrophobicContact CG2-CG1 4.04Å; Q49-I53 PolarHBondContact O-N 2.68Å; I50-I53 PolarHBondContact O-N 3.02Å; I53-K55 VanDerWaalsContact C-N 3.3Å; I53-K55 PolarHBondContact O-N 2.92Å; I53-L56 WeakPolarHBondContact O-CB 3.46Å; I53-L56 PolarHBondContact O-N 2.86Å; I53-L57 HydrophobicContact CG2-CD1 4.3Å; I53-L57 WeakPolarHBondContact O-CG 3.44Å; I53-L57 PolarHBondContact O-N 2.94Å; I53-L87 HydrophobicContact CG2-CD1 3.74Å
54	A	93.5	Very high	92.3	Very high	41 Å²	41	65.1 Å²	65.1	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-39.3	174.9	0	0	0	0	0	111.8	I50 T51 L57 A58	I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.42Å; T51-A54 PolarHBondContact O-N 2.89Å; A54-L57 PolarHBondContact O-N 3.41Å; A54-A58 PolarHBondContact O-N 3.49Å
55	K	94.8	Very high	92.2	Very high	139 Å²	139	67.4 Å²	67.4	60%	0.604	36%	0.355	S	S	*	.	H	α-helix	trans	-63.8	-47.3	173.4	-171	-173.9	178.9	-161.8	0	111.5	T51 R52 I53 L57 A58 E59	T51-K55 PolarHBondContact O-N 3.18Å; R52-K55 WeakPolarHBondContact O-CB 3.41Å; R52-K55 PolarHBondContact O-N 3.37Å; I53-K55 VanDerWaalsContact C-N 3.3Å; I53-K55 PolarHBondContact O-N 2.92Å; K55-L57 VanDerWaalsContact C-N 3.32Å; K55-L57 PolarHBondContact O-N 3.17Å; K55-A58 WeakPolarHBondContact O-CB 3.47Å; K55-A58 PolarHBondContact O-N 3.35Å; K55-A58 VanDerWaalsContact O-N 3.09Å; K55-E59 WeakPolarHBondContact CE-OE1 3.22Å; K55-E59 IonicContact NZ-OE1 2.57Å; K55-E59 PolarHBondContact O-N 3.22Å
56	L	94	Very high	92.2	Very high	52 Å²	52	72.6 Å²	72.6	27%	0.272	38%	0.381	S	S	.	.	H	α-helix	trans	-55.5	-47.3	175.6	-179.4	153.9	0	0	0	111	R52 I53 A58 E59 E60 Y130	R52-L56 PolarHBondContact O-N 2.77Å; I53-L56 WeakPolarHBondContact O-CB 3.46Å; I53-L56 PolarHBondContact O-N 2.86Å; L56-A58 VanDerWaalsContact C-N 3.28Å; L56-A58 PolarHBondContact O-N 2.81Å; L56-E59 WeakPolarHBondContact O-CB 3.43Å; L56-E59 PolarHBondContact O-N 2.91Å; L56-E60 HydrophobicContact CD2-CG 3.95Å; L56-E60 WeakPolarHBondContact O-CB 3.09Å; L56-E60 VanDerWaalsContact O-CG 3.31Å; L56-E60 WeakPolarHBondContact O-CG 3.5Å; L56-E60 PolarHBondContact O-N 2.96Å; L56-Y130 HydrophobicContact CD2-CD1 4.05Å; L56-Y130 HydrophobicContact CD2-CD2 4.08Å; L56-Y130 HydrophobicContact CD2-CE1 4.48Å; L56-Y130 HydrophobicContact CD2-CE2 4.49Å; L56-Y130 HydrophobicContact CD2-CG 3.83Å
57	L	94.4	Very high	92.2	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-65.2	-30.2	178.4	-69.2	171.9	0	0	0	113.3	L42 I53 A54 K55 Y61 I80 V83 Q84 L87 Y130	L42-L57 HydrophobicContact CD2-CD1 4.43Å; I53-L57 HydrophobicContact CG2-CD1 4.3Å; I53-L57 WeakPolarHBondContact O-CG 3.44Å; I53-L57 PolarHBondContact O-N 2.94Å; A54-L57 PolarHBondContact O-N 3.41Å; K55-L57 VanDerWaalsContact C-N 3.32Å; K55-L57 PolarHBondContact O-N 3.17Å; L57-Y61 WeakPolarHBondContact O-CB 3.31Å; L57-Y61 PolarHBondContact O-N 3.26Å; L57-I80 HydrophobicContact CB-CG2 4.32Å; L57-I80 HydrophobicContact CD2-CG2 4.45Å; L57-I80 WeakPolarHBondContact O-CG2 3.35Å; L57-V83 HydrophobicContact CD1-CB 4.37Å; L57-V83 HydrophobicContact CD1-CG1 3.64Å; L57-V83 HydrophobicContact CD2-CG1 4.25Å; L57-Q84 HydrophobicContact CB-CG 3.91Å; L57-Q84 HydrophobicContact CD1-CG 4.03Å; L57-L87 HydrophobicContact CD1-CD1 3.28Å; L57-Y130 HydrophobicContact CD2-CD2 4Å; L57-Y130 HydrophobicContact CD2-CE2 3.51Å
58	A	94.4	Very high	92.3	Very high	53 Å²	53	73.5 Å²	73.5	44%	0.438	38%	0.383	S	S	.	.	H	α-helix	trans	-70.3	-39.5	174.3	0	0	0	0	0	111.8	A54 K55 L56 Y61 G62	A54-A58 PolarHBondContact O-N 3.49Å; K55-A58 WeakPolarHBondContact O-CB 3.47Å; K55-A58 PolarHBondContact O-N 3.35Å; K55-A58 VanDerWaalsContact O-N 3.09Å; L56-A58 VanDerWaalsContact C-N 3.28Å; L56-A58 PolarHBondContact O-N 2.81Å; A58-Y61 PolarHBondContact O-N 2.82Å; A58-G62 PolarHBondContact O-N 3.4Å; A58-G62 VanDerWaalsContact O-N 3.12Å
59	E	95	Very high	92.3	Very high	109 Å²	109	75.2 Å²	75.2	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-45.5	173.4	-69	171.3	-175	0	0	110.7	K55 L56 Y61 G62 T63	K55-E59 WeakPolarHBondContact CE-OE1 3.22Å; K55-E59 IonicContact NZ-OE1 2.57Å; K55-E59 PolarHBondContact O-N 3.22Å; L56-E59 WeakPolarHBondContact O-CB 3.43Å; L56-E59 PolarHBondContact O-N 2.91Å; E59-Y61 PolarHBondContact O-N 2.94Å; E59-G62 WeakPolarHBondContact O-CA 3.33Å; E59-G62 PolarHBondContact O-N 2.82Å; E59-G62 VanDerWaalsContact O-N 3.11Å; E59-T63 PolarHBondContact O-N 2.96Å; E59-T63 PolarHBondContact O-OG1 2.81Å
60	E	92.3	Very high	92.2	Very high	67 Å²	67	77.7 Å²	77.7	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-37.1	176.4	-71.3	-63.8	138.7	0	0	113	L56 G62 T63 A64 I80 Y130	L56-E60 HydrophobicContact CD2-CG 3.95Å; L56-E60 WeakPolarHBondContact O-CB 3.09Å; L56-E60 VanDerWaalsContact O-CG 3.31Å; L56-E60 WeakPolarHBondContact O-CG 3.5Å; L56-E60 PolarHBondContact O-N 2.96Å; E60-G62 VanDerWaalsContact C-N 3.3Å; E60-G62 PolarHBondContact O-N 3Å; E60-T63 PolarHBondContact O-N 2.97Å; E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.29Å; E60-A64 PolarHBondContact O-N 3.04Å; E60-I80 HydrophobicContact CB-CD1 4.3Å; E60-Y130 HydrophobicContact CB-CE1 4.17Å; E60-Y130 WeakPolarHBondContact CB-OH 3.1Å; E60-Y130 VanDerWaalsContact CD-CE1 3.43Å; E60-Y130 HydrophobicContact CG-CD1 4.17Å; E60-Y130 HydrophobicContact CG-CE1 3.42Å; E60-Y130 VanDerWaalsContact CG-CE1 3.42Å; E60-Y130 WeakPolarHBondContact OE2-CE1 3.34Å
61	Y	93.5	Very high	91.9	Very high	90 Å²	90	81.6 Å²	81.6	35%	0.353	43%	0.426	S	S	.	.	H	α-helix	trans	-60	-43.2	171.8	-169.6	-83.8	0	0	0	111.2	L57 A58 E59 A64 S65 L77 I80	L57-Y61 WeakPolarHBondContact O-CB 3.31Å; L57-Y61 PolarHBondContact O-N 3.26Å; A58-Y61 PolarHBondContact O-N 2.82Å; E59-Y61 PolarHBondContact O-N 2.94Å; Y61-A64 PolarHBondContact O-N 3.4Å; Y61-S65 PolarHBondContact O-N 3.21Å; Y61-S65 VanDerWaalsContact O-N 3.12Å; Y61-L77 HydrophobicContact CD1-CD2 3.95Å; Y61-L77 HydrophobicContact CD2-CD2 3.69Å; Y61-L77 HydrophobicContact CE1-CD2 3.86Å; Y61-L77 HydrophobicContact CE2-CB 3.9Å; Y61-L77 HydrophobicContact CE2-CD2 3.6Å; Y61-L77 HydrophobicContact CE2-CG 4.28Å; Y61-L77 HydrophobicContact CG-CD2 3.86Å; Y61-L77 WeakPolarHBondContact O-CD2 3.37Å; Y61-I80 HydrophobicContact CD2-CB 4.2Å; Y61-I80 HydrophobicContact CD2-CG2 3.94Å
62	G	93.3	Very high	91.6	Very high	34 Å²	34	78.1 Å²	78.1	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-60	-47.2	174.7	0	0	0	0	0	112.2	A58 E59 E60 S65	A58-G62 PolarHBondContact O-N 3.4Å; A58-G62 VanDerWaalsContact O-N 3.12Å; E59-G62 WeakPolarHBondContact O-CA 3.33Å; E59-G62 PolarHBondContact O-N 2.82Å; E59-G62 VanDerWaalsContact O-N 3.11Å; E60-G62 VanDerWaalsContact C-N 3.3Å; E60-G62 PolarHBondContact O-N 3Å; G62-S65 WeakPolarHBondContact O-CB 3.32Å; G62-S65 PolarHBondContact O-N 3.41Å; G62-S65 PolarHBondContact O-OG 3Å
63	T	91.5	Very high	91.4	Very high	90 Å²	90	76.4 Å²	76.4	55%	0.552	40%	0.397	S	S	*	.	H	α-helix	trans	-62.5	-44.3	177.2	-57.5	0	0	0	0	111.7	E59 E60 S65 N66	E59-T63 PolarHBondContact O-N 2.96Å; E59-T63 PolarHBondContact O-OG1 2.81Å; E60-T63 PolarHBondContact O-N 2.97Å; T63-S65 PolarHBondContact O-N 3.25Å; T63-N66 WeakPolarHBondContact O-CB 3.47Å; T63-N66 PolarHBondContact O-N 2.8Å; T63-N66 VanDerWaalsContact O-N 3.17Å
64	A	89.7	Confident	91.2	Very high	8 Å²	8	80.9 Å²	80.9	7%	0.066	42%	0.42	C	S	.	.	H	α-helix	trans	-63.4	-26.9	179	0	0	0	0	0	113.2	E60 Y61 N66 I67 R73 V76 L77 I80	E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.29Å; E60-A64 PolarHBondContact O-N 3.04Å; Y61-A64 PolarHBondContact O-N 3.4Å; A64-N66 PolarHBondContact O-N 3.08Å; A64-N66 VanDerWaalsContact O-N 3.15Å; A64-I67 HydrophobicContact CB-CD1 4.1Å; A64-I67 WeakPolarHBondContact O-CB 3.21Å; A64-I67 WeakPolarHBondContact O-CD1 3.42Å; A64-I67 VanDerWaalsContact O-CG1 3.26Å; A64-I67 WeakPolarHBondContact O-CG1 3.43Å; A64-I67 PolarHBondContact O-N 3.34Å; A64-I67 VanDerWaalsContact O-N 3.11Å; A64-R73 WeakPolarHBondContact O-CG 3.33Å; A64-V76 HydrophobicContact CB-CB 4.44Å; A64-V76 HydrophobicContact CB-CG1 3.72Å; A64-L77 HydrophobicContact CB-CD2 3.82Å; A64-I80 HydrophobicContact CB-CD1 4.02Å
65	S	91.6	Very high	90.9	Very high	48 Å²	48	80.2 Å²	80.2	34%	0.336	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.9	176.9	78.7	0	0	0	0	113.5	Y61 G62 T63 R73	Y61-S65 PolarHBondContact O-N 3.21Å; Y61-S65 VanDerWaalsContact O-N 3.12Å; G62-S65 WeakPolarHBondContact O-CB 3.32Å; G62-S65 PolarHBondContact O-N 3.41Å; G62-S65 PolarHBondContact O-OG 3Å; T63-S65 PolarHBondContact O-N 3.25Å; S65-R73 WeakPolarHBondContact O-CD 3.23Å; S65-R73 PolarHBondContact O-NH1 3.05Å; S65-R73 VanDerWaalsContact O-NH1 3.07Å
66	N	91.9	Very high	90.6	Very high	131 Å²	131	73.9 Å²	73.9	70%	0.701	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.1	179	-63.2	-47.1	0	0	0	113.9	T63 A64 K68	T63-N66 WeakPolarHBondContact O-CB 3.47Å; T63-N66 PolarHBondContact O-N 2.8Å; T63-N66 VanDerWaalsContact O-N 3.17Å; A64-N66 PolarHBondContact O-N 3.08Å; A64-N66 VanDerWaalsContact O-N 3.15Å; N66-K68 PolarHBondContact O-N 2.95Å
67	I	88.5	Confident	90.6	Very high	46 Å²	46	72.5 Å²	72.5	24%	0.236	38%	0.379	C	S	.	.			trans	-62.1	125.4	177.7	-66.7	168.4	0	0	0	110	A64 N72 R73 V76	A64-I67 HydrophobicContact CB-CD1 4.1Å; A64-I67 WeakPolarHBondContact O-CB 3.21Å; A64-I67 WeakPolarHBondContact O-CD1 3.42Å; A64-I67 VanDerWaalsContact O-CG1 3.26Å; A64-I67 WeakPolarHBondContact O-CG1 3.43Å; A64-I67 PolarHBondContact O-N 3.34Å; A64-I67 VanDerWaalsContact O-N 3.11Å; I67-N72 HydrophobicContact CG2-CB 4.26Å; I67-R73 HydrophobicContact CB-CB 3.9Å; I67-R73 HydrophobicContact CB-CG 4.3Å; I67-R73 HydrophobicContact CG2-CB 4.06Å; I67-R73 WeakPolarHBondContact O-CD 3.48Å; I67-V76 HydrophobicContact CD1-CB 4.24Å; I67-V76 HydrophobicContact CD1-CG1 4.43Å; I67-V76 HydrophobicContact CD1-CG2 3.99Å
68	K	89.6	Confident	90.4	Very high	212 Å²	212	75 Å²	75	92%	0.922	40%	0.397	S	S	*	.	S	Bend	trans	-64.8	-41	-176.5	-65	-177.2	-179.3	179.2	0	113.4	N66 R70	N66-K68 PolarHBondContact O-N 2.95Å; K68-R70 PolarHBondContact O-N 3.09Å
69	S	88.5	Confident	90.3	Very high	64 Å²	64	72.7 Å²	72.7	45%	0.448	38%	0.377	S	S	.	.			trans	-72.3	115	178.7	173.8	0	0	0	0	109.9	V71 N72 R73	S69-V71 VanDerWaalsContact C-N 3.32Å; S69-V71 PolarHBondContact O-N 3.35Å; S69-N72 PolarHBondContact O-N 3.31Å; S69-N72 PolarHBondContact OG-N 3.49Å; S69-R73 VanDerWaalsContact O-CB 3.23Å; S69-R73 WeakPolarHBondContact O-CB 3.5Å; S69-R73 PolarHBondContact O-N 3.04Å
70	R	88.7	Confident	90.2	Very high	187 Å²	187	67.5 Å²	67.5	71%	0.706	35%	0.353	S	S	*	.	H	α-helix	trans	-57.9	-44	-179.1	-178.4	-179.5	177.1	-175.5	-0.5	112.1	K68 L74	K68-R70 PolarHBondContact O-N 3.09Å; R70-L74 HydrophobicContact CG-CD1 4.15Å; R70-L74 WeakPolarHBondContact O-CG 3.49Å; R70-L74 PolarHBondContact O-N 2.87Å
71	V	86.4	Confident	90.3	Very high	105 Å²	105	66.4 Å²	66.4	64%	0.636	35%	0.351	S	S	*	.	H	α-helix	trans	-65.5	-51.2	-178.5	179.9	0	0	0	0	110	S69 R73 L74 S75	S69-V71 VanDerWaalsContact C-N 3.32Å; S69-V71 PolarHBondContact O-N 3.35Å; V71-R73 VanDerWaalsContact C-N 3.33Å; V71-R73 PolarHBondContact O-N 3.21Å; V71-L74 PolarHBondContact O-N 2.87Å; V71-S75 PolarHBondContact O-N 3.31Å; V71-S75 VanDerWaalsContact O-N 3.09Å; V71-S75 PolarHBondContact O-OG 3.08Å
72	N	84.4	Confident	90.2	Very high	38 Å²	38	62.2 Å²	62.2	20%	0.203	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-44.9	179.3	-165.7	23.9	0	0	0	111.2	T37 I67 S69 L74 S75 V76	T37-N72 PolarHBondContact OG1-ND2 3.49Å; T37-N72 PolarHBondContact OG1-OD1 3.36Å; I67-N72 HydrophobicContact CG2-CB 4.26Å; S69-N72 PolarHBondContact O-N 3.31Å; S69-N72 PolarHBondContact OG-N 3.49Å; N72-L74 PolarHBondContact O-N 2.87Å; N72-S75 PolarHBondContact O-N 2.8Å; N72-V76 VanDerWaalsContact O-CG2 3.26Å; N72-V76 WeakPolarHBondContact O-CG2 3.37Å; N72-V76 PolarHBondContact O-N 3.28Å
73	R	89.7	Confident	90.2	Very high	87 Å²	87	60.6 Å²	60.6	33%	0.328	32%	0.318	S	S	.	.	H	α-helix	trans	-54.6	-50.3	176.8	-178.5	169.9	61.8	-178.5	0.2	112.2	A64 S65 I67 S69 V71 S75 V76 L77	A64-R73 WeakPolarHBondContact O-CG 3.33Å; S65-R73 WeakPolarHBondContact O-CD 3.23Å; S65-R73 PolarHBondContact O-NH1 3.05Å; S65-R73 VanDerWaalsContact O-NH1 3.07Å; I67-R73 HydrophobicContact CB-CB 3.9Å; I67-R73 HydrophobicContact CB-CG 4.3Å; I67-R73 HydrophobicContact CG2-CB 4.06Å; I67-R73 WeakPolarHBondContact O-CD 3.48Å; S69-R73 VanDerWaalsContact O-CB 3.23Å; S69-R73 WeakPolarHBondContact O-CB 3.5Å; S69-R73 PolarHBondContact O-N 3.04Å; V71-R73 VanDerWaalsContact C-N 3.33Å; V71-R73 PolarHBondContact O-N 3.21Å; R73-S75 VanDerWaalsContact C-N 3.31Å; R73-S75 PolarHBondContact O-N 3.18Å; R73-V76 PolarHBondContact O-N 2.85Å; R73-L77 HydrophobicContact CG-CD1 3.77Å; R73-L77 HydrophobicContact CG-CG 4.27Å; R73-L77 WeakPolarHBondContact O-CB 3.08Å; R73-L77 WeakPolarHBondContact O-CG 3.37Å; R73-L77 PolarHBondContact O-N 3.05Å
74	L	90.2	Very high	90.4	Very high	98 Å²	98	58.9 Å²	58.9	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-40.6	-179.9	-72.1	172.4	0	0	0	111.7	R70 V71 N72 S78	R70-L74 HydrophobicContact CG-CD1 4.15Å; R70-L74 WeakPolarHBondContact O-CG 3.49Å; R70-L74 PolarHBondContact O-N 2.87Å; V71-L74 PolarHBondContact O-N 2.87Å; N72-L74 PolarHBondContact O-N 2.87Å; L74-S78 VanDerWaalsContact O-CB 3.26Å; L74-S78 WeakPolarHBondContact O-CB 3.44Å; L74-S78 PolarHBondContact O-N 3.35Å
75	S	86.9	Confident	90.5	Very high	27 Å²	27	64.1 Å²	64.1	19%	0.189	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-46.2	177.5	-59.1	0	0	0	0	112.2	V71 N72 R73 S78 A79	V71-S75 PolarHBondContact O-N 3.31Å; V71-S75 VanDerWaalsContact O-N 3.09Å; V71-S75 PolarHBondContact O-OG 3.08Å; N72-S75 PolarHBondContact O-N 2.8Å; R73-S75 VanDerWaalsContact C-N 3.31Å; R73-S75 PolarHBondContact O-N 3.18Å; S75-S78 PolarHBondContact O-N 2.92Å; S75-A79 PolarHBondContact O-N 3.09Å
76	V	89	Confident	90.5	Very high	6 Å²	6	64.9 Å²	64.9	4%	0.036	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-47.9	177	-179	0	0	0	0	111.3	T37 A64 I67 N72 R73 S78 A79 I80	T37-V76 WeakPolarHBondContact O-CG2 3.32Å; A64-V76 HydrophobicContact CB-CB 4.44Å; A64-V76 HydrophobicContact CB-CG1 3.72Å; I67-V76 HydrophobicContact CD1-CB 4.24Å; I67-V76 HydrophobicContact CD1-CG1 4.43Å; I67-V76 HydrophobicContact CD1-CG2 3.99Å; N72-V76 VanDerWaalsContact O-CG2 3.26Å; N72-V76 WeakPolarHBondContact O-CG2 3.37Å; N72-V76 PolarHBondContact O-N 3.28Å; R73-V76 PolarHBondContact O-N 2.85Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 2.87Å; V76-A79 WeakPolarHBondContact O-CB 3.38Å; V76-A79 PolarHBondContact O-N 3.24Å; V76-A79 VanDerWaalsContact O-N 3.15Å; V76-I80 HydrophobicContact CG1-CD1 3.89Å; V76-I80 HydrophobicContact CG1-CG1 4.33Å; V76-I80 WeakPolarHBondContact O-CG1 3.24Å; V76-I80 PolarHBondContact O-N 3.15Å
77	L	92.1	Very high	90.5	Very high	22 Å²	22	58.9 Å²	58.9	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-39	179.6	-67.1	175.1	0	0	0	111.9	Y61 A64 R73 T81	Y61-L77 HydrophobicContact CD1-CD2 3.95Å; Y61-L77 HydrophobicContact CD2-CD2 3.69Å; Y61-L77 HydrophobicContact CE1-CD2 3.86Å; Y61-L77 HydrophobicContact CE2-CB 3.9Å; Y61-L77 HydrophobicContact CE2-CD2 3.6Å; Y61-L77 HydrophobicContact CE2-CG 4.28Å; Y61-L77 HydrophobicContact CG-CD2 3.86Å; Y61-L77 WeakPolarHBondContact O-CD2 3.37Å; A64-L77 HydrophobicContact CB-CD2 3.82Å; R73-L77 HydrophobicContact CG-CD1 3.77Å; R73-L77 HydrophobicContact CG-CG 4.27Å; R73-L77 WeakPolarHBondContact O-CB 3.08Å; R73-L77 WeakPolarHBondContact O-CG 3.37Å; R73-L77 PolarHBondContact O-N 3.05Å; L77-T81 WeakPolarHBondContact O-CB 3.49Å; L77-T81 PolarHBondContact O-N 3.38Å; L77-T81 PolarHBondContact O-OG1 2.97Å
78	S	91.3	Very high	90.7	Very high	54 Å²	54	65 Å²	65	38%	0.378	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-41.4	175.1	-177.4	0	0	0	0	112.1	L74 S75 V76 T81 S82	L74-S78 VanDerWaalsContact O-CB 3.26Å; L74-S78 WeakPolarHBondContact O-CB 3.44Å; L74-S78 PolarHBondContact O-N 3.35Å; S75-S78 PolarHBondContact O-N 2.92Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 2.87Å; S78-T81 PolarHBondContact O-N 3.06Å; S78-S82 WeakPolarHBondContact O-CB 3.4Å; S78-S82 PolarHBondContact O-N 3.1Å; S78-S82 PolarHBondContact O-OG 2.91Å
79	A	91.4	Very high	90.8	Very high	3 Å²	3	61 Å²	61	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-49.6	175.3	0	0	0	0	0	111.1	I40 S75 V76 T81 S82 V83	I40-A79 HydrophobicContact CD1-CB 3.6Å; I40-A79 HydrophobicContact CG1-CB 4.08Å; S75-A79 PolarHBondContact O-N 3.09Å; V76-A79 WeakPolarHBondContact O-CB 3.38Å; V76-A79 PolarHBondContact O-N 3.24Å; V76-A79 VanDerWaalsContact O-N 3.15Å; A79-T81 VanDerWaalsContact C-N 3.32Å; A79-T81 PolarHBondContact O-N 3.4Å; A79-S82 WeakPolarHBondContact O-CB 3.43Å; A79-S82 PolarHBondContact O-N 2.85Å; A79-S82 VanDerWaalsContact O-N 3.09Å; A79-V83 WeakPolarHBondContact O-CG2 3.43Å; A79-V83 PolarHBondContact O-N 2.84Å
80	I	93.7	Very high	90.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.9	-44.7	177.6	-64.3	172.8	0	0	0	110.7	I40 L57 E60 Y61 A64 V76 S82 V83 Q84	I40-I80 HydrophobicContact CD1-CB 4.3Å; I40-I80 HydrophobicContact CD1-CG1 3.58Å; L57-I80 HydrophobicContact CB-CG2 4.32Å; L57-I80 HydrophobicContact CD2-CG2 4.45Å; L57-I80 WeakPolarHBondContact O-CG2 3.35Å; E60-I80 HydrophobicContact CB-CD1 4.3Å; Y61-I80 HydrophobicContact CD2-CB 4.2Å; Y61-I80 HydrophobicContact CD2-CG2 3.94Å; A64-I80 HydrophobicContact CB-CD1 4.02Å; V76-I80 HydrophobicContact CG1-CD1 3.89Å; V76-I80 HydrophobicContact CG1-CG1 4.33Å; V76-I80 WeakPolarHBondContact O-CG1 3.24Å; V76-I80 PolarHBondContact O-N 3.15Å; I80-S82 PolarHBondContact O-N 2.98Å; I80-V83 PolarHBondContact O-N 3.15Å; I80-Q84 HydrophobicContact CG2-CG 4.34Å; I80-Q84 WeakPolarHBondContact O-CG 3.43Å; I80-Q84 PolarHBondContact O-N 3.08Å
81	T	93.8	Very high	91	Very high	44 Å²	44	59 Å²	59	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-58.6	-40.2	178	-56.2	0	0	0	0	111.3	L77 S78 A79 Q84 Q85	L77-T81 WeakPolarHBondContact O-CB 3.49Å; L77-T81 PolarHBondContact O-N 3.38Å; L77-T81 PolarHBondContact O-OG1 2.97Å; S78-T81 PolarHBondContact O-N 3.06Å; A79-T81 VanDerWaalsContact C-N 3.32Å; A79-T81 PolarHBondContact O-N 3.4Å; T81-Q84 PolarHBondContact O-N 2.78Å; T81-Q85 WeakPolarHBondContact O-CG 3.5Å; T81-Q85 PolarHBondContact O-N 3.47Å
82	S	92.5	Very high	91.2	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-67.4	-39.8	179.1	-56.4	0	0	0	0	112	S78 A79 I80 Q85 R86 C102 K114	S78-S82 WeakPolarHBondContact O-CB 3.4Å; S78-S82 PolarHBondContact O-N 3.1Å; S78-S82 PolarHBondContact O-OG 2.91Å; A79-S82 WeakPolarHBondContact O-CB 3.43Å; A79-S82 PolarHBondContact O-N 2.85Å; A79-S82 VanDerWaalsContact O-N 3.09Å; I80-S82 PolarHBondContact O-N 2.98Å; S82-Q85 PolarHBondContact O-N 3.12Å; S82-R86 PolarHBondContact O-N 2.87Å; S82-C102 WeakPolarHBondContact CB-SG 3.42Å; S82-K114 WeakPolarHBondContact OG-CE 3.35Å; S82-K114 PolarHBondContact OG-NZ 3.33Å
83	V	93.9	Very high	91.6	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-44.1	173.8	178.8	0	0	0	0	110.7	I40 L42 L57 A79 I80 Q85 R86 L87 V100 C102	I40-V83 HydrophobicContact CB-CG2 4.4Å; I40-V83 HydrophobicContact CD1-CG2 4.18Å; I40-V83 HydrophobicContact CG2-CG2 4.2Å; L42-V83 HydrophobicContact CD2-CG1 3.53Å; L57-V83 HydrophobicContact CD1-CB 4.37Å; L57-V83 HydrophobicContact CD1-CG1 3.64Å; L57-V83 HydrophobicContact CD2-CG1 4.25Å; A79-V83 WeakPolarHBondContact O-CG2 3.43Å; A79-V83 PolarHBondContact O-N 2.84Å; I80-V83 PolarHBondContact O-N 3.15Å; V83-Q85 VanDerWaalsContact C-N 3.34Å; V83-Q85 PolarHBondContact O-N 3.29Å; V83-R86 PolarHBondContact O-N 3.17Å; V83-L87 HydrophobicContact CG1-CD1 4.26Å; V83-L87 HydrophobicContact CG1-CG 4.5Å; V83-L87 WeakPolarHBondContact O-CG 3.3Å; V83-L87 PolarHBondContact O-N 3.07Å; V83-V100 HydrophobicContact CG1-CG1 4.25Å; V83-V100 HydrophobicContact CG2-CG1 4.3Å; V83-C102 HydrophobicContact CG2-CB 3.54Å
84	Q	93.9	Very high	91.7	Very high	53 Å²	53	58.8 Å²	58.8	25%	0.248	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-42.4	176.3	-73.3	177.2	-20	0	0	112.2	L57 I80 T81 R86 L87 K88	L57-Q84 HydrophobicContact CB-CG 3.91Å; L57-Q84 HydrophobicContact CD1-CG 4.03Å; I80-Q84 HydrophobicContact CG2-CG 4.34Å; I80-Q84 WeakPolarHBondContact O-CG 3.43Å; I80-Q84 PolarHBondContact O-N 3.08Å; T81-Q84 PolarHBondContact O-N 2.78Å; Q84-R86 VanDerWaalsContact C-N 3.34Å; Q84-L87 PolarHBondContact O-N 3.1Å; Q84-K88 WeakPolarHBondContact O-CG 3.29Å; Q84-K88 PolarHBondContact O-N 2.61Å
85	Q	93.5	Very high	91.6	Very high	119 Å²	119	59.5 Å²	59.5	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-63	-41.2	175.4	-74.9	174.3	-12.3	0	0	111.6	T81 S82 V83 K88	T81-Q85 WeakPolarHBondContact O-CG 3.5Å; T81-Q85 PolarHBondContact O-N 3.47Å; S82-Q85 PolarHBondContact O-N 3.12Å; V83-Q85 VanDerWaalsContact C-N 3.34Å; V83-Q85 PolarHBondContact O-N 3.29Å; Q85-K88 WeakPolarHBondContact O-CB 3.48Å; Q85-K88 PolarHBondContact O-N 2.87Å
86	R	91	Very high	91.7	Very high	64 Å²	64	59.7 Å²	59.7	24%	0.242	30%	0.299	C	S	.	.	H	α-helix	trans	-65.9	-42.5	178.6	-161.8	71.8	80.7	143.4	0.2	112.2	S82 V83 Q84 K88 L89 Y90 N116 D118	S82-R86 PolarHBondContact O-N 2.87Å; V83-R86 PolarHBondContact O-N 3.17Å; Q84-R86 VanDerWaalsContact C-N 3.34Å; R86-K88 PolarHBondContact O-N 2.83Å; R86-L89 VanDerWaalsContact O-CB 3.29Å; R86-L89 WeakPolarHBondContact O-CB 3.41Å; R86-L89 WeakPolarHBondContact O-CG 3.45Å; R86-L89 PolarHBondContact O-N 3.45Å; R86-Y90 WeakPolarHBondContact O-CD2 3.43Å; R86-N116 PolarHBondContact NE-OD1 2.86Å; R86-N116 VanDerWaalsContact NE-OD1 3.11Å; R86-N116 PolarHBondContact NH2-ND2 3.24Å; R86-N116 PolarHBondContact NH2-O 2.95Å; R86-N116 PolarHBondContact NH2-OD1 2.91Å; R86-D118 VanDerWaalsContact CD-CG 3.44Å; R86-D118 WeakPolarHBondContact CD-OD1 3.03Å; R86-D118 HydrophobicContact CG-CB 3.85Å; R86-D118 VanDerWaalsContact CG-CG 3.45Å; R86-D118 IonicContact CZ-OD1 2.67Å; R86-D118 IonicContact NE-OD1 3.98Å; R86-D118 PolarHBondContact NE-OD1 2.92Å; R86-D118 IonicContact NH1-OD1 3.05Å; R86-D118 PolarHBondContact NH1-OD1 2.62Å; R86-D118 IonicContact NH2-OD1 2.7Å
87	L	92.5	Very high	91.9	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-61.2	-28.2	177.5	-76.1	174	0	0	0	113.4	L42 I44 I50 I53 L57 V83 Q84 L89 Y90 L98	L42-L87 HydrophobicContact CD2-CD1 4.2Å; I44-L87 HydrophobicContact CD1-CD2 3.7Å; I50-L87 HydrophobicContact CG2-CB 4.4Å; I53-L87 HydrophobicContact CG2-CD1 3.74Å; L57-L87 HydrophobicContact CD1-CD1 3.28Å; V83-L87 HydrophobicContact CG1-CD1 4.26Å; V83-L87 HydrophobicContact CG1-CG 4.5Å; V83-L87 WeakPolarHBondContact O-CG 3.3Å; V83-L87 PolarHBondContact O-N 3.07Å; Q84-L87 PolarHBondContact O-N 3.1Å; L87-L89 PolarHBondContact O-N 3.02Å; L87-Y90 PolarHBondContact O-N 2.93Å; L87-Y90 VanDerWaalsContact O-N 3.13Å; L87-L98 HydrophobicContact CD2-CD2 3.81Å
88	K	91.8	Very high	92	Very high	176 Å²	176	58.3 Å²	58.3	77%	0.765	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-20	175.5	-70	175.9	-177.5	-176.8	0	113.5	Q84 Q85 R86 Y90	Q84-K88 WeakPolarHBondContact O-CG 3.29Å; Q84-K88 PolarHBondContact O-N 2.61Å; Q85-K88 WeakPolarHBondContact O-CB 3.48Å; Q85-K88 PolarHBondContact O-N 2.87Å; R86-K88 PolarHBondContact O-N 2.83Å; K88-Y90 PolarHBondContact O-N 3.35Å
89	L	91.3	Very high	92.1	Very high	128 Å²	128	55.8 Å²	55.8	67%	0.67	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.3	175.1	-57.7	176.7	0	0	0	112	R86 L87	R86-L89 VanDerWaalsContact O-CB 3.29Å; R86-L89 WeakPolarHBondContact O-CB 3.41Å; R86-L89 WeakPolarHBondContact O-CG 3.45Å; R86-L89 PolarHBondContact O-N 3.45Å; L87-L89 PolarHBondContact O-N 3.02Å
90	Y	91.7	Very high	92.3	Very high	61 Å²	61	55.6 Å²	55.6	24%	0.239	27%	0.273	C	S	.	.			trans	-103.7	122.6	-178.8	-63.5	-91.3	0	0	0	109.9	I50 R86 L87 K88 P94 L98 D118	I50-Y90 VanDerWaalsContact CD1-C 3.48Å; I50-Y90 WeakPolarHBondContact CD1-O 3.36Å; R86-Y90 WeakPolarHBondContact O-CD2 3.43Å; L87-Y90 PolarHBondContact O-N 2.93Å; L87-Y90 VanDerWaalsContact O-N 3.13Å; K88-Y90 PolarHBondContact O-N 3.35Å; Y90-P94 HydrophobicContact CD1-CG 4.15Å; Y90-P94 HydrophobicContact CE1-CG 4.16Å; Y90-L98 HydrophobicContact CD1-CD1 4.43Å; Y90-L98 HydrophobicContact CD1-CD2 4.32Å; Y90-L98 HydrophobicContact CD2-CD2 3.82Å; Y90-L98 HydrophobicContact CE1-CD1 3.81Å; Y90-L98 HydrophobicContact CE1-CD2 4.44Å; Y90-L98 HydrophobicContact CE2-CD1 4.01Å; Y90-L98 HydrophobicContact CE2-CD2 3.96Å; Y90-L98 HydrophobicContact CG-CD2 4.02Å; Y90-D118 VanDerWaalsContact CE2-OD2 3.28Å; Y90-D118 WeakPolarHBondContact CE2-OD2 3.47Å; Y90-D118 PolarHBondContact OH-OD2 3.15Å
91	T	89.4	Confident	92.3	Very high	147 Å²	147	55.6 Å²	55.6	90%	0.902	27%	0.273	S	S	*	.	S	Bend	trans	-79.6	-29.8	173.3	-46.9	0	0	0	0	111.9
92	R	91.6	Very high	92.3	Very high	193 Å²	193	53.5 Å²	53.5	73%	0.728	26%	0.26	S	S	*	.	S	Bend	trans	-143	153.6	178	63.7	-178.8	-179.7	-174.7	-0.2	109.8	I50	I50-R92 VanDerWaalsContact CD1-C 3.41Å
93	V	92.2	Very high	92.2	Very high	16 Å²	16	53.5 Å²	53.5	10%	0.097	26%	0.26	C	S	.	.			trans	-63.4	132.5	171.5	-176.9	0	0	0	0	108.2	I44 D48 I50 L98	I44-V93 HydrophobicContact CB-CG1 4.47Å; I44-V93 HydrophobicContact CG2-CB 4.5Å; I44-V93 HydrophobicContact CG2-CG1 3.94Å; I44-V93 HydrophobicContact CG2-CG2 3.68Å; D48-V93 HydrophobicContact CB-CG2 4.48Å; D48-V93 WeakPolarHBondContact O-CG2 3.45Å; I50-V93 HydrophobicContact CG1-CG2 3.73Å; V93-L98 HydrophobicContact CG1-CB 4.4Å
94	P	92.4	Very high	91.9	Very high	17 Å²	17	54.9 Å²	54.9	11%	0.11	27%	0.268	C	S	.	.			trans	-59	165.5	176.2	-20.1	32.2	0	0	0	112.9	Y90 N96 G97 L98 E120	Y90-P94 HydrophobicContact CD1-CG 4.15Å; Y90-P94 HydrophobicContact CE1-CG 4.16Å; P94-N96 VanDerWaalsContact C-N 3.28Å; P94-N96 PolarHBondContact O-N 2.67Å; P94-G97 PolarHBondContact O-N 3.11Å; P94-L98 HydrophobicContact CG-CB 4.44Å; P94-L98 HydrophobicContact CG-CD1 4.42Å; P94-E120 HydrophobicContact CB-CB 3.95Å; P94-E120 HydrophobicContact CB-CG 3.7Å; P94-E120 WeakPolarHBondContact CB-OE1 3.26Å; P94-E120 WeakPolarHBondContact CB-OE2 3.32Å; P94-E120 HydrophobicContact CG-CB 4.24Å; P94-E120 HydrophobicContact CG-CG 4.5Å
95	T	88.7	Confident	91.6	Very high	113 Å²	113	53.6 Å²	53.6	69%	0.693	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.6	-171.9	34.9	0	0	0	0	114.2	P46 E120	P46-T95 WeakPolarHBondContact CB-O 3.43Å; T95-E120 PolarHBondContact N-OE1 2.73Å; T95-E120 PolarHBondContact OG1-OE1 3.46Å
96	N	88.2	Confident	91.3	Very high	30 Å²	30	50.4 Å²	50.4	16%	0.16	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	3.9	177.2	-68.1	-22	0	0	0	113.1	P94 E120 P121 F122 P124 V125	P94-N96 VanDerWaalsContact C-N 3.28Å; P94-N96 PolarHBondContact O-N 2.67Å; N96-E120 HydrophobicContact CB-CG 3.9Å; N96-E120 PolarHBondContact N-OE1 2.83Å; N96-P121 WeakPolarHBondContact CB-O 3.49Å; N96-P121 PolarHBondContact ND2-O 3.15Å; N96-F122 PolarHBondContact ND2-O 3.21Å; N96-P124 VanDerWaalsContact O-CA 3.3Å; N96-P124 WeakPolarHBondContact O-CA 3.27Å; N96-P124 WeakPolarHBondContact OD1-CD 3.21Å; N96-P124 WeakPolarHBondContact OD1-CG 3.25Å; N96-V125 WeakPolarHBondContact O-CG2 3.47Å; N96-V125 PolarHBondContact O-N 2.91Å
97	G	92.1	Very high	90.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.			trans	96.6	-178.3	-172.3	0	0	0	0	0	112.9	I44 P94 P121	I44-G97 CarbonylContact O-C 3.57Å; I44-G97 WeakPolarHBondContact O-CA 3.24Å; P94-G97 PolarHBondContact O-N 3.11Å; G97-P121 WeakPolarHBondContact O-CD 3.1Å
98	L	94.3	Very high	90.2	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	131.7	179.7	-177.7	62.2	0	0	0	109.7	I44 L87 Y90 V93 P94 V100	I44-L98 HydrophobicContact CB-CB 4.32Å; I44-L98 HydrophobicContact CD1-CB 4.34Å; I44-L98 HydrophobicContact CD1-CD2 4.22Å; I44-L98 PolarHBondContact N-O 3.17Å; I44-L98 PolarHBondContact O-N 2.87Å; L87-L98 HydrophobicContact CD2-CD2 3.81Å; Y90-L98 HydrophobicContact CD1-CD1 4.43Å; Y90-L98 HydrophobicContact CD1-CD2 4.32Å; Y90-L98 HydrophobicContact CD2-CD2 3.82Å; Y90-L98 HydrophobicContact CE1-CD1 3.81Å; Y90-L98 HydrophobicContact CE1-CD2 4.44Å; Y90-L98 HydrophobicContact CE2-CD1 4.01Å; Y90-L98 HydrophobicContact CE2-CD2 3.96Å; Y90-L98 HydrophobicContact CG-CD2 4.02Å; V93-L98 HydrophobicContact CG1-CB 4.4Å; P94-L98 HydrophobicContact CG-CB 4.44Å; P94-L98 HydrophobicContact CG-CD1 4.42Å; L98-V100 HydrophobicContact CD2-CG2 4.14Å; L98-V100 HydrophobicContact CG-CG2 3.95Å
99	V	94.5	Very high	89.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.2	174.4	177	0	0	0	0	108.5	L42 I43 Y101 D118 F119 P121 L141	L42-V99 WeakPolarHBondContact O-CA 3.3Å; I43-V99 HydrophobicContact CG1-CG1 4.42Å; I43-V99 HydrophobicContact CG1-CG2 4.28Å; I43-V99 HydrophobicContact CG2-CG2 4.15Å; V99-Y101 HydrophobicContact CG1-CD2 3.94Å; V99-Y101 HydrophobicContact CG1-CE2 3.35Å; V99-D118 VanDerWaalsContact O-CA 3.26Å; V99-D118 WeakPolarHBondContact O-CA 3.16Å; V99-F119 HydrophobicContact CB-CD1 4.39Å; V99-F119 HydrophobicContact CB-CE1 3.94Å; V99-F119 HydrophobicContact CB-CZ 4.05Å; V99-F119 HydrophobicContact CG1-CE1 3.79Å; V99-F119 HydrophobicContact CG1-CZ 4.03Å; V99-F119 PolarHBondContact N-O 3.11Å; V99-F119 PolarHBondContact O-N 2.78Å; V99-F119 VanDerWaalsContact O-N 3.08Å; V99-P121 HydrophobicContact CB-CG 4.49Å; V99-P121 HydrophobicContact CG2-CG 3.56Å; V99-L141 HydrophobicContact CG1-CD1 4.42Å; V99-L141 HydrophobicContact CG1-CD2 4.49Å; V99-L141 HydrophobicContact CG2-CD2 4.07Å
100	V	95.1	Very high	89	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.7	178.8	-171.9	0	0	0	0	109.2	L42 V83 L98 I117 D118	L42-V100 HydrophobicContact CB-CB 4.26Å; L42-V100 HydrophobicContact CD2-CB 4.47Å; L42-V100 PolarHBondContact N-O 3.39Å; L42-V100 PolarHBondContact O-N 3.35Å; V83-V100 HydrophobicContact CG1-CG1 4.25Å; V83-V100 HydrophobicContact CG2-CG1 4.3Å; L98-V100 HydrophobicContact CD2-CG2 4.14Å; L98-V100 HydrophobicContact CG-CG2 3.95Å; V100-I117 CarbonylContact C-O 3.5Å; V100-I117 WeakPolarHBondContact CA-O 3.47Å; V100-D118 HydrophobicContact CG1-CB 4.42Å; V100-D118 HydrophobicContact CG2-CB 4.09Å
101	Y	94.8	Very high	88.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.7	169.8	-65	-70.2	0	0	0	109.5	L29 I40 S41 V99 N116 I117 F119 F136 H137 L141	L29-Y101 HydrophobicContact CD1-CD1 4.48Å; L29-Y101 HydrophobicContact CD1-CD2 3.48Å; L29-Y101 VanDerWaalsContact CD1-CD2 3.48Å; L29-Y101 HydrophobicContact CD1-CE1 4.39Å; L29-Y101 HydrophobicContact CD1-CE2 3.36Å; L29-Y101 HydrophobicContact CD1-CG 4.05Å; L29-Y101 HydrophobicContact CD2-CD2 4.19Å; L29-Y101 HydrophobicContact CD2-CG 4.11Å; I40-Y101 WeakPolarHBondContact O-CA 3.37Å; S41-Y101 WeakPolarHBondContact OG-CD1 3.3Å; S41-Y101 VanDerWaalsContact OG-CE1 3.31Å; S41-Y101 WeakPolarHBondContact OG-CE1 3.45Å; V99-Y101 HydrophobicContact CG1-CD2 3.94Å; V99-Y101 HydrophobicContact CG1-CE2 3.35Å; Y101-N116 CarbonylContact O-C 3.49Å; Y101-N116 WeakPolarHBondContact O-CA 3.21Å; Y101-I117 PolarHBondContact N-O 3.31Å; Y101-I117 PolarHBondContact O-N 3.41Å; Y101-F119 HydrophobicContact CE2-CE1 4.32Å; Y101-F136 HydrophobicContact CD1-CB 3.95Å; Y101-F136 AromaticContact CD1-CD1 3.58Å; Y101-F136 HydrophobicContact CD1-CD1 3.58Å; Y101-F136 HydrophobicContact CD1-CE1 4.25Å; Y101-F136 AromaticContact CD1-CG 3.85Å; Y101-F136 HydrophobicContact CD1-CG 3.85Å; Y101-F136 HydrophobicContact CE1-CB 4.13Å; Y101-F136 HydrophobicContact CG-CD1 4.21Å; Y101-F136 HydrophobicContact CG-CG 4.41Å; Y101-H137 WeakPolarHBondContact CE1-O 3.41Å; Y101-H137 PolarHBondContact OH-O 3.26Å; Y101-L141 HydrophobicContact CE2-CD1 3.71Å; Y101-L141 WeakPolarHBondContact OH-CD1 3.29Å
102	C	93.2	Very high	88.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.3	176.3	-168.2	0	0	0	0	111.7	I40 S82 V83 V115	I40-C102 WeakPolarHBondContact CB-O 3.33Å; I40-C102 PolarHBondContact N-O 3.39Å; I40-C102 PolarHBondContact O-N 3.13Å; S82-C102 WeakPolarHBondContact CB-SG 3.42Å; V83-C102 HydrophobicContact CG2-CB 3.54Å; C102-V115 VanDerWaalsContact CA-O 3.29Å; C102-V115 WeakPolarHBondContact CA-O 3.49Å; C102-V115 PolarHBondContact SG-O 3.35Å
103	G	91.2	Very high	88	Confident	2 Å²	2	53 Å²	53	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-176.9	176.2	0	0	0	0	0	112.3	S38 V115	S38-G103 WeakPolarHBondContact O-CA 3.44Å; G103-V115 PolarHBondContact N-O 3.1Å; G103-V115 PolarHBondContact O-N 3.26Å
104	T	87.6	Confident	87.7	Confident	29 Å²	29	57.6 Å²	57.6	18%	0.178	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.8	174.2	-53.5	0	0	0	0	108.9	E112 K113	T104-E112 HydrophobicContact CG2-CB 3.61Å; T104-E112 HydrophobicContact CG2-CG 3.96Å; T104-K113 WeakPolarHBondContact CA-O 3.46Å
105	I	87.6	Confident	87.5	Confident	27 Å²	27	57.7 Å²	57.7	14%	0.138	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	149.2	176.1	69.8	169.9	0	0	0	109.2	A32 M39 K113 V115 F136	A32-I105 HydrophobicContact CB-CB 4.29Å; A32-I105 HydrophobicContact CB-CD1 4.43Å; A32-I105 HydrophobicContact CB-CG2 3.75Å; M39-I105 HydrophobicContact CE-CG2 3.55Å; M39-I105 HydrophobicContact SD-CG2 4.47Å; I105-K113 HydrophobicContact CG1-CB 3.96Å; I105-K113 WeakPolarHBondContact CG1-O 2.99Å; I105-K113 PolarHBondContact N-O 3.03Å; I105-K113 PolarHBondContact O-N 2.8Å; I105-V115 HydrophobicContact CB-CG2 4.35Å; I105-V115 HydrophobicContact CD1-CG2 3.57Å; I105-V115 HydrophobicContact CG1-CG2 3.72Å; I105-V115 HydrophobicContact CG2-CB 4.4Å; I105-V115 HydrophobicContact CG2-CG2 3.73Å; I105-F136 HydrophobicContact CG2-CE2 4.24Å
106	V	85.1	Confident	87.6	Confident	52 Å²	52	54.6 Å²	54.6	32%	0.315	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.3	172.4	-173	0	0	0	0	107.9	R33 N35	R33-V106 PolarHBondContact O-N 3.22Å; N35-V106 HydrophobicContact CB-CG2 3.68Å
107	T	82.4	Confident	87.8	Confident	44 Å²	44	55.6 Å²	55.6	27%	0.27	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-76.4	165.6	172.4	64.7	0	0	0	0	110.5	D109 G110 K111 K113	T107-D109 PolarHBondContact O-N 3.13Å; T107-G110 WeakPolarHBondContact O-CA 3.37Å; T107-G110 PolarHBondContact O-N 2.99Å; T107-K111 PolarHBondContact N-O 2.7Å; T107-K111 PolarHBondContact OG1-N 3.36Å; T107-K111 PolarHBondContact OG1-O 3.35Å; T107-K113 HydrophobicContact CG2-CB 3.94Å; T107-K113 HydrophobicContact CG2-CD 4.43Å
108	E	78.9	Confident	87.8	Confident	204 Å²	204	57.1 Å²	57.1	95%	0.953	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.9	178.6	-64	-176.6	172	0	0	112.6	G110	E108-G110 PolarHBondContact O-N 3.08Å; E108-G110 VanDerWaalsContact O-N 3.13Å
109	D	80.1	Confident	87.7	Confident	132 Å²	132	58.9 Å²	58.9	71%	0.706	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	1.6	173.7	-56.1	-35.6	0	0	0	114.4	T107 K111	T107-D109 PolarHBondContact O-N 3.13Å; D109-K111 VanDerWaalsContact C-N 3.25Å; D109-K111 HydrophobicContact CB-CG 4.36Å; D109-K111 PolarHBondContact O-N 3.44Å
110	G	77.7	Confident	87.5	Confident	54 Å²	54	62.5 Å²	62.5	56%	0.557	32%	0.319	S	S	*	.	S	Bend	trans	74.1	9.4	-175.1	0	0	0	0	0	114.6	T107 E108	T107-G110 WeakPolarHBondContact O-CA 3.37Å; T107-G110 PolarHBondContact O-N 2.99Å; E108-G110 PolarHBondContact O-N 3.08Å; E108-G110 VanDerWaalsContact O-N 3.13Å
111	K	83.1	Confident	87.1	Confident	143 Å²	143	62.5 Å²	62.5	62%	0.622	32%	0.319	S	S	*	.			trans	-83.6	146.4	177.6	-64.9	179	-177.3	168.8	0	110.9	T107 D109	T107-K111 PolarHBondContact N-O 2.7Å; T107-K111 PolarHBondContact OG1-N 3.36Å; T107-K111 PolarHBondContact OG1-O 3.35Å; D109-K111 VanDerWaalsContact C-N 3.25Å; D109-K111 HydrophobicContact CB-CG 4.36Å; D109-K111 PolarHBondContact O-N 3.44Å
112	E	82.7	Confident	86.4	Confident	123 Å²	123	63.6 Å²	63.6	58%	0.575	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	122.1	175.2	-72.6	-171.7	-179.3	0	0	110.7	T104	T104-E112 HydrophobicContact CG2-CB 3.61Å; T104-E112 HydrophobicContact CG2-CG 3.96Å
113	K	85	Confident	85.7	Confident	127 Å²	127	65.5 Å²	65.5	55%	0.552	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.9	174.8	-178.6	175.7	179.6	178.3	0	109.9	T104 I105 T107	T104-K113 WeakPolarHBondContact CA-O 3.46Å; I105-K113 HydrophobicContact CG1-CB 3.96Å; I105-K113 WeakPolarHBondContact CG1-O 2.99Å; I105-K113 PolarHBondContact N-O 3.03Å; I105-K113 PolarHBondContact O-N 2.8Å; T107-K113 HydrophobicContact CG2-CB 3.94Å; T107-K113 HydrophobicContact CG2-CD 4.43Å
114	K	86.5	Confident	85.3	Confident	112 Å²	112	68.4 Å²	68.4	49%	0.487	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.4	174.4	-169.1	172.8	-179.9	176.8	0	110	S82	S82-K114 WeakPolarHBondContact OG-CE 3.35Å; S82-K114 PolarHBondContact OG-NZ 3.33Å
115	V	88.8	Confident	85.2	Confident	20 Å²	20	67.2 Å²	67.2	12%	0.121	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.5	173.1	176.7	0	0	0	0	108.4	C102 G103 I105 I117 F136	C102-V115 VanDerWaalsContact CA-O 3.29Å; C102-V115 WeakPolarHBondContact CA-O 3.49Å; C102-V115 PolarHBondContact SG-O 3.35Å; G103-V115 PolarHBondContact N-O 3.1Å; G103-V115 PolarHBondContact O-N 3.26Å; I105-V115 HydrophobicContact CB-CG2 4.35Å; I105-V115 HydrophobicContact CD1-CG2 3.57Å; I105-V115 HydrophobicContact CG1-CG2 3.72Å; I105-V115 HydrophobicContact CG2-CB 4.4Å; I105-V115 HydrophobicContact CG2-CG2 3.73Å; V115-I117 HydrophobicContact CG1-CD1 3.75Å; V115-I117 HydrophobicContact CG1-CG1 3.82Å; V115-F136 HydrophobicContact CB-CE2 4.42Å; V115-F136 HydrophobicContact CB-CZ 4.33Å; V115-F136 HydrophobicContact CG1-CE2 4.12Å; V115-F136 HydrophobicContact CG1-CZ 4.19Å
116	N	90.9	Very high	84.8	Confident	48 Å²	48	73 Å²	73	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	101.6	175.6	-169.3	-14.9	0	0	0	107.9	R86 Y101	R86-N116 PolarHBondContact NE-OD1 2.86Å; R86-N116 VanDerWaalsContact NE-OD1 3.11Å; R86-N116 PolarHBondContact NH2-ND2 3.24Å; R86-N116 PolarHBondContact NH2-O 2.95Å; R86-N116 PolarHBondContact NH2-OD1 2.91Å; Y101-N116 CarbonylContact O-C 3.49Å; Y101-N116 WeakPolarHBondContact O-CA 3.21Å
117	I	92.3	Very high	84.8	Confident	51 Å²	51	74.3 Å²	74.3	26%	0.262	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.9	-174	-57.3	176.1	0	0	0	107.8	L25 L29 V100 Y101 V115 F119	L25-I117 HydrophobicContact CD1-CD1 3.69Å; L25-I117 HydrophobicContact CD1-CG2 4.3Å; L25-I117 HydrophobicContact CD2-CG2 4.39Å; L29-I117 HydrophobicContact CD2-CD1 4.29Å; V100-I117 CarbonylContact C-O 3.5Å; V100-I117 WeakPolarHBondContact CA-O 3.47Å; Y101-I117 PolarHBondContact N-O 3.31Å; Y101-I117 PolarHBondContact O-N 3.41Å; V115-I117 HydrophobicContact CG1-CD1 3.75Å; V115-I117 HydrophobicContact CG1-CG1 3.82Å; I117-F119 HydrophobicContact CG2-CD1 4.18Å
118	D	92.5	Very high	85.1	Confident	31 Å²	31	75.1 Å²	75.1	17%	0.166	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	138.4	173.6	60.8	-63.5	0	0	0	110.2	R86 Y90 V99 V100	R86-D118 VanDerWaalsContact CD-CG 3.44Å; R86-D118 WeakPolarHBondContact CD-OD1 3.03Å; R86-D118 HydrophobicContact CG-CB 3.85Å; R86-D118 VanDerWaalsContact CG-CG 3.45Å; R86-D118 IonicContact CZ-OD1 2.67Å; R86-D118 IonicContact NE-OD1 3.98Å; R86-D118 PolarHBondContact NE-OD1 2.92Å; R86-D118 IonicContact NH1-OD1 3.05Å; R86-D118 PolarHBondContact NH1-OD1 2.62Å; R86-D118 IonicContact NH2-OD1 2.7Å; Y90-D118 VanDerWaalsContact CE2-OD2 3.28Å; Y90-D118 WeakPolarHBondContact CE2-OD2 3.47Å; Y90-D118 PolarHBondContact OH-OD2 3.15Å; V99-D118 VanDerWaalsContact O-CA 3.26Å; V99-D118 WeakPolarHBondContact O-CA 3.16Å; V100-D118 HydrophobicContact CG1-CB 4.42Å; V100-D118 HydrophobicContact CG2-CB 4.09Å
119	F	91.6	Very high	85.7	Confident	37 Å²	37	67.2 Å²	67.2	16%	0.162	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	155.1	178.8	66.3	-78	0	0	0	111.5	I22 L25 V99 Y101 I117 P121 L141	I22-F119 HydrophobicContact CD1-CE2 4.06Å; I22-F119 HydrophobicContact CG1-CE2 4.06Å; L25-F119 HydrophobicContact CD2-CD1 3.98Å; L25-F119 HydrophobicContact CD2-CE1 3.35Å; L25-F119 HydrophobicContact CD2-CZ 3.69Å; V99-F119 HydrophobicContact CB-CD1 4.39Å; V99-F119 HydrophobicContact CB-CE1 3.94Å; V99-F119 HydrophobicContact CB-CZ 4.05Å; V99-F119 HydrophobicContact CG1-CE1 3.79Å; V99-F119 HydrophobicContact CG1-CZ 4.03Å; V99-F119 PolarHBondContact N-O 3.11Å; V99-F119 PolarHBondContact O-N 2.78Å; V99-F119 VanDerWaalsContact O-N 3.08Å; Y101-F119 HydrophobicContact CE2-CE1 4.32Å; I117-F119 HydrophobicContact CG2-CD1 4.18Å; F119-P121 HydrophobicContact CE2-CB 4.48Å; F119-P121 HydrophobicContact CE2-CG 4.35Å; F119-L141 HydrophobicContact CE1-CD1 4.44Å; F119-L141 HydrophobicContact CE2-CD2 4.21Å; F119-L141 HydrophobicContact CZ-CD1 3.77Å; F119-L141 HydrophobicContact CZ-CD2 3.81Å; F119-L141 HydrophobicContact CZ-CG 4.47Å
120	E	91.2	Very high	86.4	Confident	76 Å²	76	63 Å²	63	36%	0.355	33%	0.328	S	S	.	.			trans	-82.3	124.2	165.3	175.5	169.9	-157.4	0	0	108.8	P94 T95 N96	P94-E120 HydrophobicContact CB-CB 3.95Å; P94-E120 HydrophobicContact CB-CG 3.7Å; P94-E120 WeakPolarHBondContact CB-OE1 3.26Å; P94-E120 WeakPolarHBondContact CB-OE2 3.32Å; P94-E120 HydrophobicContact CG-CB 4.24Å; P94-E120 HydrophobicContact CG-CG 4.5Å; T95-E120 PolarHBondContact N-OE1 2.73Å; T95-E120 PolarHBondContact OG1-OE1 3.46Å; N96-E120 HydrophobicContact CB-CG 3.9Å; N96-E120 PolarHBondContact N-OE1 2.83Å
121	P	86.5	Confident	87.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	32%	0.319	C	S	.	.			trans	-65.8	152.2	174.6	-19.3	32.3	0	0	0	112.2	N96 G97 V99 F119 R123 V125 L144	N96-P121 WeakPolarHBondContact CB-O 3.49Å; N96-P121 PolarHBondContact ND2-O 3.15Å; G97-P121 WeakPolarHBondContact O-CD 3.1Å; V99-P121 HydrophobicContact CB-CG 4.49Å; V99-P121 HydrophobicContact CG2-CG 3.56Å; F119-P121 HydrophobicContact CE2-CB 4.48Å; F119-P121 HydrophobicContact CE2-CG 4.35Å; P121-R123 WeakPolarHBondContact CB-O 3.35Å; P121-R123 PolarHBondContact O-N 2.81Å; P121-R123 VanDerWaalsContact O-N 3.14Å; P121-V125 HydrophobicContact CG-CG1 4.1Å; P121-V125 HydrophobicContact CG-CG2 4.49Å; P121-L144 HydrophobicContact CB-CD1 3.56Å; P121-L144 HydrophobicContact CG-CD1 4.23Å
122	F	79.7	Confident	87.4	Confident	22 Å²	22	59 Å²	59	10%	0.096	30%	0.303	C	S	.	.	S	Bend	trans	-66.3	-11	175.6	71	-71.5	0	0	0	114.9	E18 M19 I22 N96 L144 L145	E18-F122 HydrophobicContact CB-CB 3.95Å; E18-F122 HydrophobicContact CB-CG 4.38Å; M19-F122 HydrophobicContact CB-CZ 4.32Å; M19-F122 HydrophobicContact CE-CE2 4.21Å; M19-F122 HydrophobicContact CE-CZ 4.31Å; M19-F122 HydrophobicContact CG-CZ 4.35Å; I22-F122 HydrophobicContact CD1-CD1 3.22Å; I22-F122 HydrophobicContact CD1-CE1 3.48Å; I22-F122 VanDerWaalsContact CD1-CE1 3.48Å; I22-F122 HydrophobicContact CD1-CG 4.4Å; N96-F122 PolarHBondContact ND2-O 3.21Å; F122-L144 HydrophobicContact CE1-CB 4.18Å; F122-L144 WeakPolarHBondContact CZ-O 3.46Å; F122-L145 HydrophobicContact CE1-CD2 4.47Å; F122-L145 HydrophobicContact CZ-CD2 4.47Å
123	R	79	Confident	87.7	Confident	40 Å²	40	55.3 Å²	55.3	15%	0.151	29%	0.287	C	S	.	.	S	Bend	trans	-137.8	146.8	178	-83.1	-172.5	-88.3	178.6	-16	110.7	P121 V125 L144 A146 D148	P121-R123 WeakPolarHBondContact CB-O 3.35Å; P121-R123 PolarHBondContact O-N 2.81Å; P121-R123 VanDerWaalsContact O-N 3.14Å; R123-V125 PolarHBondContact O-N 2.91Å; R123-L144 HydrophobicContact CB-CD2 4.06Å; R123-L144 PolarHBondContact NE-O 3.06Å; R123-L144 PolarHBondContact NH2-O 3.33Å; R123-A146 PolarHBondContact NH1-O 3.39Å; R123-A146 PolarHBondContact NH2-O 3.39Å; R123-D148 IonicContact CZ-OD2 3.65Å; R123-D148 VanDerWaalsContact NH1-CB 3.29Å; R123-D148 IonicContact NH1-OD1 3.81Å; R123-D148 PolarHBondContact NH1-OD1 2.95Å; R123-D148 IonicContact NH1-OD2 3.07Å; R123-D148 PolarHBondContact NH1-OD2 2.58Å
124	P	82.7	Confident	87.9	Confident	64 Å²	64	52.8 Å²	52.8	42%	0.416	28%	0.28	S	S	.	.			trans	-53.7	123.9	175.3	-27.6	35.6	0	0	0	113.6	P46 N96	P46-P124 HydrophobicContact CG-CB 4.28Å; N96-P124 VanDerWaalsContact O-CA 3.3Å; N96-P124 WeakPolarHBondContact O-CA 3.27Å; N96-P124 WeakPolarHBondContact OD1-CD 3.21Å; N96-P124 WeakPolarHBondContact OD1-CG 3.25Å
125	V	84.5	Confident	88	Confident	4 Å²	4	51 Å²	51	2%	0.024	27%	0.272	C	S	.	.			trans	-84.3	120.7	169.5	-77.4	0	0	0	0	110.8	I43 P45 P46 N96 P121 R123 L144	I43-V125 HydrophobicContact CG2-CB 4Å; I43-V125 HydrophobicContact CG2-CG1 4.23Å; I43-V125 HydrophobicContact CG2-CG2 3.82Å; P45-V125 VanDerWaalsContact CA-O 3.32Å; P45-V125 WeakPolarHBondContact CA-O 3.48Å; P45-V125 VanDerWaalsContact CB-O 3.27Å; P45-V125 WeakPolarHBondContact CB-O 3.31Å; P46-V125 WeakPolarHBondContact CD-O 3.39Å; N96-V125 WeakPolarHBondContact O-CG2 3.47Å; N96-V125 PolarHBondContact O-N 2.91Å; P121-V125 HydrophobicContact CG-CG1 4.1Å; P121-V125 HydrophobicContact CG-CG2 4.49Å; R123-V125 PolarHBondContact O-N 2.91Å; V125-L144 HydrophobicContact CG1-CD1 3.53Å; V125-L144 HydrophobicContact CG1-CD2 4.02Å; V125-L144 HydrophobicContact CG1-CG 4.06Å
126	N	80.2	Confident	88.2	Confident	147 Å²	147	50.3 Å²	50.3	79%	0.786	27%	0.268	S	S	*	.			trans	-86.7	-10	179.3	-66.6	-30.6	0	0	0	113.7
127	T	83.6	Confident	88.3	Confident	81 Å²	81	49.2 Å²	49.2	50%	0.497	26%	0.261	S	S	.	.			trans	-102.6	128.4	-174.2	-53	0	0	0	0	110.2	I43	I43-T127 VanDerWaalsContact CG2-O 3.29Å; I43-T127 WeakPolarHBondContact CG2-O 3.2Å
128	S	89.4	Confident	88.2	Confident	61 Å²	61	47 Å²	47	43%	0.427	25%	0.25	S	C	.	.			trans	-88.3	129.2	164.3	-176	0	0	0	0	109.3	I43	I43-S128 WeakPolarHBondContact O-CA 3.46Å
129	L	92.2	Very high	88	Confident	38 Å²	38	50.5 Å²	50.5	20%	0.199	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132	179.3	-171.5	68.2	0	0	0	109.5	L42 I43 L131 H137	L42-L129 CarbonylContact C-O 3.59Å; L42-L129 WeakPolarHBondContact CA-O 3.5Å; I43-L129 HydrophobicContact CB-CB 3.92Å; I43-L129 HydrophobicContact CD1-CB 4.22Å; I43-L129 HydrophobicContact CD1-CD2 3.98Å; I43-L129 HydrophobicContact CG1-CB 4.09Å; I43-L129 HydrophobicContact CG1-CD2 4.39Å; I43-L129 PolarHBondContact N-O 3.26Å; I43-L129 PolarHBondContact O-N 3.45Å; L129-L131 HydrophobicContact CD1-CD1 3.63Å; L129-L131 HydrophobicContact CD1-CG 3.76Å; L129-L131 HydrophobicContact CD2-CD1 4.27Å; L129-L131 HydrophobicContact CG-CD1 4.16Å; L129-L131 HydrophobicContact CG-CG 4.13Å; L129-H137 HydrophobicContact CD2-CB 4.16Å
130	Y	93.9	Very high	87.6	Confident	43 Å²	43	49.6 Å²	49.6	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	115.9	160.5	169.6	-94.5	0	0	0	107	I40 S41 L42 L56 L57 E60	I40-Y130 HydrophobicContact CG2-CD2 4.18Å; I40-Y130 HydrophobicContact CG2-CE2 3.82Å; S41-Y130 WeakPolarHBondContact O-CA 3.31Å; L42-Y130 HydrophobicContact CD1-CD2 4.23Å; L56-Y130 HydrophobicContact CD2-CD1 4.05Å; L56-Y130 HydrophobicContact CD2-CD2 4.08Å; L56-Y130 HydrophobicContact CD2-CE1 4.48Å; L56-Y130 HydrophobicContact CD2-CE2 4.49Å; L56-Y130 HydrophobicContact CD2-CG 3.83Å; L57-Y130 HydrophobicContact CD2-CD2 4Å; L57-Y130 HydrophobicContact CD2-CE2 3.51Å; E60-Y130 HydrophobicContact CB-CE1 4.17Å; E60-Y130 WeakPolarHBondContact CB-OH 3.1Å; E60-Y130 VanDerWaalsContact CD-CE1 3.43Å; E60-Y130 HydrophobicContact CG-CD1 4.17Å; E60-Y130 HydrophobicContact CG-CE1 3.42Å; E60-Y130 VanDerWaalsContact CG-CE1 3.42Å; E60-Y130 WeakPolarHBondContact OE2-CE1 3.34Å
131	L	92.2	Very high	87.3	Confident	69 Å²	69	46 Å²	46	36%	0.361	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.7	176.5	-72	176.7	0	0	0	109.6	I40 S41 L129 H137	I40-L131 CarbonylContact C-O 3.5Å; I40-L131 VanDerWaalsContact CA-O 3.31Å; I40-L131 WeakPolarHBondContact CA-O 3.49Å; S41-L131 PolarHBondContact N-O 2.96Å; S41-L131 PolarHBondContact O-N 3.11Å; L129-L131 HydrophobicContact CD1-CD1 3.63Å; L129-L131 HydrophobicContact CD1-CG 3.76Å; L129-L131 HydrophobicContact CD2-CD1 4.27Å; L129-L131 HydrophobicContact CG-CD1 4.16Å; L129-L131 HydrophobicContact CG-CG 4.13Å; L131-H137 HydrophobicContact CD1-CB 4.26Å
132	C	89.7	Confident	87.2	Confident	43 Å²	43	49.1 Å²	49.1	29%	0.291	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.2	169.1	-171.9	0	0	0	0	108.4	T37 M39 I40	T37-C132 PolarHBondContact O-SG 3.19Å; M39-C132 CarbonylContact O-C 3.57Å; M39-C132 WeakPolarHBondContact O-CA 3.48Å; I40-C132 HydrophobicContact CG1-CB 4.27Å
133	D	89.7	Confident	87.1	Confident	47 Å²	47	51.1 Å²	51.1	25%	0.251	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	-175.5	-172.5	-159	-1.5	0	0	0	110.7	T37 S38 M39 K135 H137	T37-D133 CarbonylContact C-O 3.55Å; T37-D133 WeakPolarHBondContact CA-O 3.01Å; S38-D133 PolarHBondContact N-O 3.01Å; M39-D133 WeakPolarHBondContact CA-O 3.27Å; M39-D133 VanDerWaalsContact CB-O 3.31Å; M39-D133 WeakPolarHBondContact CB-O 3.32Å; M39-D133 PolarHBondContact N-O 3.28Å; M39-D133 PolarHBondContact O-N 3.33Å; D133-K135 VanDerWaalsContact C-N 3.28Å; D133-H137 IonicContact OD2-CE1 3.54Å; D133-H137 IonicContact OD2-NE2 2.62Å; D133-H137 PolarHBondContact OD2-NE2 3.17Å
134	N	87.9	Confident	87	Confident	74 Å²	74	50 Å²	50	40%	0.396	28%	0.284	S	S	.	.	S	Bend	trans	-86.2	4.4	173.9	70.3	-9.2	0	0	0	114.3	G34 G36 M39	G34-N134 PolarHBondContact N-O 3.38Å; G36-N134 VanDerWaalsContact O-CA 3.29Å; G36-N134 WeakPolarHBondContact O-CA 3.3Å; G36-N134 WeakPolarHBondContact O-CB 3.35Å; M39-N134 VanDerWaalsContact SD-C 3.57Å
135	K	89.8	Confident	86.5	Confident	73 Å²	73	48.1 Å²	48.1	32%	0.317	27%	0.27	S	S	.	.	S	Bend	trans	-144.6	160	177.5	62.8	173.3	-174.6	162.4	0	109.8	D133	D133-K135 VanDerWaalsContact C-N 3.28Å
136	F	93.5	Very high	85.6	Confident	7 Å²	7	49.4 Å²	49.4	3%	0.031	28%	0.282	C	S	.	.			trans	-81.4	139.8	167.1	-66.4	-53.8	0	0	0	110.6	L29 M39 I40 S41 Y101 I105 V115	L29-F136 HydrophobicContact CB-CB 4.24Å; L29-F136 HydrophobicContact CB-CD2 4.16Å; L29-F136 HydrophobicContact CD2-CB 4.45Å; L29-F136 HydrophobicContact CD2-CD2 3.32Å; L29-F136 HydrophobicContact CD2-CE2 3.67Å; L29-F136 HydrophobicContact CD2-CG 4.02Å; L29-F136 HydrophobicContact CG-CD2 4.31Å; M39-F136 HydrophobicContact CB-CD1 3.92Å; M39-F136 HydrophobicContact CB-CE1 3.77Å; M39-F136 HydrophobicContact CB-CZ 4.35Å; M39-F136 HydrophobicContact CE-CD1 3.97Å; M39-F136 HydrophobicContact CE-CD2 3.18Å; M39-F136 HydrophobicContact CE-CE1 3.87Å; M39-F136 HydrophobicContact CE-CE2 3.07Å; M39-F136 HydrophobicContact CE-CG 3.66Å; M39-F136 HydrophobicContact CE-CZ 3.44Å; M39-F136 VanDerWaalsContact CE-CZ 3.44Å; M39-F136 HydrophobicContact CG-CE1 4.47Å; I40-F136 WeakPolarHBondContact O-CE1 3.48Å; S41-F136 WeakPolarHBondContact OG-CA 3.26Å; Y101-F136 HydrophobicContact CD1-CB 3.95Å; Y101-F136 AromaticContact CD1-CD1 3.58Å; Y101-F136 HydrophobicContact CD1-CD1 3.58Å; Y101-F136 HydrophobicContact CD1-CE1 4.25Å; Y101-F136 AromaticContact CD1-CG 3.85Å; Y101-F136 HydrophobicContact CD1-CG 3.85Å; Y101-F136 HydrophobicContact CE1-CB 4.13Å; Y101-F136 HydrophobicContact CG-CD1 4.21Å; Y101-F136 HydrophobicContact CG-CG 4.41Å; I105-F136 HydrophobicContact CG2-CE2 4.24Å; V115-F136 HydrophobicContact CB-CE2 4.42Å; V115-F136 HydrophobicContact CB-CZ 4.33Å; V115-F136 HydrophobicContact CG1-CE2 4.12Å; V115-F136 HydrophobicContact CG1-CZ 4.19Å
137	H	91.5	Very high	84.6	Confident	24 Å²	24	45.3 Å²	45.3	11%	0.111	26%	0.259	C	S	.	.			trans	-94.9	108.1	175.1	-71.4	-93.9	0	0	0	109.1	S41 Y101 L129 L131 D133 E139	S41-H137 PolarHBondContact OG-N 3.48Å; Y101-H137 WeakPolarHBondContact CE1-O 3.41Å; Y101-H137 PolarHBondContact OH-O 3.26Å; L129-H137 HydrophobicContact CD2-CB 4.16Å; L131-H137 HydrophobicContact CD1-CB 4.26Å; D133-H137 IonicContact OD2-CE1 3.54Å; D133-H137 IonicContact OD2-NE2 2.62Å; D133-H137 PolarHBondContact OD2-NE2 3.17Å; H137-E139 VanDerWaalsContact CA-OE2 3.24Å; H137-E139 WeakPolarHBondContact CA-OE2 3.36Å; H137-E139 VanDerWaalsContact CB-OE2 3.26Å; H137-E139 WeakPolarHBondContact CB-OE2 3.45Å; H137-E139 IonicContact CG-OE2 3.54Å; H137-E139 IonicContact ND1-OE1 2.78Å; H137-E139 IonicContact ND1-OE2 2.69Å
138	T	90.3	Very high	83.4	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.031	25%	0.253	C	S	.	.			trans	-104.4	-0.7	-173.8	50	0	0	0	0	113.2	I26 L29 E30 A140 L141 V142	I26-T138 HydrophobicContact CG1-CG2 4.45Å; I26-T138 HydrophobicContact CG2-CG2 4.3Å; L29-T138 HydrophobicContact CB-CG2 3.76Å; L29-T138 HydrophobicContact CD1-CG2 3.97Å; E30-T138 HydrophobicContact CG-CG2 4.25Å; E30-T138 WeakPolarHBondContact CG-OG1 3.48Å; E30-T138 PolarHBondContact OE1-OG1 2.81Å; T138-A140 VanDerWaalsContact C-N 3.26Å; T138-A140 PolarHBondContact O-N 2.63Å; T138-A140 VanDerWaalsContact O-N 3.17Å; T138-L141 WeakPolarHBondContact O-CA 3.32Å; T138-L141 WeakPolarHBondContact O-CB 3.41Å; T138-L141 PolarHBondContact O-N 2.76Å; T138-V142 PolarHBondContact O-N 3.3Å
139	E	88.2	Confident	82.5	Confident	105 Å²	105	42.3 Å²	42.3	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-57.3	-39.1	-168.9	-64.2	80.4	179.7	0	0	112.3	H137 L141 V142 A143	H137-E139 VanDerWaalsContact CA-OE2 3.24Å; H137-E139 WeakPolarHBondContact CA-OE2 3.36Å; H137-E139 VanDerWaalsContact CB-OE2 3.26Å; H137-E139 WeakPolarHBondContact CB-OE2 3.45Å; H137-E139 IonicContact CG-OE2 3.54Å; H137-E139 IonicContact ND1-OE1 2.78Å; H137-E139 IonicContact ND1-OE2 2.69Å; E139-L141 VanDerWaalsContact C-N 3.35Å; E139-L141 PolarHBondContact O-N 3.23Å; E139-V142 PolarHBondContact O-N 2.99Å; E139-A143 PolarHBondContact O-N 3.35Å
140	A	84.4	Confident	82	Confident	17 Å²	17	43.4 Å²	43.4	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-34.7	176.7	0	0	0	0	0	112.6	I43 T138 L144	I43-A140 HydrophobicContact CD1-CB 3.35Å; T138-A140 VanDerWaalsContact C-N 3.26Å; T138-A140 PolarHBondContact O-N 2.63Å; T138-A140 VanDerWaalsContact O-N 3.17Å; A140-L144 WeakPolarHBondContact O-CG 3.48Å; A140-L144 PolarHBondContact O-N 3.49Å
141	L	84.8	Confident	81.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-73.6	-37.1	174	-67.2	179.7	0	0	0	111.7	I22 I26 V99 Y101 F119 T138 E139 A143 L144 L145	I22-L141 HydrophobicContact CG2-CB 4.35Å; I26-L141 HydrophobicContact CD1-CB 3.58Å; I26-L141 HydrophobicContact CG1-CB 3.97Å; I26-L141 HydrophobicContact CG1-CD1 4.17Å; V99-L141 HydrophobicContact CG1-CD1 4.42Å; V99-L141 HydrophobicContact CG1-CD2 4.49Å; V99-L141 HydrophobicContact CG2-CD2 4.07Å; Y101-L141 HydrophobicContact CE2-CD1 3.71Å; Y101-L141 WeakPolarHBondContact OH-CD1 3.29Å; F119-L141 HydrophobicContact CE1-CD1 4.44Å; F119-L141 HydrophobicContact CE2-CD2 4.21Å; F119-L141 HydrophobicContact CZ-CD1 3.77Å; F119-L141 HydrophobicContact CZ-CD2 3.81Å; F119-L141 HydrophobicContact CZ-CG 4.47Å; T138-L141 WeakPolarHBondContact O-CA 3.32Å; T138-L141 WeakPolarHBondContact O-CB 3.41Å; T138-L141 PolarHBondContact O-N 2.76Å; E139-L141 VanDerWaalsContact C-N 3.35Å; E139-L141 PolarHBondContact O-N 3.23Å; L141-A143 PolarHBondContact O-N 3Å; L141-L144 HydrophobicContact CD2-CD1 3.91Å; L141-L144 CarbonylContact O-C 3.56Å; L141-L144 WeakPolarHBondContact O-CA 3.38Å; L141-L144 WeakPolarHBondContact O-CB 3.33Å; L141-L144 PolarHBondContact O-N 2.88Å; L141-L145 PolarHBondContact O-N 2.96Å; L141-L145 VanDerWaalsContact O-N 3.07Å
142	V	83	Confident	81.8	Confident	67 Å²	67	38.8 Å²	38.8	41%	0.406	22%	0.218	S	C	.	.	H	α-helix	trans	-59.8	-39.9	174.1	176.7	0	0	0	0	110	I26 T138 E139 L144 L145 A146	I26-V142 HydrophobicContact CD1-CG2 3.83Å; I26-V142 HydrophobicContact CG2-CG2 4.03Å; T138-V142 PolarHBondContact O-N 3.3Å; E139-V142 PolarHBondContact O-N 2.99Å; V142-L144 VanDerWaalsContact C-N 3.28Å; V142-L144 PolarHBondContact O-N 3.17Å; V142-L145 WeakPolarHBondContact O-CB 3.49Å; V142-L145 PolarHBondContact O-N 3Å; V142-A146 PolarHBondContact O-N 3.29Å
143	A	78.4	Confident	82.1	Confident	65 Å²	65	36.7 Å²	36.7	54%	0.537	20%	0.204	S	C	.	.	H	α-helix	trans	-61.5	-35.7	173.1	0	0	0	0	0	112.5	E139 L141 L145 A146	E139-A143 PolarHBondContact O-N 3.35Å; L141-A143 PolarHBondContact O-N 3Å; A143-L145 PolarHBondContact O-N 3Å; A143-A146 WeakPolarHBondContact O-CB 3.41Å; A143-A146 PolarHBondContact O-N 3.2Å
144	L	77.3	Confident	82.4	Confident	16 Å²	16	34.5 Å²	34.5	8%	0.084	19%	0.192	C	C	.	.	H	α-helix	trans	-71.7	-14.1	171.8	-58.5	179.5	0	0	0	113.3	P121 F122 R123 V125 A140 L141 V142	P121-L144 HydrophobicContact CB-CD1 3.56Å; P121-L144 HydrophobicContact CG-CD1 4.23Å; F122-L144 HydrophobicContact CE1-CB 4.18Å; F122-L144 WeakPolarHBondContact CZ-O 3.46Å; R123-L144 HydrophobicContact CB-CD2 4.06Å; R123-L144 PolarHBondContact NE-O 3.06Å; R123-L144 PolarHBondContact NH2-O 3.33Å; V125-L144 HydrophobicContact CG1-CD1 3.53Å; V125-L144 HydrophobicContact CG1-CD2 4.02Å; V125-L144 HydrophobicContact CG1-CG 4.06Å; A140-L144 WeakPolarHBondContact O-CG 3.48Å; A140-L144 PolarHBondContact O-N 3.49Å; L141-L144 HydrophobicContact CD2-CD1 3.91Å; L141-L144 CarbonylContact O-C 3.56Å; L141-L144 WeakPolarHBondContact O-CA 3.38Å; L141-L144 WeakPolarHBondContact O-CB 3.33Å; L141-L144 PolarHBondContact O-N 2.88Å; V142-L144 VanDerWaalsContact C-N 3.28Å; V142-L144 PolarHBondContact O-N 3.17Å
145	L	72.8	Confident	82.7	Confident	24 Å²	24	31 Å²	31	13%	0.126	17%	0.173	C	C	.	.	H	α-helix	trans	-88.1	-14.4	174.3	-68.2	178.7	0	0	0	112.5	M19 I22 K23 I26 F122 L141 V142 A143 D147	M19-L145 HydrophobicContact CB-CD2 4.45Å; M19-L145 HydrophobicContact CG-CD2 3.51Å; M19-L145 WeakPolarHBondContact O-CD2 3.33Å; I22-L145 HydrophobicContact CB-CD2 4.07Å; I22-L145 HydrophobicContact CG2-CD1 4.35Å; I22-L145 HydrophobicContact CG2-CD2 3.75Å; I22-L145 HydrophobicContact CG2-CG 4.05Å; K23-L145 HydrophobicContact CB-CD1 4.31Å; K23-L145 HydrophobicContact CG-CD1 3.44Å; K23-L145 VanDerWaalsContact CG-CD1 3.44Å; K23-L145 HydrophobicContact CG-CD2 3.82Å; K23-L145 HydrophobicContact CG-CG 4.23Å; I26-L145 HydrophobicContact CD1-CD1 3.39Å; I26-L145 HydrophobicContact CD1-CG 4.12Å; F122-L145 HydrophobicContact CE1-CD2 4.47Å; F122-L145 HydrophobicContact CZ-CD2 4.47Å; L141-L145 PolarHBondContact O-N 2.96Å; L141-L145 VanDerWaalsContact O-N 3.07Å; V142-L145 WeakPolarHBondContact O-CB 3.49Å; V142-L145 PolarHBondContact O-N 3Å; A143-L145 PolarHBondContact O-N 3Å; L145-D147 PolarHBondContact O-N 3.29Å
146	A	64.7	Low	82.9	Confident	32 Å²	32	27.8 Å²	27.8	26%	0.264	16%	0.16	S	C	.	.	S	Bend	trans	-55.7	125.6	172.3	0	0	0	0	0	108.7	R123 V142 A143 D148	R123-A146 PolarHBondContact NH1-O 3.39Å; R123-A146 PolarHBondContact NH2-O 3.39Å; V142-A146 PolarHBondContact O-N 3.29Å; A143-A146 WeakPolarHBondContact O-CB 3.41Å; A143-A146 PolarHBondContact O-N 3.2Å; A146-D148 PolarHBondContact O-N 3.07Å; A146-D148 VanDerWaalsContact O-N 3.12Å
147	D	59.3	Low	82.7	Confident	60 Å²	60	28.2 Å²	28.2	32%	0.321	16%	0.162	S	C	.	.			trans	-67.7	105.3	-166.8	-86.2	-26.2	0	0	0	111.8	L145 S149 G168 K284	L145-D147 PolarHBondContact O-N 3.29Å; D147-S149 PolarHBondContact O-N 2.91Å; D147-S149 VanDerWaalsContact O-N 3.12Å; D147-G168 WeakPolarHBondContact O-CA 3.04Å; D147-G168 PolarHBondContact O-N 3.17Å; D147-K284 IonicContact OD1-NZ 3.86Å; D147-K284 PolarHBondContact OD1-NZ 2.95Å; D147-K284 VanDerWaalsContact OD2-CE 3.31Å; D147-K284 WeakPolarHBondContact OD2-CE 3.44Å; D147-K284 IonicContact OD2-NZ 3.52Å; D147-K284 PolarHBondContact OD2-NZ 3.12Å
148	D	58.4	Low	82.5	Confident	68 Å²	68	28.4 Å²	28.4	36%	0.364	17%	0.171	S	C	.	.			trans	-84.7	32	178.5	-87	-6.4	0	0	0	113.1	R123 A146 K150 S167	R123-D148 IonicContact CZ-OD2 3.65Å; R123-D148 VanDerWaalsContact NH1-CB 3.29Å; R123-D148 IonicContact NH1-OD1 3.81Å; R123-D148 PolarHBondContact NH1-OD1 2.95Å; R123-D148 IonicContact NH1-OD2 3.07Å; R123-D148 PolarHBondContact NH1-OD2 2.58Å; A146-D148 PolarHBondContact O-N 3.07Å; A146-D148 VanDerWaalsContact O-N 3.12Å; D148-K150 VanDerWaalsContact C-N 3.27Å; D148-K150 PolarHBondContact O-N 3.4Å; D148-S167 WeakPolarHBondContact CA-OG 3.1Å; D148-S167 WeakPolarHBondContact CB-OG 3.36Å; D148-S167 WeakPolarHBondContact OD1-CB 3.45Å; D148-S167 PolarHBondContact OD1-OG 2.89Å
149	S	70.7	Confident	82.4	Confident	11 Å²	11	33.9 Å²	33.9	8%	0.077	20%	0.2	C	C	.	.			trans	-56.8	102.7	162.4	-73.5	0	0	0	0	106.5	D147 F151 E227	D147-S149 PolarHBondContact O-N 2.91Å; D147-S149 VanDerWaalsContact O-N 3.12Å; S149-F151 VanDerWaalsContact CB-CE2 3.41Å; S149-F151 WeakPolarHBondContact O-CD2 3.41Å; S149-F151 WeakPolarHBondContact O-CE2 3.31Å; S149-F151 PolarHBondContact O-N 3.12Å; S149-F151 VanDerWaalsContact O-N 3.15Å; S149-E227 WeakPolarHBondContact CB-OE2 3.47Å; S149-E227 PolarHBondContact OG-OE1 3.08Å; S149-E227 PolarHBondContact OG-OE2 3.34Å
150	K	80.9	Confident	82.6	Confident	62 Å²	62	29.3 Å²	29.3	27%	0.27	18%	0.181	S	C	.	.			trans	-78.2	106.8	-173.2	-169.3	175.4	176.3	170	0	107.4	D148 T165 L166 I226 E227	D148-K150 VanDerWaalsContact C-N 3.27Å; D148-K150 PolarHBondContact O-N 3.4Å; K150-T165 HydrophobicContact CD-CG2 4.41Å; K150-T165 VanDerWaalsContact CE-CB 3.5Å; K150-T165 WeakPolarHBondContact CE-OG1 3.24Å; K150-T165 HydrophobicContact CG-CG2 4.25Å; K150-L166 WeakPolarHBondContact CA-O 3Å; K150-I226 HydrophobicContact CG-CG2 4.24Å; K150-I226 CarbonylContact O-C 3.47Å; K150-I226 WeakPolarHBondContact O-CA 3.1Å; K150-I226 VanDerWaalsContact O-CB 3.3Å; K150-I226 WeakPolarHBondContact O-CB 3.26Å; K150-E227 PolarHBondContact O-N 3.33Å
151	F	89.6	Confident	83.1	Confident	14 Å²	14	28.7 Å²	28.7	6%	0.061	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.9	176.9	-63.4	-71.1	0	0	0	109.9	S149 F153 T165 L166 E227 G228 I256 L280 V283	S149-F151 VanDerWaalsContact CB-CE2 3.41Å; S149-F151 WeakPolarHBondContact O-CD2 3.41Å; S149-F151 WeakPolarHBondContact O-CE2 3.31Å; S149-F151 PolarHBondContact O-N 3.12Å; S149-F151 VanDerWaalsContact O-N 3.15Å; F151-F153 HydrophobicContact CB-CE2 4.05Å; F151-T165 CarbonylContact O-C 3.57Å; F151-T165 VanDerWaalsContact O-CA 3.24Å; F151-T165 WeakPolarHBondContact O-CA 3.4Å; F151-L166 PolarHBondContact N-O 3.4Å; F151-L166 PolarHBondContact O-N 3.36Å; F151-E227 HydrophobicContact CE1-CB 4.26Å; F151-G228 CarbonylContact C-O 3.57Å; F151-G228 WeakPolarHBondContact CA-O 3.5Å; F151-I256 HydrophobicContact CD1-CD1 3.88Å; F151-I256 HydrophobicContact CE1-CD1 3.82Å; F151-L280 HydrophobicContact CB-CD1 4.39Å; F151-L280 HydrophobicContact CB-CD2 3.94Å; F151-L280 HydrophobicContact CD1-CD2 3.41Å; F151-L280 VanDerWaalsContact CD1-CD2 3.41Å; F151-L280 HydrophobicContact CD2-CB 4.29Å; F151-L280 HydrophobicContact CD2-CD1 3.92Å; F151-L280 HydrophobicContact CD2-CD2 3.63Å; F151-L280 HydrophobicContact CD2-CG 4.13Å; F151-L280 HydrophobicContact CE1-CD2 3.71Å; F151-L280 HydrophobicContact CE2-CB 4.01Å; F151-L280 HydrophobicContact CE2-CD1 4.47Å; F151-L280 HydrophobicContact CE2-CD2 3.9Å; F151-L280 HydrophobicContact CE2-CG 4.33Å; F151-L280 HydrophobicContact CG-CD1 4.22Å; F151-L280 HydrophobicContact CG-CD2 3.36Å; F151-L280 HydrophobicContact CG-CG 4.3Å; F151-L280 HydrophobicContact CZ-CB 4.33Å; F151-L280 HydrophobicContact CZ-CD2 3.93Å; F151-V283 HydrophobicContact CE1-CB 4.29Å; F151-V283 HydrophobicContact CE1-CG1 4.31Å; F151-V283 HydrophobicContact CE1-CG2 3.97Å; F151-V283 HydrophobicContact CZ-CB 4.19Å; F151-V283 HydrophobicContact CZ-CG1 4.47Å; F151-V283 HydrophobicContact CZ-CG2 4.18Å
152	G	93	Very high	83.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	142.3	173.3	0	0	0	0	0	110.8	G228 L229 I230	G152-G228 PolarHBondContact N-O 2.65Å; G152-L229 CarbonylContact O-C 3.52Å; G152-L229 WeakPolarHBondContact O-CA 3.32Å; G152-I230 PolarHBondContact O-N 3.49Å
153	F	95.1	Very high	84.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.7	171.5	-73.7	-102.5	0	0	0	109.1	F151 F163 G164 L166 I230 F269 A272 I273 A276 L280	F151-F153 HydrophobicContact CB-CE2 4.05Å; F153-F163 WeakPolarHBondContact O-CA 3.5Å; F153-G164 PolarHBondContact N-O 3.15Å; F153-G164 PolarHBondContact O-N 3.34Å; F153-L166 HydrophobicContact CD2-CB 4.22Å; F153-L166 HydrophobicContact CE2-CB 3.64Å; F153-L166 HydrophobicContact CE2-CD2 4.2Å; F153-L166 HydrophobicContact CZ-CD2 4.38Å; F153-I230 WeakPolarHBondContact CA-O 3.49Å; F153-I230 HydrophobicContact CD1-CB 3.88Å; F153-I230 HydrophobicContact CD1-CG2 4Å; F153-I230 HydrophobicContact CE1-CB 3.9Å; F153-I230 HydrophobicContact CE1-CD1 3.86Å; F153-I230 HydrophobicContact CE1-CG1 4.38Å; F153-I230 HydrophobicContact CE1-CG2 3.94Å; F153-I230 HydrophobicContact CG-CB 4.45Å; F153-I230 HydrophobicContact CZ-CB 4.46Å; F153-I230 HydrophobicContact CZ-CD1 3.84Å; F153-F269 HydrophobicContact CB-CD2 3.87Å; F153-F269 HydrophobicContact CB-CE2 3.46Å; F153-F269 VanDerWaalsContact CB-CE2 3.46Å; F153-F269 HydrophobicContact CB-CZ 4.48Å; F153-F269 HydrophobicContact CD1-CD2 4.38Å; F153-F269 HydrophobicContact CD1-CE2 4.17Å; F153-F269 AromaticContact CD2-CE2 3.87Å; F153-F269 HydrophobicContact CD2-CE2 3.87Å; F153-F269 HydrophobicContact CG-CD2 4.14Å; F153-F269 AromaticContact CG-CE2 3.58Å; F153-F269 HydrophobicContact CG-CE2 3.58Å; F153-A272 HydrophobicContact CD1-CB 4.07Å; F153-A272 HydrophobicContact CE1-CB 4.28Å; F153-I273 HydrophobicContact CE1-CG1 4.13Å; F153-I273 HydrophobicContact CE2-CG1 4.34Å; F153-I273 HydrophobicContact CZ-CG1 4.01Å; F153-A276 HydrophobicContact CE1-CB 3.78Å; F153-A276 HydrophobicContact CZ-CB 3.86Å; F153-L280 HydrophobicContact CE2-CD1 4.29Å; F153-L280 HydrophobicContact CZ-CD1 3.88Å
154	I	95.6	Very high	85	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	112.5	169.6	-56.7	174.4	0	0	0	107	V156 F163 V210 A214 F218 L229 I230 L231 A232 L241 F247	I154-V156 HydrophobicContact CG2-CG2 3.59Å; I154-F163 HydrophobicContact CD1-CD1 4.34Å; I154-F163 HydrophobicContact CD1-CE1 4.18Å; I154-F163 HydrophobicContact CG1-CD1 3.89Å; I154-F163 HydrophobicContact CG1-CE1 4.09Å; I154-F163 HydrophobicContact CG2-CD1 4.24Å; I154-F163 HydrophobicContact CG2-CE1 3.91Å; I154-F163 HydrophobicContact CG2-CZ 4.4Å; I154-V210 HydrophobicContact CG2-CG1 3.91Å; I154-A214 HydrophobicContact CD1-CB 3.66Å; I154-F218 HydrophobicContact CD1-CD2 4.41Å; I154-F218 HydrophobicContact CD1-CE2 3.93Å; I154-F218 HydrophobicContact CG1-CE2 3.64Å; I154-F218 HydrophobicContact CG1-CZ 4.4Å; I154-L229 HydrophobicContact CD1-CD1 3.98Å; I154-L229 HydrophobicContact CD1-CD2 4.16Å; I154-L229 HydrophobicContact CG1-CD1 3.95Å; I154-I230 PolarHBondContact N-O 3.41Å; I154-L231 HydrophobicContact CB-CD2 3.79Å; I154-L231 HydrophobicContact CD1-CD2 3.77Å; I154-L231 HydrophobicContact CG1-CD2 4.13Å; I154-A232 PolarHBondContact O-N 2.9Å; I154-A232 VanDerWaalsContact O-O 3.06Å; I154-L241 HydrophobicContact CG2-CD2 4.13Å; I154-F247 HydrophobicContact CD1-CE2 4.19Å; I154-F247 HydrophobicContact CD1-CZ 4.19Å
155	V	95.3	Very high	85.7	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	111.5	176.2	-179.5	0	0	0	0	108	A161 L162 A232 I261 F269	V155-A161 CarbonylContact O-C 3.58Å; V155-A161 VanDerWaalsContact O-CA 3.26Å; V155-A161 WeakPolarHBondContact O-CA 3.33Å; V155-L162 HydrophobicContact CB-CB 4.26Å; V155-L162 HydrophobicContact CG2-CD2 4.49Å; V155-L162 PolarHBondContact N-O 2.61Å; V155-L162 PolarHBondContact O-N 2.76Å; V155-A232 CarbonylContact C-O 3.57Å; V155-A232 VanDerWaalsContact CA-O 3.29Å; V155-A232 WeakPolarHBondContact CA-O 3.28Å; V155-A232 HydrophobicContact CG2-CB 4.31Å; V155-I261 HydrophobicContact CG1-CD1 3.57Å; V155-F269 HydrophobicContact CG2-CB 3.93Å; V155-F269 HydrophobicContact CG2-CD2 4.24Å; V155-F269 HydrophobicContact CG2-CG 4.45Å
156	V	93.4	Very high	86.2	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.03	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.5	-178.8	-169.5	0	0	0	0	110	I154 Y206 V210 A232 G233 I234 F237 L241	I154-V156 HydrophobicContact CG2-CG2 3.59Å; V156-Y206 HydrophobicContact CG1-CE1 3.83Å; V156-Y206 WeakPolarHBondContact CG1-OH 3.4Å; V156-V210 HydrophobicContact CG2-CG1 4.02Å; V156-A232 PolarHBondContact N-O 2.92Å; V156-G233 WeakPolarHBondContact O-CA 3.36Å; V156-I234 PolarHBondContact O-N 3.01Å; V156-F237 HydrophobicContact CG1-CB 3.88Å; V156-F237 HydrophobicContact CG1-CG 4.48Å; V156-L241 HydrophobicContact CG2-CD2 4.06Å
157	D	89.8	Confident	86.8	Confident	16 Å²	16	21.2 Å²	21.2	9%	0.086	12%	0.122	C	C	.	.			trans	-126.4	-175.9	168.5	77.5	10.2	0	0	0	111.2	N159 G160 Y206 I234 G264	D157-N159 VanDerWaalsContact C-N 3.26Å; D157-N159 PolarHBondContact O-N 2.89Å; D157-N159 VanDerWaalsContact OD1-C 3.31Å; D157-N159 VanDerWaalsContact OD1-CA 3.29Å; D157-N159 WeakPolarHBondContact OD1-CA 3.37Å; D157-N159 WeakPolarHBondContact OD1-CB 3.14Å; D157-N159 PolarHBondContact OD1-N 2.95Å; D157-G160 PolarHBondContact N-O 3.19Å; D157-G160 PolarHBondContact OD1-N 3.33Å; D157-Y206 VanDerWaalsContact O-CE1 3.3Å; D157-Y206 WeakPolarHBondContact O-CE1 3.31Å; D157-Y206 PolarHBondContact O-OH 3Å; D157-I234 HydrophobicContact CB-CD1 4.16Å; D157-I234 HydrophobicContact CB-CG1 4.36Å; D157-G264 VanDerWaalsContact OD2-CA 3.26Å; D157-G264 WeakPolarHBondContact OD2-CA 3.44Å
158	G	87	Confident	87.2	Confident	28 Å²	28	19.4 Å²	19.4	29%	0.289	12%	0.118	S	C	.	.	S	Bend	trans	-76.2	-6.3	178.1	0	0	0	0	0	115.5
159	N	88.3	Confident	87.4	Confident	121 Å²	121	23.6 Å²	23.6	65%	0.647	14%	0.14	S	C	*	.	S	Bend	trans	-112.7	-12.8	-176.5	-61.8	-29	0	0	0	112.9	D157 T178 V179	D157-N159 VanDerWaalsContact C-N 3.26Å; D157-N159 PolarHBondContact O-N 2.89Å; D157-N159 VanDerWaalsContact OD1-C 3.31Å; D157-N159 VanDerWaalsContact OD1-CA 3.29Å; D157-N159 WeakPolarHBondContact OD1-CA 3.37Å; D157-N159 WeakPolarHBondContact OD1-CB 3.14Å; D157-N159 PolarHBondContact OD1-N 2.95Å; N159-T178 CarbonylContact O-C 3.56Å; N159-T178 VanDerWaalsContact O-CA 3.27Å; N159-T178 WeakPolarHBondContact O-CA 3.42Å; N159-T178 WeakPolarHBondContact O-CB 3.48Å; N159-V179 CarbonylContact C-O 3.46Å; N159-V179 WeakPolarHBondContact CA-O 3.48Å; N159-V179 PolarHBondContact O-N 3.36Å
160	G	92.1	Very high	87.4	Confident	9 Å²	9	27.6 Å²	27.6	9%	0.093	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.8	173.8	-175.7	0	0	0	0	0	114.4	D157 F177 Y206	D157-G160 PolarHBondContact N-O 3.19Å; D157-G160 PolarHBondContact OD1-N 3.33Å; G160-F177 CarbonylContact C-O 3.53Å; G160-F177 WeakPolarHBondContact CA-O 3.39Å; G160-Y206 PolarHBondContact O-OH 3.21Å
161	A	94.9	Very high	87.4	Confident	4 Å²	4	30.2 Å²	30.2	3%	0.033	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	143	177.9	0	0	0	0	0	110.4	V155 F163 K176 F177 Y206 V210	V155-A161 CarbonylContact O-C 3.58Å; V155-A161 VanDerWaalsContact O-CA 3.26Å; V155-A161 WeakPolarHBondContact O-CA 3.33Å; A161-F163 HydrophobicContact CB-CE2 3.93Å; A161-F163 HydrophobicContact CB-CZ 4.34Å; A161-K176 WeakPolarHBondContact O-CA 3.3Å; A161-F177 HydrophobicContact CB-CE1 4.25Å; A161-F177 HydrophobicContact CB-CE2 4.27Å; A161-F177 HydrophobicContact CB-CZ 3.95Å; A161-F177 PolarHBondContact N-O 3.26Å; A161-F177 PolarHBondContact O-N 3.2Å; A161-Y206 HydrophobicContact CB-CE2 4.33Å; A161-Y206 PolarHBondContact N-OH 3Å; A161-V210 HydrophobicContact CB-CG2 3.77Å
162	L	95.9	Very high	87.3	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.6	173.8	-178.8	153.6	0	0	0	109.5	V155 V173 K176 E266 F269	V155-L162 HydrophobicContact CB-CB 4.26Å; V155-L162 HydrophobicContact CG2-CD2 4.49Å; V155-L162 PolarHBondContact N-O 2.61Å; V155-L162 PolarHBondContact O-N 2.76Å; L162-V173 HydrophobicContact CD1-CG1 3.9Å; L162-V173 HydrophobicContact CD1-CG2 4.29Å; L162-V173 HydrophobicContact CD2-CG1 4.21Å; L162-V173 HydrophobicContact CD2-CG2 4.4Å; L162-V173 HydrophobicContact CG-CG1 3.89Å; L162-K176 HydrophobicContact CB-CB 4.3Å; L162-K176 HydrophobicContact CD1-CB 4.4Å; L162-K176 HydrophobicContact CG-CB 4.28Å; L162-E266 HydrophobicContact CD1-CB 4.45Å; L162-E266 HydrophobicContact CD1-CG 3.6Å; L162-F269 HydrophobicContact CD2-CB 4.05Å; L162-F269 HydrophobicContact CD2-CD1 3.89Å; L162-F269 HydrophobicContact CD2-CD2 4.49Å; L162-F269 HydrophobicContact CD2-CE1 4.48Å; L162-F269 HydrophobicContact CD2-CG 3.89Å
163	F	96.8	Very high	87.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.9	177.5	-57.9	-100	0	0	0	107.5	F153 I154 A161 L174 H175 F177 V210 T213 A214 L217 F218	F153-F163 WeakPolarHBondContact O-CA 3.5Å; I154-F163 HydrophobicContact CD1-CD1 4.34Å; I154-F163 HydrophobicContact CD1-CE1 4.18Å; I154-F163 HydrophobicContact CG1-CD1 3.89Å; I154-F163 HydrophobicContact CG1-CE1 4.09Å; I154-F163 HydrophobicContact CG2-CD1 4.24Å; I154-F163 HydrophobicContact CG2-CE1 3.91Å; I154-F163 HydrophobicContact CG2-CZ 4.4Å; A161-F163 HydrophobicContact CB-CE2 3.93Å; A161-F163 HydrophobicContact CB-CZ 4.34Å; F163-L174 PolarHBondContact O-N 3.47Å; F163-H175 HydrophobicContact CB-CB 4.46Å; F163-H175 HydrophobicContact CD2-CB 4.32Å; F163-H175 PolarHBondContact N-O 3.49Å; F163-H175 PolarHBondContact O-N 3.06Å; F163-F177 HydrophobicContact CE2-CD1 4.21Å; F163-F177 AromaticContact CE2-CE1 3.61Å; F163-F177 HydrophobicContact CE2-CE1 3.61Å; F163-F177 HydrophobicContact CE2-CZ 4.42Å; F163-F177 HydrophobicContact CZ-CE1 4.18Å; F163-V210 HydrophobicContact CE1-CG1 4.2Å; F163-V210 HydrophobicContact CZ-CB 4.39Å; F163-V210 HydrophobicContact CZ-CG1 3.84Å; F163-T213 HydrophobicContact CD2-CG2 4.05Å; F163-T213 HydrophobicContact CE1-CG2 4.2Å; F163-T213 HydrophobicContact CE2-CG2 3.67Å; F163-T213 HydrophobicContact CG-CG2 4.49Å; F163-T213 HydrophobicContact CZ-CG2 3.74Å; F163-A214 HydrophobicContact CE1-CB 3.95Å; F163-L217 HydrophobicContact CB-CD1 3.5Å; F163-L217 VanDerWaalsContact CB-CD1 3.5Å; F163-L217 HydrophobicContact CD1-CD1 4Å; F163-L217 HydrophobicContact CD2-CD1 4.15Å; F163-L217 HydrophobicContact CG-CD1 3.62Å; F163-F218 HydrophobicContact CB-CZ 4.47Å; F163-F218 HydrophobicContact CD1-CE2 4.07Å
164	G	94.1	Very high	87.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	164.7	-178.7	0	0	0	0	0	111.5	F153 E172	F153-G164 PolarHBondContact N-O 3.15Å; F153-G164 PolarHBondContact O-N 3.34Å; G164-E172 CarbonylContact C-O 3.51Å; G164-E172 WeakPolarHBondContact CA-O 3.43Å
165	T	91.6	Very high	87.1	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.1	173.8	53	0	0	0	0	110.2	K150 F151 R171 E172 L174 F218 I226	K150-T165 HydrophobicContact CD-CG2 4.41Å; K150-T165 VanDerWaalsContact CE-CB 3.5Å; K150-T165 WeakPolarHBondContact CE-OG1 3.24Å; K150-T165 HydrophobicContact CG-CG2 4.25Å; F151-T165 CarbonylContact O-C 3.57Å; F151-T165 VanDerWaalsContact O-CA 3.24Å; F151-T165 WeakPolarHBondContact O-CA 3.4Å; T165-R171 WeakPolarHBondContact O-CA 3.42Å; T165-E172 PolarHBondContact N-O 3.41Å; T165-E172 PolarHBondContact O-N 3.04Å; T165-L174 HydrophobicContact CG2-CD1 3.64Å; T165-L174 HydrophobicContact CG2-CG 4.18Å; T165-F218 HydrophobicContact CG2-CD1 4.44Å; T165-F218 HydrophobicContact CG2-CE1 3.7Å; T165-I226 HydrophobicContact CG2-CG2 4.44Å
166	L	84.9	Confident	87.1	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.1	170.2	-176.1	70.1	0	0	0	108.1	K150 F151 F153 R171 I273 L280	K150-L166 WeakPolarHBondContact CA-O 3Å; F151-L166 PolarHBondContact N-O 3.4Å; F151-L166 PolarHBondContact O-N 3.36Å; F153-L166 HydrophobicContact CD2-CB 4.22Å; F153-L166 HydrophobicContact CE2-CB 3.64Å; F153-L166 HydrophobicContact CE2-CD2 4.2Å; F153-L166 HydrophobicContact CZ-CD2 4.38Å; L166-R171 HydrophobicContact CD1-CB 4.25Å; L166-I273 HydrophobicContact CD1-CD1 4.33Å; L166-I273 HydrophobicContact CD1-CG2 4.37Å; L166-I273 HydrophobicContact CD2-CG1 4.46Å; L166-I273 HydrophobicContact CD2-CG2 3.9Å; L166-L280 HydrophobicContact CD2-CD1 3.69Å
167	S	76.5	Confident	87.1	Confident	21 Å²	21	50.4 Å²	50.4	15%	0.147	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	107.1	177.6	-166.4	0	0	0	0	106.8	D148 N169 T170	D148-S167 WeakPolarHBondContact CA-OG 3.1Å; D148-S167 WeakPolarHBondContact CB-OG 3.36Å; D148-S167 WeakPolarHBondContact OD1-CB 3.45Å; D148-S167 PolarHBondContact OD1-OG 2.89Å; S167-N169 PolarHBondContact O-N 3.24Å; S167-N169 VanDerWaalsContact O-N 3.11Å; S167-T170 PolarHBondContact N-O 3.01Å; S167-T170 PolarHBondContact O-N 3.39Å; S167-T170 PolarHBondContact O-OG1 3.09Å
168	G	67.9	Low	87.3	Confident	22 Å²	22	55.6 Å²	55.6	23%	0.227	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-115.1	-170.2	0	0	0	0	0	111.3	D147	D147-G168 WeakPolarHBondContact O-CA 3.04Å; D147-G168 PolarHBondContact O-N 3.17Å
169	N	62.2	Low	87.4	Confident	156 Å²	156	55.7 Å²	55.7	83%	0.834	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-1.4	177.5	-64	-16.1	0	0	0	113	S167	S167-N169 PolarHBondContact O-N 3.24Å; S167-N169 VanDerWaalsContact O-N 3.11Å
170	T	69.6	Low	87.3	Confident	95 Å²	95	58.6 Å²	58.6	58%	0.583	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.6	-178.2	19.7	0	0	0	0	110.8	S167	S167-T170 PolarHBondContact N-O 3.01Å; S167-T170 PolarHBondContact O-N 3.39Å; S167-T170 PolarHBondContact O-OG1 3.09Å
171	R	81.9	Confident	87	Confident	117 Å²	117	59.8 Å²	59.8	44%	0.442	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.7	169.1	75	179.1	-174.3	113.6	13	110.2	T165 L166 F269 N270 I273	T165-R171 WeakPolarHBondContact O-CA 3.42Å; L166-R171 HydrophobicContact CD1-CB 4.25Å; R171-F269 HydrophobicContact CB-CE1 4.2Å; R171-F269 HydrophobicContact CB-CZ 4.33Å; R171-N270 PolarHBondContact NH1-OD1 3.12Å; R171-I273 HydrophobicContact CB-CD1 4.09Å
172	E	86.6	Confident	86.5	Confident	109 Å²	109	61.1 Å²	61.1	51%	0.509	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.9	176.4	-174.2	-179.4	-172.7	0	0	109.3	G164 T165 L174	G164-E172 CarbonylContact C-O 3.51Å; G164-E172 WeakPolarHBondContact CA-O 3.43Å; T165-E172 PolarHBondContact N-O 3.41Å; T165-E172 PolarHBondContact O-N 3.04Å; E172-L174 HydrophobicContact CG-CD2 4.2Å
173	V	92.5	Very high	85.7	Confident	50 Å²	50	69.6 Å²	69.6	30%	0.303	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	109.7	172.7	178.4	0	0	0	0	107.7	L162 F269	L162-V173 HydrophobicContact CD1-CG1 3.9Å; L162-V173 HydrophobicContact CD1-CG2 4.29Å; L162-V173 HydrophobicContact CD2-CG1 4.21Å; L162-V173 HydrophobicContact CD2-CG2 4.4Å; L162-V173 HydrophobicContact CG-CG1 3.89Å; V173-F269 HydrophobicContact CG2-CD1 4.08Å; V173-F269 HydrophobicContact CG2-CE1 4.04Å
174	L	92.8	Very high	84.9	Confident	54 Å²	54	78 Å²	78	28%	0.283	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-44.7	-177.8	-60.9	-179.4	0	0	0	111.6	F163 T165 E172 L217 F218	F163-L174 PolarHBondContact O-N 3.47Å; T165-L174 HydrophobicContact CG2-CD1 3.64Å; T165-L174 HydrophobicContact CG2-CG 4.18Å; E172-L174 HydrophobicContact CG-CD2 4.2Å; L174-L217 HydrophobicContact CB-CD1 4.33Å; L174-L217 HydrophobicContact CB-CD2 4.32Å; L174-L217 HydrophobicContact CD1-CB 4.28Å; L174-F218 HydrophobicContact CD1-CD1 4.48Å; L174-F218 HydrophobicContact CD1-CE1 3.94Å
175	H	95	Very high	83.8	Confident	82 Å²	82	83.3 Å²	83.3	38%	0.38	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	150.5	-178.1	-165.1	59	0	0	0	111.3	F163 F177 L217	F163-H175 HydrophobicContact CB-CB 4.46Å; F163-H175 HydrophobicContact CD2-CB 4.32Å; F163-H175 PolarHBondContact N-O 3.49Å; F163-H175 PolarHBondContact O-N 3.06Å; H175-F177 AromaticContact CD2-CD1 3.78Å; H175-F177 AromaticContact NE2-CD1 3.79Å; H175-L217 HydrophobicContact CB-CD1 3.63Å; H175-L217 HydrophobicContact CB-CD2 4.47Å
176	K	94.6	Very high	82.9	Confident	124 Å²	124	87.2 Å²	87.2	54%	0.539	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.9	170	62.7	-177.6	174.9	-175	0	109.9	A161 L162 E266	A161-K176 WeakPolarHBondContact O-CA 3.3Å; L162-K176 HydrophobicContact CB-CB 4.3Å; L162-K176 HydrophobicContact CD1-CB 4.4Å; L162-K176 HydrophobicContact CG-CB 4.28Å; K176-E266 IonicContact NZ-OE1 2.72Å; K176-E266 PolarHBondContact NZ-OE1 2.8Å
177	F	94.8	Very high	82.4	Confident	25 Å²	25	97.1 Å²	97.1	11%	0.11	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153.8	172	64.5	-100.9	0	0	0	111	G160 A161 F163 H175 V179 Y206 K209 V210 T213	G160-F177 CarbonylContact C-O 3.53Å; G160-F177 WeakPolarHBondContact CA-O 3.39Å; A161-F177 HydrophobicContact CB-CE1 4.25Å; A161-F177 HydrophobicContact CB-CE2 4.27Å; A161-F177 HydrophobicContact CB-CZ 3.95Å; A161-F177 PolarHBondContact N-O 3.26Å; A161-F177 PolarHBondContact O-N 3.2Å; F163-F177 HydrophobicContact CE2-CD1 4.21Å; F163-F177 AromaticContact CE2-CE1 3.61Å; F163-F177 HydrophobicContact CE2-CE1 3.61Å; F163-F177 HydrophobicContact CE2-CZ 4.42Å; F163-F177 HydrophobicContact CZ-CE1 4.18Å; H175-F177 AromaticContact CD2-CD1 3.78Å; H175-F177 AromaticContact NE2-CD1 3.79Å; F177-V179 HydrophobicContact CD2-CG2 4.48Å; F177-V179 HydrophobicContact CE2-CG2 4.32Å; F177-Y206 HydrophobicContact CE2-CD2 4.16Å; F177-Y206 AromaticContact CE2-CE2 3.74Å; F177-Y206 HydrophobicContact CE2-CE2 3.74Å; F177-Y206 HydrophobicContact CZ-CE2 4.28Å; F177-K209 HydrophobicContact CD2-CD 4.48Å; F177-K209 HydrophobicContact CE1-CG 4.49Å; F177-K209 HydrophobicContact CE2-CD 3.89Å; F177-K209 HydrophobicContact CE2-CG 4.32Å; F177-K209 HydrophobicContact CZ-CD 3.99Å; F177-K209 HydrophobicContact CZ-CG 3.93Å; F177-V210 HydrophobicContact CZ-CG2 3.84Å; F177-T213 HydrophobicContact CE1-CG2 4.3Å
178	T	92.6	Very high	82.4	Confident	124 Å²	124	99.7 Å²	99.7	76%	0.761	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	157	177.5	54.8	0	0	0	0	111.2	N159	N159-T178 CarbonylContact O-C 3.56Å; N159-T178 VanDerWaalsContact O-CA 3.27Å; N159-T178 WeakPolarHBondContact O-CA 3.42Å; N159-T178 WeakPolarHBondContact O-CB 3.48Å
179	V	89.8	Confident	83.1	Confident	31 Å²	31	100.9 Å²	100.9	19%	0.188	54%	0.535	C	S	.	.			trans	-143.5	139.3	178.9	132.7	0	0	0	0	109.6	N159 F177 L181 Y206	N159-V179 CarbonylContact C-O 3.46Å; N159-V179 WeakPolarHBondContact CA-O 3.48Å; N159-V179 PolarHBondContact O-N 3.36Å; F177-V179 HydrophobicContact CD2-CG2 4.48Å; F177-V179 HydrophobicContact CE2-CG2 4.32Å; V179-L181 HydrophobicContact CG1-CD1 4.19Å; V179-L181 HydrophobicContact CG1-CD2 3.68Å; V179-L181 HydrophobicContact CG1-CG 3.52Å; V179-Y206 HydrophobicContact CB-CD2 4.03Å; V179-Y206 HydrophobicContact CB-CE2 4Å; V179-Y206 HydrophobicContact CG1-CD1 4.28Å; V179-Y206 HydrophobicContact CG1-CD2 3.93Å; V179-Y206 HydrophobicContact CG1-CE1 4.44Å; V179-Y206 HydrophobicContact CG1-CE2 4.12Å; V179-Y206 HydrophobicContact CG1-CG 3.99Å; V179-Y206 HydrophobicContact CG2-CD2 3.7Å; V179-Y206 HydrophobicContact CG2-CE2 4.02Å; V179-Y206 HydrophobicContact CG2-CG 4.42Å
180	E	86.9	Confident	84.1	Confident	181 Å²	181	103 Å²	103	85%	0.846	54%	0.54	S	S	*	.			trans	-105.8	103.4	174.4	-70.6	-171	168	0	0	111
181	L	86.2	Confident	84.6	Confident	35 Å²	35	101.3 Å²	101.3	18%	0.183	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-92.4	134.5	177.8	-63.2	176.7	0	0	0	111.8	V179 K183 K202 R203 Y206 F237	V179-L181 HydrophobicContact CG1-CD1 4.19Å; V179-L181 HydrophobicContact CG1-CD2 3.68Å; V179-L181 HydrophobicContact CG1-CG 3.52Å; L181-K183 PolarHBondContact O-N 3.2Å; L181-K202 HydrophobicContact CD2-CB 4.28Å; L181-R203 HydrophobicContact CD1-CG 4.43Å; L181-R203 HydrophobicContact CD2-CG 4.47Å; L181-Y206 HydrophobicContact CD1-CD1 4.06Å; L181-Y206 HydrophobicContact CD1-CE1 4.4Å; L181-F237 HydrophobicContact CD1-CE1 4.25Å; L181-F237 HydrophobicContact CD1-CE2 4.1Å; L181-F237 HydrophobicContact CD1-CZ 3.5Å
182	P	83	Confident	84.6	Confident	32 Å²	32	97.3 Å²	97.3	21%	0.208	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-60.4	130.7	175.3	-17.8	28.6	0	0	0	110.2	R199 K202	P182-R199 HydrophobicContact CB-CB 4.4Å; P182-R199 PolarHBondContact O-NH1 2.97Å; P182-K202 HydrophobicContact CG-CD 3.64Å
183	K	80	Confident	84.5	Confident	180 Å²	180	99 Å²	99	78%	0.783	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-69.3	160.5	-179.5	-67.4	-176.5	-179	178.7	0	112.3	L181 H185 R199	L181-K183 PolarHBondContact O-N 3.2Å; K183-H185 PolarHBondContact O-N 3.05Å; K183-R199 VanDerWaalsContact CA-NH1 3.25Å
184	K	79.1	Confident	84.2	Confident	177 Å²	177	105.6 Å²	105.6	77%	0.77	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-72.9	118.9	177.8	-172.1	177.3	-180	179.9	0	107	G186	K184-G186 PolarHBondContact O-N 3.28Å
185	H	71.5	Confident	83.8	Confident	111 Å²	111	106.8 Å²	106.8	51%	0.514	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-77.1	121.3	176	-67	-76.3	0	0	0	109.3	K183	K183-H185 PolarHBondContact O-N 3.05Å
186	G	72.6	Confident	83.3	Confident	85 Å²	85	105.3 Å²	105.3	88%	0.876	56%	0.56	S	S	*	*			trans	-82.6	-13.6	176.4	0	0	0	0	0	114.2	K184	K184-G186 PolarHBondContact O-N 3.28Å
187	R	75.3	Confident	82.9	Confident	228 Å²	228	108.6 Å²	108.6	86%	0.86	57%	0.569	S	S	*	*	S	Bend	trans	-96.9	122.5	-178.7	-59.5	-178.5	88.2	122.5	-0.3	109.7
188	G	76.4	Confident	82.6	Confident	76 Å²	76	111.1 Å²	111.1	78%	0.784	58%	0.583	S	S	*	*			trans	-66.4	157.1	172.1	0	0	0	0	0	112.3
189	G	81.2	Confident	82.3	Confident	47 Å²	47	107.5 Å²	107.5	49%	0.485	56%	0.556	S	S	.	*			trans	169.8	166.8	179.1	0	0	0	0	0	111.8	S191 A192	G189-S191 PolarHBondContact O-N 3.12Å; G189-S191 VanDerWaalsContact O-N 3.15Å; G189-A192 WeakPolarHBondContact O-CB 3.44Å; G189-A192 PolarHBondContact O-N 3.46Å
190	Q	83.1	Confident	82.2	Confident	199 Å²	199	111.6 Å²	111.6	93%	0.93	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-35	-178.8	-72.5	-68.9	-14.5	0	0	112.8
191	S	81.5	Confident	82.3	Confident	60 Å²	60	108.1 Å²	108.1	42%	0.42	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-7.3	177.8	55	0	0	0	0	114.5	G189 L193 R194 F195	G189-S191 PolarHBondContact O-N 3.12Å; G189-S191 VanDerWaalsContact O-N 3.15Å; S191-L193 VanDerWaalsContact C-N 3.3Å; S191-L193 PolarHBondContact O-N 2.92Å; S191-R194 WeakPolarHBondContact O-CB 3.05Å; S191-R194 PolarHBondContact O-N 2.91Å; S191-R194 VanDerWaalsContact O-N 3.1Å; S191-F195 WeakPolarHBondContact O-CD2 3.46Å; S191-F195 PolarHBondContact O-N 2.89Å; S191-F195 VanDerWaalsContact OG-CE2 3.3Å; S191-F195 WeakPolarHBondContact OG-CE2 3.23Å
192	A	81.4	Confident	82.4	Confident	34 Å²	34	111 Å²	111	28%	0.281	57%	0.569	S	S	.	*	H	α-helix	trans	-59.6	-40.2	-173.8	0	0	0	0	0	112.2	G189 R194 F195 A196	G189-A192 WeakPolarHBondContact O-CB 3.44Å; G189-A192 PolarHBondContact O-N 3.46Å; A192-R194 PolarHBondContact O-N 2.84Å; A192-F195 PolarHBondContact O-N 3.43Å; A192-A196 WeakPolarHBondContact O-CB 3.49Å; A192-A196 PolarHBondContact O-N 3.44Å
193	L	84.1	Confident	82.7	Confident	143 Å²	143	113 Å²	113	75%	0.749	57%	0.572	S	S	*	*	H	α-helix	trans	-62.9	-41.4	176.6	-171	71.2	0	0	0	111.9	S191 A196 R197	S191-L193 VanDerWaalsContact C-N 3.3Å; S191-L193 PolarHBondContact O-N 2.92Å; L193-A196 PolarHBondContact O-N 2.91Å; L193-R197 PolarHBondContact O-N 3.29Å
194	R	86.2	Confident	83.2	Confident	189 Å²	189	108.6 Å²	108.6	71%	0.713	56%	0.555	S	S	*	*	H	α-helix	trans	-63.1	-44.6	176.4	-177.5	-176.8	173.2	-143.4	-0.9	111.2	S191 A192 R197 L198	S191-R194 WeakPolarHBondContact O-CB 3.05Å; S191-R194 PolarHBondContact O-N 2.91Å; S191-R194 VanDerWaalsContact O-N 3.1Å; A192-R194 PolarHBondContact O-N 2.84Å; R194-R197 PolarHBondContact O-N 2.93Å; R194-L198 WeakPolarHBondContact O-CB 3.26Å; R194-L198 PolarHBondContact O-N 2.82Å
195	F	85.2	Confident	83.7	Confident	80 Å²	80	103.7 Å²	103.7	35%	0.351	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-37.9	177.2	-69.6	-59.5	0	0	0	112.4	S191 A192 L198 R199	S191-F195 WeakPolarHBondContact O-CD2 3.46Å; S191-F195 PolarHBondContact O-N 2.89Å; S191-F195 VanDerWaalsContact OG-CE2 3.3Å; S191-F195 WeakPolarHBondContact OG-CE2 3.23Å; A192-F195 PolarHBondContact O-N 3.43Å; F195-L198 PolarHBondContact O-N 3.06Å; F195-R199 WeakPolarHBondContact O-CB 3.38Å; F195-R199 PolarHBondContact O-N 3.07Å
196	A	84.6	Confident	84.7	Confident	50 Å²	50	98.7 Å²	98.7	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-45.8	174	0	0	0	0	0	111.6	A192 L193 R199 M200	A192-A196 WeakPolarHBondContact O-CB 3.49Å; A192-A196 PolarHBondContact O-N 3.44Å; L193-A196 PolarHBondContact O-N 2.91Å; A196-R199 WeakPolarHBondContact O-CB 3.26Å; A196-R199 PolarHBondContact O-N 3.11Å; A196-M200 WeakPolarHBondContact O-CG 3.46Å; A196-M200 PolarHBondContact O-N 2.63Å
197	R	86.5	Confident	85.6	Confident	193 Å²	193	95.2 Å²	95.2	73%	0.728	48%	0.475	S	S	*	.	H	α-helix	trans	-60.2	-47.9	176	-175.7	179.2	-83.8	-179.2	-5.5	111.5	L193 R194 R199 M200 E201	L193-R197 PolarHBondContact O-N 3.29Å; R194-R197 PolarHBondContact O-N 2.93Å; R197-R199 VanDerWaalsContact C-N 3.28Å; R197-R199 PolarHBondContact O-N 3.12Å; R197-M200 PolarHBondContact O-N 3.41Å; R197-M200 VanDerWaalsContact O-N 3.15Å; R197-E201 WeakPolarHBondContact O-CB 3.04Å; R197-E201 PolarHBondContact O-N 2.85Å
198	L	87.7	Confident	86.4	Confident	78 Å²	78	89.4 Å²	89.4	41%	0.408	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-35.6	178.9	-170.1	67.8	0	0	0	112.4	R194 F195 K202	R194-L198 WeakPolarHBondContact O-CB 3.26Å; R194-L198 PolarHBondContact O-N 2.82Å; F195-L198 PolarHBondContact O-N 3.06Å; L198-K202 PolarHBondContact O-N 3.14Å
199	R	86.4	Confident	87.2	Confident	48 Å²	48	90.3 Å²	90.3	18%	0.181	44%	0.436	C	S	.	.	H	α-helix	trans	-64.9	-46.7	173.7	179.3	-178.7	165.8	103.1	-9.6	111.4	P182 K183 F195 A196 R197 K202 R203	P182-R199 HydrophobicContact CB-CB 4.4Å; P182-R199 PolarHBondContact O-NH1 2.97Å; K183-R199 VanDerWaalsContact CA-NH1 3.25Å; F195-R199 WeakPolarHBondContact O-CB 3.38Å; F195-R199 PolarHBondContact O-N 3.07Å; A196-R199 WeakPolarHBondContact O-CB 3.26Å; A196-R199 PolarHBondContact O-N 3.11Å; R197-R199 VanDerWaalsContact C-N 3.28Å; R197-R199 PolarHBondContact O-N 3.12Å; R199-K202 PolarHBondContact O-N 2.9Å; R199-R203 WeakPolarHBondContact O-CG 3.4Å; R199-R203 PolarHBondContact O-N 3.28Å
200	M	86.9	Confident	87.8	Confident	118 Å²	118	88.1 Å²	88.1	58%	0.581	41%	0.413	S	S	*	.	H	α-helix	trans	-64.8	-40.7	179.3	-68.5	-54.9	-66.8	0	0	111.8	A196 R197 R203 H204	A196-M200 WeakPolarHBondContact O-CG 3.46Å; A196-M200 PolarHBondContact O-N 2.63Å; R197-M200 PolarHBondContact O-N 3.41Å; R197-M200 VanDerWaalsContact O-N 3.15Å; M200-R203 WeakPolarHBondContact O-CB 3.48Å; M200-R203 PolarHBondContact O-N 2.88Å; M200-H204 PolarHBondContact O-N 3.15Å
201	E	89.3	Confident	88.3	Confident	107 Å²	107	78.7 Å²	78.7	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-45.4	176.4	-171.5	177.1	-177.6	0	0	112.2	R197 R203 H204 N205	R197-E201 WeakPolarHBondContact O-CB 3.04Å; R197-E201 PolarHBondContact O-N 2.85Å; E201-R203 VanDerWaalsContact C-N 3.32Å; E201-R203 PolarHBondContact O-N 3.3Å; E201-H204 PolarHBondContact O-N 2.87Å; E201-N205 PolarHBondContact O-N 3.02Å; E201-N205 PolarHBondContact O-ND2 2.75Å
202	K	89	Confident	88.8	Confident	97 Å²	97	81 Å²	81	42%	0.422	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-35.8	174.5	-82.3	-167	169.9	-166.7	0	113.1	L181 P182 L198 R199 Y206	L181-K202 HydrophobicContact CD2-CB 4.28Å; P182-K202 HydrophobicContact CG-CD 3.64Å; L198-K202 PolarHBondContact O-N 3.14Å; R199-K202 PolarHBondContact O-N 2.9Å; K202-Y206 WeakPolarHBondContact O-CB 3.31Å; K202-Y206 PolarHBondContact O-N 2.92Å
203	R	89.5	Confident	89.5	Confident	72 Å²	72	80 Å²	80	27%	0.272	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-45.2	174.1	-77.4	177.3	163	-153.9	-18.2	111.5	L181 R199 M200 E201 N205 Y206 V207 F237	L181-R203 HydrophobicContact CD1-CG 4.43Å; L181-R203 HydrophobicContact CD2-CG 4.47Å; R199-R203 WeakPolarHBondContact O-CG 3.4Å; R199-R203 PolarHBondContact O-N 3.28Å; M200-R203 WeakPolarHBondContact O-CB 3.48Å; M200-R203 PolarHBondContact O-N 2.88Å; E201-R203 VanDerWaalsContact C-N 3.32Å; E201-R203 PolarHBondContact O-N 3.3Å; R203-N205 PolarHBondContact O-N 3.4Å; R203-Y206 WeakPolarHBondContact O-CB 3.48Å; R203-Y206 PolarHBondContact O-N 3.36Å; R203-V207 WeakPolarHBondContact O-CG2 3.46Å; R203-V207 PolarHBondContact O-N 2.94Å; R203-F237 HydrophobicContact CB-CE1 4.28Å; R203-F237 HydrophobicContact CG-CE1 3.94Å; R203-F237 HydrophobicContact CG-CZ 3.98Å
204	H	89.3	Confident	89.9	Confident	88 Å²	88	73.2 Å²	73.2	41%	0.407	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-46.7	176.7	-170.9	75.9	0	0	0	112	M200 E201 Y206 V207 R208 M246	M200-H204 PolarHBondContact O-N 3.15Å; E201-H204 PolarHBondContact O-N 2.87Å; H204-Y206 VanDerWaalsContact C-N 3.27Å; H204-Y206 PolarHBondContact O-N 2.96Å; H204-V207 PolarHBondContact O-N 3.39Å; H204-R208 PolarHBondContact O-N 3.39Å; H204-M246 WeakPolarHBondContact CE1-CE 3.45Å
205	N	90.8	Very high	90.2	Very high	75 Å²	75	66.2 Å²	66.2	40%	0.401	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-34.2	176.6	-70.2	-19.6	0	0	0	112.5	E201 R203 K209	E201-N205 PolarHBondContact O-N 3.02Å; E201-N205 PolarHBondContact O-ND2 2.75Å; R203-N205 PolarHBondContact O-N 3.4Å; N205-K209 WeakPolarHBondContact O-CB 3.39Å; N205-K209 PolarHBondContact O-N 3.38Å
206	Y	91.9	Very high	90.6	Very high	5 Å²	5	69.5 Å²	69.5	2%	0.02	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-48.1	175.1	174.6	-134.1	0	0	0	111.9	V156 D157 G160 A161 F177 V179 L181 K202 R203 H204 R208 K209 V210 F237	V156-Y206 HydrophobicContact CG1-CE1 3.83Å; V156-Y206 WeakPolarHBondContact CG1-OH 3.4Å; D157-Y206 VanDerWaalsContact O-CE1 3.3Å; D157-Y206 WeakPolarHBondContact O-CE1 3.31Å; D157-Y206 PolarHBondContact O-OH 3Å; G160-Y206 PolarHBondContact O-OH 3.21Å; A161-Y206 HydrophobicContact CB-CE2 4.33Å; A161-Y206 PolarHBondContact N-OH 3Å; F177-Y206 HydrophobicContact CE2-CD2 4.16Å; F177-Y206 AromaticContact CE2-CE2 3.74Å; F177-Y206 HydrophobicContact CE2-CE2 3.74Å; F177-Y206 HydrophobicContact CZ-CE2 4.28Å; V179-Y206 HydrophobicContact CB-CD2 4.03Å; V179-Y206 HydrophobicContact CB-CE2 4Å; V179-Y206 HydrophobicContact CG1-CD1 4.28Å; V179-Y206 HydrophobicContact CG1-CD2 3.93Å; V179-Y206 HydrophobicContact CG1-CE1 4.44Å; V179-Y206 HydrophobicContact CG1-CE2 4.12Å; V179-Y206 HydrophobicContact CG1-CG 3.99Å; V179-Y206 HydrophobicContact CG2-CD2 3.7Å; V179-Y206 HydrophobicContact CG2-CE2 4.02Å; V179-Y206 HydrophobicContact CG2-CG 4.42Å; L181-Y206 HydrophobicContact CD1-CD1 4.06Å; L181-Y206 HydrophobicContact CD1-CE1 4.4Å; K202-Y206 WeakPolarHBondContact O-CB 3.31Å; K202-Y206 PolarHBondContact O-N 2.92Å; R203-Y206 WeakPolarHBondContact O-CB 3.48Å; R203-Y206 PolarHBondContact O-N 3.36Å; H204-Y206 VanDerWaalsContact C-N 3.27Å; H204-Y206 PolarHBondContact O-N 2.96Å; Y206-R208 VanDerWaalsContact C-N 3.3Å; Y206-R208 PolarHBondContact O-N 2.92Å; Y206-K209 PolarHBondContact O-N 3.02Å; Y206-V210 HydrophobicContact CD2-CG2 3.93Å; Y206-V210 HydrophobicContact CE2-CG2 3.57Å; Y206-V210 WeakPolarHBondContact O-CG2 3.41Å; Y206-V210 PolarHBondContact O-N 3.27Å; Y206-F237 HydrophobicContact CD1-CD1 4.4Å; Y206-F237 HydrophobicContact CD1-CE1 4.16Å; Y206-F237 HydrophobicContact CE1-CD1 4.49Å
207	V	91.6	Very high	90.9	Very high	13 Å²	13	69.2 Å²	69.2	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-58.5	-43.4	175.6	175.7	0	0	0	0	110.8	R203 H204 K209 V210 A211 F237 L241 M246	R203-V207 WeakPolarHBondContact O-CG2 3.46Å; R203-V207 PolarHBondContact O-N 2.94Å; H204-V207 PolarHBondContact O-N 3.39Å; V207-K209 PolarHBondContact O-N 3.33Å; V207-V210 PolarHBondContact O-N 2.7Å; V207-A211 PolarHBondContact O-N 3.3Å; V207-F237 HydrophobicContact CG2-CD1 4.39Å; V207-L241 HydrophobicContact CG1-CB 4.44Å; V207-L241 HydrophobicContact CG1-CD1 3.85Å; V207-M246 HydrophobicContact CB-CE 4.36Å; V207-M246 HydrophobicContact CG1-CE 3.98Å
208	R	91.9	Very high	91.3	Very high	106 Å²	106	60 Å²	60	40%	0.4	28%	0.279	S	S	.	.	H	α-helix	trans	-57.3	-50	174.3	-177.7	-179.3	-64.9	169.1	-4.1	112.2	H204 Y206 V210 A211 E212 M246	H204-R208 PolarHBondContact O-N 3.39Å; Y206-R208 VanDerWaalsContact C-N 3.3Å; Y206-R208 PolarHBondContact O-N 2.92Å; R208-V210 VanDerWaalsContact C-N 3.27Å; R208-V210 PolarHBondContact O-N 3.22Å; R208-A211 PolarHBondContact O-N 2.9Å; R208-E212 WeakPolarHBondContact CD-OE1 3.17Å; R208-E212 HydrophobicContact CG-CG 4.4Å; R208-E212 VanDerWaalsContact CG-OE1 3.31Å; R208-E212 WeakPolarHBondContact CG-OE1 3.49Å; R208-E212 WeakPolarHBondContact O-CG 3.18Å; R208-E212 PolarHBondContact O-N 3.26Å; R208-M246 HydrophobicContact CB-SD 3.83Å; R208-M246 HydrophobicContact CG-SD 4.19Å
209	K	93.2	Very high	91.3	Very high	94 Å²	94	57.2 Å²	57.2	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-40.4	179.2	-176.1	178.2	177.8	-177.5	0	111.6	F177 N205 Y206 V207 T213	F177-K209 HydrophobicContact CD2-CD 4.48Å; F177-K209 HydrophobicContact CE1-CG 4.49Å; F177-K209 HydrophobicContact CE2-CD 3.89Å; F177-K209 HydrophobicContact CE2-CG 4.32Å; F177-K209 HydrophobicContact CZ-CD 3.99Å; F177-K209 HydrophobicContact CZ-CG 3.93Å; N205-K209 WeakPolarHBondContact O-CB 3.39Å; N205-K209 PolarHBondContact O-N 3.38Å; Y206-K209 PolarHBondContact O-N 3.02Å; V207-K209 PolarHBondContact O-N 3.33Å; K209-T213 WeakPolarHBondContact O-CB 3.48Å; K209-T213 PolarHBondContact O-N 3.39Å; K209-T213 PolarHBondContact O-OG1 2.82Å
210	V	93.9	Very high	91.3	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-44.6	176.8	173.5	0	0	0	0	111	I154 V156 A161 F163 F177 Y206 V207 R208 T213 A214 L241	I154-V210 HydrophobicContact CG2-CG1 3.91Å; V156-V210 HydrophobicContact CG2-CG1 4.02Å; A161-V210 HydrophobicContact CB-CG2 3.77Å; F163-V210 HydrophobicContact CE1-CG1 4.2Å; F163-V210 HydrophobicContact CZ-CB 4.39Å; F163-V210 HydrophobicContact CZ-CG1 3.84Å; F177-V210 HydrophobicContact CZ-CG2 3.84Å; Y206-V210 HydrophobicContact CD2-CG2 3.93Å; Y206-V210 HydrophobicContact CE2-CG2 3.57Å; Y206-V210 WeakPolarHBondContact O-CG2 3.41Å; Y206-V210 PolarHBondContact O-N 3.27Å; V207-V210 PolarHBondContact O-N 2.7Å; R208-V210 VanDerWaalsContact C-N 3.27Å; R208-V210 PolarHBondContact O-N 3.22Å; V210-T213 PolarHBondContact O-N 3.05Å; V210-A214 WeakPolarHBondContact O-CB 3.24Å; V210-A214 PolarHBondContact O-N 3.16Å; V210-L241 HydrophobicContact CB-CD1 4.29Å; V210-L241 HydrophobicContact CG1-CD1 3.96Å; V210-L241 HydrophobicContact CG1-CD2 3.59Å; V210-L241 HydrophobicContact CG1-CG 4.45Å
211	A	93.3	Very high	91	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-47.4	177.3	0	0	0	0	0	112.5	V207 R208 T213 A214 T215 L241 F247	V207-A211 PolarHBondContact O-N 3.3Å; R208-A211 PolarHBondContact O-N 2.9Å; A211-T213 VanDerWaalsContact C-N 3.33Å; A211-T213 PolarHBondContact O-N 3.28Å; A211-A214 WeakPolarHBondContact O-CB 3.31Å; A211-A214 PolarHBondContact O-N 2.84Å; A211-T215 PolarHBondContact O-N 2.95Å; A211-T215 PolarHBondContact O-OG1 2.87Å; A211-L241 HydrophobicContact CB-CD1 4.1Å; A211-F247 HydrophobicContact CB-CD2 4.03Å
212	E	93.1	Very high	90.7	Very high	108 Å²	108	60.9 Å²	60.9	51%	0.505	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-41.5	177.5	-71.5	171.3	-175.1	0	0	112	R208 A214 T215 Q216	R208-E212 WeakPolarHBondContact CD-OE1 3.17Å; R208-E212 HydrophobicContact CG-CG 4.4Å; R208-E212 VanDerWaalsContact CG-OE1 3.31Å; R208-E212 WeakPolarHBondContact CG-OE1 3.49Å; R208-E212 WeakPolarHBondContact O-CG 3.18Å; R208-E212 PolarHBondContact O-N 3.26Å; E212-A214 VanDerWaalsContact C-N 3.35Å; E212-T215 PolarHBondContact O-N 2.79Å; E212-Q216 WeakPolarHBondContact O-CG 3.48Å; E212-Q216 PolarHBondContact O-N 2.81Å; E212-Q216 VanDerWaalsContact O-N 3.08Å
213	T	94.3	Very high	90.3	Very high	15 Å²	15	64.3 Å²	64.3	9%	0.092	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-38.3	176.8	-52.4	0	0	0	0	111.1	F163 F177 K209 V210 A211 T215 Q216 L217	F163-T213 HydrophobicContact CD2-CG2 4.05Å; F163-T213 HydrophobicContact CE1-CG2 4.2Å; F163-T213 HydrophobicContact CE2-CG2 3.67Å; F163-T213 HydrophobicContact CG-CG2 4.49Å; F163-T213 HydrophobicContact CZ-CG2 3.74Å; F177-T213 HydrophobicContact CE1-CG2 4.3Å; K209-T213 WeakPolarHBondContact O-CB 3.48Å; K209-T213 PolarHBondContact O-N 3.39Å; K209-T213 PolarHBondContact O-OG1 2.82Å; V210-T213 PolarHBondContact O-N 3.05Å; A211-T213 VanDerWaalsContact C-N 3.33Å; A211-T213 PolarHBondContact O-N 3.28Å; T213-T215 VanDerWaalsContact C-N 3.35Å; T213-T215 PolarHBondContact O-N 2.96Å; T213-Q216 PolarHBondContact O-N 3.38Å; T213-L217 HydrophobicContact CG2-CD1 3.82Å; T213-L217 HydrophobicContact CG2-CG 4.38Å; T213-L217 WeakPolarHBondContact O-CG 3.37Å; T213-L217 PolarHBondContact O-N 2.91Å; T213-L217 VanDerWaalsContact O-N 3.09Å
214	A	94	Very high	90.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-45.1	175.2	0	0	0	0	0	111.3	I154 F163 V210 A211 E212 Q216 L217 F218 F247 L251	I154-A214 HydrophobicContact CD1-CB 3.66Å; F163-A214 HydrophobicContact CE1-CB 3.95Å; V210-A214 WeakPolarHBondContact O-CB 3.24Å; V210-A214 PolarHBondContact O-N 3.16Å; A211-A214 WeakPolarHBondContact O-CB 3.31Å; A211-A214 PolarHBondContact O-N 2.84Å; E212-A214 VanDerWaalsContact C-N 3.35Å; A214-Q216 PolarHBondContact O-N 2.9Å; A214-L217 PolarHBondContact O-N 3.18Å; A214-F218 HydrophobicContact CB-CD2 4.25Å; A214-F218 WeakPolarHBondContact O-CB 3.27Å; A214-F218 WeakPolarHBondContact O-CD2 3.32Å; A214-F218 PolarHBondContact O-N 2.66Å; A214-F247 HydrophobicContact CB-CE2 3.91Å; A214-F247 HydrophobicContact CB-CZ 4.47Å; A214-L251 HydrophobicContact CB-CD1 3.97Å
215	T	92.1	Very high	90	Very high	41 Å²	41	61.2 Å²	61.2	25%	0.252	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-45.2	176.3	-57.6	0	0	0	0	111.3	A211 E212 T213 L217 I219	A211-T215 PolarHBondContact O-N 2.95Å; A211-T215 PolarHBondContact O-OG1 2.87Å; E212-T215 PolarHBondContact O-N 2.79Å; T213-T215 VanDerWaalsContact C-N 3.35Å; T213-T215 PolarHBondContact O-N 2.96Å; T215-L217 VanDerWaalsContact C-N 3.3Å; T215-L217 PolarHBondContact O-N 3.43Å; T215-I219 HydrophobicContact CG2-CD1 3.77Å; T215-I219 VanDerWaalsContact O-CB 3.29Å; T215-I219 WeakPolarHBondContact O-CB 3.48Å; T215-I219 PolarHBondContact O-N 3.07Å; T215-I219 VanDerWaalsContact O-N 3.08Å
216	Q	92.5	Very high	89.9	Confident	149 Å²	149	58 Å²	58	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-63.1	-34	179.3	-71.1	173.4	7.7	0	0	113.5	E212 T213 A214	E212-Q216 WeakPolarHBondContact O-CG 3.48Å; E212-Q216 PolarHBondContact O-N 2.81Å; E212-Q216 VanDerWaalsContact O-N 3.08Å; T213-Q216 PolarHBondContact O-N 3.38Å; A214-Q216 PolarHBondContact O-N 2.9Å
217	L	92.3	Very high	89.5	Confident	44 Å²	44	60.2 Å²	60.2	23%	0.23	29%	0.294	C	S	.	.	H	α-helix	trans	-90.6	-38.9	-175.4	-65.8	173.9	0	0	0	113.1	F163 L174 H175 T213 A214 T215 N225	F163-L217 HydrophobicContact CB-CD1 3.5Å; F163-L217 VanDerWaalsContact CB-CD1 3.5Å; F163-L217 HydrophobicContact CD1-CD1 4Å; F163-L217 HydrophobicContact CD2-CD1 4.15Å; F163-L217 HydrophobicContact CG-CD1 3.62Å; L174-L217 HydrophobicContact CB-CD1 4.33Å; L174-L217 HydrophobicContact CB-CD2 4.32Å; L174-L217 HydrophobicContact CD1-CB 4.28Å; H175-L217 HydrophobicContact CB-CD1 3.63Å; H175-L217 HydrophobicContact CB-CD2 4.47Å; T213-L217 HydrophobicContact CG2-CD1 3.82Å; T213-L217 HydrophobicContact CG2-CG 4.38Å; T213-L217 WeakPolarHBondContact O-CG 3.37Å; T213-L217 PolarHBondContact O-N 2.91Å; T213-L217 VanDerWaalsContact O-N 3.09Å; A214-L217 PolarHBondContact O-N 3.18Å; T215-L217 VanDerWaalsContact C-N 3.3Å; T215-L217 PolarHBondContact O-N 3.43Å; L217-N225 PolarHBondContact O-ND2 3.31Å
218	F	93.6	Very high	89.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-100.8	-4.3	-172.6	-61.2	-50.8	0	0	0	114.4	I154 F163 T165 L174 A214 P224 N225 I226 L229 L251	I154-F218 HydrophobicContact CD1-CD2 4.41Å; I154-F218 HydrophobicContact CD1-CE2 3.93Å; I154-F218 HydrophobicContact CG1-CE2 3.64Å; I154-F218 HydrophobicContact CG1-CZ 4.4Å; F163-F218 HydrophobicContact CB-CZ 4.47Å; F163-F218 HydrophobicContact CD1-CE2 4.07Å; T165-F218 HydrophobicContact CG2-CD1 4.44Å; T165-F218 HydrophobicContact CG2-CE1 3.7Å; L174-F218 HydrophobicContact CD1-CD1 4.48Å; L174-F218 HydrophobicContact CD1-CE1 3.94Å; A214-F218 HydrophobicContact CB-CD2 4.25Å; A214-F218 WeakPolarHBondContact O-CB 3.27Å; A214-F218 WeakPolarHBondContact O-CD2 3.32Å; A214-F218 PolarHBondContact O-N 2.66Å; F218-P224 CarbonylContact O-C 3.45Å; F218-P224 WeakPolarHBondContact O-CA 3.5Å; F218-N225 VanDerWaalsContact CA-OD1 3.26Å; F218-N225 WeakPolarHBondContact CA-OD1 3.29Å; F218-N225 PolarHBondContact O-N 2.83Å; F218-N225 PolarHBondContact O-OD1 2.91Å; F218-N225 VanDerWaalsContact O-OD1 3.12Å; F218-I226 HydrophobicContact CB-CD1 3.93Å; F218-I226 HydrophobicContact CB-CG1 4.26Å; F218-I226 HydrophobicContact CD1-CD1 3.93Å; F218-I226 HydrophobicContact CD1-CG1 4.46Å; F218-I226 HydrophobicContact CD1-CG2 3.71Å; F218-I226 HydrophobicContact CD2-CD1 4.3Å; F218-I226 HydrophobicContact CE1-CG2 4.2Å; F218-I226 HydrophobicContact CG-CD1 3.81Å; F218-I226 HydrophobicContact CG-CG1 4.5Å; F218-L229 HydrophobicContact CD2-CD1 4.17Å; F218-L229 HydrophobicContact CE2-CD1 3.91Å; F218-L229 HydrophobicContact CZ-CD1 4.42Å; F218-L251 HydrophobicContact CB-CD1 4.31Å; F218-L251 HydrophobicContact CB-CD2 3.64Å
219	I	89.3	Confident	89.4	Confident	19 Å²	19	54.6 Å²	54.6	10%	0.097	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.5	174.2	-62	166.3	0	0	0	108.8	T215 R223 D248 L251	T215-I219 HydrophobicContact CG2-CD1 3.77Å; T215-I219 VanDerWaalsContact O-CB 3.29Å; T215-I219 WeakPolarHBondContact O-CB 3.48Å; T215-I219 PolarHBondContact O-N 3.07Å; T215-I219 VanDerWaalsContact O-N 3.08Å; I219-R223 WeakPolarHBondContact CA-O 3.42Å; I219-D248 HydrophobicContact CD1-CB 4.07Å; I219-D248 VanDerWaalsContact CD1-CG 3.49Å; I219-D248 WeakPolarHBondContact CD1-OD2 3.38Å; I219-L251 HydrophobicContact CD1-CD1 4.16Å; I219-L251 HydrophobicContact CD1-CD2 4.24Å; I219-L251 HydrophobicContact CD1-CG 3.85Å; I219-L251 HydrophobicContact CG1-CD2 3.99Å; I219-L251 HydrophobicContact CG1-CG 4.15Å
220	T	85.3	Confident	89.5	Confident	74 Å²	74	50.1 Å²	50.1	45%	0.454	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	127.6	177.7	-51.1	0	0	0	0	107.7	D222 R223 N225	T220-D222 VanDerWaalsContact C-N 3.29Å; T220-D222 PolarHBondContact O-N 2.95Å; T220-R223 PolarHBondContact N-O 2.68Å; T220-R223 PolarHBondContact O-N 3.19Å; T220-R223 VanDerWaalsContact O-N 3.1Å; T220-R223 VanDerWaalsContact O-O 3.05Å; T220-N225 PolarHBondContact OG1-ND2 3.01Å; T220-N225 VanDerWaalsContact OG1-ND2 3.07Å
221	N	81.6	Confident	89.5	Confident	154 Å²	154	50.1 Å²	50.1	82%	0.824	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	47.4	-175.3	-59.4	-28.9	0	0	0	113.2	R223	N221-R223 PolarHBondContact O-N 3.36Å
222	D	81.6	Confident	89.6	Confident	122 Å²	122	50 Å²	50	65%	0.652	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	6.8	178.8	-146.1	54.3	0	0	0	115.6	T220 R250	T220-D222 VanDerWaalsContact C-N 3.29Å; T220-D222 PolarHBondContact O-N 2.95Å; D222-R250 VanDerWaalsContact C-NH1 3.28Å; D222-R250 VanDerWaalsContact CA-NH1 3.31Å; D222-R250 PolarHBondContact O-NH1 3.04Å; D222-R250 IonicContact OD1-CZ 3.91Å; D222-R250 IonicContact OD1-NH1 3.63Å; D222-R250 PolarHBondContact OD1-NH1 3.49Å; D222-R250 IonicContact OD1-NH2 2.89Å; D222-R250 IonicContact OD2-NH1 2.7Å
223	R	81.8	Confident	89.5	Confident	169 Å²	169	44.9 Å²	44.9	64%	0.638	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.4	178.2	-66.9	-178.5	178.5	177.7	-1.7	111.3	E9 I219 T220 N221 N225	E9-R223 IonicContact OE2-NH1 2.83Å; I219-R223 WeakPolarHBondContact CA-O 3.42Å; T220-R223 PolarHBondContact N-O 2.68Å; T220-R223 PolarHBondContact O-N 3.19Å; T220-R223 VanDerWaalsContact O-N 3.1Å; T220-R223 VanDerWaalsContact O-O 3.05Å; N221-R223 PolarHBondContact O-N 3.36Å; R223-N225 PolarHBondContact O-N 3.48Å
224	P	86.3	Confident	89	Confident	42 Å²	42	47.3 Å²	47.3	27%	0.273	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	130.1	170.3	-24.2	34.4	0	0	0	111.1	F218 I226 R250 K254	F218-P224 CarbonylContact O-C 3.45Å; F218-P224 WeakPolarHBondContact O-CA 3.5Å; P224-I226 VanDerWaalsContact C-N 3.32Å; P224-R250 HydrophobicContact CG-CB 3.99Å; P224-K254 HydrophobicContact CB-CG 4.33Å; P224-K254 HydrophobicContact CG-CG 4.43Å
225	N	85.8	Confident	88.4	Confident	54 Å²	54	50 Å²	50	29%	0.289	26%	0.261	S	S	.	.	S	Bend	trans	-92.4	7.3	177.5	67.3	20.3	0	0	0	113.2	L217 F218 T220 R223	L217-N225 PolarHBondContact O-ND2 3.31Å; F218-N225 VanDerWaalsContact CA-OD1 3.26Å; F218-N225 WeakPolarHBondContact CA-OD1 3.29Å; F218-N225 PolarHBondContact O-N 2.83Å; F218-N225 PolarHBondContact O-OD1 2.91Å; F218-N225 VanDerWaalsContact O-OD1 3.12Å; T220-N225 PolarHBondContact OG1-ND2 3.01Å; T220-N225 VanDerWaalsContact OG1-ND2 3.07Å; R223-N225 PolarHBondContact O-N 3.48Å
226	I	88.6	Confident	88.1	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.031	28%	0.278	C	S	.	.	S	Bend	trans	-122	145	177.9	55.2	173.6	0	0	0	110.8	K150 T165 F218 P224 L229 L251	K150-I226 HydrophobicContact CG-CG2 4.24Å; K150-I226 CarbonylContact O-C 3.47Å; K150-I226 WeakPolarHBondContact O-CA 3.1Å; K150-I226 VanDerWaalsContact O-CB 3.3Å; K150-I226 WeakPolarHBondContact O-CB 3.26Å; T165-I226 HydrophobicContact CG2-CG2 4.44Å; F218-I226 HydrophobicContact CB-CD1 3.93Å; F218-I226 HydrophobicContact CB-CG1 4.26Å; F218-I226 HydrophobicContact CD1-CD1 3.93Å; F218-I226 HydrophobicContact CD1-CG1 4.46Å; F218-I226 HydrophobicContact CD1-CG2 3.71Å; F218-I226 HydrophobicContact CD2-CD1 4.3Å; F218-I226 HydrophobicContact CE1-CG2 4.2Å; F218-I226 HydrophobicContact CG-CD1 3.81Å; F218-I226 HydrophobicContact CG-CG1 4.5Å; P224-I226 VanDerWaalsContact C-N 3.32Å; I226-L229 HydrophobicContact CD1-CB 3.86Å; I226-L229 HydrophobicContact CD1-CD1 3.81Å; I226-L229 HydrophobicContact CD1-CG 4.37Å; I226-L251 HydrophobicContact CD1-CD2 4.37Å
227	E	83.2	Confident	87.8	Confident	53 Å²	53	47.1 Å²	47.1	25%	0.248	25%	0.249	C	C	.	.	S	Bend	trans	-76.9	-27.9	176.3	-72.5	-171.1	-169.1	0	0	112.3	Q12 S149 K150 F151 K254	Q12-E227 PolarHBondContact NE2-OE1 3.09Å; S149-E227 WeakPolarHBondContact CB-OE2 3.47Å; S149-E227 PolarHBondContact OG-OE1 3.08Å; S149-E227 PolarHBondContact OG-OE2 3.34Å; K150-E227 PolarHBondContact O-N 3.33Å; F151-E227 HydrophobicContact CE1-CB 4.26Å; E227-K254 WeakPolarHBondContact O-CD 3.29Å
228	G	89.1	Confident	87.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	163.9	173.5	0	0	0	0	0	112.8	F151 G152 K254	F151-G228 CarbonylContact C-O 3.57Å; F151-G228 WeakPolarHBondContact CA-O 3.5Å; G152-G228 PolarHBondContact N-O 2.65Å; G228-K254 CarbonylContact C-O 3.52Å; G228-K254 VanDerWaalsContact CA-O 3.27Å; G228-K254 WeakPolarHBondContact CA-O 3.38Å
229	L	92.8	Very high	87.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.8	-172.1	-178	68	0	0	0	110.4	G152 I154 F218 I226 L231 F247 L251 K254 I256	G152-L229 CarbonylContact O-C 3.52Å; G152-L229 WeakPolarHBondContact O-CA 3.32Å; I154-L229 HydrophobicContact CD1-CD1 3.98Å; I154-L229 HydrophobicContact CD1-CD2 4.16Å; I154-L229 HydrophobicContact CG1-CD1 3.95Å; F218-L229 HydrophobicContact CD2-CD1 4.17Å; F218-L229 HydrophobicContact CE2-CD1 3.91Å; F218-L229 HydrophobicContact CZ-CD1 4.42Å; I226-L229 HydrophobicContact CD1-CB 3.86Å; I226-L229 HydrophobicContact CD1-CD1 3.81Å; I226-L229 HydrophobicContact CD1-CG 4.37Å; L229-L231 HydrophobicContact CD2-CD2 4.09Å; L229-L231 HydrophobicContact CG-CD2 4.29Å; L229-F247 HydrophobicContact CD2-CE1 3.79Å; L229-F247 HydrophobicContact CD2-CZ 3.47Å; L229-F247 VanDerWaalsContact CD2-CZ 3.47Å; L229-L251 HydrophobicContact CD2-CB 4.33Å; L229-K254 PolarHBondContact N-O 3.45Å; L229-I256 PolarHBondContact O-N 2.87Å
230	I	94.2	Very high	87.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.4	174.6	-62.1	-174.1	0	0	0	109	G152 F153 I154 K257 V259 A276 L280	G152-I230 PolarHBondContact O-N 3.49Å; F153-I230 WeakPolarHBondContact CA-O 3.49Å; F153-I230 HydrophobicContact CD1-CB 3.88Å; F153-I230 HydrophobicContact CD1-CG2 4Å; F153-I230 HydrophobicContact CE1-CB 3.9Å; F153-I230 HydrophobicContact CE1-CD1 3.86Å; F153-I230 HydrophobicContact CE1-CG1 4.38Å; F153-I230 HydrophobicContact CE1-CG2 3.94Å; F153-I230 HydrophobicContact CG-CB 4.45Å; F153-I230 HydrophobicContact CZ-CB 4.46Å; F153-I230 HydrophobicContact CZ-CD1 3.84Å; I154-I230 PolarHBondContact N-O 3.41Å; I230-K257 WeakPolarHBondContact CA-O 3.49Å; I230-V259 HydrophobicContact CG2-CG2 3.81Å; I230-A276 HydrophobicContact CD1-CB 3.24Å; I230-L280 HydrophobicContact CD1-CD1 4.42Å; I230-L280 HydrophobicContact CD1-CD2 3.58Å; I230-L280 HydrophobicContact CD1-CG 4.03Å; I230-L280 HydrophobicContact CG1-CD2 4.44Å
231	L	94.6	Very high	87.2	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.7	173.1	-60.3	-171.7	0	0	0	108.8	I154 L229 K238 L241 L255 K257 T258 V259	I154-L231 HydrophobicContact CB-CD2 3.79Å; I154-L231 HydrophobicContact CD1-CD2 3.77Å; I154-L231 HydrophobicContact CG1-CD2 4.13Å; L229-L231 HydrophobicContact CD2-CD2 4.09Å; L229-L231 HydrophobicContact CG-CD2 4.29Å; L231-K238 HydrophobicContact CB-CB 4.34Å; L231-K238 WeakPolarHBondContact CD1-O 3.38Å; L231-L241 HydrophobicContact CD1-CD2 4.36Å; L231-L241 HydrophobicContact CD1-CG 4.49Å; L231-L241 HydrophobicContact CD2-CD2 4.04Å; L231-L255 HydrophobicContact CD1-CD1 3.4Å; L231-L255 HydrophobicContact CG-CD1 3.65Å; L231-K257 PolarHBondContact N-O 3.44Å; L231-K257 VanDerWaalsContact N-O 3.15Å; L231-T258 HydrophobicContact CB-CG2 4.08Å; L231-T258 HydrophobicContact CD1-CG2 4.47Å; L231-T258 CarbonylContact O-C 3.54Å; L231-T258 VanDerWaalsContact O-CA 3.23Å; L231-T258 WeakPolarHBondContact O-CA 3.4Å; L231-V259 PolarHBondContact O-N 3.29Å
232	A	94.8	Very high	87.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	146.8	176.5	0	0	0	0	0	109.9	I154 V155 V156 V259 I261 A272	I154-A232 PolarHBondContact O-N 2.9Å; I154-A232 VanDerWaalsContact O-O 3.06Å; V155-A232 CarbonylContact C-O 3.57Å; V155-A232 VanDerWaalsContact CA-O 3.29Å; V155-A232 WeakPolarHBondContact CA-O 3.28Å; V155-A232 HydrophobicContact CG2-CB 4.31Å; V156-A232 PolarHBondContact N-O 2.92Å; A232-V259 VanDerWaalsContact CA-O 3.32Å; A232-V259 WeakPolarHBondContact CA-O 3.08Å; A232-V259 HydrophobicContact CB-CB 4.41Å; A232-I261 HydrophobicContact CB-CD1 4.05Å; A232-I261 HydrophobicContact CB-CG2 4.11Å; A232-A272 HydrophobicContact CB-CB 3.49Å; A232-A272 VanDerWaalsContact CB-CB 3.49Å
233	G	91.4	Very high	87.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.4	162.8	179.4	0	0	0	0	0	115.2	V156 K238 V259	V156-G233 WeakPolarHBondContact O-CA 3.36Å; G233-K238 PolarHBondContact O-NZ 3.25Å; G233-V259 PolarHBondContact N-O 2.99Å
234	I	84.5	Confident	87.6	Confident	66 Å²	66	34.2 Å²	34.2	34%	0.338	19%	0.192	S	C	.	.	S	Bend	trans	-88.1	129.3	177.6	-52.8	176.5	0	0	0	108.3	V156 D157 I261	V156-I234 PolarHBondContact O-N 3.01Å; D157-I234 HydrophobicContact CB-CD1 4.16Å; D157-I234 HydrophobicContact CB-CG1 4.36Å; I234-I261 HydrophobicContact CG1-CG1 4.34Å
235	A	81.4	Confident	87.5	Confident	56 Å²	56	40.2 Å²	40.2	46%	0.463	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	-152.5	-177.8	0	0	0	0	0	113.3	F237 K238	A235-F237 PolarHBondContact O-N 3.35Å; A235-K238 PolarHBondContact O-NZ 3.44Å
236	D	85.2	Confident	87.5	Confident	114 Å²	114	40.5 Å²	40.5	61%	0.61	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.1	-162.4	-49.6	-40.7	0	0	0	114.5	K238 S239 D240	D236-K238 VanDerWaalsContact C-N 3.26Å; D236-K238 PolarHBondContact O-N 2.97Å; D236-K238 VanDerWaalsContact O-N 3.16Å; D236-S239 WeakPolarHBondContact O-CA 3.01Å; D236-S239 WeakPolarHBondContact O-CB 2.99Å; D236-S239 PolarHBondContact O-N 2.96Å; D236-D240 PolarHBondContact O-N 3.39Å
237	F	86	Confident	87.5	Confident	16 Å²	16	40.4 Å²	40.4	7%	0.07	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-35.4	-175.6	-80.2	-64.6	0	0	0	113.9	V156 L181 R203 Y206 V207 A235 S239 L241	V156-F237 HydrophobicContact CG1-CB 3.88Å; V156-F237 HydrophobicContact CG1-CG 4.48Å; L181-F237 HydrophobicContact CD1-CE1 4.25Å; L181-F237 HydrophobicContact CD1-CE2 4.1Å; L181-F237 HydrophobicContact CD1-CZ 3.5Å; R203-F237 HydrophobicContact CB-CE1 4.28Å; R203-F237 HydrophobicContact CG-CE1 3.94Å; R203-F237 HydrophobicContact CG-CZ 3.98Å; Y206-F237 HydrophobicContact CD1-CD1 4.4Å; Y206-F237 HydrophobicContact CD1-CE1 4.16Å; Y206-F237 HydrophobicContact CE1-CD1 4.49Å; V207-F237 HydrophobicContact CG2-CD1 4.39Å; A235-F237 PolarHBondContact O-N 3.35Å; F237-S239 VanDerWaalsContact C-N 3.34Å; F237-L241 WeakPolarHBondContact O-CB 3.37Å; F237-L241 PolarHBondContact O-N 3.41Å
238	K	87.8	Confident	87.8	Confident	5 Å²	5	39.5 Å²	39.5	2%	0.022	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-35.9	175.9	63	178.9	175.2	-68	0	112.2	L231 G233 A235 D236 G242 V259 D260	L231-K238 HydrophobicContact CB-CB 4.34Å; L231-K238 WeakPolarHBondContact CD1-O 3.38Å; G233-K238 PolarHBondContact O-NZ 3.25Å; A235-K238 PolarHBondContact O-NZ 3.44Å; D236-K238 VanDerWaalsContact C-N 3.26Å; D236-K238 PolarHBondContact O-N 2.97Å; D236-K238 VanDerWaalsContact O-N 3.16Å; K238-G242 PolarHBondContact O-N 2.99Å; K238-G242 VanDerWaalsContact O-N 3.09Å; K238-V259 WeakPolarHBondContact CD-O 3.48Å; K238-V259 WeakPolarHBondContact CE-O 3.5Å; K238-D260 WeakPolarHBondContact CE-OD1 3.39Å; K238-D260 IonicContact NZ-OD1 2.76Å; K238-D260 PolarHBondContact NZ-OD1 3.24Å
239	S	86.5	Confident	87.8	Confident	45 Å²	45	47 Å²	47	32%	0.315	25%	0.254	S	S	.	.	H	α-helix	trans	-73.5	-44.7	178.6	-54.6	0	0	0	0	109.9	D236 F237 L241 G242 Q243	D236-S239 WeakPolarHBondContact O-CA 3.01Å; D236-S239 WeakPolarHBondContact O-CB 2.99Å; D236-S239 PolarHBondContact O-N 2.96Å; F237-S239 VanDerWaalsContact C-N 3.34Å; S239-L241 VanDerWaalsContact C-N 3.3Å; S239-L241 PolarHBondContact O-N 2.91Å; S239-G242 PolarHBondContact O-N 2.81Å; S239-Q243 WeakPolarHBondContact O-CB 3.36Å; S239-Q243 WeakPolarHBondContact O-CG 3.32Å; S239-Q243 PolarHBondContact O-N 3.42Å
240	D	86.9	Confident	87.6	Confident	75 Å²	75	50.6 Å²	50.6	40%	0.401	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-44.5	173.9	-68	-14.1	0	0	0	110.9	D236 S244	D236-D240 PolarHBondContact O-N 3.39Å; D240-S244 VanDerWaalsContact O-CB 3.22Å; D240-S244 WeakPolarHBondContact O-CB 3.36Å; D240-S244 PolarHBondContact O-N 3.15Å
241	L	87.5	Confident	87.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-49.3	177.6	-178.5	68.8	0	0	0	111.8	I154 V156 V207 V210 A211 L231 F237 S239 Q243 S244 F247	I154-L241 HydrophobicContact CG2-CD2 4.13Å; V156-L241 HydrophobicContact CG2-CD2 4.06Å; V207-L241 HydrophobicContact CG1-CB 4.44Å; V207-L241 HydrophobicContact CG1-CD1 3.85Å; V210-L241 HydrophobicContact CB-CD1 4.29Å; V210-L241 HydrophobicContact CG1-CD1 3.96Å; V210-L241 HydrophobicContact CG1-CD2 3.59Å; V210-L241 HydrophobicContact CG1-CG 4.45Å; A211-L241 HydrophobicContact CB-CD1 4.1Å; L231-L241 HydrophobicContact CD1-CD2 4.36Å; L231-L241 HydrophobicContact CD1-CG 4.49Å; L231-L241 HydrophobicContact CD2-CD2 4.04Å; F237-L241 WeakPolarHBondContact O-CB 3.37Å; F237-L241 PolarHBondContact O-N 3.41Å; S239-L241 VanDerWaalsContact C-N 3.3Å; S239-L241 PolarHBondContact O-N 2.91Å; L241-Q243 VanDerWaalsContact C-N 3.29Å; L241-Q243 PolarHBondContact O-N 3.37Å; L241-S244 PolarHBondContact O-N 2.88Å; L241-S244 PolarHBondContact O-OG 3.33Å; L241-F247 HydrophobicContact CD1-CD2 3.92Å; L241-F247 HydrophobicContact CD1-CE2 4.37Å; L241-F247 HydrophobicContact CD2-CE2 4.48Å; L241-F247 HydrophobicContact CG-CD2 4.12Å; L241-F247 HydrophobicContact CG-CE2 4.33Å
242	G	85.2	Confident	87.1	Confident	13 Å²	13	54.6 Å²	54.6	13%	0.134	29%	0.286	C	S	.	.	H	α-helix	trans	-68.7	-24.5	-176.9	0	0	0	0	0	114.6	K238 S239 Q252	K238-G242 PolarHBondContact O-N 2.99Å; K238-G242 VanDerWaalsContact O-N 3.09Å; S239-G242 PolarHBondContact O-N 2.81Å; G242-Q252 PolarHBondContact O-NE2 2.84Å
243	Q	85.4	Confident	86.7	Confident	155 Å²	155	58.8 Å²	58.8	72%	0.724	32%	0.321	S	S	*	.	H	α-helix	trans	-96.5	-7.7	175.6	-65.9	179.5	-2	0	0	113.2	S239 L241	S239-Q243 WeakPolarHBondContact O-CB 3.36Å; S239-Q243 WeakPolarHBondContact O-CG 3.32Å; S239-Q243 PolarHBondContact O-N 3.42Å; L241-Q243 VanDerWaalsContact C-N 3.29Å; L241-Q243 PolarHBondContact O-N 3.37Å
244	S	83.3	Confident	86.6	Confident	16 Å²	16	62.8 Å²	62.8	11%	0.112	34%	0.338	C	S	.	.			trans	-72.2	135	-178.1	70.8	0	0	0	0	111.8	D240 L241 M246 F247	D240-S244 VanDerWaalsContact O-CB 3.22Å; D240-S244 WeakPolarHBondContact O-CB 3.36Å; D240-S244 PolarHBondContact O-N 3.15Å; L241-S244 PolarHBondContact O-N 2.88Å; L241-S244 PolarHBondContact O-OG 3.33Å; S244-M246 PolarHBondContact O-N 3.5Å; S244-F247 WeakPolarHBondContact O-CB 3.37Å; S244-F247 PolarHBondContact O-N 2.96Å
245	D	83.8	Confident	86.8	Confident	169 Å²	169	62.3 Å²	62.3	90%	0.904	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.4	171.5	-57	-38.2	0	0	0	113.1	F247	D245-F247 VanDerWaalsContact C-N 3.33Å
246	M	85.2	Confident	87.1	Confident	60 Å²	60	62.3 Å²	62.3	30%	0.296	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.3	176.8	-62.2	-179.1	-70.9	0	0	112.4	H204 V207 R208 S244	H204-M246 WeakPolarHBondContact CE1-CE 3.45Å; V207-M246 HydrophobicContact CB-CE 4.36Å; V207-M246 HydrophobicContact CG1-CE 3.98Å; R208-M246 HydrophobicContact CB-SD 3.83Å; R208-M246 HydrophobicContact CG-SD 4.19Å; S244-M246 PolarHBondContact O-N 3.5Å
247	F	88.6	Confident	87.3	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.018	32%	0.315	C	S	.	.	S	Bend	trans	-77.4	133	178.2	-157.6	-115.2	0	0	0	110	I154 A211 A214 L229 L241 S244 D245 Q249 L251 Q252	I154-F247 HydrophobicContact CD1-CE2 4.19Å; I154-F247 HydrophobicContact CD1-CZ 4.19Å; A211-F247 HydrophobicContact CB-CD2 4.03Å; A214-F247 HydrophobicContact CB-CE2 3.91Å; A214-F247 HydrophobicContact CB-CZ 4.47Å; L229-F247 HydrophobicContact CD2-CE1 3.79Å; L229-F247 HydrophobicContact CD2-CZ 3.47Å; L229-F247 VanDerWaalsContact CD2-CZ 3.47Å; L241-F247 HydrophobicContact CD1-CD2 3.92Å; L241-F247 HydrophobicContact CD1-CE2 4.37Å; L241-F247 HydrophobicContact CD2-CE2 4.48Å; L241-F247 HydrophobicContact CG-CD2 4.12Å; L241-F247 HydrophobicContact CG-CE2 4.33Å; S244-F247 WeakPolarHBondContact O-CB 3.37Å; S244-F247 PolarHBondContact O-N 2.96Å; D245-F247 VanDerWaalsContact C-N 3.33Å; F247-Q249 PolarHBondContact O-N 2.99Å; F247-L251 HydrophobicContact CD1-CB 4.3Å; F247-L251 HydrophobicContact CE1-CB 3.51Å; F247-L251 HydrophobicContact CE2-CD1 4.47Å; F247-L251 HydrophobicContact CZ-CB 3.73Å; F247-L251 HydrophobicContact CZ-CD1 4.08Å; F247-Q252 HydrophobicContact CD1-CB 4.13Å
248	D	89.9	Confident	87.6	Confident	33 Å²	33	63 Å²	63	18%	0.176	33%	0.331	C	S	.	.			trans	-61	126.2	-177.6	-171	-63.6	0	0	0	110.2	I219 R250 L251 Q252	I219-D248 HydrophobicContact CD1-CB 4.07Å; I219-D248 VanDerWaalsContact CD1-CG 3.49Å; I219-D248 WeakPolarHBondContact CD1-OD2 3.38Å; D248-R250 PolarHBondContact O-N 3.47Å; D248-R250 VanDerWaalsContact O-N 3.1Å; D248-R250 VanDerWaalsContact OD1-CB 3.24Å; D248-R250 WeakPolarHBondContact OD1-CB 3.26Å; D248-R250 WeakPolarHBondContact OD1-CG 3.5Å; D248-R250 IonicContact OD1-CZ 3.67Å; D248-R250 PolarHBondContact OD1-N 2.94Å; D248-R250 IonicContact OD1-NE 2.8Å; D248-R250 PolarHBondContact OD1-NE 3.07Å; D248-R250 IonicContact OD1-NH2 3.35Å; D248-R250 IonicContact OD2-CZ 2.61Å; D248-R250 IonicContact OD2-NE 3.87Å; D248-R250 PolarHBondContact OD2-NE 3.2Å; D248-R250 IonicContact OD2-NH2 2.66Å; D248-R250 PolarHBondContact OD2-NH2 3.39Å; D248-L251 HydrophobicContact CB-CD1 4.36Å; D248-L251 HydrophobicContact CB-CG 4.33Å; D248-L251 WeakPolarHBondContact O-CB 3.21Å; D248-L251 PolarHBondContact O-N 3.27Å; D248-Q252 PolarHBondContact O-N 3Å
249	Q	89.1	Confident	87.8	Confident	159 Å²	159	63.1 Å²	63.1	74%	0.743	33%	0.332	S	S	*	.	H	α-helix	trans	-57.3	-30	-175.5	-67.2	-177.3	0.7	0	0	112.7	F247 Q252 A253	F247-Q249 PolarHBondContact O-N 2.99Å; Q249-Q252 WeakPolarHBondContact O-CB 3.5Å; Q249-Q252 PolarHBondContact O-N 3.15Å; Q249-A253 PolarHBondContact O-N 3.09Å
250	R	88.8	Confident	88.1	Confident	75 Å²	75	66.6 Å²	66.6	28%	0.283	35%	0.347	S	S	.	.	H	α-helix	trans	-70.3	-35.2	177.8	-59.7	169.5	-70.4	-168.7	-12.9	111.7	D222 P224 D248 K254	D222-R250 VanDerWaalsContact C-NH1 3.28Å; D222-R250 VanDerWaalsContact CA-NH1 3.31Å; D222-R250 PolarHBondContact O-NH1 3.04Å; D222-R250 IonicContact OD1-CZ 3.91Å; D222-R250 IonicContact OD1-NH1 3.63Å; D222-R250 PolarHBondContact OD1-NH1 3.49Å; D222-R250 IonicContact OD1-NH2 2.89Å; D222-R250 IonicContact OD2-NH1 2.7Å; P224-R250 HydrophobicContact CG-CB 3.99Å; D248-R250 PolarHBondContact O-N 3.47Å; D248-R250 VanDerWaalsContact O-N 3.1Å; D248-R250 VanDerWaalsContact OD1-CB 3.24Å; D248-R250 WeakPolarHBondContact OD1-CB 3.26Å; D248-R250 WeakPolarHBondContact OD1-CG 3.5Å; D248-R250 IonicContact OD1-CZ 3.67Å; D248-R250 PolarHBondContact OD1-N 2.94Å; D248-R250 IonicContact OD1-NE 2.8Å; D248-R250 PolarHBondContact OD1-NE 3.07Å; D248-R250 IonicContact OD1-NH2 3.35Å; D248-R250 IonicContact OD2-CZ 2.61Å; D248-R250 IonicContact OD2-NE 3.87Å; D248-R250 PolarHBondContact OD2-NE 3.2Å; D248-R250 IonicContact OD2-NH2 2.66Å; D248-R250 PolarHBondContact OD2-NH2 3.39Å; R250-K254 WeakPolarHBondContact O-CG 3.26Å
251	L	89.8	Confident	88.4	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-74.9	-35.9	173.2	-65	-178.9	0	0	0	111	A214 F218 I219 I226 L229 F247 D248 A253 K254 L255	A214-L251 HydrophobicContact CB-CD1 3.97Å; F218-L251 HydrophobicContact CB-CD1 4.31Å; F218-L251 HydrophobicContact CB-CD2 3.64Å; I219-L251 HydrophobicContact CD1-CD1 4.16Å; I219-L251 HydrophobicContact CD1-CD2 4.24Å; I219-L251 HydrophobicContact CD1-CG 3.85Å; I219-L251 HydrophobicContact CG1-CD2 3.99Å; I219-L251 HydrophobicContact CG1-CG 4.15Å; I226-L251 HydrophobicContact CD1-CD2 4.37Å; L229-L251 HydrophobicContact CD2-CB 4.33Å; F247-L251 HydrophobicContact CD1-CB 4.3Å; F247-L251 HydrophobicContact CE1-CB 3.51Å; F247-L251 HydrophobicContact CE2-CD1 4.47Å; F247-L251 HydrophobicContact CZ-CB 3.73Å; F247-L251 HydrophobicContact CZ-CD1 4.08Å; D248-L251 HydrophobicContact CB-CD1 4.36Å; D248-L251 HydrophobicContact CB-CG 4.33Å; D248-L251 WeakPolarHBondContact O-CB 3.21Å; D248-L251 PolarHBondContact O-N 3.27Å; L251-A253 VanDerWaalsContact C-N 3.31Å; L251-A253 PolarHBondContact O-N 3.06Å; L251-K254 CarbonylContact O-C 3.54Å; L251-K254 WeakPolarHBondContact O-CA 3.43Å; L251-K254 PolarHBondContact O-N 3.39Å; L251-L255 PolarHBondContact O-N 3.46Å; L251-L255 VanDerWaalsContact O-N 3.15Å
252	Q	88.2	Confident	88.5	Confident	85 Å²	85	67.2 Å²	67.2	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-60.6	-41.5	175	-159.7	176.7	14.1	0	0	111.5	G242 F247 D248 Q249 K254 L255	G242-Q252 PolarHBondContact O-NE2 2.84Å; F247-Q252 HydrophobicContact CD1-CB 4.13Å; D248-Q252 PolarHBondContact O-N 3Å; Q249-Q252 WeakPolarHBondContact O-CB 3.5Å; Q249-Q252 PolarHBondContact O-N 3.15Å; Q252-K254 PolarHBondContact O-N 3.19Å; Q252-L255 VanDerWaalsContact O-CB 3.25Å; Q252-L255 WeakPolarHBondContact O-CB 3.37Å; Q252-L255 PolarHBondContact O-N 2.83Å; Q252-L255 VanDerWaalsContact O-N 3.11Å
253	A	87	Confident	88.6	Confident	88 Å²	88	73.8 Å²	73.8	73%	0.727	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-19.2	174.1	0	0	0	0	0	113.9	Q249 L251	Q249-A253 PolarHBondContact O-N 3.09Å; L251-A253 VanDerWaalsContact C-N 3.31Å; L251-A253 PolarHBondContact O-N 3.06Å
254	K	88.4	Confident	88.6	Confident	84 Å²	84	67.1 Å²	67.1	37%	0.365	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-1.6	176.6	-65.9	-67	-175	176.1	0	112.9	P224 E227 G228 L229 R250 L251 Q252 I256	P224-K254 HydrophobicContact CB-CG 4.33Å; P224-K254 HydrophobicContact CG-CG 4.43Å; E227-K254 WeakPolarHBondContact O-CD 3.29Å; G228-K254 CarbonylContact C-O 3.52Å; G228-K254 VanDerWaalsContact CA-O 3.27Å; G228-K254 WeakPolarHBondContact CA-O 3.38Å; L229-K254 PolarHBondContact N-O 3.45Å; R250-K254 WeakPolarHBondContact O-CG 3.26Å; L251-K254 CarbonylContact O-C 3.54Å; L251-K254 WeakPolarHBondContact O-CA 3.43Å; L251-K254 PolarHBondContact O-N 3.39Å; Q252-K254 PolarHBondContact O-N 3.19Å; K254-I256 PolarHBondContact O-N 3.15Å
255	L	89.4	Confident	88.8	Confident	55 Å²	55	67.8 Å²	67.8	29%	0.288	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	113.9	179.7	-170.3	143.2	0	0	0	110.1	L231 L251 Q252	L231-L255 HydrophobicContact CD1-CD1 3.4Å; L231-L255 HydrophobicContact CG-CD1 3.65Å; L251-L255 PolarHBondContact O-N 3.46Å; L251-L255 VanDerWaalsContact O-N 3.15Å; Q252-L255 VanDerWaalsContact O-CB 3.25Å; Q252-L255 WeakPolarHBondContact O-CB 3.37Å; Q252-L255 PolarHBondContact O-N 2.83Å; Q252-L255 VanDerWaalsContact O-N 3.11Å
256	I	88	Confident	89.2	Confident	56 Å²	56	63.6 Å²	63.6	29%	0.287	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-49.4	-178.5	-60.6	169.2	0	0	0	110.1	F151 L229 K254 T279 L280 V283	F151-I256 HydrophobicContact CD1-CD1 3.88Å; F151-I256 HydrophobicContact CE1-CD1 3.82Å; L229-I256 PolarHBondContact O-N 2.87Å; K254-I256 PolarHBondContact O-N 3.15Å; I256-T279 HydrophobicContact CG2-CG2 3.44Å; I256-T279 VanDerWaalsContact CG2-CG2 3.44Å; I256-L280 HydrophobicContact CD1-CD2 4.18Å; I256-V283 HydrophobicContact CD1-CG2 3.6Å; I256-V283 HydrophobicContact CG1-CG2 4.46Å
257	K	88.5	Confident	89.5	Confident	80 Å²	80	65.1 Å²	65.1	35%	0.348	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.9	-170.1	-170.8	172.4	-179.5	-174	0	111.6	I230 L231 V259 T279	I230-K257 WeakPolarHBondContact CA-O 3.49Å; L231-K257 PolarHBondContact N-O 3.44Å; L231-K257 VanDerWaalsContact N-O 3.15Å; K257-V259 HydrophobicContact CD-CG2 4.31Å; K257-V259 HydrophobicContact CG-CG2 4.16Å; K257-T279 HydrophobicContact CB-CG2 4.25Å; K257-T279 HydrophobicContact CD-CG2 3.95Å; K257-T279 VanDerWaalsContact CD-OG1 3.3Å; K257-T279 WeakPolarHBondContact CD-OG1 3.37Å; K257-T279 PolarHBondContact NZ-OG1 3Å; K257-T279 VanDerWaalsContact NZ-OG1 3.17Å
258	T	91.5	Very high	89.6	Confident	65 Å²	65	64.9 Å²	64.9	40%	0.399	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.7	165.5	49.1	0	0	0	0	109.2	L231	L231-T258 HydrophobicContact CB-CG2 4.08Å; L231-T258 HydrophobicContact CD1-CG2 4.47Å; L231-T258 CarbonylContact O-C 3.54Å; L231-T258 VanDerWaalsContact O-CA 3.23Å; L231-T258 WeakPolarHBondContact O-CA 3.4Å
259	V	92.4	Very high	89.7	Confident	8 Å²	8	63.3 Å²	63.3	5%	0.048	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.7	-175.2	-176.5	0	0	0	0	110.5	I230 L231 A232 G233 K238 K257 I261 L275	I230-V259 HydrophobicContact CG2-CG2 3.81Å; L231-V259 PolarHBondContact O-N 3.29Å; A232-V259 VanDerWaalsContact CA-O 3.32Å; A232-V259 WeakPolarHBondContact CA-O 3.08Å; A232-V259 HydrophobicContact CB-CB 4.41Å; G233-V259 PolarHBondContact N-O 2.99Å; K238-V259 WeakPolarHBondContact CD-O 3.48Å; K238-V259 WeakPolarHBondContact CE-O 3.5Å; K257-V259 HydrophobicContact CD-CG2 4.31Å; K257-V259 HydrophobicContact CG-CG2 4.16Å; V259-I261 HydrophobicContact CG1-CG2 4.19Å; V259-L275 HydrophobicContact CG1-CB 3.63Å; V259-L275 HydrophobicContact CG1-CD1 3.41Å; V259-L275 VanDerWaalsContact CG1-CD1 3.41Å; V259-L275 HydrophobicContact CG1-CG 4.16Å
260	D	93	Very high	89.8	Confident	117 Å²	117	58.7 Å²	58.7	63%	0.626	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	124.2	169.3	-74.3	-71.8	0	0	0	110.4	K238	K238-D260 WeakPolarHBondContact CE-OD1 3.39Å; K238-D260 IonicContact NZ-OD1 2.76Å; K238-D260 PolarHBondContact NZ-OD1 3.24Å
261	I	92.9	Very high	89.9	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.056	32%	0.316	C	S	.	.			trans	-122.1	159.3	177.4	61.5	179.2	0	0	0	110.5	V155 A232 I234 V259 Y263 Q271 A272 L275	V155-I261 HydrophobicContact CG1-CD1 3.57Å; A232-I261 HydrophobicContact CB-CD1 4.05Å; A232-I261 HydrophobicContact CB-CG2 4.11Å; I234-I261 HydrophobicContact CG1-CG1 4.34Å; V259-I261 HydrophobicContact CG1-CG2 4.19Å; I261-Y263 WeakPolarHBondContact CD1-O 3.32Å; I261-Y263 WeakPolarHBondContact CG1-O 3.43Å; I261-Q271 HydrophobicContact CG2-CB 4.4Å; I261-Q271 HydrophobicContact CG2-CG 4.31Å; I261-A272 HydrophobicContact CG2-CB 4.1Å; I261-L275 HydrophobicContact CG2-CD1 4.42Å
262	S	89.5	Confident	90	Very high	79 Å²	79	57.3 Å²	57.3	55%	0.552	32%	0.316	S	S	*	.	S	Bend	trans	-94.7	-25.4	-177	-48.9	0	0	0	0	112.9	Q271	S262-Q271 PolarHBondContact OG-NE2 2.89Å
263	Y	88.1	Confident	90	Very high	150 Å²	150	54.4 Å²	54.4	59%	0.588	30%	0.303	S	S	*	.	S	Bend	trans	-123.3	151.5	-176.1	-54.1	-77.1	0	0	0	110.7	I261 G268	I261-Y263 WeakPolarHBondContact CD1-O 3.32Å; I261-Y263 WeakPolarHBondContact CG1-O 3.43Å; Y263-G268 WeakPolarHBondContact O-CA 3.2Å
264	G	84.7	Confident	90	Very high	15 Å²	15	57 Å²	57	16%	0.155	30%	0.3	C	S	.	.			trans	-90.1	-177.2	171.9	0	0	0	0	0	113.4	D157 T267 G268	D157-G264 VanDerWaalsContact OD2-CA 3.26Å; D157-G264 WeakPolarHBondContact OD2-CA 3.44Å; G264-T267 PolarHBondContact O-OG1 3.39Å; G264-G268 PolarHBondContact O-N 3.4Å; G264-G268 VanDerWaalsContact O-N 3.08Å
265	G	88.8	Confident	90	Very high	31 Å²	31	56.8 Å²	56.8	32%	0.32	30%	0.302	S	S	.	.	H	α-helix	trans	58.9	-144.4	173.8	0	0	0	0	0	114.1	T267 G268 F269	G265-T267 PolarHBondContact O-N 3.41Å; G265-G268 PolarHBondContact O-N 2.96Å; G265-F269 PolarHBondContact O-N 3.24Å
266	E	91	Very high	89.9	Confident	80 Å²	80	54.1 Å²	54.1	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-69.5	-32.3	-174.7	-68.3	-179.9	-149.6	0	0	113.2	L162 K176 F269 N270	L162-E266 HydrophobicContact CD1-CB 4.45Å; L162-E266 HydrophobicContact CD1-CG 3.6Å; K176-E266 IonicContact NZ-OE1 2.72Å; K176-E266 PolarHBondContact NZ-OE1 2.8Å; E266-F269 WeakPolarHBondContact O-CB 3.49Å; E266-F269 PolarHBondContact O-N 3.45Å; E266-N270 PolarHBondContact O-N 2.98Å; E266-N270 VanDerWaalsContact O-N 3.13Å
267	T	91.3	Very high	89.5	Confident	92 Å²	92	55.1 Å²	55.1	56%	0.564	30%	0.297	S	S	*	.	H	α-helix	trans	-66.1	-42.4	173.4	42.3	0	0	0	0	111.3	G264 G265 F269 N270 Q271	G264-T267 PolarHBondContact O-OG1 3.39Å; G265-T267 PolarHBondContact O-N 3.41Å; T267-F269 VanDerWaalsContact C-N 3.3Å; T267-F269 PolarHBondContact O-N 3.23Å; T267-N270 PolarHBondContact O-N 2.95Å; T267-Q271 PolarHBondContact O-N 2.91Å
268	G	91.2	Very high	89	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-36.7	173.5	0	0	0	0	0	112.9	Y263 G264 G265 Q271 A272	Y263-G268 WeakPolarHBondContact O-CA 3.2Å; G264-G268 PolarHBondContact O-N 3.4Å; G264-G268 VanDerWaalsContact O-N 3.08Å; G265-G268 PolarHBondContact O-N 2.96Å; G268-Q271 PolarHBondContact O-N 3.44Å; G268-A272 WeakPolarHBondContact O-CB 3.26Å; G268-A272 PolarHBondContact O-N 2.92Å
269	F	93.1	Very high	88.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-44.6	175.9	-177.8	-148.2	0	0	0	112.3	F153 V155 L162 R171 V173 G265 E266 T267 A272 I273	F153-F269 HydrophobicContact CB-CD2 3.87Å; F153-F269 HydrophobicContact CB-CE2 3.46Å; F153-F269 VanDerWaalsContact CB-CE2 3.46Å; F153-F269 HydrophobicContact CB-CZ 4.48Å; F153-F269 HydrophobicContact CD1-CD2 4.38Å; F153-F269 HydrophobicContact CD1-CE2 4.17Å; F153-F269 AromaticContact CD2-CE2 3.87Å; F153-F269 HydrophobicContact CD2-CE2 3.87Å; F153-F269 HydrophobicContact CG-CD2 4.14Å; F153-F269 AromaticContact CG-CE2 3.58Å; F153-F269 HydrophobicContact CG-CE2 3.58Å; V155-F269 HydrophobicContact CG2-CB 3.93Å; V155-F269 HydrophobicContact CG2-CD2 4.24Å; V155-F269 HydrophobicContact CG2-CG 4.45Å; L162-F269 HydrophobicContact CD2-CB 4.05Å; L162-F269 HydrophobicContact CD2-CD1 3.89Å; L162-F269 HydrophobicContact CD2-CD2 4.49Å; L162-F269 HydrophobicContact CD2-CE1 4.48Å; L162-F269 HydrophobicContact CD2-CG 3.89Å; R171-F269 HydrophobicContact CB-CE1 4.2Å; R171-F269 HydrophobicContact CB-CZ 4.33Å; V173-F269 HydrophobicContact CG2-CD1 4.08Å; V173-F269 HydrophobicContact CG2-CE1 4.04Å; G265-F269 PolarHBondContact O-N 3.24Å; E266-F269 WeakPolarHBondContact O-CB 3.49Å; E266-F269 PolarHBondContact O-N 3.45Å; T267-F269 VanDerWaalsContact C-N 3.3Å; T267-F269 PolarHBondContact O-N 3.23Å; F269-A272 WeakPolarHBondContact O-CB 3.35Å; F269-A272 PolarHBondContact O-N 3Å; F269-I273 HydrophobicContact CD1-CD1 4.49Å; F269-I273 HydrophobicContact CD2-CD1 3.96Å; F269-I273 HydrophobicContact CD2-CG1 4.11Å; F269-I273 HydrophobicContact CE1-CD1 4.21Å; F269-I273 HydrophobicContact CE2-CD1 3.6Å; F269-I273 HydrophobicContact CE2-CG1 3.81Å; F269-I273 HydrophobicContact CG-CD1 4.38Å; F269-I273 HydrophobicContact CZ-CD1 3.76Å; F269-I273 HydrophobicContact CZ-CG1 4.43Å; F269-I273 WeakPolarHBondContact O-CG1 3.46Å; F269-I273 PolarHBondContact O-N 3.2Å
270	N	89.6	Confident	87.6	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-43.1	176.7	-66	-18.9	0	0	0	111.8	R171 E266 T267 A272 I273 E274	R171-N270 PolarHBondContact NH1-OD1 3.12Å; E266-N270 PolarHBondContact O-N 2.98Å; E266-N270 VanDerWaalsContact O-N 3.13Å; T267-N270 PolarHBondContact O-N 2.95Å; N270-A272 VanDerWaalsContact C-N 3.3Å; N270-A272 PolarHBondContact O-N 3.45Å; N270-I273 WeakPolarHBondContact O-CB 3.49Å; N270-I273 PolarHBondContact O-N 3.36Å; N270-E274 PolarHBondContact O-N 3.36Å
271	Q	91.6	Very high	86.5	Confident	46 Å²	46	54.2 Å²	54.2	22%	0.215	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-40.1	175.3	-170.6	-179.8	17.6	0	0	111.7	I261 S262 T267 G268 E274 L275	I261-Q271 HydrophobicContact CG2-CB 4.4Å; I261-Q271 HydrophobicContact CG2-CG 4.31Å; S262-Q271 PolarHBondContact OG-NE2 2.89Å; T267-Q271 PolarHBondContact O-N 2.91Å; G268-Q271 PolarHBondContact O-N 3.44Å; Q271-E274 PolarHBondContact O-N 2.65Å; Q271-L275 HydrophobicContact CG-CD1 4.1Å; Q271-L275 WeakPolarHBondContact O-CG 3.47Å; Q271-L275 PolarHBondContact O-N 3.02Å; Q271-L275 VanDerWaalsContact O-N 3.08Å
272	A	91.9	Very high	85.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-40.5	176.3	0	0	0	0	0	112	F153 A232 I261 G268 F269 N270 A276	F153-A272 HydrophobicContact CD1-CB 4.07Å; F153-A272 HydrophobicContact CE1-CB 4.28Å; A232-A272 HydrophobicContact CB-CB 3.49Å; A232-A272 VanDerWaalsContact CB-CB 3.49Å; I261-A272 HydrophobicContact CG2-CB 4.1Å; G268-A272 WeakPolarHBondContact O-CB 3.26Å; G268-A272 PolarHBondContact O-N 2.92Å; F269-A272 WeakPolarHBondContact O-CB 3.35Å; F269-A272 PolarHBondContact O-N 3Å; N270-A272 VanDerWaalsContact C-N 3.3Å; N270-A272 PolarHBondContact O-N 3.45Å; A272-A276 WeakPolarHBondContact O-CB 3.47Å; A272-A276 PolarHBondContact O-N 3.25Å
273	I	87.2	Confident	84.4	Confident	24 Å²	24	51.6 Å²	51.6	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-50.2	175.2	-70.3	164.3	0	0	0	110.1	F153 L166 R171 F269 N270 L275 A276 T277	F153-I273 HydrophobicContact CE1-CG1 4.13Å; F153-I273 HydrophobicContact CE2-CG1 4.34Å; F153-I273 HydrophobicContact CZ-CG1 4.01Å; L166-I273 HydrophobicContact CD1-CD1 4.33Å; L166-I273 HydrophobicContact CD1-CG2 4.37Å; L166-I273 HydrophobicContact CD2-CG1 4.46Å; L166-I273 HydrophobicContact CD2-CG2 3.9Å; R171-I273 HydrophobicContact CB-CD1 4.09Å; F269-I273 HydrophobicContact CD1-CD1 4.49Å; F269-I273 HydrophobicContact CD2-CD1 3.96Å; F269-I273 HydrophobicContact CD2-CG1 4.11Å; F269-I273 HydrophobicContact CE1-CD1 4.21Å; F269-I273 HydrophobicContact CE2-CD1 3.6Å; F269-I273 HydrophobicContact CE2-CG1 3.81Å; F269-I273 HydrophobicContact CG-CD1 4.38Å; F269-I273 HydrophobicContact CZ-CD1 3.76Å; F269-I273 HydrophobicContact CZ-CG1 4.43Å; F269-I273 WeakPolarHBondContact O-CG1 3.46Å; F269-I273 PolarHBondContact O-N 3.2Å; N270-I273 WeakPolarHBondContact O-CB 3.49Å; N270-I273 PolarHBondContact O-N 3.36Å; I273-L275 PolarHBondContact O-N 3.07Å; I273-A276 WeakPolarHBondContact O-CB 3.47Å; I273-A276 PolarHBondContact O-N 2.86Å; I273-A276 VanDerWaalsContact O-N 3.1Å; I273-T277 PolarHBondContact O-N 2.88Å; I273-T277 PolarHBondContact O-OG1 2.84Å
274	E	87.5	Confident	83.4	Confident	142 Å²	142	47.6 Å²	47.6	66%	0.664	27%	0.271	S	S	*	.	H	α-helix	trans	-57	-49.1	-179.9	-73.4	177.1	-177.6	0	0	111.6	N270 Q271 A276 T277	N270-E274 PolarHBondContact O-N 3.36Å; Q271-E274 PolarHBondContact O-N 2.65Å; E274-A276 PolarHBondContact O-N 2.8Å; E274-T277 WeakPolarHBondContact O-CB 3.43Å; E274-T277 PolarHBondContact O-N 2.95Å; E274-T277 PolarHBondContact O-OG1 3.4Å
275	L	89.3	Confident	82.7	Confident	79 Å²	79	50.8 Å²	50.8	41%	0.414	28%	0.281	S	S	.	.	H	α-helix	trans	-68.4	-20.1	179.1	-68.2	172.5	0	0	0	114.1	V259 I261 Q271 I273	V259-L275 HydrophobicContact CG1-CB 3.63Å; V259-L275 HydrophobicContact CG1-CD1 3.41Å; V259-L275 VanDerWaalsContact CG1-CD1 3.41Å; V259-L275 HydrophobicContact CG1-CG 4.16Å; I261-L275 HydrophobicContact CG2-CD1 4.42Å; Q271-L275 HydrophobicContact CG-CD1 4.1Å; Q271-L275 WeakPolarHBondContact O-CG 3.47Å; Q271-L275 PolarHBondContact O-N 3.02Å; Q271-L275 VanDerWaalsContact O-N 3.08Å; I273-L275 PolarHBondContact O-N 3.07Å
276	A	86.5	Confident	81.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-89.3	-22	179.2	0	0	0	0	0	113.7	F153 I230 A272 I273 E274 D278 T279 L280	F153-A276 HydrophobicContact CE1-CB 3.78Å; F153-A276 HydrophobicContact CZ-CB 3.86Å; I230-A276 HydrophobicContact CD1-CB 3.24Å; A272-A276 WeakPolarHBondContact O-CB 3.47Å; A272-A276 PolarHBondContact O-N 3.25Å; I273-A276 WeakPolarHBondContact O-CB 3.47Å; I273-A276 PolarHBondContact O-N 2.86Å; I273-A276 VanDerWaalsContact O-N 3.1Å; E274-A276 PolarHBondContact O-N 2.8Å; A276-D278 VanDerWaalsContact C-N 3.28Å; A276-D278 PolarHBondContact O-N 3.48Å; A276-D278 VanDerWaalsContact O-N 3.15Å; A276-T279 WeakPolarHBondContact O-CA 3.49Å; A276-T279 WeakPolarHBondContact O-CB 3.44Å; A276-T279 PolarHBondContact O-N 2.92Å; A276-L280 HydrophobicContact CB-CD1 4.13Å; A276-L280 HydrophobicContact CB-CG 4.19Å; A276-L280 WeakPolarHBondContact O-CG 3.39Å; A276-L280 PolarHBondContact O-N 3.3Å
277	T	79.8	Confident	81.1	Confident	76 Å²	76	53.4 Å²	53.4	47%	0.466	29%	0.286	S	S	.	.	H	α-helix	trans	-47.5	-47.7	-172.2	-49.3	0	0	0	0	113.2	I273 E274 T279 L280 S281	I273-T277 PolarHBondContact O-N 2.88Å; I273-T277 PolarHBondContact O-OG1 2.84Å; E274-T277 WeakPolarHBondContact O-CB 3.43Å; E274-T277 PolarHBondContact O-N 2.95Å; E274-T277 PolarHBondContact O-OG1 3.4Å; T277-T279 VanDerWaalsContact C-N 3.29Å; T277-T279 PolarHBondContact O-N 3.42Å; T277-L280 PolarHBondContact O-N 2.9Å; T277-S281 PolarHBondContact O-N 3.03Å; T277-S281 VanDerWaalsContact O-N 3.08Å; T277-S281 PolarHBondContact O-OG 3.44Å; T277-S281 VanDerWaalsContact O-OG 3.13Å
278	D	78.5	Confident	80.5	Confident	135 Å²	135	50.1 Å²	50.1	72%	0.722	27%	0.265	S	S	*	.	H	α-helix	trans	-65.5	-33.6	-179.9	-61.4	-22.1	0	0	0	112.4	A276 S281 G282	A276-D278 VanDerWaalsContact C-N 3.28Å; A276-D278 PolarHBondContact O-N 3.48Å; A276-D278 VanDerWaalsContact O-N 3.15Å; D278-S281 PolarHBondContact O-OG 3.13Å; D278-G282 PolarHBondContact O-N 2.93Å
279	T	79.8	Confident	79.9	Confident	35 Å²	35	54.7 Å²	54.7	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-78.6	-38.2	-179.4	-45.9	0	0	0	0	111.2	I256 K257 A276 T277 G282 V283	I256-T279 HydrophobicContact CG2-CG2 3.44Å; I256-T279 VanDerWaalsContact CG2-CG2 3.44Å; K257-T279 HydrophobicContact CB-CG2 4.25Å; K257-T279 HydrophobicContact CD-CG2 3.95Å; K257-T279 VanDerWaalsContact CD-OG1 3.3Å; K257-T279 WeakPolarHBondContact CD-OG1 3.37Å; K257-T279 PolarHBondContact NZ-OG1 3Å; K257-T279 VanDerWaalsContact NZ-OG1 3.17Å; A276-T279 WeakPolarHBondContact O-CA 3.49Å; A276-T279 WeakPolarHBondContact O-CB 3.44Å; A276-T279 PolarHBondContact O-N 2.92Å; T277-T279 VanDerWaalsContact C-N 3.29Å; T277-T279 PolarHBondContact O-N 3.42Å; T279-G282 PolarHBondContact O-N 3.43Å; T279-V283 PolarHBondContact O-N 3.02Å
280	L	75.3	Confident	79.5	Confident	15 Å²	15	61.8 Å²	61.8	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-66.7	-42.4	179	-65.9	-178.7	0	0	0	112.1	F151 F153 L166 I230 I256 A276 T277 G282 V283	F151-L280 HydrophobicContact CB-CD1 4.39Å; F151-L280 HydrophobicContact CB-CD2 3.94Å; F151-L280 HydrophobicContact CD1-CD2 3.41Å; F151-L280 VanDerWaalsContact CD1-CD2 3.41Å; F151-L280 HydrophobicContact CD2-CB 4.29Å; F151-L280 HydrophobicContact CD2-CD1 3.92Å; F151-L280 HydrophobicContact CD2-CD2 3.63Å; F151-L280 HydrophobicContact CD2-CG 4.13Å; F151-L280 HydrophobicContact CE1-CD2 3.71Å; F151-L280 HydrophobicContact CE2-CB 4.01Å; F151-L280 HydrophobicContact CE2-CD1 4.47Å; F151-L280 HydrophobicContact CE2-CD2 3.9Å; F151-L280 HydrophobicContact CE2-CG 4.33Å; F151-L280 HydrophobicContact CG-CD1 4.22Å; F151-L280 HydrophobicContact CG-CD2 3.36Å; F151-L280 HydrophobicContact CG-CG 4.3Å; F151-L280 HydrophobicContact CZ-CB 4.33Å; F151-L280 HydrophobicContact CZ-CD2 3.93Å; F153-L280 HydrophobicContact CE2-CD1 4.29Å; F153-L280 HydrophobicContact CZ-CD1 3.88Å; L166-L280 HydrophobicContact CD2-CD1 3.69Å; I230-L280 HydrophobicContact CD1-CD1 4.42Å; I230-L280 HydrophobicContact CD1-CD2 3.58Å; I230-L280 HydrophobicContact CD1-CG 4.03Å; I230-L280 HydrophobicContact CG1-CD2 4.44Å; I256-L280 HydrophobicContact CD1-CD2 4.18Å; A276-L280 HydrophobicContact CB-CD1 4.13Å; A276-L280 HydrophobicContact CB-CG 4.19Å; A276-L280 WeakPolarHBondContact O-CG 3.39Å; A276-L280 PolarHBondContact O-N 3.3Å; T277-L280 PolarHBondContact O-N 2.9Å; L280-G282 PolarHBondContact O-N 2.79Å; L280-V283 PolarHBondContact O-N 3.29Å; L280-V283 VanDerWaalsContact O-N 3.15Å
281	S	68.7	Low	79.4	Confident	67 Å²	67	60.3 Å²	60.3	47%	0.469	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-33.2	173.4	57.4	0	0	0	0	112	T277 D278 V283 F285	T277-S281 PolarHBondContact O-N 3.03Å; T277-S281 VanDerWaalsContact O-N 3.08Å; T277-S281 PolarHBondContact O-OG 3.44Å; T277-S281 VanDerWaalsContact O-OG 3.13Å; D278-S281 PolarHBondContact O-OG 3.13Å; S281-V283 VanDerWaalsContact C-N 3.33Å; S281-V283 PolarHBondContact O-N 3.22Å; S281-F285 VanDerWaalsContact O-CD2 3.32Å; S281-F285 WeakPolarHBondContact O-CD2 3.46Å
282	G	68.7	Low	79.4	Confident	20 Å²	20	58.1 Å²	58.1	21%	0.206	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-25.8	174.2	0	0	0	0	0	115.4	D278 T279 L280 K284 F285 I286	D278-G282 PolarHBondContact O-N 2.93Å; T279-G282 PolarHBondContact O-N 3.43Å; L280-G282 PolarHBondContact O-N 2.79Å; G282-K284 PolarHBondContact O-N 3.35Å; G282-F285 WeakPolarHBondContact O-CB 3.15Å; G282-F285 PolarHBondContact O-N 2.94Å; G282-F285 VanDerWaalsContact O-N 3.17Å; G282-I286 VanDerWaalsContact O-CG1 3.28Å; G282-I286 WeakPolarHBondContact O-CG1 3.43Å; G282-I286 PolarHBondContact O-N 3.45Å
283	V	69.7	Low	79.2	Confident	15 Å²	15	61.8 Å²	61.8	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-40.1	-174.1	179.3	0	0	0	0	112.3	F151 I256 T279 L280 S281 I286 Q287	F151-V283 HydrophobicContact CE1-CB 4.29Å; F151-V283 HydrophobicContact CE1-CG1 4.31Å; F151-V283 HydrophobicContact CE1-CG2 3.97Å; F151-V283 HydrophobicContact CZ-CB 4.19Å; F151-V283 HydrophobicContact CZ-CG1 4.47Å; F151-V283 HydrophobicContact CZ-CG2 4.18Å; I256-V283 HydrophobicContact CD1-CG2 3.6Å; I256-V283 HydrophobicContact CG1-CG2 4.46Å; T279-V283 PolarHBondContact O-N 3.02Å; L280-V283 PolarHBondContact O-N 3.29Å; L280-V283 VanDerWaalsContact O-N 3.15Å; S281-V283 VanDerWaalsContact C-N 3.33Å; S281-V283 PolarHBondContact O-N 3.22Å; V283-I286 PolarHBondContact O-N 3.33Å; V283-Q287 PolarHBondContact O-N 3.07Å
284	K	68	Low	79.3	Confident	66 Å²	66	66 Å²	66	29%	0.287	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-42.7	175.9	-73.4	-169	168.8	-161.4	0	112	D147 G282 I286 Q287 E288	D147-K284 IonicContact OD1-NZ 3.86Å; D147-K284 PolarHBondContact OD1-NZ 2.95Å; D147-K284 VanDerWaalsContact OD2-CE 3.31Å; D147-K284 WeakPolarHBondContact OD2-CE 3.44Å; D147-K284 IonicContact OD2-NZ 3.52Å; D147-K284 PolarHBondContact OD2-NZ 3.12Å; G282-K284 PolarHBondContact O-N 3.35Å; K284-I286 VanDerWaalsContact C-N 3.26Å; K284-I286 PolarHBondContact O-N 3.49Å; K284-Q287 PolarHBondContact O-N 2.69Å; K284-E288 WeakPolarHBondContact O-CB 3.4Å; K284-E288 PolarHBondContact O-N 3.03Å
285	F	68.7	Low	79.6	Confident	82 Å²	82	59.3 Å²	59.3	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-34.7	174.4	-67.8	-66.8	0	0	0	112.1	S281 G282 K289 K400	S281-F285 VanDerWaalsContact O-CD2 3.32Å; S281-F285 WeakPolarHBondContact O-CD2 3.46Å; G282-F285 WeakPolarHBondContact O-CB 3.15Å; G282-F285 PolarHBondContact O-N 2.94Å; G282-F285 VanDerWaalsContact O-N 3.17Å; F285-K289 WeakPolarHBondContact O-CB 3.39Å; F285-K289 PolarHBondContact O-N 2.59Å; F285-K400 HydrophobicContact CE1-CB 3.66Å; F285-K400 HydrophobicContact CE1-CD 4.12Å; F285-K400 HydrophobicContact CZ-CB 4.29Å; F285-K400 HydrophobicContact CZ-CD 4.09Å
286	I	72.2	Confident	79.7	Confident	89 Å²	89	56.5 Å²	56.5	46%	0.456	28%	0.282	S	S	.	.	H	α-helix	trans	-68.1	-40.3	175.6	-67.5	162.7	0	0	0	111.2	G282 V283 K284 K290	G282-I286 VanDerWaalsContact O-CG1 3.28Å; G282-I286 WeakPolarHBondContact O-CG1 3.43Å; G282-I286 PolarHBondContact O-N 3.45Å; V283-I286 PolarHBondContact O-N 3.33Å; K284-I286 VanDerWaalsContact C-N 3.26Å; K284-I286 PolarHBondContact O-N 3.49Å; I286-K290 HydrophobicContact CG2-CD 4.35Å; I286-K290 WeakPolarHBondContact O-CB 3.49Å; I286-K290 WeakPolarHBondContact O-CG 3.41Å; I286-K290 PolarHBondContact O-N 3.03Å
287	Q	75	Confident	80	Confident	76 Å²	76	59.5 Å²	59.5	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-64.8	-48.7	175.9	-72	175.7	3.1	0	0	111.2	V283 K284 K289 K290 L291	V283-Q287 PolarHBondContact O-N 3.07Å; K284-Q287 PolarHBondContact O-N 2.69Å; Q287-K289 VanDerWaalsContact C-N 3.35Å; Q287-K289 PolarHBondContact O-N 2.86Å; Q287-K290 PolarHBondContact O-N 2.96Å; Q287-L291 PolarHBondContact O-N 3.42Å
288	E	77.8	Confident	80.5	Confident	24 Å²	24	57.6 Å²	57.6	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-56.2	-49.1	174.4	-173.4	-172.5	98.3	0	0	110.9	K284 K290 L291 I292 V397 T398 S401	K284-E288 WeakPolarHBondContact O-CB 3.4Å; K284-E288 PolarHBondContact O-N 3.03Å; E288-K290 PolarHBondContact O-N 3.11Å; E288-L291 WeakPolarHBondContact O-CB 3.12Å; E288-L291 PolarHBondContact O-N 2.96Å; E288-I292 HydrophobicContact CG-CD1 4Å; E288-I292 WeakPolarHBondContact O-CG1 3.33Å; E288-I292 PolarHBondContact O-N 2.78Å; E288-V397 HydrophobicContact CG-CB 3.96Å; E288-V397 HydrophobicContact CG-CG1 3.95Å; E288-T398 PolarHBondContact OE1-OG1 2.53Å; E288-T398 WeakPolarHBondContact OE2-CB 3.47Å; E288-T398 PolarHBondContact OE2-N 2.78Å; E288-T398 PolarHBondContact OE2-OG1 2.71Å; E288-S401 WeakPolarHBondContact OE1-CB 3.48Å; E288-S401 PolarHBondContact OE1-OG 2.76Å
289	K	79.1	Confident	81	Confident	95 Å²	95	52.8 Å²	52.8	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-58.6	-44	177.1	173	168.6	174.1	142.9	0	112.3	F285 Q287 L291 I292 Q293 E403	F285-K289 WeakPolarHBondContact O-CB 3.39Å; F285-K289 PolarHBondContact O-N 2.59Å; Q287-K289 VanDerWaalsContact C-N 3.35Å; Q287-K289 PolarHBondContact O-N 2.86Å; K289-L291 VanDerWaalsContact C-N 3.34Å; K289-I292 PolarHBondContact O-N 3.45Å; K289-Q293 WeakPolarHBondContact O-CB 3.46Å; K289-Q293 PolarHBondContact O-N 2.97Å; K289-E403 WeakPolarHBondContact CD-OE1 3.29Å; K289-E403 WeakPolarHBondContact CE-OE1 3.28Å; K289-E403 HydrophobicContact CG-CG 4.09Å; K289-E403 IonicContact NZ-OE1 3.59Å; K289-E403 PolarHBondContact NZ-OE1 2.83Å
290	K	85.5	Confident	81.5	Confident	149 Å²	149	56 Å²	56	65%	0.648	28%	0.281	S	S	*	.	H	α-helix	trans	-64.3	-39.3	177.9	-79.2	-178.7	179.1	-174.1	0	112.1	I286 Q287 E288 R294	I286-K290 HydrophobicContact CG2-CD 4.35Å; I286-K290 WeakPolarHBondContact O-CB 3.49Å; I286-K290 WeakPolarHBondContact O-CG 3.41Å; I286-K290 PolarHBondContact O-N 3.03Å; Q287-K290 PolarHBondContact O-N 2.96Å; E288-K290 PolarHBondContact O-N 3.11Å; K290-R294 WeakPolarHBondContact O-CB 3.45Å; K290-R294 PolarHBondContact O-N 2.8Å
291	L	87.5	Confident	82.2	Confident	32 Å²	32	62 Å²	62	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-50.1	176.7	175	66.1	0	0	0	111.1	Q287 E288 K289 Q293 R294 Y295 T324 V326 E395 V397 I417	Q287-L291 PolarHBondContact O-N 3.42Å; E288-L291 WeakPolarHBondContact O-CB 3.12Å; E288-L291 PolarHBondContact O-N 2.96Å; K289-L291 VanDerWaalsContact C-N 3.34Å; L291-Q293 VanDerWaalsContact C-N 3.34Å; L291-R294 WeakPolarHBondContact O-CB 3.41Å; L291-R294 PolarHBondContact O-N 2.83Å; L291-Y295 PolarHBondContact O-N 2.84Å; L291-T324 HydrophobicContact CD1-CG2 3.96Å; L291-V326 HydrophobicContact CD1-CG2 4.36Å; L291-V326 HydrophobicContact CD2-CG2 4.18Å; L291-V326 HydrophobicContact CG-CG2 4.25Å; L291-E395 HydrophobicContact CD2-CB 3.48Å; L291-E395 VanDerWaalsContact CD2-CB 3.48Å; L291-E395 HydrophobicContact CD2-CG 3.75Å; L291-V397 HydrophobicContact CD2-CG1 4.13Å; L291-I417 HydrophobicContact CD1-CD1 4.46Å
292	I	90.1	Very high	83	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-36.7	-179.8	-61.4	177.2	0	0	0	111	E288 K289 Y295 F296 V397 E403 F407	E288-I292 HydrophobicContact CG-CD1 4Å; E288-I292 WeakPolarHBondContact O-CG1 3.33Å; E288-I292 PolarHBondContact O-N 2.78Å; K289-I292 PolarHBondContact O-N 3.45Å; I292-Y295 WeakPolarHBondContact O-CB 3.16Å; I292-Y295 PolarHBondContact O-N 2.63Å; I292-F296 HydrophobicContact CG2-CD1 4.44Å; I292-F296 HydrophobicContact CG2-CD2 3.98Å; I292-F296 HydrophobicContact CG2-CE1 3.99Å; I292-F296 HydrophobicContact CG2-CE2 3.51Å; I292-F296 HydrophobicContact CG2-CG 4.43Å; I292-F296 HydrophobicContact CG2-CZ 3.5Å; I292-F296 WeakPolarHBondContact O-CG 3.34Å; I292-F296 PolarHBondContact O-N 2.88Å; I292-V397 HydrophobicContact CD1-CB 4.31Å; I292-V397 HydrophobicContact CD1-CG1 4.36Å; I292-V397 HydrophobicContact CD1-CG2 4.41Å; I292-V397 HydrophobicContact CG1-CG1 4.45Å; I292-E403 HydrophobicContact CB-CB 4.17Å; I292-E403 HydrophobicContact CG2-CB 3.84Å; I292-F407 HydrophobicContact CD1-CB 4.41Å; I292-F407 HydrophobicContact CG2-CB 4.14Å
293	Q	87.9	Confident	83.7	Confident	76 Å²	76	64.4 Å²	64.4	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-61	-45.8	173.6	-173.6	63.7	50.7	0	0	111	K289 L291 Y295 F296 D297	K289-Q293 WeakPolarHBondContact O-CB 3.46Å; K289-Q293 PolarHBondContact O-N 2.97Å; L291-Q293 VanDerWaalsContact C-N 3.34Å; Q293-Y295 VanDerWaalsContact C-N 3.27Å; Q293-Y295 PolarHBondContact O-N 3.28Å; Q293-F296 CarbonylContact O-C 3.54Å; Q293-F296 PolarHBondContact O-N 2.86Å; Q293-F296 VanDerWaalsContact O-N 3.11Å; Q293-D297 PolarHBondContact NE2-OD1 2.83Å; Q293-D297 WeakPolarHBondContact O-CB 3.46Å; Q293-D297 PolarHBondContact O-N 3.11Å
294	R	90.9	Very high	84.5	Confident	113 Å²	113	64.6 Å²	64.6	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-56.9	-43.7	174.6	-177.2	-178.2	176.2	-168.9	-4.8	111	K290 L291 D297 E298 I417	K290-R294 WeakPolarHBondContact O-CB 3.45Å; K290-R294 PolarHBondContact O-N 2.8Å; L291-R294 WeakPolarHBondContact O-CB 3.41Å; L291-R294 PolarHBondContact O-N 2.83Å; R294-D297 PolarHBondContact O-N 3.2Å; R294-E298 WeakPolarHBondContact O-CG 3.38Å; R294-E298 PolarHBondContact O-N 2.84Å; R294-E298 VanDerWaalsContact O-N 3.12Å; R294-I417 HydrophobicContact CB-CD1 4.48Å; R294-I417 HydrophobicContact CG-CD1 4.07Å
295	Y	92.9	Very high	85.7	Confident	1 Å²	1	65.2 Å²	65.2	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-44.8	175.1	175.6	-102.5	0	0	0	112.5	L291 I292 Q293 D297 E298 I299 C307 F308 F407 F411 I417	L291-Y295 PolarHBondContact O-N 2.84Å; I292-Y295 WeakPolarHBondContact O-CB 3.16Å; I292-Y295 PolarHBondContact O-N 2.63Å; Q293-Y295 VanDerWaalsContact C-N 3.27Å; Q293-Y295 PolarHBondContact O-N 3.28Å; Y295-D297 VanDerWaalsContact C-N 3.34Å; Y295-D297 PolarHBondContact O-N 3.05Å; Y295-E298 PolarHBondContact O-N 2.99Å; Y295-I299 HydrophobicContact CD1-CD1 3.71Å; Y295-I299 HydrophobicContact CE1-CD1 3.3Å; Y295-I299 HydrophobicContact CE2-CD1 4.33Å; Y295-I299 HydrophobicContact CG-CD1 4.37Å; Y295-I299 WeakPolarHBondContact O-CG1 3.3Å; Y295-I299 PolarHBondContact O-N 3.06Å; Y295-C307 WeakPolarHBondContact CE2-O 3.47Å; Y295-C307 PolarHBondContact OH-O 2.88Å; Y295-F308 WeakPolarHBondContact OH-CB 3.48Å; Y295-F407 HydrophobicContact CD1-CD2 4.04Å; Y295-F407 HydrophobicContact CD1-CE2 4.22Å; Y295-F407 AromaticContact CE1-CD2 3.73Å; Y295-F407 HydrophobicContact CE1-CD2 3.73Å; Y295-F407 AromaticContact CE1-CE2 3.72Å; Y295-F407 HydrophobicContact CE1-CE2 3.72Å; Y295-F411 HydrophobicContact CE1-CD1 4.38Å; Y295-F411 HydrophobicContact CE1-CD2 4.28Å; Y295-F411 HydrophobicContact CE1-CG 4.16Å; Y295-I417 HydrophobicContact CD2-CG1 3.95Å
296	F	91.8	Very high	86.8	Confident	20 Å²	20	63.2 Å²	63.2	9%	0.088	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-30.7	176	-67.6	-19.7	0	0	0	113.6	I292 Q293 I299 S300 E403 Q406 F407 F411	I292-F296 HydrophobicContact CG2-CD1 4.44Å; I292-F296 HydrophobicContact CG2-CD2 3.98Å; I292-F296 HydrophobicContact CG2-CE1 3.99Å; I292-F296 HydrophobicContact CG2-CE2 3.51Å; I292-F296 HydrophobicContact CG2-CG 4.43Å; I292-F296 HydrophobicContact CG2-CZ 3.5Å; I292-F296 WeakPolarHBondContact O-CG 3.34Å; I292-F296 PolarHBondContact O-N 2.88Å; Q293-F296 CarbonylContact O-C 3.54Å; Q293-F296 PolarHBondContact O-N 2.86Å; Q293-F296 VanDerWaalsContact O-N 3.11Å; F296-I299 HydrophobicContact CD1-CD1 4.08Å; F296-I299 PolarHBondContact O-N 2.79Å; F296-S300 VanDerWaalsContact O-CB 3.3Å; F296-S300 WeakPolarHBondContact O-CB 3.49Å; F296-S300 PolarHBondContact O-N 3.12Å; F296-S300 PolarHBondContact O-OG 3.22Å; F296-E403 HydrophobicContact CE2-CB 4.3Å; F296-Q406 HydrophobicContact CE2-CB 4.08Å; F296-Q406 HydrophobicContact CZ-CB 3.89Å; F296-F407 HydrophobicContact CE1-CB 4.45Å; F296-F407 HydrophobicContact CZ-CB 4.15Å; F296-F411 AromaticContact CD1-CE2 3.93Å; F296-F411 HydrophobicContact CD1-CE2 3.93Å; F296-F411 HydrophobicContact CD1-CZ 4.42Å; F296-F411 AromaticContact CE1-CD2 3.78Å; F296-F411 HydrophobicContact CE1-CD2 3.78Å; F296-F411 AromaticContact CE1-CE2 3.36Å; F296-F411 HydrophobicContact CE1-CE2 3.36Å; F296-F411 HydrophobicContact CE1-CZ 4.27Å; F296-F411 HydrophobicContact CZ-CE2 4.22Å
297	D	92.2	Very high	87.8	Confident	63 Å²	63	59 Å²	59	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-41.5	175.3	-65.4	-20.6	0	0	0	110.1	Q293 R294 Y295 I299 S300 Q301	Q293-D297 PolarHBondContact NE2-OD1 2.83Å; Q293-D297 WeakPolarHBondContact O-CB 3.46Å; Q293-D297 PolarHBondContact O-N 3.11Å; R294-D297 PolarHBondContact O-N 3.2Å; Y295-D297 VanDerWaalsContact C-N 3.34Å; Y295-D297 PolarHBondContact O-N 3.05Å; D297-I299 VanDerWaalsContact C-N 3.3Å; D297-I299 PolarHBondContact O-N 3.48Å; D297-S300 PolarHBondContact O-N 3.35Å; D297-Q301 WeakPolarHBondContact O-CB 3.39Å; D297-Q301 VanDerWaalsContact O-CG 3.24Å; D297-Q301 WeakPolarHBondContact O-CG 3.33Å; D297-Q301 PolarHBondContact O-N 3.29Å
298	E	91	Very high	88.6	Confident	36 Å²	36	59.8 Å²	59.8	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-37	174.7	-64.4	-63.3	164.5	0	0	112.1	R294 Y295 S303 Y306 I417	R294-E298 WeakPolarHBondContact O-CG 3.38Å; R294-E298 PolarHBondContact O-N 2.84Å; R294-E298 VanDerWaalsContact O-N 3.12Å; Y295-E298 PolarHBondContact O-N 2.99Å; E298-S303 WeakPolarHBondContact O-CB 3.47Å; E298-S303 PolarHBondContact O-N 3.33Å; E298-S303 VanDerWaalsContact O-N 3.11Å; E298-S303 PolarHBondContact O-OG 2.87Å; E298-S303 VanDerWaalsContact OE2-CB 3.25Å; E298-S303 WeakPolarHBondContact OE2-CB 3.42Å; E298-S303 PolarHBondContact OE2-OG 3.3Å; E298-Y306 HydrophobicContact CB-CD1 4.46Å; E298-Y306 WeakPolarHBondContact O-CD1 3.39Å; E298-I417 HydrophobicContact CG-CG2 4.42Å
299	I	89.3	Confident	89.2	Confident	35 Å²	35	59.7 Å²	59.7	18%	0.179	30%	0.298	C	S	.	.	H	α-helix	trans	-69.6	-47.1	174.8	-66.4	157.5	0	0	0	110.9	Y295 F296 D297 Q301 D302 Y306 F411	Y295-I299 HydrophobicContact CD1-CD1 3.71Å; Y295-I299 HydrophobicContact CE1-CD1 3.3Å; Y295-I299 HydrophobicContact CE2-CD1 4.33Å; Y295-I299 HydrophobicContact CG-CD1 4.37Å; Y295-I299 WeakPolarHBondContact O-CG1 3.3Å; Y295-I299 PolarHBondContact O-N 3.06Å; F296-I299 HydrophobicContact CD1-CD1 4.08Å; F296-I299 PolarHBondContact O-N 2.79Å; D297-I299 VanDerWaalsContact C-N 3.3Å; D297-I299 PolarHBondContact O-N 3.48Å; I299-Q301 VanDerWaalsContact C-N 3.28Å; I299-Q301 PolarHBondContact O-N 2.86Å; I299-D302 PolarHBondContact O-N 3.36Å; I299-Y306 HydrophobicContact CB-CD1 4.46Å; I299-Y306 HydrophobicContact CB-CE1 4.42Å; I299-Y306 HydrophobicContact CB-CE2 4.42Å; I299-Y306 HydrophobicContact CD1-CD2 4.34Å; I299-Y306 HydrophobicContact CG1-CD1 3.97Å; I299-Y306 HydrophobicContact CG1-CD2 3.44Å; I299-Y306 VanDerWaalsContact CG1-CD2 3.44Å; I299-Y306 HydrophobicContact CG1-CE1 4.25Å; I299-Y306 HydrophobicContact CG1-CE2 3.73Å; I299-Y306 HydrophobicContact CG1-CG 3.56Å; I299-Y306 HydrophobicContact CG2-CE2 4.38Å; I299-F411 HydrophobicContact CD1-CD1 4.21Å; I299-F411 HydrophobicContact CD1-CE1 3.5Å; I299-F411 VanDerWaalsContact CD1-CE1 3.5Å; I299-F411 HydrophobicContact CD1-CE2 4.22Å; I299-F411 HydrophobicContact CD1-CZ 3.51Å; I299-F411 HydrophobicContact CG1-CE1 4.44Å; I299-F411 HydrophobicContact CG2-CZ 4.45Å
300	S	89.7	Confident	89.8	Confident	101 Å²	101	56.2 Å²	56.2	71%	0.706	29%	0.285	S	S	*	.	H	α-helix	trans	-67.7	-29.4	-175.6	-58.5	0	0	0	0	112.6	F296 D297	F296-S300 VanDerWaalsContact O-CB 3.3Å; F296-S300 WeakPolarHBondContact O-CB 3.49Å; F296-S300 PolarHBondContact O-N 3.12Å; F296-S300 PolarHBondContact O-OG 3.22Å; D297-S300 PolarHBondContact O-N 3.35Å
301	Q	89.1	Confident	90	Very high	141 Å²	141	55.1 Å²	55.1	66%	0.659	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.4	174.5	-69.4	174.3	36.6	0	0	113.1	D297 I299 S303	D297-Q301 WeakPolarHBondContact O-CB 3.39Å; D297-Q301 VanDerWaalsContact O-CG 3.24Å; D297-Q301 WeakPolarHBondContact O-CG 3.33Å; D297-Q301 PolarHBondContact O-N 3.29Å; I299-Q301 VanDerWaalsContact C-N 3.28Å; I299-Q301 PolarHBondContact O-N 2.86Å; Q301-S303 PolarHBondContact O-N 3.18Å
302	D	85.2	Confident	90.1	Very high	122 Å²	122	56 Å²	56	65%	0.652	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	42.9	-169.7	-159.8	25	0	0	0	112	I299 G304	I299-D302 PolarHBondContact O-N 3.36Å; D302-G304 PolarHBondContact O-N 3.09Å; D302-G304 VanDerWaalsContact O-N 3.11Å
303	S	85.2	Confident	90.2	Very high	16 Å²	16	56 Å²	56	11%	0.112	29%	0.286	C	S	.	.			trans	-66.7	-13.7	-172.3	64.8	0	0	0	0	113	E298 Q301 K305 Q421	E298-S303 WeakPolarHBondContact O-CB 3.47Å; E298-S303 PolarHBondContact O-N 3.33Å; E298-S303 VanDerWaalsContact O-N 3.11Å; E298-S303 PolarHBondContact O-OG 2.87Å; E298-S303 VanDerWaalsContact OE2-CB 3.25Å; E298-S303 WeakPolarHBondContact OE2-CB 3.42Å; E298-S303 PolarHBondContact OE2-OG 3.3Å; Q301-S303 PolarHBondContact O-N 3.18Å; S303-K305 PolarHBondContact O-N 2.98Å; S303-K305 VanDerWaalsContact O-N 3.14Å; S303-K305 PolarHBondContact OG-N 3.19Å; S303-K305 VanDerWaalsContact OG-N 3.11Å; S303-Q421 WeakPolarHBondContact O-CG 3.24Å; S303-Q421 PolarHBondContact O-NE2 2.86Å
304	G	86.4	Confident	90.4	Very high	20 Å²	20	52.9 Å²	52.9	21%	0.206	27%	0.272	C	S	.	.	S	Bend	trans	63.6	5.7	-168.7	0	0	0	0	0	114.7	D302 Q421 L422	D302-G304 PolarHBondContact O-N 3.09Å; D302-G304 VanDerWaalsContact O-N 3.11Å; G304-Q421 WeakPolarHBondContact O-CA 3.4Å; G304-L422 PolarHBondContact O-N 3.25Å
305	K	91.2	Very high	90.5	Very high	79 Å²	79	50.8 Å²	50.8	34%	0.343	27%	0.266	S	S	.	.			trans	-101	33.2	-177.5	-64.2	-176.4	-175.5	178.7	0	112.9	S303 L418 Q421	S303-K305 PolarHBondContact O-N 2.98Å; S303-K305 VanDerWaalsContact O-N 3.14Å; S303-K305 PolarHBondContact OG-N 3.19Å; S303-K305 VanDerWaalsContact OG-N 3.11Å; K305-L418 HydrophobicContact CB-CB 4.42Å; K305-L418 PolarHBondContact O-N 3.42Å; K305-Q421 HydrophobicContact CG-CG 3.85Å
306	Y	93	Very high	90.4	Very high	40 Å²	40	50.8 Å²	50.8	16%	0.157	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	153.1	178.2	65	-87.8	0	0	0	110.2	E298 I299 F308 G416	E298-Y306 HydrophobicContact CB-CD1 4.46Å; E298-Y306 WeakPolarHBondContact O-CD1 3.39Å; I299-Y306 HydrophobicContact CB-CD1 4.46Å; I299-Y306 HydrophobicContact CB-CE1 4.42Å; I299-Y306 HydrophobicContact CB-CE2 4.42Å; I299-Y306 HydrophobicContact CD1-CD2 4.34Å; I299-Y306 HydrophobicContact CG1-CD1 3.97Å; I299-Y306 HydrophobicContact CG1-CD2 3.44Å; I299-Y306 VanDerWaalsContact CG1-CD2 3.44Å; I299-Y306 HydrophobicContact CG1-CE1 4.25Å; I299-Y306 HydrophobicContact CG1-CE2 3.73Å; I299-Y306 HydrophobicContact CG1-CG 3.56Å; I299-Y306 HydrophobicContact CG2-CE2 4.38Å; Y306-F308 HydrophobicContact CD2-CD1 4.11Å; Y306-F308 AromaticContact CE2-CD1 3.98Å; Y306-F308 HydrophobicContact CE2-CD1 3.98Å; Y306-F308 HydrophobicContact CE2-CE1 4.01Å; Y306-G416 CarbonylContact C-O 3.51Å; Y306-G416 WeakPolarHBondContact CA-O 3.39Å
307	C	92.2	Very high	90.4	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.4	167.8	62.4	0	0	0	0	109.7	Y295 G415 G416 L418 F424	Y295-C307 WeakPolarHBondContact CE2-O 3.47Å; Y295-C307 PolarHBondContact OH-O 2.88Å; C307-G415 CarbonylContact O-C 3.54Å; C307-G415 WeakPolarHBondContact O-CA 3.3Å; C307-G416 PolarHBondContact N-O 3.25Å; C307-G416 PolarHBondContact O-N 3.09Å; C307-G416 PolarHBondContact SG-N 2.79Å; C307-G416 VanDerWaalsContact SG-N 3.38Å; C307-L418 HydrophobicContact CB-CD2 4.3Å; C307-F424 HydrophobicContact CB-CE2 4.24Å; C307-F424 HydrophobicContact CB-CZ 3.66Å
308	F	92.2	Very high	90.2	Very high	92 Å²	92	53.9 Å²	53.9	40%	0.404	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	158	178	60.7	-92.1	0	0	0	110.5	Y295 Y306 F411	Y295-F308 WeakPolarHBondContact OH-CB 3.48Å; Y306-F308 HydrophobicContact CD2-CD1 4.11Å; Y306-F308 AromaticContact CE2-CD1 3.98Å; Y306-F308 HydrophobicContact CE2-CD1 3.98Å; Y306-F308 HydrophobicContact CE2-CE1 4.01Å; F308-F411 HydrophobicContact CB-CB 4.1Å; F308-F411 HydrophobicContact CB-CD1 3.75Å; F308-F411 HydrophobicContact CB-CG 4.39Å; F308-F411 HydrophobicContact CD1-CD1 4.34Å; F308-F411 HydrophobicContact CD2-CD1 4.5Å; F308-F411 AromaticContact CG-CD1 3.97Å; F308-F411 HydrophobicContact CG-CD1 3.97Å
309	G	90.8	Very high	90.1	Very high	21 Å²	21	56.3 Å²	56.3	22%	0.216	29%	0.292	C	S	.	.	S	Bend	trans	75.6	160.5	-177.9	0	0	0	0	0	112.9	T313 I414	G309-T313 WeakPolarHBondContact O-CB 3.49Å; G309-T313 PolarHBondContact O-N 2.84Å; G309-T313 PolarHBondContact O-OG1 3.23Å; G309-I414 PolarHBondContact N-O 2.67Å; G309-I414 VanDerWaalsContact N-O 3.08Å
310	V	91	Very high	90.1	Very high	23 Å²	23	56 Å²	56	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-45.7	-169.3	176.3	0	0	0	0	111.5	L314 V333 H350 L379 I414	V310-L314 HydrophobicContact CG1-CD1 3.69Å; V310-L314 HydrophobicContact CG1-CG 4.46Å; V310-L314 WeakPolarHBondContact O-CB 3.35Å; V310-L314 WeakPolarHBondContact O-CD1 3.33Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.13Å; V310-V333 HydrophobicContact CG1-CG1 4.45Å; V310-V333 HydrophobicContact CG2-CG1 4.17Å; V310-V333 HydrophobicContact CG2-CG2 4.01Å; V310-H350 HydrophobicContact CG1-CB 3.64Å; V310-L379 HydrophobicContact CG1-CD2 3.71Å; V310-L379 HydrophobicContact CG2-CD2 4.36Å; V310-I414 HydrophobicContact CG2-CG2 3.78Å
311	E	89.9	Confident	90.2	Very high	126 Å²	126	51.2 Å²	51.2	59%	0.589	26%	0.263	S	S	*	.	H	α-helix	trans	-66.8	-54.2	-173.6	-171	176.1	168.2	0	0	112.2	T313 L314 K315	E311-T313 VanDerWaalsContact C-N 3.32Å; E311-T313 PolarHBondContact O-N 3.41Å; E311-L314 PolarHBondContact O-N 3.01Å; E311-K315 HydrophobicContact CG-CD 4.38Å; E311-K315 WeakPolarHBondContact O-CG 3.47Å; E311-K315 PolarHBondContact O-N 2.77Å; E311-K315 WeakPolarHBondContact OE1-CE 3.38Å; E311-K315 IonicContact OE1-NZ 3.58Å; E311-K315 PolarHBondContact OE1-NZ 3.24Å
312	D	90.8	Very high	90.4	Very high	49 Å²	49	44.5 Å²	44.5	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-36.4	-177.6	-62.6	-18	0	0	0	111.8	S316 F424	D312-S316 VanDerWaalsContact O-CB 3.28Å; D312-S316 WeakPolarHBondContact O-CB 3.38Å; D312-S316 PolarHBondContact O-N 3Å; D312-S316 PolarHBondContact O-OG 3.17Å; D312-F424 HydrophobicContact CB-CD1 4.02Å; D312-F424 HydrophobicContact CB-CE1 3.76Å; D312-F424 HydrophobicContact CB-CZ 4.31Å
313	T	92.7	Very high	90.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-41.8	176.2	-55.9	0	0	0	0	111.4	G309 E311 S316 L317 L325 I414	G309-T313 WeakPolarHBondContact O-CB 3.49Å; G309-T313 PolarHBondContact O-N 2.84Å; G309-T313 PolarHBondContact O-OG1 3.23Å; E311-T313 VanDerWaalsContact C-N 3.32Å; E311-T313 PolarHBondContact O-N 3.41Å; T313-S316 PolarHBondContact O-N 3.29Å; T313-L317 HydrophobicContact CG2-CD1 4.2Å; T313-L317 WeakPolarHBondContact O-CB 3.23Å; T313-L317 VanDerWaalsContact O-CG 3.29Å; T313-L317 WeakPolarHBondContact O-CG 3.48Å; T313-L317 PolarHBondContact O-N 2.8Å; T313-L325 HydrophobicContact CG2-CD1 3.35Å; T313-I414 HydrophobicContact CG2-CD1 4.33Å; T313-I414 HydrophobicContact CG2-CG1 4.04Å
314	L	92.1	Very high	91.1	Very high	12 Å²	12	42 Å²	42	6%	0.063	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-42.9	178.5	-73.4	172.4	0	0	0	112.5	V310 E311 S316 L317 E318 H350 L379 W382 L383	V310-L314 HydrophobicContact CG1-CD1 3.69Å; V310-L314 HydrophobicContact CG1-CG 4.46Å; V310-L314 WeakPolarHBondContact O-CB 3.35Å; V310-L314 WeakPolarHBondContact O-CD1 3.33Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.13Å; E311-L314 PolarHBondContact O-N 3.01Å; L314-S316 VanDerWaalsContact C-N 3.28Å; L314-S316 PolarHBondContact O-N 3.13Å; L314-L317 HydrophobicContact CD2-CD1 4.06Å; L314-L317 WeakPolarHBondContact O-CB 3.46Å; L314-L317 PolarHBondContact O-N 3.19Å; L314-L317 VanDerWaalsContact O-N 3.11Å; L314-E318 WeakPolarHBondContact O-CG 3.36Å; L314-E318 PolarHBondContact O-N 2.84Å; L314-H350 WeakPolarHBondContact CD1-CE1 3.19Å; L314-H350 WeakPolarHBondContact CD1-ND1 3.36Å; L314-H350 WeakPolarHBondContact CD1-NE2 3.09Å; L314-L379 HydrophobicContact CD1-CD1 4.44Å; L314-L379 HydrophobicContact CD2-CD1 4.3Å; L314-W382 HydrophobicContact CD2-CZ3 4.16Å; L314-L383 HydrophobicContact CD2-CD2 4.43Å
315	K	91.3	Very high	91.5	Very high	69 Å²	69	41 Å²	41	30%	0.3	21%	0.205	S	C	.	.	H	α-helix	trans	-56.7	-45.4	171.8	-71.4	176.4	-174.8	167.9	0	110.9	E311 L317 E318 M319	E311-K315 HydrophobicContact CG-CD 4.38Å; E311-K315 WeakPolarHBondContact O-CG 3.47Å; E311-K315 PolarHBondContact O-N 2.77Å; E311-K315 WeakPolarHBondContact OE1-CE 3.38Å; E311-K315 IonicContact OE1-NZ 3.58Å; E311-K315 PolarHBondContact OE1-NZ 3.24Å; K315-L317 VanDerWaalsContact C-N 3.31Å; K315-L317 PolarHBondContact O-N 2.78Å; K315-E318 PolarHBondContact O-N 3.17Å; K315-M319 WeakPolarHBondContact O-CG 3.41Å; K315-M319 PolarHBondContact O-N 3.4Å
316	S	91	Very high	91.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-35.4	176.8	-57.4	0	0	0	0	113	D312 T313 L314 G320 A321 F424	D312-S316 VanDerWaalsContact O-CB 3.28Å; D312-S316 WeakPolarHBondContact O-CB 3.38Å; D312-S316 PolarHBondContact O-N 3Å; D312-S316 PolarHBondContact O-OG 3.17Å; T313-S316 PolarHBondContact O-N 3.29Å; L314-S316 VanDerWaalsContact C-N 3.28Å; L314-S316 PolarHBondContact O-N 3.13Å; S316-G320 PolarHBondContact O-N 2.84Å; S316-A321 PolarHBondContact O-N 3.33Å; S316-F424 VanDerWaalsContact OG-CE1 3.32Å; S316-F424 WeakPolarHBondContact OG-CE1 3.34Å; S316-F424 VanDerWaalsContact OG-CZ 3.27Å; S316-F424 WeakPolarHBondContact OG-CZ 3.41Å
317	L	91.3	Very high	91.7	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-45.8	175.7	-80	164.3	0	0	0	111.2	T313 L314 K315 M319 G320 V322 L325 L383 F390 T392	T313-L317 HydrophobicContact CG2-CD1 4.2Å; T313-L317 WeakPolarHBondContact O-CB 3.23Å; T313-L317 VanDerWaalsContact O-CG 3.29Å; T313-L317 WeakPolarHBondContact O-CG 3.48Å; T313-L317 PolarHBondContact O-N 2.8Å; L314-L317 HydrophobicContact CD2-CD1 4.06Å; L314-L317 WeakPolarHBondContact O-CB 3.46Å; L314-L317 PolarHBondContact O-N 3.19Å; L314-L317 VanDerWaalsContact O-N 3.11Å; K315-L317 VanDerWaalsContact C-N 3.31Å; K315-L317 PolarHBondContact O-N 2.78Å; L317-M319 VanDerWaalsContact C-N 3.27Å; L317-M319 PolarHBondContact O-N 2.94Å; L317-G320 PolarHBondContact O-N 3.2Å; L317-V322 HydrophobicContact CD2-CB 3.83Å; L317-V322 HydrophobicContact CD2-CG1 4.24Å; L317-V322 HydrophobicContact CD2-CG2 3.97Å; L317-V322 HydrophobicContact CG-CB 4.34Å; L317-V322 HydrophobicContact CG-CG2 3.9Å; L317-L325 HydrophobicContact CD1-CD1 4Å; L317-L325 HydrophobicContact CD1-CD2 3.91Å; L317-L325 HydrophobicContact CD2-CD1 4.47Å; L317-L325 HydrophobicContact CD2-CD2 4.12Å; L317-L325 HydrophobicContact CG-CD1 4.49Å; L317-L383 HydrophobicContact CD1-CD2 3.84Å; L317-F390 HydrophobicContact CB-CD1 4.33Å; L317-F390 HydrophobicContact CB-CG 4.35Å; L317-F390 HydrophobicContact CD2-CB 4.2Å; L317-F390 HydrophobicContact CD2-CG 4.39Å; L317-F390 WeakPolarHBondContact O-CD1 3.45Å; L317-T392 HydrophobicContact CD2-CG2 3.73Å
318	E	89.5	Confident	91.7	Very high	146 Å²	146	37.4 Å²	37.4	68%	0.682	19%	0.189	S	C	*	.	H	α-helix	trans	-62.1	-35.4	178.1	-71.7	175.4	-179.2	0	0	112.1	L314 K315 G320 F390	L314-E318 WeakPolarHBondContact O-CG 3.36Å; L314-E318 PolarHBondContact O-N 2.84Å; K315-E318 PolarHBondContact O-N 3.17Å; E318-G320 PolarHBondContact O-N 2.67Å; E318-F390 HydrophobicContact CG-CE1 4.44Å
319	M	88.7	Confident	91.4	Very high	88 Å²	88	35.5 Å²	35.5	43%	0.433	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.8	172.8	-65.8	178.1	78.3	0	0	113.9	K315 L317 A321 Y420 L422 L427	K315-M319 WeakPolarHBondContact O-CG 3.41Å; K315-M319 PolarHBondContact O-N 3.4Å; L317-M319 VanDerWaalsContact C-N 3.27Å; L317-M319 PolarHBondContact O-N 2.94Å; M319-A321 PolarHBondContact O-N 2.89Å; M319-Y420 PolarHBondContact O-OH 3.43Å; M319-L422 HydrophobicContact CE-CD2 3.53Å; M319-L422 HydrophobicContact SD-CD2 3.87Å; M319-L427 HydrophobicContact CE-CD2 4.46Å; M319-L427 HydrophobicContact SD-CD1 4.04Å; M319-L427 HydrophobicContact SD-CD2 4.05Å
320	G	89.2	Confident	91.3	Very high	28 Å²	28	38.6 Å²	38.6	29%	0.289	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	18	-176.6	0	0	0	0	0	114	S316 L317 E318 R419	S316-G320 PolarHBondContact O-N 2.84Å; L317-G320 PolarHBondContact O-N 3.2Å; E318-G320 PolarHBondContact O-N 2.67Å; G320-R419 PolarHBondContact O-NH1 2.79Å
321	A	90.7	Very high	91.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.			trans	-83.4	-24.1	-174.9	0	0	0	0	0	113.5	S316 M319 E323 L418 R419 Y420 L422	S316-A321 PolarHBondContact O-N 3.33Å; M319-A321 PolarHBondContact O-N 2.89Å; A321-E323 PolarHBondContact O-N 3.11Å; A321-L418 HydrophobicContact CB-CD2 4.3Å; A321-L418 CarbonylContact O-C 3.58Å; A321-L418 WeakPolarHBondContact O-CA 3.49Å; A321-R419 WeakPolarHBondContact O-CG 3.07Å; A321-R419 PolarHBondContact O-N 3.24Å; A321-Y420 HydrophobicContact CB-CE1 4.12Å; A321-Y420 HydrophobicContact CB-CE2 3.94Å; A321-Y420 WeakPolarHBondContact CB-OH 3.41Å; A321-L422 HydrophobicContact CB-CD1 3.19Å; A321-L422 HydrophobicContact CB-CG 4.22Å
322	V	93.2	Very high	91.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	115.7	-176	-174	0	0	0	0	111.3	L317 L325 T392 L418 R419	L317-V322 HydrophobicContact CD2-CB 3.83Å; L317-V322 HydrophobicContact CD2-CG1 4.24Å; L317-V322 HydrophobicContact CD2-CG2 3.97Å; L317-V322 HydrophobicContact CG-CB 4.34Å; L317-V322 HydrophobicContact CG-CG2 3.9Å; V322-L325 HydrophobicContact CG1-CB 3.99Å; V322-L325 HydrophobicContact CG1-CD1 4.49Å; V322-T392 WeakPolarHBondContact CG1-OG1 3.44Å; V322-T392 VanDerWaalsContact O-CB 3.29Å; V322-T392 WeakPolarHBondContact O-CB 3.2Å; V322-T392 PolarHBondContact O-OG1 3.06Å; V322-L418 HydrophobicContact CB-CD2 4.39Å; V322-L418 HydrophobicContact CG2-CD2 3.73Å; V322-R419 PolarHBondContact O-NH1 2.86Å; V322-R419 PolarHBondContact O-NH2 3.38Å
323	E	93.1	Very high	91.1	Very high	73 Å²	73	32.5 Å²	32.5	34%	0.341	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-54.9	172.1	-170.3	-174.9	151.4	0	0	111	A321 T392 T393 I417 R419	A321-E323 PolarHBondContact O-N 3.11Å; E323-T392 PolarHBondContact O-OG1 3.41Å; E323-T393 PolarHBondContact O-N 3.02Å; E323-T393 PolarHBondContact O-OG1 3.35Å; E323-I417 WeakPolarHBondContact CB-O 3.39Å; E323-I417 PolarHBondContact N-O 3.43Å; E323-R419 HydrophobicContact CB-CG 3.64Å; E323-R419 HydrophobicContact CG-CG 4.25Å
324	T	93.4	Very high	91.1	Very high	11 Å²	11	34 Å²	34	7%	0.067	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	113.5	-178.2	-49.8	0	0	0	0	109	L291 V326 T393 E395 G416 I417	L291-T324 HydrophobicContact CD1-CG2 3.96Å; T324-V326 HydrophobicContact CG2-CG2 4.39Å; T324-T393 CarbonylContact C-O 3.5Å; T324-T393 WeakPolarHBondContact CA-O 3.31Å; T324-T393 WeakPolarHBondContact CA-OG1 3.36Å; T324-T393 PolarHBondContact OG1-OG1 3.15Å; T324-E395 HydrophobicContact CG2-CB 4.46Å; T324-E395 HydrophobicContact CG2-CG 3.92Å; T324-G416 CarbonylContact O-C 3.58Å; T324-G416 VanDerWaalsContact O-CA 3.23Å; T324-G416 WeakPolarHBondContact O-CA 3.32Å; T324-I417 PolarHBondContact N-O 2.98Å; T324-I417 PolarHBondContact O-N 3.49Å
325	L	94.7	Very high	91.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	119.8	175.3	179.1	65.8	0	0	0	108.9	T313 L317 V322 V327 L383 T392 T393 L394 E395	T313-L325 HydrophobicContact CG2-CD1 3.35Å; L317-L325 HydrophobicContact CD1-CD1 4Å; L317-L325 HydrophobicContact CD1-CD2 3.91Å; L317-L325 HydrophobicContact CD2-CD1 4.47Å; L317-L325 HydrophobicContact CD2-CD2 4.12Å; L317-L325 HydrophobicContact CG-CD1 4.49Å; V322-L325 HydrophobicContact CG1-CB 3.99Å; V322-L325 HydrophobicContact CG1-CD1 4.49Å; L325-V327 HydrophobicContact CD1-CG2 4.25Å; L325-V327 HydrophobicContact CD2-CG2 4.15Å; L325-V327 HydrophobicContact CG-CG2 3.78Å; L325-L383 HydrophobicContact CD2-CD1 4.17Å; L325-L383 HydrophobicContact CD2-CD2 3.86Å; L325-L383 HydrophobicContact CD2-CG 4.43Å; L325-T392 HydrophobicContact CB-CG2 4.14Å; L325-T392 HydrophobicContact CD2-CG2 4.41Å; L325-T393 PolarHBondContact N-O 3.03Å; L325-L394 HydrophobicContact CB-CD1 4.44Å; L325-L394 HydrophobicContact CD2-CD1 3.86Å; L325-L394 HydrophobicContact CG-CD1 4.06Å; L325-E395 PolarHBondContact O-N 3.05Å
326	V	94	Very high	91	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.8	-179.8	-173.5	0	0	0	0	108.6	L291 T324 E395 V397 F407 G415	L291-V326 HydrophobicContact CD1-CG2 4.36Å; L291-V326 HydrophobicContact CD2-CG2 4.18Å; L291-V326 HydrophobicContact CG-CG2 4.25Å; T324-V326 HydrophobicContact CG2-CG2 4.39Å; V326-E395 WeakPolarHBondContact CA-O 3.26Å; V326-V397 HydrophobicContact CG1-CB 4.45Å; V326-V397 HydrophobicContact CG1-CG1 3.69Å; V326-V397 HydrophobicContact CG1-CG2 3.84Å; V326-F407 HydrophobicContact CB-CZ 4.09Å; V326-F407 HydrophobicContact CG1-CE1 3.94Å; V326-F407 HydrophobicContact CG1-CE2 4.42Å; V326-F407 HydrophobicContact CG1-CZ 3.87Å; V326-F407 WeakPolarHBondContact O-CZ 3.29Å; V326-G415 PolarHBondContact N-O 3.5Å; V326-G415 PolarHBondContact O-N 2.93Å
327	V	94	Very high	90.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.2	-177.2	-164.8	0	0	0	0	110.9	L325 L331 L380 L383 L394 E395 I396 V397 I414	L325-V327 HydrophobicContact CD1-CG2 4.25Å; L325-V327 HydrophobicContact CD2-CG2 4.15Å; L325-V327 HydrophobicContact CG-CG2 3.78Å; V327-L331 HydrophobicContact CG1-CB 4.08Å; V327-L331 HydrophobicContact CG1-CD2 3.64Å; V327-L331 HydrophobicContact CG1-CG 4.42Å; V327-L380 HydrophobicContact CB-CD1 4.04Å; V327-L380 HydrophobicContact CG1-CD1 3.77Å; V327-L383 HydrophobicContact CG2-CD1 4.16Å; V327-L394 HydrophobicContact CB-CD1 4.23Å; V327-L394 HydrophobicContact CG2-CD1 3.55Å; V327-E395 PolarHBondContact N-O 3.38Å; V327-I396 CarbonylContact O-C 3.6Å; V327-I396 VanDerWaalsContact O-CA 3.3Å; V327-I396 WeakPolarHBondContact O-CA 3.44Å; V327-V397 PolarHBondContact O-N 2.86Å; V327-I414 HydrophobicContact CG2-CG1 4.37Å
328	W	92	Very high	90.7	Very high	45 Å²	45	33.3 Å²	33.3	17%	0.17	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	135	175.1	178.9	45.9	0	0	0	111.7	N330 L331 V397 D399 V408 G413	W328-N330 HydrophobicContact CD2-CB 4.08Å; W328-N330 VanDerWaalsContact CE3-C 3.47Å; W328-N330 HydrophobicContact CE3-CB 4.24Å; W328-N330 HydrophobicContact CH2-CB 3.81Å; W328-N330 HydrophobicContact CZ2-CB 3.63Å; W328-N330 HydrophobicContact CZ3-CB 4.1Å; W328-N330 VanDerWaalsContact CZ3-O 3.24Å; W328-N330 WeakPolarHBondContact CZ3-O 3.25Å; W328-N330 PolarHBondContact O-N 2.84Å; W328-L331 WeakPolarHBondContact O-CB 3.23Å; W328-L331 PolarHBondContact O-N 2.95Å; W328-V397 WeakPolarHBondContact CA-O 3.32Å; W328-D399 HydrophobicContact CZ2-CB 4.4Å; W328-V408 HydrophobicContact CB-CG2 3.89Å; W328-V408 HydrophobicContact CD2-CG1 4.03Å; W328-V408 HydrophobicContact CD2-CG2 3.64Å; W328-V408 HydrophobicContact CE3-CG1 3.86Å; W328-V408 HydrophobicContact CE3-CG2 4.24Å; W328-V408 HydrophobicContact CG-CG2 3.47Å; W328-V408 VanDerWaalsContact CG-CG2 3.47Å; W328-V408 HydrophobicContact CH2-CG1 4.21Å; W328-V408 HydrophobicContact CZ2-CG1 4.35Å; W328-V408 HydrophobicContact CZ3-CG1 3.96Å; W328-G413 WeakPolarHBondContact CB-O 3.47Å; W328-G413 PolarHBondContact N-O 2.81Å
329	E	86.8	Confident	90.4	Very high	51 Å²	51	30.8 Å²	30.8	24%	0.238	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.9	-175.9	67.7	173	174	0	0	114.6	W20 L380 I396 V397 T398	W20-E329 PolarHBondContact NE1-O 3.24Å; E329-L380 WeakPolarHBondContact O-CD2 3.49Å; E329-I396 HydrophobicContact CB-CG2 3.6Å; E329-V397 PolarHBondContact N-O 2.82Å; E329-T398 HydrophobicContact CG-CG2 4.45Å
330	N	87.6	Confident	90	Very high	86 Å²	86	27.7 Å²	27.7	46%	0.46	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	27.8	179.4	-60.3	-50.3	0	0	0	112.3	W328 S332	W328-N330 HydrophobicContact CD2-CB 4.08Å; W328-N330 VanDerWaalsContact CE3-C 3.47Å; W328-N330 HydrophobicContact CE3-CB 4.24Å; W328-N330 HydrophobicContact CH2-CB 3.81Å; W328-N330 HydrophobicContact CZ2-CB 3.63Å; W328-N330 HydrophobicContact CZ3-CB 4.1Å; W328-N330 VanDerWaalsContact CZ3-O 3.24Å; W328-N330 WeakPolarHBondContact CZ3-O 3.25Å; W328-N330 PolarHBondContact O-N 2.84Å; N330-S332 PolarHBondContact O-N 3.05Å; N330-S332 PolarHBondContact O-OG 2.81Å; N330-S332 VanDerWaalsContact O-OG 3.09Å
331	L	89.5	Confident	89.2	Confident	7 Å²	7	28.9 Å²	28.9	4%	0.037	15%	0.148	C	C	.	.			trans	-55.6	105	174.8	-176.8	71.6	0	0	0	110.4	V327 W328 V333 L379 I414	V327-L331 HydrophobicContact CG1-CB 4.08Å; V327-L331 HydrophobicContact CG1-CD2 3.64Å; V327-L331 HydrophobicContact CG1-CG 4.42Å; W328-L331 WeakPolarHBondContact O-CB 3.23Å; W328-L331 PolarHBondContact O-N 2.95Å; L331-V333 VanDerWaalsContact C-N 3.28Å; L331-V333 HydrophobicContact CD1-CG2 3.75Å; L331-V333 HydrophobicContact CD2-CB 4.35Å; L331-V333 HydrophobicContact CD2-CG2 4.33Å; L331-V333 HydrophobicContact CG-CB 4.14Å; L331-V333 HydrophobicContact CG-CG2 3.87Å; L331-V333 PolarHBondContact O-N 3.24Å; L331-V333 VanDerWaalsContact O-N 3.13Å; L331-L379 HydrophobicContact CD2-CD2 4.23Å; L331-I414 HydrophobicContact CD1-CB 4.4Å; L331-I414 HydrophobicContact CD2-CB 4.25Å; L331-I414 HydrophobicContact CD2-CD1 4.13Å
332	S	88.2	Confident	88.4	Confident	63 Å²	63	37.4 Å²	37.4	44%	0.441	19%	0.194	S	C	.	.			trans	-90.1	66.3	-179.6	-57.8	0	0	0	0	109.3	N330 P353	N330-S332 PolarHBondContact O-N 3.05Å; N330-S332 PolarHBondContact O-OG 2.81Å; N330-S332 VanDerWaalsContact O-OG 3.09Å; S332-P353 WeakPolarHBondContact O-CD 3.43Å
333	V	91	Very high	87.4	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.215	C	C	.	.			trans	-126.6	123.4	174.5	178.2	0	0	0	0	107.5	V310 L331 H350 L351 R352 L379	V310-V333 HydrophobicContact CG1-CG1 4.45Å; V310-V333 HydrophobicContact CG2-CG1 4.17Å; V310-V333 HydrophobicContact CG2-CG2 4.01Å; L331-V333 VanDerWaalsContact C-N 3.28Å; L331-V333 HydrophobicContact CD1-CG2 3.75Å; L331-V333 HydrophobicContact CD2-CB 4.35Å; L331-V333 HydrophobicContact CD2-CG2 4.33Å; L331-V333 HydrophobicContact CG-CB 4.14Å; L331-V333 HydrophobicContact CG-CG2 3.87Å; L331-V333 PolarHBondContact O-N 3.24Å; L331-V333 VanDerWaalsContact O-N 3.13Å; V333-H350 HydrophobicContact CG1-CB 3.98Å; V333-L351 WeakPolarHBondContact CA-O 3.42Å; V333-R352 HydrophobicContact CG2-CG 3.97Å; V333-L379 HydrophobicContact CB-CB 4.18Å; V333-L379 HydrophobicContact CB-CD2 4.28Å; V333-L379 HydrophobicContact CG1-CB 4.12Å; V333-L379 HydrophobicContact CG1-CD2 3.85Å; V333-L379 WeakPolarHBondContact O-CB 2.97Å; V333-L379 PolarHBondContact O-N 3.31Å
334	N	91.3	Very high	86.4	Confident	30 Å²	30	46.5 Å²	46.5	16%	0.16	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.4	176.1	-78	-35	0	0	0	110.2	Y336 H350 L351 E356 L378	N334-Y336 HydrophobicContact CB-CD2 4.23Å; N334-Y336 HydrophobicContact CB-CE2 3.5Å; N334-Y336 VanDerWaalsContact CB-CE2 3.5Å; N334-H350 CarbonylContact O-C 3.58Å; N334-H350 VanDerWaalsContact O-CA 3.3Å; N334-H350 WeakPolarHBondContact O-CA 3.44Å; N334-L351 PolarHBondContact N-O 3.37Å; N334-L351 PolarHBondContact O-N 3.35Å; N334-E356 PolarHBondContact ND2-OE1 3.41Å; N334-L378 WeakPolarHBondContact OD1-CD2 3.44Å
335	R	92.8	Very high	85.5	Confident	35 Å²	35	47.8 Å²	47.8	13%	0.132	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.1	172.1	178.7	177.4	-179.7	-77.5	-7	108.3	V337 V348 T376 Q377	R335-V337 VanDerWaalsContact NH1-CG2 3.31Å; R335-V348 HydrophobicContact CG-CG1 3.9Å; R335-T376 WeakPolarHBondContact O-CA 3.43Å; R335-Q377 HydrophobicContact CB-CG 4.25Å; R335-Q377 PolarHBondContact N-O 3.19Å; R335-Q377 PolarHBondContact O-N 3.11Å; R335-Q377 VanDerWaalsContact O-N 3.07Å
336	Y	89.3	Confident	85	Confident	18 Å²	18	52.3 Å²	52.3	7%	0.071	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.4	175.6	-65.8	-94.1	0	0	0	110	N334 V348 I349 L351 E356 F362 I373 D375 T376	N334-Y336 HydrophobicContact CB-CD2 4.23Å; N334-Y336 HydrophobicContact CB-CE2 3.5Å; N334-Y336 VanDerWaalsContact CB-CE2 3.5Å; Y336-V348 WeakPolarHBondContact O-CA 3.18Å; Y336-I349 HydrophobicContact CD2-CG1 4.43Å; Y336-I349 HydrophobicContact CG-CG1 4.45Å; Y336-I349 PolarHBondContact N-O 3.35Å; Y336-I349 PolarHBondContact O-N 3.3Å; Y336-L351 HydrophobicContact CD2-CB 4.38Å; Y336-L351 HydrophobicContact CD2-CD1 4.13Å; Y336-L351 HydrophobicContact CD2-CG 4.26Å; Y336-L351 HydrophobicContact CE2-CB 4.06Å; Y336-L351 HydrophobicContact CE2-CD1 4.06Å; Y336-L351 HydrophobicContact CE2-CG 4.33Å; Y336-E356 HydrophobicContact CE2-CG 4.23Å; Y336-E356 WeakPolarHBondContact OH-CG 3.34Å; Y336-E356 PolarHBondContact OH-OE1 2.95Å; Y336-E356 PolarHBondContact OH-OE2 3.36Å; Y336-F362 HydrophobicContact CD1-CE1 4.11Å; Y336-F362 HydrophobicContact CE1-CE1 4.23Å; Y336-F362 HydrophobicContact CE1-CZ 4.35Å; Y336-F362 HydrophobicContact CG-CE1 4.5Å; Y336-I373 HydrophobicContact CD1-CG2 4.1Å; Y336-D375 WeakPolarHBondContact CA-O 3.46Å; Y336-T376 HydrophobicContact CD1-CG2 3.85Å; Y336-T376 VanDerWaalsContact CD1-OG1 3.26Å; Y336-T376 WeakPolarHBondContact CD1-OG1 3.47Å; Y336-T376 HydrophobicContact CE1-CG2 3.4Å; Y336-T376 VanDerWaalsContact CE1-CG2 3.4Å; Y336-T376 WeakPolarHBondContact CE1-OG1 3.3Å; Y336-T376 HydrophobicContact CE2-CG2 4.47Å
337	V	88.8	Confident	84.6	Confident	17 Å²	17	57.4 Å²	57.4	10%	0.103	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112	166.3	-174	0	0	0	0	107.1	R335 N346 V348 L374 D375	R335-V337 VanDerWaalsContact NH1-CG2 3.31Å; V337-N346 HydrophobicContact CG1-CB 4Å; V337-V348 HydrophobicContact CG2-CG2 4.42Å; V337-L374 HydrophobicContact CG1-CD1 4.47Å; V337-L374 WeakPolarHBondContact O-CB 3.12Å; V337-L374 PolarHBondContact O-N 3.38Å; V337-D375 HydrophobicContact CB-CB 4.1Å; V337-D375 HydrophobicContact CG2-CB 4.12Å; V337-D375 PolarHBondContact N-O 2.76Å; V337-D375 PolarHBondContact O-N 3.11Å
338	L	87.2	Confident	84.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.6	-177.5	-57.2	-175.4	0	0	0	110.2	N346 R347 I349 F362 L371 E372 I373	L338-N346 CarbonylContact O-C 3.53Å; L338-N346 WeakPolarHBondContact O-CA 3.48Å; L338-R347 HydrophobicContact CB-CB 4.43Å; L338-R347 WeakPolarHBondContact CB-O 3.49Å; L338-R347 PolarHBondContact N-O 3.21Å; L338-R347 PolarHBondContact O-N 2.83Å; L338-I349 HydrophobicContact CD1-CD1 3.53Å; L338-I349 HydrophobicContact CD1-CG1 3.93Å; L338-I349 HydrophobicContact CG-CD1 4.39Å; L338-I349 HydrophobicContact CG-CG1 4.35Å; L338-F362 HydrophobicContact CD1-CD1 4.39Å; L338-F362 HydrophobicContact CD2-CD1 4.18Å; L338-F362 HydrophobicContact CD2-CE1 4.4Å; L338-L371 HydrophobicContact CB-CB 4.18Å; L338-L371 HydrophobicContact CB-CD1 4.36Å; L338-L371 HydrophobicContact CD1-CB 4.14Å; L338-L371 HydrophobicContact CD1-CD1 3.65Å; L338-E372 CarbonylContact C-O 3.46Å; L338-E372 WeakPolarHBondContact CA-O 3.34Å; L338-I373 HydrophobicContact CD2-CB 4.2Å; L338-I373 HydrophobicContact CD2-CG1 3.65Å; L338-I373 HydrophobicContact CD2-CG2 4.49Å
339	K	82.8	Confident	84.1	Confident	93 Å²	93	59 Å²	59	40%	0.404	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.9	172.1	-169.2	177.9	179	-176.2	0	109.7	E372 L374	K339-E372 HydrophobicContact CB-CB 4.36Å; K339-E372 PolarHBondContact N-O 3.23Å; K339-E372 PolarHBondContact O-N 3.13Å; K339-E372 VanDerWaalsContact O-N 3.09Å; K339-L374 HydrophobicContact CB-CD1 3.81Å; K339-L374 HydrophobicContact CB-CD2 4.19Å; K339-L374 HydrophobicContact CB-CG 3.87Å; K339-L374 HydrophobicContact CD-CD1 4.37Å; K339-L374 HydrophobicContact CD-CD2 4.31Å; K339-L374 HydrophobicContact CG-CD1 4.44Å
340	V	80	Confident	84.4	Confident	23 Å²	23	59 Å²	59	14%	0.139	32%	0.315	C	S	.	.			trans	-81.9	126.5	173.4	-175.8	0	0	0	0	108.6	N342 S343 L371	V340-N342 PolarHBondContact O-N 3.39Å; V340-S343 PolarHBondContact O-N 2.96Å; V340-L371 HydrophobicContact CB-CD2 4.04Å; V340-L371 HydrophobicContact CG1-CD2 4.24Å; V340-L371 HydrophobicContact CG2-CD2 3.69Å
341	P	74.1	Confident	84.3	Confident	52 Å²	52	55.1 Å²	55.1	34%	0.338	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	128.8	171.8	-22.3	33	0	0	0	110.1	S343 D370	P341-S343 VanDerWaalsContact C-N 3.34Å; P341-S343 PolarHBondContact O-N 2.98Å; P341-D370 WeakPolarHBondContact CG-O 3.41Å
342	N	72.5	Confident	84.3	Confident	179 Å²	179	58.7 Å²	58.7	96%	0.957	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	10.1	-179.8	-49.1	-32.8	0	0	0	117.3	V340	V340-N342 PolarHBondContact O-N 3.39Å
343	S	71.7	Confident	84	Confident	63 Å²	63	59 Å²	59	44%	0.441	31%	0.308	S	S	.	.			trans	-118.6	146.9	168.7	-172	0	0	0	0	110.8	V340 P341 G345	V340-S343 PolarHBondContact O-N 2.96Å; P341-S343 VanDerWaalsContact C-N 3.34Å; P341-S343 PolarHBondContact O-N 2.98Å; S343-G345 PolarHBondContact OG-N 2.74Å
344	E	73.1	Confident	83.7	Confident	203 Å²	203	64.3 Å²	64.3	95%	0.949	34%	0.337	S	S	*	.	S	Bend	trans	-77.6	-11.8	173.1	-70.2	-169.4	159.3	0	0	112.4
345	G	75.2	Confident	83.3	Confident	37 Å²	37	66.3 Å²	66.3	38%	0.381	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-79.6	133.2	-179.5	0	0	0	0	0	113.6	S343	S343-G345 PolarHBondContact OG-N 2.74Å
346	N	84.2	Confident	82.7	Confident	96 Å²	96	67.4 Å²	67.4	51%	0.513	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135.3	166	-67.2	-19.9	0	0	0	109.6	V337 L338	V337-N346 HydrophobicContact CG1-CB 4Å; L338-N346 CarbonylContact O-C 3.53Å; L338-N346 WeakPolarHBondContact O-CA 3.48Å
347	R	84	Confident	82.2	Confident	107 Å²	107	72.1 Å²	72.1	40%	0.404	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.1	173	-172.8	178.2	-179.7	-179.1	0	109.4	L338 I349	L338-R347 HydrophobicContact CB-CB 4.43Å; L338-R347 WeakPolarHBondContact CB-O 3.49Å; L338-R347 PolarHBondContact N-O 3.21Å; L338-R347 PolarHBondContact O-N 2.83Å; R347-I349 HydrophobicContact CG-CG2 4.13Å
348	V	87.3	Confident	81.8	Confident	57 Å²	57	73.4 Å²	73.4	35%	0.345	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.3	175.5	-175.5	0	0	0	0	108.7	R335 Y336 V337	R335-V348 HydrophobicContact CG-CG1 3.9Å; Y336-V348 WeakPolarHBondContact O-CA 3.18Å; V337-V348 HydrophobicContact CG2-CG2 4.42Å
349	I	89.5	Confident	81.4	Confident	20 Å²	20	83.5 Å²	83.5	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	152.4	175.4	65.5	171.5	0	0	0	110.6	Y336 L338 R347 L351 H361	Y336-I349 HydrophobicContact CD2-CG1 4.43Å; Y336-I349 HydrophobicContact CG-CG1 4.45Å; Y336-I349 PolarHBondContact N-O 3.35Å; Y336-I349 PolarHBondContact O-N 3.3Å; L338-I349 HydrophobicContact CD1-CD1 3.53Å; L338-I349 HydrophobicContact CD1-CG1 3.93Å; L338-I349 HydrophobicContact CG-CD1 4.39Å; L338-I349 HydrophobicContact CG-CG1 4.35Å; R347-I349 HydrophobicContact CG-CG2 4.13Å; I349-L351 HydrophobicContact CD1-CD1 3.75Å; I349-L351 HydrophobicContact CD1-CD2 4.29Å; I349-L351 HydrophobicContact CD1-CG 4Å; I349-L351 HydrophobicContact CG1-CD1 4.49Å; I349-L351 HydrophobicContact CG1-CG 4.34Å; I349-H361 HydrophobicContact CD1-CB 4.04Å; I349-H361 WeakPolarHBondContact CD1-O 3.24Å
350	H	91.7	Very high	81.3	Confident	52 Å²	52	88.3 Å²	88.3	24%	0.241	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	115.8	179.7	-55.5	93.2	0	0	0	108.5	V310 L314 V333 N334	V310-H350 HydrophobicContact CG1-CB 3.64Å; L314-H350 WeakPolarHBondContact CD1-CE1 3.19Å; L314-H350 WeakPolarHBondContact CD1-ND1 3.36Å; L314-H350 WeakPolarHBondContact CD1-NE2 3.09Å; V333-H350 HydrophobicContact CG1-CB 3.98Å; N334-H350 CarbonylContact O-C 3.58Å; N334-H350 VanDerWaalsContact O-CA 3.3Å; N334-H350 WeakPolarHBondContact O-CA 3.44Å
351	L	87.2	Confident	81.3	Confident	5 Å²	5	90.3 Å²	90.3	3%	0.026	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.7	-175.3	-59.1	178.3	0	0	0	110.4	V333 N334 Y336 I349 Q355 E356 H361 F362	V333-L351 WeakPolarHBondContact CA-O 3.42Å; N334-L351 PolarHBondContact N-O 3.37Å; N334-L351 PolarHBondContact O-N 3.35Å; Y336-L351 HydrophobicContact CD2-CB 4.38Å; Y336-L351 HydrophobicContact CD2-CD1 4.13Å; Y336-L351 HydrophobicContact CD2-CG 4.26Å; Y336-L351 HydrophobicContact CE2-CB 4.06Å; Y336-L351 HydrophobicContact CE2-CD1 4.06Å; Y336-L351 HydrophobicContact CE2-CG 4.33Å; I349-L351 HydrophobicContact CD1-CD1 3.75Å; I349-L351 HydrophobicContact CD1-CD2 4.29Å; I349-L351 HydrophobicContact CD1-CG 4Å; I349-L351 HydrophobicContact CG1-CD1 4.49Å; I349-L351 HydrophobicContact CG1-CG 4.34Å; L351-Q355 HydrophobicContact CB-CB 4.28Å; L351-Q355 HydrophobicContact CD2-CB 4.11Å; L351-E356 HydrophobicContact CB-CG 4.05Å; L351-E356 HydrophobicContact CD1-CG 4.46Å; L351-H361 HydrophobicContact CD1-CB 3.9Å; L351-H361 HydrophobicContact CD2-CB 4.1Å; L351-F362 HydrophobicContact CD1-CE1 4.5Å; L351-F362 HydrophobicContact CD1-CE2 4.07Å; L351-F362 HydrophobicContact CD1-CZ 3.74Å
352	R	87.8	Confident	81.6	Confident	82 Å²	82	89.6 Å²	89.6	31%	0.309	44%	0.442	S	S	.	.			trans	-85.1	157.5	164.4	-67.4	178.3	-176.5	-87.7	-0.7	109.9	V333 D354 Q355 E356 G412	V333-R352 HydrophobicContact CG2-CG 3.97Å; R352-D354 WeakPolarHBondContact CB-OD1 3.46Å; R352-D354 PolarHBondContact O-N 3.19Å; R352-Q355 HydrophobicContact CB-CG 4.46Å; R352-Q355 WeakPolarHBondContact O-CA 3.3Å; R352-Q355 WeakPolarHBondContact O-CB 3.4Å; R352-Q355 PolarHBondContact O-N 2.77Å; R352-E356 PolarHBondContact O-N 3.35Å; R352-E356 VanDerWaalsContact O-N 3.12Å; R352-G412 PolarHBondContact NH2-O 3.05Å
353	P	83.3	Confident	81.9	Confident	69 Å²	69	83 Å²	83	45%	0.448	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.3	-178.6	-30.6	33.8	0	0	0	115.3	S332	S332-P353 WeakPolarHBondContact O-CD 3.43Å
354	D	84	Confident	82.1	Confident	113 Å²	113	80.7 Å²	80.7	60%	0.604	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-33.7	175	56.5	-52.5	0	0	0	112.7	R352 T357	R352-D354 WeakPolarHBondContact CB-OD1 3.46Å; R352-D354 PolarHBondContact O-N 3.19Å; D354-T357 PolarHBondContact O-OG1 3.18Å
355	Q	83.1	Confident	82.1	Confident	72 Å²	72	75.8 Å²	75.8	34%	0.336	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-81.7	-23.8	179.7	-58.8	175.7	-44.3	0	0	112.8	L351 R352 T357 D358 H361	L351-Q355 HydrophobicContact CB-CB 4.28Å; L351-Q355 HydrophobicContact CD2-CB 4.11Å; R352-Q355 HydrophobicContact CB-CG 4.46Å; R352-Q355 WeakPolarHBondContact O-CA 3.3Å; R352-Q355 WeakPolarHBondContact O-CB 3.4Å; R352-Q355 PolarHBondContact O-N 2.77Å; Q355-T357 PolarHBondContact O-N 2.91Å; Q355-T357 VanDerWaalsContact O-N 3.15Å; Q355-D358 PolarHBondContact O-N 3.44Å; Q355-H361 PolarHBondContact O-CD2 2.86Å
356	E	79.7	Confident	82.1	Confident	57 Å²	57	82.7 Å²	82.7	27%	0.266	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-60.4	-24.1	178.3	-70.9	174.6	-160.4	0	0	113.3	N334 Y336 L351 R352 D358	N334-E356 PolarHBondContact ND2-OE1 3.41Å; Y336-E356 HydrophobicContact CE2-CG 4.23Å; Y336-E356 WeakPolarHBondContact OH-CG 3.34Å; Y336-E356 PolarHBondContact OH-OE1 2.95Å; Y336-E356 PolarHBondContact OH-OE2 3.36Å; L351-E356 HydrophobicContact CB-CG 4.05Å; L351-E356 HydrophobicContact CD1-CG 4.46Å; R352-E356 PolarHBondContact O-N 3.35Å; R352-E356 VanDerWaalsContact O-N 3.12Å; E356-D358 VanDerWaalsContact C-N 3.3Å
357	T	78.7	Confident	81.6	Confident	118 Å²	118	82.1 Å²	82.1	72%	0.724	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-76.3	-17	177.2	63.3	0	0	0	0	113.5	D354 Q355 R359	D354-T357 PolarHBondContact O-OG1 3.18Å; Q355-T357 PolarHBondContact O-N 2.91Å; Q355-T357 VanDerWaalsContact O-N 3.15Å; T357-R359 PolarHBondContact O-N 3.1Å
358	D	81.6	Confident	81.2	Confident	44 Å²	44	79.5 Å²	79.5	24%	0.235	41%	0.405	C	S	.	.			trans	-84.9	107.3	-178.9	-168.3	-13.8	0	0	0	110.9	Q355 E356 R360 H361	Q355-D358 PolarHBondContact O-N 3.44Å; E356-D358 VanDerWaalsContact C-N 3.3Å; D358-R360 PolarHBondContact O-N 2.76Å; D358-R360 VanDerWaalsContact OD1-CB 3.31Å; D358-R360 WeakPolarHBondContact OD1-CB 3.41Å; D358-R360 VanDerWaalsContact OD1-CG 3.31Å; D358-R360 WeakPolarHBondContact OD1-CG 3.32Å; D358-R360 IonicContact OD1-CZ 2.67Å; D358-R360 PolarHBondContact OD1-N 2.92Å; D358-R360 IonicContact OD1-NE 2.93Å; D358-R360 PolarHBondContact OD1-NE 2.66Å; D358-R360 IonicContact OD2-CZ 3.77Å; D358-R360 IonicContact OD2-NE 3.77Å; D358-R360 PolarHBondContact OD2-NE 3.29Å; D358-R360 IonicContact OD2-NH2 3.94Å; D358-R360 PolarHBondContact OD2-NH2 2.84Å; D358-H361 PolarHBondContact O-N 2.94Å
359	R	78.9	Confident	80.7	Confident	212 Å²	212	78.8 Å²	78.8	80%	0.8	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-56.7	-24	179.6	-69.9	-174.3	176.7	-172.4	-2.2	113.2	T357 H361 F362 V363	T357-R359 PolarHBondContact O-N 3.1Å; R359-H361 PolarHBondContact O-N 3.34Å; R359-H361 VanDerWaalsContact O-N 3.14Å; R359-F362 PolarHBondContact O-N 2.81Å; R359-V363 WeakPolarHBondContact O-CG2 3.48Å; R359-V363 PolarHBondContact O-N 3.45Å
360	R	81	Confident	80.4	Confident	194 Å²	194	83.9 Å²	83.9	73%	0.732	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-59.5	-25.9	-179.6	-67.6	-180	-72.8	178.5	-2.2	113.2	D358 F362	D358-R360 PolarHBondContact O-N 2.76Å; D358-R360 VanDerWaalsContact OD1-CB 3.31Å; D358-R360 WeakPolarHBondContact OD1-CB 3.41Å; D358-R360 VanDerWaalsContact OD1-CG 3.31Å; D358-R360 WeakPolarHBondContact OD1-CG 3.32Å; D358-R360 IonicContact OD1-CZ 2.67Å; D358-R360 PolarHBondContact OD1-N 2.92Å; D358-R360 IonicContact OD1-NE 2.93Å; D358-R360 PolarHBondContact OD1-NE 2.66Å; D358-R360 IonicContact OD2-CZ 3.77Å; D358-R360 IonicContact OD2-NE 3.77Å; D358-R360 PolarHBondContact OD2-NE 3.29Å; D358-R360 IonicContact OD2-NH2 3.94Å; D358-R360 PolarHBondContact OD2-NH2 2.84Å; R360-F362 VanDerWaalsContact C-N 3.27Å; R360-F362 PolarHBondContact O-N 2.87Å
361	H	78.1	Confident	79.9	Confident	65 Å²	65	82 Å²	82	30%	0.301	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-74.8	-17.5	176.6	-67.6	-61.3	0	0	0	113.8	I349 L351 Q355 D358 R359	I349-H361 HydrophobicContact CD1-CB 4.04Å; I349-H361 WeakPolarHBondContact CD1-O 3.24Å; L351-H361 HydrophobicContact CD1-CB 3.9Å; L351-H361 HydrophobicContact CD2-CB 4.1Å; Q355-H361 PolarHBondContact O-CD2 2.86Å; D358-H361 PolarHBondContact O-N 2.94Å; R359-H361 PolarHBondContact O-N 3.34Å; R359-H361 VanDerWaalsContact O-N 3.14Å
362	F	81.3	Confident	79.8	Confident	36 Å²	36	87.4 Å²	87.4	16%	0.158	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-109.2	9.4	-178	-58.3	-80.6	0	0	0	112.7	Y336 L338 L351 R359 R360 L371 I373	Y336-F362 HydrophobicContact CD1-CE1 4.11Å; Y336-F362 HydrophobicContact CE1-CE1 4.23Å; Y336-F362 HydrophobicContact CE1-CZ 4.35Å; Y336-F362 HydrophobicContact CG-CE1 4.5Å; L338-F362 HydrophobicContact CD1-CD1 4.39Å; L338-F362 HydrophobicContact CD2-CD1 4.18Å; L338-F362 HydrophobicContact CD2-CE1 4.4Å; L351-F362 HydrophobicContact CD1-CE1 4.5Å; L351-F362 HydrophobicContact CD1-CE2 4.07Å; L351-F362 HydrophobicContact CD1-CZ 3.74Å; R359-F362 PolarHBondContact O-N 2.81Å; R360-F362 VanDerWaalsContact C-N 3.27Å; R360-F362 PolarHBondContact O-N 2.87Å; F362-L371 WeakPolarHBondContact O-CB 3.5Å; F362-L371 PolarHBondContact O-N 2.84Å; F362-I373 HydrophobicContact CD1-CD1 4.02Å; F362-I373 HydrophobicContact CD1-CG1 4.13Å; F362-I373 HydrophobicContact CE1-CD1 3.82Å; F362-I373 HydrophobicContact CE1-CG1 4.18Å
363	V	79.4	Confident	79.7	Confident	40 Å²	40	87.5 Å²	87.5	24%	0.242	45%	0.453	C	S	.	.	B	Isolated β-bridge	trans	-116	134.6	175.2	-179.4	0	0	0	0	107.9	R359 P365 G368	R359-V363 WeakPolarHBondContact O-CG2 3.48Å; R359-V363 PolarHBondContact O-N 3.45Å; V363-P365 WeakPolarHBondContact O-CD 3.29Å; V363-G368 WeakPolarHBondContact CG1-O 3.38Å
364	D	75.1	Confident	79.8	Confident	16 Å²	16	88.2 Å²	88.2	9%	0.086	45%	0.452	C	S	.	.			trans	-66.9	119.5	173.2	-179.2	14.7	0	0	0	110	E366 T367 G368 S369 L371	D364-E366 PolarHBondContact O-N 2.95Å; D364-E366 PolarHBondContact OD1-N 2.83Å; D364-T367 WeakPolarHBondContact CB-OG1 3.29Å; D364-T367 WeakPolarHBondContact OD2-CB 3.48Å; D364-T367 WeakPolarHBondContact OD2-CG2 3.31Å; D364-T367 PolarHBondContact OD2-N 3.14Å; D364-T367 PolarHBondContact OD2-OG1 3.11Å; D364-G368 VanDerWaalsContact O-CA 3.23Å; D364-G368 WeakPolarHBondContact O-CA 3.33Å; D364-G368 PolarHBondContact O-N 3.44Å; D364-S369 PolarHBondContact N-O 2.85Å; D364-L371 HydrophobicContact CB-CD2 3.93Å; D364-L371 HydrophobicContact CB-CG 4.39Å
365	P	73.3	Confident	79.9	Confident	100 Å²	100	86.1 Å²	86.1	65%	0.649	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.3	-179.8	22.9	-33.1	0	0	0	113.7	V363	V363-P365 WeakPolarHBondContact O-CD 3.29Å
366	E	74.3	Confident	80.1	Confident	181 Å²	181	85.8 Å²	85.8	85%	0.846	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-46.2	-177.6	-64.8	-171.3	172.2	0	0	112.7	D364	D364-E366 PolarHBondContact O-N 2.95Å; D364-E366 PolarHBondContact OD1-N 2.83Å
367	T	74.4	Confident	80.6	Confident	84 Å²	84	85.2 Å²	85.2	52%	0.515	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-15.5	-176.3	64.2	0	0	0	0	113.8	D364 S369	D364-T367 WeakPolarHBondContact CB-OG1 3.29Å; D364-T367 WeakPolarHBondContact OD2-CB 3.48Å; D364-T367 WeakPolarHBondContact OD2-CG2 3.31Å; D364-T367 PolarHBondContact OD2-N 3.14Å; D364-T367 PolarHBondContact OD2-OG1 3.11Å; T367-S369 VanDerWaalsContact CB-OG 3.3Å; T367-S369 WeakPolarHBondContact CB-OG 3.17Å; T367-S369 PolarHBondContact O-N 2.76Å; T367-S369 WeakPolarHBondContact OG1-CB 3.28Å; T367-S369 PolarHBondContact OG1-N 2.72Å; T367-S369 PolarHBondContact OG1-OG 3.07Å
368	G	75.1	Confident	81.2	Confident	53 Å²	53	82.2 Å²	82.2	55%	0.546	42%	0.421	S	S	.	.			trans	67.6	10.1	-171	0	0	0	0	0	113.6	V363 D364	V363-G368 WeakPolarHBondContact CG1-O 3.38Å; D364-G368 VanDerWaalsContact O-CA 3.23Å; D364-G368 WeakPolarHBondContact O-CA 3.33Å; D364-G368 PolarHBondContact O-N 3.44Å
369	S	78.5	Confident	81.7	Confident	41 Å²	41	80.1 Å²	80.1	29%	0.287	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-81.1	142.7	-178.1	-44.2	0	0	0	0	111	D364 T367 L371	D364-S369 PolarHBondContact N-O 2.85Å; T367-S369 VanDerWaalsContact CB-OG 3.3Å; T367-S369 WeakPolarHBondContact CB-OG 3.17Å; T367-S369 PolarHBondContact O-N 2.76Å; T367-S369 WeakPolarHBondContact OG1-CB 3.28Å; T367-S369 PolarHBondContact OG1-N 2.72Å; T367-S369 PolarHBondContact OG1-OG 3.07Å; S369-L371 PolarHBondContact O-N 2.63Å
370	D	81.6	Confident	82.2	Confident	128 Å²	128	70.2 Å²	70.2	68%	0.684	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-65.4	129.9	171.7	-69.3	-33.4	0	0	0	110.3	P341	P341-D370 WeakPolarHBondContact CG-O 3.41Å
371	L	82.4	Confident	82.6	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.063	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-81.6	134.5	177.2	-62.9	174.3	0	0	0	110.2	L338 V340 F362 D364 S369	L338-L371 HydrophobicContact CB-CB 4.18Å; L338-L371 HydrophobicContact CB-CD1 4.36Å; L338-L371 HydrophobicContact CD1-CB 4.14Å; L338-L371 HydrophobicContact CD1-CD1 3.65Å; V340-L371 HydrophobicContact CB-CD2 4.04Å; V340-L371 HydrophobicContact CG1-CD2 4.24Å; V340-L371 HydrophobicContact CG2-CD2 3.69Å; F362-L371 WeakPolarHBondContact O-CB 3.5Å; F362-L371 PolarHBondContact O-N 2.84Å; D364-L371 HydrophobicContact CB-CD2 3.93Å; D364-L371 HydrophobicContact CB-CG 4.39Å; S369-L371 PolarHBondContact O-N 2.63Å
372	E	83.9	Confident	83.2	Confident	119 Å²	119	61.7 Å²	61.7	56%	0.556	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	129	177.7	-174.1	-177.8	-172.3	0	0	110.2	L338 K339 L374	L338-E372 CarbonylContact C-O 3.46Å; L338-E372 WeakPolarHBondContact CA-O 3.34Å; K339-E372 HydrophobicContact CB-CB 4.36Å; K339-E372 PolarHBondContact N-O 3.23Å; K339-E372 PolarHBondContact O-N 3.13Å; K339-E372 VanDerWaalsContact O-N 3.09Å; E372-L374 PolarHBondContact O-N 3Å
373	I	85.3	Confident	83.7	Confident	83 Å²	83	60 Å²	60	43%	0.426	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	111.4	175.8	-57.3	169.6	0	0	0	108.8	Y336 L338 F362 T376	Y336-I373 HydrophobicContact CD1-CG2 4.1Å; L338-I373 HydrophobicContact CD2-CB 4.2Å; L338-I373 HydrophobicContact CD2-CG1 3.65Å; L338-I373 HydrophobicContact CD2-CG2 4.49Å; F362-I373 HydrophobicContact CD1-CD1 4.02Å; F362-I373 HydrophobicContact CD1-CG1 4.13Å; F362-I373 HydrophobicContact CE1-CD1 3.82Å; F362-I373 HydrophobicContact CE1-CG1 4.18Å; I373-T376 VanDerWaalsContact CG2-OG1 3.31Å; I373-T376 WeakPolarHBondContact CG2-OG1 3.42Å
374	L	85.7	Confident	84.1	Confident	84 Å²	84	58.3 Å²	58.3	44%	0.44	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-41.8	176.9	-65.1	-179.1	0	0	0	112.6	V337 K339 E372	V337-L374 HydrophobicContact CG1-CD1 4.47Å; V337-L374 WeakPolarHBondContact O-CB 3.12Å; V337-L374 PolarHBondContact O-N 3.38Å; K339-L374 HydrophobicContact CB-CD1 3.81Å; K339-L374 HydrophobicContact CB-CD2 4.19Å; K339-L374 HydrophobicContact CB-CG 3.87Å; K339-L374 HydrophobicContact CD-CD1 4.37Å; K339-L374 HydrophobicContact CD-CD2 4.31Å; K339-L374 HydrophobicContact CG-CD1 4.44Å; E372-L374 PolarHBondContact O-N 3Å
375	D	86.7	Confident	84.6	Confident	70 Å²	70	62.1 Å²	62.1	37%	0.374	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	146.5	-177.2	-175.7	38.3	0	0	0	110.6	Y336 V337 Q377	Y336-D375 WeakPolarHBondContact CA-O 3.46Å; V337-D375 HydrophobicContact CB-CB 4.1Å; V337-D375 HydrophobicContact CG2-CB 4.12Å; V337-D375 PolarHBondContact N-O 2.76Å; V337-D375 PolarHBondContact O-N 3.11Å; D375-Q377 PolarHBondContact OD2-NE2 3.41Å
376	T	87.2	Confident	85.4	Confident	65 Å²	65	59.9 Å²	59.9	40%	0.399	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	120.2	175.4	-56.1	0	0	0	0	108.4	R335 Y336 I373	R335-T376 WeakPolarHBondContact O-CA 3.43Å; Y336-T376 HydrophobicContact CD1-CG2 3.85Å; Y336-T376 VanDerWaalsContact CD1-OG1 3.26Å; Y336-T376 WeakPolarHBondContact CD1-OG1 3.47Å; Y336-T376 HydrophobicContact CE1-CG2 3.4Å; Y336-T376 VanDerWaalsContact CE1-CG2 3.4Å; Y336-T376 WeakPolarHBondContact CE1-OG1 3.3Å; Y336-T376 HydrophobicContact CE2-CG2 4.47Å; I373-T376 VanDerWaalsContact CG2-OG1 3.31Å; I373-T376 WeakPolarHBondContact CG2-OG1 3.42Å
377	Q	89.7	Confident	86.1	Confident	44 Å²	44	51.7 Å²	51.7	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.5	179.1	62.5	-174	-54.5	0	0	110.4	R335 D375 L379 W382	R335-Q377 HydrophobicContact CB-CG 4.25Å; R335-Q377 PolarHBondContact N-O 3.19Å; R335-Q377 PolarHBondContact O-N 3.11Å; R335-Q377 VanDerWaalsContact O-N 3.07Å; D375-Q377 PolarHBondContact OD2-NE2 3.41Å; Q377-L379 PolarHBondContact O-N 3.03Å; Q377-W382 HydrophobicContact CG-CB 4.27Å
378	L	91.1	Very high	86.6	Confident	56 Å²	56	54.6 Å²	54.6	29%	0.293	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.8	173.7	-76.3	160.2	0	0	0	109.6	N334 L380 D381 W382	N334-L378 WeakPolarHBondContact OD1-CD2 3.44Å; L378-L380 PolarHBondContact O-N 2.69Å; L378-D381 HydrophobicContact CB-CB 4.38Å; L378-D381 WeakPolarHBondContact O-CB 3.41Å; L378-D381 PolarHBondContact O-N 2.93Å; L378-W382 PolarHBondContact O-N 3.06Å; L378-W382 VanDerWaalsContact O-N 3.11Å
379	L	91.8	Very high	87.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.4	-39.2	-179.6	178.2	57.9	0	0	0	111.4	V310 L314 L331 V333 Q377 D381 W382 L383 I414	V310-L379 HydrophobicContact CG1-CD2 3.71Å; V310-L379 HydrophobicContact CG2-CD2 4.36Å; L314-L379 HydrophobicContact CD1-CD1 4.44Å; L314-L379 HydrophobicContact CD2-CD1 4.3Å; L331-L379 HydrophobicContact CD2-CD2 4.23Å; V333-L379 HydrophobicContact CB-CB 4.18Å; V333-L379 HydrophobicContact CB-CD2 4.28Å; V333-L379 HydrophobicContact CG1-CB 4.12Å; V333-L379 HydrophobicContact CG1-CD2 3.85Å; V333-L379 WeakPolarHBondContact O-CB 2.97Å; V333-L379 PolarHBondContact O-N 3.31Å; Q377-L379 PolarHBondContact O-N 3.03Å; L379-D381 VanDerWaalsContact C-N 3.33Å; L379-D381 PolarHBondContact O-N 3.08Å; L379-W382 HydrophobicContact CD1-CE3 4.15Å; L379-W382 PolarHBondContact O-N 3.12Å; L379-L383 HydrophobicContact CD1-CD1 4.29Å; L379-L383 HydrophobicContact CD1-CG 4.19Å; L379-L383 HydrophobicContact CG-CD1 3.97Å; L379-L383 HydrophobicContact CG-CG 4.35Å; L379-L383 WeakPolarHBondContact O-CB 3.44Å; L379-L383 VanDerWaalsContact O-CG 3.31Å; L379-L383 WeakPolarHBondContact O-CG 3.21Å; L379-L383 PolarHBondContact O-N 2.94Å; L379-I414 HydrophobicContact CD2-CD1 4.09Å
380	L	90.9	Very high	87.6	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-35.1	176.3	-179.5	56.5	0	0	0	112.8	W20 V327 E329 L378 L383 A384 I396	W20-L380 HydrophobicContact CD2-CD2 4.48Å; W20-L380 HydrophobicContact CH2-CB 4.23Å; W20-L380 HydrophobicContact CH2-CD2 3.78Å; W20-L380 HydrophobicContact CH2-CG 3.55Å; W20-L380 HydrophobicContact CZ2-CB 4.42Å; W20-L380 HydrophobicContact CZ2-CD2 3.23Å; W20-L380 HydrophobicContact CZ2-CG 3.6Å; W20-L380 HydrophobicContact CZ3-CG 4.16Å; V327-L380 HydrophobicContact CB-CD1 4.04Å; V327-L380 HydrophobicContact CG1-CD1 3.77Å; E329-L380 WeakPolarHBondContact O-CD2 3.49Å; L378-L380 PolarHBondContact O-N 2.69Å; L380-L383 PolarHBondContact O-N 2.84Å; L380-A384 VanDerWaalsContact O-CB 3.29Å; L380-A384 WeakPolarHBondContact O-CB 3.27Å; L380-A384 PolarHBondContact O-N 3.3Å; L380-I396 HydrophobicContact CD1-CD1 4.21Å; L380-I396 HydrophobicContact CD1-CG1 4.31Å
381	D	88.6	Confident	87.9	Confident	45 Å²	45	52.6 Å²	52.6	24%	0.241	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-44.7	174.1	-71.6	-30.1	0	0	0	110.8	W20 K24 L378 L379 A384 L385	W20-D381 WeakPolarHBondContact CH2-OD1 3.48Å; W20-D381 WeakPolarHBondContact CZ3-OD1 3.44Å; K24-D381 IonicContact NZ-OD1 3.18Å; K24-D381 PolarHBondContact NZ-OD1 2.83Å; K24-D381 IonicContact NZ-OD2 2.92Å; K24-D381 PolarHBondContact NZ-OD2 3.43Å; L378-D381 HydrophobicContact CB-CB 4.38Å; L378-D381 WeakPolarHBondContact O-CB 3.41Å; L378-D381 PolarHBondContact O-N 2.93Å; L379-D381 VanDerWaalsContact C-N 3.33Å; L379-D381 PolarHBondContact O-N 3.08Å; D381-A384 PolarHBondContact O-N 2.93Å; D381-L385 WeakPolarHBondContact O-CG 3.4Å; D381-L385 PolarHBondContact O-N 3.39Å; D381-L385 VanDerWaalsContact O-N 3.13Å
382	W	90.9	Very high	88.3	Confident	36 Å²	36	52.4 Å²	52.4	14%	0.136	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-43	178.2	-177	84	0	0	0	111.5	L314 Q377 L378 L379 L385 N386 F390	L314-W382 HydrophobicContact CD2-CZ3 4.16Å; Q377-W382 HydrophobicContact CG-CB 4.27Å; L378-W382 PolarHBondContact O-N 3.06Å; L378-W382 VanDerWaalsContact O-N 3.11Å; L379-W382 HydrophobicContact CD1-CE3 4.15Å; L379-W382 PolarHBondContact O-N 3.12Å; W382-L385 PolarHBondContact O-N 3.44Å; W382-N386 HydrophobicContact CZ2-CB 4.33Å; W382-N386 PolarHBondContact NE1-ND2 3.11Å; W382-N386 WeakPolarHBondContact O-CB 3.45Å; W382-N386 PolarHBondContact O-N 3Å; W382-N386 PolarHBondContact O-ND2 3.39Å; W382-F390 AromaticContact CH2-CE2 3.72Å; W382-F390 HydrophobicContact CH2-CE2 3.72Å; W382-F390 AromaticContact CH2-CZ 3.58Å; W382-F390 HydrophobicContact CH2-CZ 3.58Å; W382-F390 HydrophobicContact CZ2-CE2 4.5Å; W382-F390 HydrophobicContact CZ2-CZ 4.31Å; W382-F390 HydrophobicContact CZ3-CE2 4.09Å; W382-F390 HydrophobicContact CZ3-CZ 4.32Å
383	L	91.7	Very high	88.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-44.9	175.3	-72	170.6	0	0	0	111.3	L314 L317 L325 V327 L379 L380 L385 N386 Y387 I414	L314-L383 HydrophobicContact CD2-CD2 4.43Å; L317-L383 HydrophobicContact CD1-CD2 3.84Å; L325-L383 HydrophobicContact CD2-CD1 4.17Å; L325-L383 HydrophobicContact CD2-CD2 3.86Å; L325-L383 HydrophobicContact CD2-CG 4.43Å; V327-L383 HydrophobicContact CG2-CD1 4.16Å; L379-L383 HydrophobicContact CD1-CD1 4.29Å; L379-L383 HydrophobicContact CD1-CG 4.19Å; L379-L383 HydrophobicContact CG-CD1 3.97Å; L379-L383 HydrophobicContact CG-CG 4.35Å; L379-L383 WeakPolarHBondContact O-CB 3.44Å; L379-L383 VanDerWaalsContact O-CG 3.31Å; L379-L383 WeakPolarHBondContact O-CG 3.21Å; L379-L383 PolarHBondContact O-N 2.94Å; L380-L383 PolarHBondContact O-N 2.84Å; L383-L385 PolarHBondContact O-N 3.33Å; L383-L385 VanDerWaalsContact O-N 3.17Å; L383-N386 PolarHBondContact O-N 3.31Å; L383-Y387 VanDerWaalsContact O-CB 3.23Å; L383-Y387 WeakPolarHBondContact O-CB 3.32Å; L383-Y387 WeakPolarHBondContact O-CD1 3.19Å; L383-Y387 PolarHBondContact O-N 3.39Å; L383-I414 HydrophobicContact CD1-CD1 4.06Å
384	A	87.5	Confident	88.9	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-28.8	177.5	0	0	0	0	0	113.1	V17 W20 R21 L380 D381 Y387 L394	V17-A384 HydrophobicContact CG1-CB 3.74Å; W20-A384 HydrophobicContact CZ3-CB 4.23Å; R21-A384 HydrophobicContact CG-CB 4.44Å; L380-A384 VanDerWaalsContact O-CB 3.29Å; L380-A384 WeakPolarHBondContact O-CB 3.27Å; L380-A384 PolarHBondContact O-N 3.3Å; D381-A384 PolarHBondContact O-N 2.93Å; A384-Y387 WeakPolarHBondContact O-CD1 3.32Å; A384-Y387 WeakPolarHBondContact O-CE1 3.28Å; A384-L394 HydrophobicContact CB-CD2 4.26Å
385	L	87	Confident	89.1	Confident	95 Å²	95	43.6 Å²	43.6	50%	0.497	24%	0.237	S	C	.	.	H	α-helix	trans	-84.2	-37.5	176.1	-70.3	170.5	0	0	0	113.3	R21 D381 W382 L383	R21-L385 VanDerWaalsContact NH2-CD2 3.29Å; D381-L385 WeakPolarHBondContact O-CG 3.4Å; D381-L385 PolarHBondContact O-N 3.39Å; D381-L385 VanDerWaalsContact O-N 3.13Å; W382-L385 PolarHBondContact O-N 3.44Å; L383-L385 PolarHBondContact O-N 3.33Å; L383-L385 VanDerWaalsContact O-N 3.17Å
386	N	88.8	Confident	89.2	Confident	54 Å²	54	41.6 Å²	41.6	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-109.7	-6.5	-167.5	-62.1	-80.4	0	0	0	114.3	W382 L383 R388 S389 F390	W382-N386 HydrophobicContact CZ2-CB 4.33Å; W382-N386 PolarHBondContact NE1-ND2 3.11Å; W382-N386 WeakPolarHBondContact O-CB 3.45Å; W382-N386 PolarHBondContact O-N 3Å; W382-N386 PolarHBondContact O-ND2 3.39Å; L383-N386 PolarHBondContact O-N 3.31Å; N386-R388 PolarHBondContact O-N 3.39Å; N386-S389 PolarHBondContact O-N 2.96Å; N386-S389 PolarHBondContact O-OG 3.25Å; N386-F390 HydrophobicContact CB-CE2 4.16Å; N386-F390 WeakPolarHBondContact O-CD2 3.48Å
387	Y	88.7	Confident	89.2	Confident	8 Å²	8	38.6 Å²	38.6	3%	0.031	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-53.4	-34.4	-176.7	75.1	-76.7	0	0	0	113.1	D14 V17 L383 A384 S389 F390 T392 L394	D14-Y387 PolarHBondContact OD1-OH 2.9Å; V17-Y387 HydrophobicContact CG1-CE1 4.44Å; L383-Y387 VanDerWaalsContact O-CB 3.23Å; L383-Y387 WeakPolarHBondContact O-CB 3.32Å; L383-Y387 WeakPolarHBondContact O-CD1 3.19Å; L383-Y387 PolarHBondContact O-N 3.39Å; A384-Y387 WeakPolarHBondContact O-CD1 3.32Å; A384-Y387 WeakPolarHBondContact O-CE1 3.28Å; Y387-S389 VanDerWaalsContact C-N 3.3Å; Y387-S389 PolarHBondContact O-N 2.68Å; Y387-F390 PolarHBondContact O-N 2.96Å; Y387-T392 WeakPolarHBondContact CD2-O 3.35Å; Y387-T392 WeakPolarHBondContact O-CG2 3.47Å; Y387-T392 PolarHBondContact O-N 2.86Å; Y387-L394 HydrophobicContact CD1-CB 4.33Å; Y387-L394 HydrophobicContact CD1-CD2 4.25Å; Y387-L394 HydrophobicContact CD2-CB 3.69Å; Y387-L394 HydrophobicContact CE2-CB 4.27Å; Y387-L394 HydrophobicContact CG-CB 3.73Å; Y387-L394 HydrophobicContact CG-CD2 4.33Å
388	R	85.9	Confident	88.9	Confident	145 Å²	145	37.7 Å²	37.7	55%	0.547	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-62.7	-32.6	178	-62.3	-176.4	-178.2	-132.3	-8.1	113.4	D14 N386 F390 G391	D14-R388 IonicContact OD1-NH2 2.91Å; D14-R388 IonicContact OD2-CZ 3.75Å; D14-R388 IonicContact OD2-NH1 3.79Å; D14-R388 IonicContact OD2-NH2 3.75Å; D14-R388 PolarHBondContact OD2-NH2 2.94Å; N386-R388 PolarHBondContact O-N 3.39Å; R388-F390 PolarHBondContact O-N 3.39Å; R388-G391 PolarHBondContact O-N 3.41Å; R388-G391 VanDerWaalsContact O-N 3.1Å
389	S	87.4	Confident	88.6	Confident	89 Å²	89	38.4 Å²	38.4	62%	0.622	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-69.6	-23.2	179.4	62.7	0	0	0	0	112.5	N386 Y387 G391	N386-S389 PolarHBondContact O-N 2.96Å; N386-S389 PolarHBondContact O-OG 3.25Å; Y387-S389 VanDerWaalsContact C-N 3.3Å; Y387-S389 PolarHBondContact O-N 2.68Å; S389-G391 VanDerWaalsContact C-N 3.29Å
390	F	87.7	Confident	87.9	Confident	44 Å²	44	45.7 Å²	45.7	19%	0.193	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-86.7	-1.1	174.3	-56.3	-70.3	0	0	0	112.9	L317 E318 W382 N386 Y387 R388 T392	L317-F390 HydrophobicContact CB-CD1 4.33Å; L317-F390 HydrophobicContact CB-CG 4.35Å; L317-F390 HydrophobicContact CD2-CB 4.2Å; L317-F390 HydrophobicContact CD2-CG 4.39Å; L317-F390 WeakPolarHBondContact O-CD1 3.45Å; E318-F390 HydrophobicContact CG-CE1 4.44Å; W382-F390 AromaticContact CH2-CE2 3.72Å; W382-F390 HydrophobicContact CH2-CE2 3.72Å; W382-F390 AromaticContact CH2-CZ 3.58Å; W382-F390 HydrophobicContact CH2-CZ 3.58Å; W382-F390 HydrophobicContact CZ2-CE2 4.5Å; W382-F390 HydrophobicContact CZ2-CZ 4.31Å; W382-F390 HydrophobicContact CZ3-CE2 4.09Å; W382-F390 HydrophobicContact CZ3-CZ 4.32Å; N386-F390 HydrophobicContact CB-CE2 4.16Å; N386-F390 WeakPolarHBondContact O-CD2 3.48Å; Y387-F390 PolarHBondContact O-N 2.96Å; R388-F390 PolarHBondContact O-N 3.39Å; F390-T392 HydrophobicContact CB-CG2 4.39Å; F390-T392 PolarHBondContact O-N 3.25Å
391	G	86.5	Confident	87.3	Confident	48 Å²	48	46.2 Å²	46.2	50%	0.495	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	19.4	-173.9	0	0	0	0	0	113.4	R388 S389 R419	R388-G391 PolarHBondContact O-N 3.41Å; R388-G391 VanDerWaalsContact O-N 3.1Å; S389-G391 VanDerWaalsContact C-N 3.29Å; G391-R419 PolarHBondContact O-NH2 3.01Å
392	T	90.7	Very high	86.9	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.043	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-92.5	162.1	-178.7	-160.6	0	0	0	0	111.7	L317 V322 E323 L325 Y387 F390	L317-T392 HydrophobicContact CD2-CG2 3.73Å; V322-T392 WeakPolarHBondContact CG1-OG1 3.44Å; V322-T392 VanDerWaalsContact O-CB 3.29Å; V322-T392 WeakPolarHBondContact O-CB 3.2Å; V322-T392 PolarHBondContact O-OG1 3.06Å; E323-T392 PolarHBondContact O-OG1 3.41Å; L325-T392 HydrophobicContact CB-CG2 4.14Å; L325-T392 HydrophobicContact CD2-CG2 4.41Å; Y387-T392 WeakPolarHBondContact CD2-O 3.35Å; Y387-T392 WeakPolarHBondContact O-CG2 3.47Å; Y387-T392 PolarHBondContact O-N 2.86Å; F390-T392 HydrophobicContact CB-CG2 4.39Å; F390-T392 PolarHBondContact O-N 3.25Å
393	T	90.3	Very high	86.6	Confident	56 Å²	56	49.8 Å²	49.8	34%	0.344	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.1	168.1	51.4	0	0	0	0	109	E323 T324 L325	E323-T393 PolarHBondContact O-N 3.02Å; E323-T393 PolarHBondContact O-OG1 3.35Å; T324-T393 CarbonylContact C-O 3.5Å; T324-T393 WeakPolarHBondContact CA-O 3.31Å; T324-T393 WeakPolarHBondContact CA-OG1 3.36Å; T324-T393 PolarHBondContact OG1-OG1 3.15Å; L325-T393 PolarHBondContact N-O 3.03Å
394	L	91.8	Very high	86.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.8	179.2	173.2	63.5	0	0	0	109.9	V17 L325 V327 A384 Y387 I396	V17-L394 HydrophobicContact CG1-CD2 4.23Å; V17-L394 HydrophobicContact CG2-CB 4.06Å; V17-L394 HydrophobicContact CG2-CD2 3.7Å; V17-L394 HydrophobicContact CG2-CG 3.82Å; L325-L394 HydrophobicContact CB-CD1 4.44Å; L325-L394 HydrophobicContact CD2-CD1 3.86Å; L325-L394 HydrophobicContact CG-CD1 4.06Å; V327-L394 HydrophobicContact CB-CD1 4.23Å; V327-L394 HydrophobicContact CG2-CD1 3.55Å; A384-L394 HydrophobicContact CB-CD2 4.26Å; Y387-L394 HydrophobicContact CD1-CB 4.33Å; Y387-L394 HydrophobicContact CD1-CD2 4.25Å; Y387-L394 HydrophobicContact CD2-CB 3.69Å; Y387-L394 HydrophobicContact CE2-CB 4.27Å; Y387-L394 HydrophobicContact CG-CB 3.73Å; Y387-L394 HydrophobicContact CG-CD2 4.33Å; L394-I396 HydrophobicContact CG-CG1 4.27Å
395	E	89.7	Confident	86.2	Confident	46 Å²	46	50.8 Å²	50.8	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.9	174.2	-71.1	-68.2	174.5	0	0	109.9	A13 L291 T324 L325 V326 V327	A13-E395 WeakPolarHBondContact CB-OE1 3.33Å; L291-E395 HydrophobicContact CD2-CB 3.48Å; L291-E395 VanDerWaalsContact CD2-CB 3.48Å; L291-E395 HydrophobicContact CD2-CG 3.75Å; T324-E395 HydrophobicContact CG2-CB 4.46Å; T324-E395 HydrophobicContact CG2-CG 3.92Å; L325-E395 PolarHBondContact O-N 3.05Å; V326-E395 WeakPolarHBondContact CA-O 3.26Å; V327-E395 PolarHBondContact N-O 3.38Å
396	I	88.7	Confident	86.3	Confident	27 Å²	27	50.8 Å²	50.8	14%	0.138	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	120.5	178.6	-58.9	178	0	0	0	108.7	V17 W20 V327 E329 L380 L394	V17-I396 HydrophobicContact CG2-CD1 4.23Å; V17-I396 HydrophobicContact CG2-CG1 4.48Å; W20-I396 HydrophobicContact CB-CD1 3.71Å; W20-I396 HydrophobicContact CD2-CD1 3.84Å; W20-I396 HydrophobicContact CE3-CD1 4.11Å; W20-I396 HydrophobicContact CG-CD1 3.64Å; W20-I396 HydrophobicContact CG-CG2 4.44Å; V327-I396 CarbonylContact O-C 3.6Å; V327-I396 VanDerWaalsContact O-CA 3.3Å; V327-I396 WeakPolarHBondContact O-CA 3.44Å; E329-I396 HydrophobicContact CB-CG2 3.6Å; L380-I396 HydrophobicContact CD1-CD1 4.21Å; L380-I396 HydrophobicContact CD1-CG1 4.31Å; L394-I396 HydrophobicContact CG-CG1 4.27Å
397	V	87.5	Confident	86.4	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.018	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	159	-176.3	-59.3	0	0	0	0	112.2	E288 L291 I292 V326 V327 W328 E329 F407	E288-V397 HydrophobicContact CG-CB 3.96Å; E288-V397 HydrophobicContact CG-CG1 3.95Å; L291-V397 HydrophobicContact CD2-CG1 4.13Å; I292-V397 HydrophobicContact CD1-CB 4.31Å; I292-V397 HydrophobicContact CD1-CG1 4.36Å; I292-V397 HydrophobicContact CD1-CG2 4.41Å; I292-V397 HydrophobicContact CG1-CG1 4.45Å; V326-V397 HydrophobicContact CG1-CB 4.45Å; V326-V397 HydrophobicContact CG1-CG1 3.69Å; V326-V397 HydrophobicContact CG1-CG2 3.84Å; V327-V397 PolarHBondContact O-N 2.86Å; W328-V397 WeakPolarHBondContact CA-O 3.32Å; E329-V397 PolarHBondContact N-O 2.82Å; V397-F407 HydrophobicContact CG2-CD1 3.97Å; V397-F407 HydrophobicContact CG2-CE1 4.03Å
398	T	84.6	Confident	86.5	Confident	24 Å²	24	49.1 Å²	49.1	15%	0.147	26%	0.26	C	S	.	.			trans	-104	169.8	175.4	73.8	0	0	0	0	111.6	E288 E329 G404	E288-T398 PolarHBondContact OE1-OG1 2.53Å; E288-T398 WeakPolarHBondContact OE2-CB 3.47Å; E288-T398 PolarHBondContact OE2-N 2.78Å; E288-T398 PolarHBondContact OE2-OG1 2.71Å; E329-T398 HydrophobicContact CG-CG2 4.45Å; T398-G404 WeakPolarHBondContact O-CA 3.46Å
399	D	83.3	Confident	86.6	Confident	71 Å²	71	52.9 Å²	52.9	38%	0.38	27%	0.274	S	S	.	.	S	Bend	trans	-100.6	14	174.2	66	-29.2	0	0	0	112.8	W328 V408	W328-D399 HydrophobicContact CZ2-CB 4.4Å; D399-V408 HydrophobicContact CB-CG2 4.15Å
400	K	78.6	Confident	86.6	Confident	154 Å²	154	51.4 Å²	51.4	67%	0.67	27%	0.273	S	S	*	.	S	Bend	trans	-80.3	-27.9	-176.6	-68.6	-178.1	-177.9	177.6	0	112.9	F285	F285-K400 HydrophobicContact CE1-CB 3.66Å; F285-K400 HydrophobicContact CE1-CD 4.12Å; F285-K400 HydrophobicContact CZ-CB 4.29Å; F285-K400 HydrophobicContact CZ-CD 4.09Å
401	S	78.2	Confident	86.7	Confident	13 Å²	13	51.4 Å²	51.4	9%	0.091	27%	0.273	C	S	.	.	S	Bend	trans	-79.5	154.4	170.9	63.3	0	0	0	0	110.4	E288 E403 G404 A405	E288-S401 WeakPolarHBondContact OE1-CB 3.48Å; E288-S401 PolarHBondContact OE1-OG 2.76Å; S401-E403 VanDerWaalsContact C-N 3.25Å; S401-E403 PolarHBondContact O-N 3.31Å; S401-G404 PolarHBondContact O-N 3.41Å; S401-G404 WeakPolarHBondContact OG-CA 3.44Å; S401-G404 PolarHBondContact OG-N 3.46Å; S401-A405 PolarHBondContact O-N 2.7Å
402	Q	79.3	Confident	86.8	Confident	137 Å²	137	50.2 Å²	50.2	64%	0.64	26%	0.261	S	S	*	.	H	α-helix	trans	-60.8	-41.2	176	179.9	-179.5	-0.7	0	0	110.7	A405 Q406	Q402-A405 PolarHBondContact O-N 3.43Å; Q402-Q406 WeakPolarHBondContact O-CG 3.39Å; Q402-Q406 PolarHBondContact O-N 3.26Å
403	E	83.8	Confident	86.8	Confident	20 Å²	20	49.9 Å²	49.9	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-42.5	177.4	-62.2	79.2	-177.8	0	0	111.1	K289 I292 F296 S401 Q406 F407	K289-E403 WeakPolarHBondContact CD-OE1 3.29Å; K289-E403 WeakPolarHBondContact CE-OE1 3.28Å; K289-E403 HydrophobicContact CG-CG 4.09Å; K289-E403 IonicContact NZ-OE1 3.59Å; K289-E403 PolarHBondContact NZ-OE1 2.83Å; I292-E403 HydrophobicContact CB-CB 4.17Å; I292-E403 HydrophobicContact CG2-CB 3.84Å; F296-E403 HydrophobicContact CE2-CB 4.3Å; S401-E403 VanDerWaalsContact C-N 3.25Å; S401-E403 PolarHBondContact O-N 3.31Å; E403-Q406 WeakPolarHBondContact O-CB 3.44Å; E403-Q406 PolarHBondContact O-N 3.12Å; E403-F407 PolarHBondContact O-N 3.47Å
404	G	85	Confident	87	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-46.7	172.2	0	0	0	0	0	112.9	T398 S401 Q406 F407 V408	T398-G404 WeakPolarHBondContact O-CA 3.46Å; S401-G404 PolarHBondContact O-N 3.41Å; S401-G404 WeakPolarHBondContact OG-CA 3.44Å; S401-G404 PolarHBondContact OG-N 3.46Å; G404-Q406 VanDerWaalsContact C-N 3.32Å; G404-Q406 PolarHBondContact O-N 3.32Å; G404-F407 WeakPolarHBondContact O-CB 3.31Å; G404-F407 PolarHBondContact O-N 3.14Å; G404-V408 WeakPolarHBondContact O-CG2 3.37Å; G404-V408 PolarHBondContact O-N 3.42Å
405	A	86	Confident	87.2	Confident	26 Å²	26	47.2 Å²	47.2	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-37.9	175.9	0	0	0	0	0	112.5	S401 Q402 R409	S401-A405 PolarHBondContact O-N 2.7Å; Q402-A405 PolarHBondContact O-N 3.43Å; A405-R409 WeakPolarHBondContact O-CB 3.41Å; A405-R409 VanDerWaalsContact O-CG 3.31Å; A405-R409 WeakPolarHBondContact O-CG 3.49Å; A405-R409 PolarHBondContact O-N 3.47Å
406	Q	89.2	Confident	87.4	Confident	95 Å²	95	45 Å²	45	44%	0.444	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-40.1	173.5	-74.8	178.1	3.8	0	0	111.9	F296 Q402 E403 G404 G410	F296-Q406 HydrophobicContact CE2-CB 4.08Å; F296-Q406 HydrophobicContact CZ-CB 3.89Å; Q402-Q406 WeakPolarHBondContact O-CG 3.39Å; Q402-Q406 PolarHBondContact O-N 3.26Å; E403-Q406 WeakPolarHBondContact O-CB 3.44Å; E403-Q406 PolarHBondContact O-N 3.12Å; G404-Q406 VanDerWaalsContact C-N 3.32Å; G404-Q406 PolarHBondContact O-N 3.32Å; Q406-G410 WeakPolarHBondContact O-CA 3.31Å; Q406-G410 PolarHBondContact O-N 2.95Å
407	F	91.6	Very high	87.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-46.7	176.4	175	-109.5	0	0	0	111.5	I292 Y295 F296 V326 V397 E403 G404 F411	I292-F407 HydrophobicContact CD1-CB 4.41Å; I292-F407 HydrophobicContact CG2-CB 4.14Å; Y295-F407 HydrophobicContact CD1-CD2 4.04Å; Y295-F407 HydrophobicContact CD1-CE2 4.22Å; Y295-F407 AromaticContact CE1-CD2 3.73Å; Y295-F407 HydrophobicContact CE1-CD2 3.73Å; Y295-F407 AromaticContact CE1-CE2 3.72Å; Y295-F407 HydrophobicContact CE1-CE2 3.72Å; F296-F407 HydrophobicContact CE1-CB 4.45Å; F296-F407 HydrophobicContact CZ-CB 4.15Å; V326-F407 HydrophobicContact CB-CZ 4.09Å; V326-F407 HydrophobicContact CG1-CE1 3.94Å; V326-F407 HydrophobicContact CG1-CE2 4.42Å; V326-F407 HydrophobicContact CG1-CZ 3.87Å; V326-F407 WeakPolarHBondContact O-CZ 3.29Å; V397-F407 HydrophobicContact CG2-CD1 3.97Å; V397-F407 HydrophobicContact CG2-CE1 4.03Å; E403-F407 PolarHBondContact O-N 3.47Å; G404-F407 WeakPolarHBondContact O-CB 3.31Å; G404-F407 PolarHBondContact O-N 3.14Å; F407-F411 HydrophobicContact CD2-CB 4.19Å; F407-F411 HydrophobicContact CD2-CD2 4.4Å; F407-F411 HydrophobicContact CE2-CB 4.29Å; F407-F411 WeakPolarHBondContact O-CA 3.36Å; F407-F411 WeakPolarHBondContact O-CB 3.46Å; F407-F411 PolarHBondContact O-N 3.2Å
408	V	89.7	Confident	87.9	Confident	27 Å²	27	43.9 Å²	43.9	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-46.9	179.2	176.6	0	0	0	0	111.8	W328 D399 G404 G412	W328-V408 HydrophobicContact CB-CG2 3.89Å; W328-V408 HydrophobicContact CD2-CG1 4.03Å; W328-V408 HydrophobicContact CD2-CG2 3.64Å; W328-V408 HydrophobicContact CE3-CG1 3.86Å; W328-V408 HydrophobicContact CE3-CG2 4.24Å; W328-V408 HydrophobicContact CG-CG2 3.47Å; W328-V408 VanDerWaalsContact CG-CG2 3.47Å; W328-V408 HydrophobicContact CH2-CG1 4.21Å; W328-V408 HydrophobicContact CZ2-CG1 4.35Å; W328-V408 HydrophobicContact CZ3-CG1 3.96Å; D399-V408 HydrophobicContact CB-CG2 4.15Å; G404-V408 WeakPolarHBondContact O-CG2 3.37Å; G404-V408 PolarHBondContact O-N 3.42Å; V408-G412 WeakPolarHBondContact O-CA 3.37Å; V408-G412 PolarHBondContact O-N 3.03Å
409	R	89.2	Confident	88.2	Confident	223 Å²	223	47.4 Å²	47.4	84%	0.842	24%	0.237	S	C	*	.	H	α-helix	trans	-76.7	-35.7	-176.4	-68.2	178.9	-177.3	-178.4	2.2	113.6	A405	A405-R409 WeakPolarHBondContact O-CB 3.41Å; A405-R409 VanDerWaalsContact O-CG 3.31Å; A405-R409 WeakPolarHBondContact O-CG 3.49Å; A405-R409 PolarHBondContact O-N 3.47Å
410	G	88.1	Confident	88.4	Confident	58 Å²	58	49 Å²	49	60%	0.598	24%	0.238	S	C	*	.	H	α-helix	trans	-86.7	-36.3	-176	0	0	0	0	0	113.7	Q406	Q406-G410 WeakPolarHBondContact O-CA 3.31Å; Q406-G410 PolarHBondContact O-N 2.95Å
411	F	89.4	Confident	88.6	Confident	45 Å²	45	48 Å²	48	20%	0.197	24%	0.236	C	C	.	.	H	α-helix	trans	-120.6	8.2	-170.7	-57.5	-84.8	0	0	0	113.3	Y295 F296 I299 F308 F407 G413	Y295-F411 HydrophobicContact CE1-CD1 4.38Å; Y295-F411 HydrophobicContact CE1-CD2 4.28Å; Y295-F411 HydrophobicContact CE1-CG 4.16Å; F296-F411 AromaticContact CD1-CE2 3.93Å; F296-F411 HydrophobicContact CD1-CE2 3.93Å; F296-F411 HydrophobicContact CD1-CZ 4.42Å; F296-F411 AromaticContact CE1-CD2 3.78Å; F296-F411 HydrophobicContact CE1-CD2 3.78Å; F296-F411 AromaticContact CE1-CE2 3.36Å; F296-F411 HydrophobicContact CE1-CE2 3.36Å; F296-F411 HydrophobicContact CE1-CZ 4.27Å; F296-F411 HydrophobicContact CZ-CE2 4.22Å; I299-F411 HydrophobicContact CD1-CD1 4.21Å; I299-F411 HydrophobicContact CD1-CE1 3.5Å; I299-F411 VanDerWaalsContact CD1-CE1 3.5Å; I299-F411 HydrophobicContact CD1-CE2 4.22Å; I299-F411 HydrophobicContact CD1-CZ 3.51Å; I299-F411 HydrophobicContact CG1-CE1 4.44Å; I299-F411 HydrophobicContact CG2-CZ 4.45Å; F308-F411 HydrophobicContact CB-CB 4.1Å; F308-F411 HydrophobicContact CB-CD1 3.75Å; F308-F411 HydrophobicContact CB-CG 4.39Å; F308-F411 HydrophobicContact CD1-CD1 4.34Å; F308-F411 HydrophobicContact CD2-CD1 4.5Å; F308-F411 AromaticContact CG-CD1 3.97Å; F308-F411 HydrophobicContact CG-CD1 3.97Å; F407-F411 HydrophobicContact CD2-CB 4.19Å; F407-F411 HydrophobicContact CD2-CD2 4.4Å; F407-F411 HydrophobicContact CE2-CB 4.29Å; F407-F411 WeakPolarHBondContact O-CA 3.36Å; F407-F411 WeakPolarHBondContact O-CB 3.46Å; F407-F411 PolarHBondContact O-N 3.2Å; F411-G413 VanDerWaalsContact C-N 3.31Å; F411-G413 PolarHBondContact O-N 3.05Å
412	G	88.4	Confident	88.5	Confident	23 Å²	23	48.4 Å²	48.4	24%	0.237	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	11	172.8	0	0	0	0	0	115.3	R352 V408	R352-G412 PolarHBondContact NH2-O 3.05Å; V408-G412 WeakPolarHBondContact O-CA 3.37Å; V408-G412 PolarHBondContact O-N 3.03Å
413	G	91.2	Very high	88.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	11.5	174.6	0	0	0	0	0	115.5	W328 F411	W328-G413 WeakPolarHBondContact CB-O 3.47Å; W328-G413 PolarHBondContact N-O 2.81Å; F411-G413 VanDerWaalsContact C-N 3.31Å; F411-G413 PolarHBondContact O-N 3.05Å
414	I	94.6	Very high	87.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	136.2	175.3	-175.9	167.6	0	0	0	109.7	G309 V310 T313 V327 L331 L379 L383	G309-I414 PolarHBondContact N-O 2.67Å; G309-I414 VanDerWaalsContact N-O 3.08Å; V310-I414 HydrophobicContact CG2-CG2 3.78Å; T313-I414 HydrophobicContact CG2-CD1 4.33Å; T313-I414 HydrophobicContact CG2-CG1 4.04Å; V327-I414 HydrophobicContact CG2-CG1 4.37Å; L331-I414 HydrophobicContact CD1-CB 4.4Å; L331-I414 HydrophobicContact CD2-CB 4.25Å; L331-I414 HydrophobicContact CD2-CD1 4.13Å; L379-I414 HydrophobicContact CD2-CD1 4.09Å; L383-I414 HydrophobicContact CD1-CD1 4.06Å
415	G	94.3	Very high	86	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	178	177.8	0	0	0	0	0	111.1	C307 V326	C307-G415 CarbonylContact O-C 3.54Å; C307-G415 WeakPolarHBondContact O-CA 3.3Å; V326-G415 PolarHBondContact N-O 3.5Å; V326-G415 PolarHBondContact O-N 2.93Å
416	G	94.1	Very high	84.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.7	-179.4	0	0	0	0	0	113.2	Y306 C307 T324	Y306-G416 CarbonylContact C-O 3.51Å; Y306-G416 WeakPolarHBondContact CA-O 3.39Å; C307-G416 PolarHBondContact N-O 3.25Å; C307-G416 PolarHBondContact O-N 3.09Å; C307-G416 PolarHBondContact SG-N 2.79Å; C307-G416 VanDerWaalsContact SG-N 3.38Å; T324-G416 CarbonylContact O-C 3.58Å; T324-G416 VanDerWaalsContact O-CA 3.23Å; T324-G416 WeakPolarHBondContact O-CA 3.32Å
417	I	94	Very high	82.4	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.9	166.6	-58	172.3	0	0	0	106.9	L291 R294 Y295 E298 E323 T324	L291-I417 HydrophobicContact CD1-CD1 4.46Å; R294-I417 HydrophobicContact CB-CD1 4.48Å; R294-I417 HydrophobicContact CG-CD1 4.07Å; Y295-I417 HydrophobicContact CD2-CG1 3.95Å; E298-I417 HydrophobicContact CG-CG2 4.42Å; E323-I417 WeakPolarHBondContact CB-O 3.39Å; E323-I417 PolarHBondContact N-O 3.43Å; T324-I417 PolarHBondContact N-O 2.98Å; T324-I417 PolarHBondContact O-N 3.49Å
418	L	93.9	Very high	80.2	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	147.8	-175.4	-52.3	176.9	0	0	0	110.9	K305 C307 A321 V322 Y420 L422 F424	K305-L418 HydrophobicContact CB-CB 4.42Å; K305-L418 PolarHBondContact O-N 3.42Å; C307-L418 HydrophobicContact CB-CD2 4.3Å; A321-L418 HydrophobicContact CB-CD2 4.3Å; A321-L418 CarbonylContact O-C 3.58Å; A321-L418 WeakPolarHBondContact O-CA 3.49Å; V322-L418 HydrophobicContact CB-CD2 4.39Å; V322-L418 HydrophobicContact CG2-CD2 3.73Å; L418-Y420 VanDerWaalsContact C-N 3.29Å; L418-Y420 VanDerWaalsContact CB-O 3.28Å; L418-Y420 WeakPolarHBondContact CB-O 3.33Å; L418-L422 HydrophobicContact CD1-CB 3.97Å; L418-L422 HydrophobicContact CD1-CD1 3.97Å; L418-L422 HydrophobicContact CD1-CG 4.42Å; L418-L422 HydrophobicContact CD2-CD1 4.45Å; L418-F424 HydrophobicContact CD1-CZ 4.4Å
419	R	90.4	Very high	77.6	Confident	98 Å²	98	63.5 Å²	63.5	37%	0.37	34%	0.341	S	S	.	.	S	Bend	trans	-66.3	-34.5	174.7	-66.1	176.7	172.7	100.2	13.5	112.2	G320 A321 V322 E323 G391	G320-R419 PolarHBondContact O-NH1 2.79Å; A321-R419 WeakPolarHBondContact O-CG 3.07Å; A321-R419 PolarHBondContact O-N 3.24Å; V322-R419 PolarHBondContact O-NH1 2.86Å; V322-R419 PolarHBondContact O-NH2 3.38Å; E323-R419 HydrophobicContact CB-CG 3.64Å; E323-R419 HydrophobicContact CG-CG 4.25Å; G391-R419 PolarHBondContact O-NH2 3.01Å
420	Y	86.9	Confident	75	Confident	105 Å²	105	55.4 Å²	55.4	41%	0.412	33%	0.327	S	S	.	.	S	Bend	trans	-145.2	164.8	-176.2	52.3	-93.6	0	0	0	109.7	M319 A321 L418 L422	M319-Y420 PolarHBondContact O-OH 3.43Å; A321-Y420 HydrophobicContact CB-CE1 4.12Å; A321-Y420 HydrophobicContact CB-CE2 3.94Å; A321-Y420 WeakPolarHBondContact CB-OH 3.41Å; L418-Y420 VanDerWaalsContact C-N 3.29Å; L418-Y420 VanDerWaalsContact CB-O 3.28Å; L418-Y420 WeakPolarHBondContact CB-O 3.33Å; Y420-L422 HydrophobicContact CD2-CG 4.47Å; Y420-L422 HydrophobicContact CE2-CD2 4.38Å; Y420-L422 HydrophobicContact CE2-CG 4.12Å
421	Q	83.4	Confident	72.4	Confident	132 Å²	132	59.7 Å²	59.7	62%	0.617	34%	0.336	S	S	*	.			trans	-67.3	132.5	-179.8	-68.7	179.5	-37	0	0	110.4	S303 G304 K305	S303-Q421 WeakPolarHBondContact O-CG 3.24Å; S303-Q421 PolarHBondContact O-NE2 2.86Å; G304-Q421 WeakPolarHBondContact O-CA 3.4Å; K305-Q421 HydrophobicContact CG-CG 3.85Å
422	L	76.4	Confident	69.8	Low	21 Å²	21	61 Å²	61	11%	0.11	35%	0.348	C	S	.	.			trans	-119.2	127.1	170.6	-90	163.6	0	0	0	108.5	G304 M319 A321 L418 Y420 F424 L427	G304-L422 PolarHBondContact O-N 3.25Å; M319-L422 HydrophobicContact CE-CD2 3.53Å; M319-L422 HydrophobicContact SD-CD2 3.87Å; A321-L422 HydrophobicContact CB-CD1 3.19Å; A321-L422 HydrophobicContact CB-CG 4.22Å; L418-L422 HydrophobicContact CD1-CB 3.97Å; L418-L422 HydrophobicContact CD1-CD1 3.97Å; L418-L422 HydrophobicContact CD1-CG 4.42Å; L418-L422 HydrophobicContact CD2-CD1 4.45Å; Y420-L422 HydrophobicContact CD2-CG 4.47Å; Y420-L422 HydrophobicContact CE2-CD2 4.38Å; Y420-L422 HydrophobicContact CE2-CG 4.12Å; L422-F424 HydrophobicContact CB-CE2 4.37Å; L422-F424 HydrophobicContact CB-CZ 4.31Å; L422-L427 HydrophobicContact CD2-CD1 4.47Å
423	D	71.9	Confident	67.3	Low	89 Å²	89	66.3 Å²	66.3	48%	0.476	37%	0.37	S	S	.	.			trans	-92.7	101.4	172.5	-157.9	-17.2	0	0	0	109.2	N425 H426	D423-N425 PolarHBondContact O-N 3.36Å; D423-N425 WeakPolarHBondContact OD1-CB 3.23Å; D423-N425 PolarHBondContact OD1-N 3.26Å; D423-N425 PolarHBondContact OD1-ND2 2.79Å; D423-H426 PolarHBondContact O-N 3.29Å
424	F	66.5	Low	64.6	Low	47 Å²	47	75.3 Å²	75.3	21%	0.206	41%	0.41	C	S	.	.	H	α-helix	trans	-65.1	-21.2	179.6	-66.9	-78.5	0	0	0	112.6	C307 D312 S316 L418 L422 H426 L427 A428	C307-F424 HydrophobicContact CB-CE2 4.24Å; C307-F424 HydrophobicContact CB-CZ 3.66Å; D312-F424 HydrophobicContact CB-CD1 4.02Å; D312-F424 HydrophobicContact CB-CE1 3.76Å; D312-F424 HydrophobicContact CB-CZ 4.31Å; S316-F424 VanDerWaalsContact OG-CE1 3.32Å; S316-F424 WeakPolarHBondContact OG-CE1 3.34Å; S316-F424 VanDerWaalsContact OG-CZ 3.27Å; S316-F424 WeakPolarHBondContact OG-CZ 3.41Å; L418-F424 HydrophobicContact CD1-CZ 4.4Å; L422-F424 HydrophobicContact CB-CE2 4.37Å; L422-F424 HydrophobicContact CB-CZ 4.31Å; F424-H426 VanDerWaalsContact C-N 3.3Å; F424-H426 PolarHBondContact O-N 2.74Å; F424-L427 HydrophobicContact CD1-CD1 4.04Å; F424-L427 HydrophobicContact CE1-CD1 4.48Å; F424-L427 PolarHBondContact O-N 2.62Å; F424-L427 VanDerWaalsContact O-N 3.12Å; F424-A428 PolarHBondContact O-N 3.35Å
425	N	57.7	Low	61.6	Low	134 Å²	134	82.7 Å²	82.7	72%	0.717	45%	0.445	S	S	*	.	H	α-helix	trans	-65.5	-34.7	178.4	-67.3	-36.3	0	0	0	112	D423 L427	D423-N425 PolarHBondContact O-N 3.36Å; D423-N425 WeakPolarHBondContact OD1-CB 3.23Å; D423-N425 PolarHBondContact OD1-N 3.26Å; D423-N425 PolarHBondContact OD1-ND2 2.79Å; N425-L427 VanDerWaalsContact C-N 3.3Å; N425-L427 PolarHBondContact O-N 3.27Å
426	H	50.4	Low	58.9	Low	130 Å²	130	89.5 Å²	89.5	60%	0.602	48%	0.481	S	S	*	.	H	α-helix	trans	-74.1	-21.1	175.4	-85.6	-62.1	0	0	0	113.1	D423 F424	D423-H426 PolarHBondContact O-N 3.29Å; F424-H426 VanDerWaalsContact C-N 3.3Å; F424-H426 PolarHBondContact O-N 2.74Å
427	L	48	Very low	56.3	Low	73 Å²	73	97 Å²	97	38%	0.382	52%	0.521	S	S	.	.	H	α-helix	trans	-81.2	-16	179.5	-75.6	161.9	0	0	0	113.4	M319 L422 F424 N425 G429	M319-L427 HydrophobicContact CE-CD2 4.46Å; M319-L427 HydrophobicContact SD-CD1 4.04Å; M319-L427 HydrophobicContact SD-CD2 4.05Å; L422-L427 HydrophobicContact CD2-CD1 4.47Å; F424-L427 HydrophobicContact CD1-CD1 4.04Å; F424-L427 HydrophobicContact CE1-CD1 4.48Å; F424-L427 PolarHBondContact O-N 2.62Å; F424-L427 VanDerWaalsContact O-N 3.12Å; N425-L427 VanDerWaalsContact C-N 3.3Å; N425-L427 PolarHBondContact O-N 3.27Å; L427-G429 PolarHBondContact O-N 2.84Å
428	A	45.2	Very low	53.5	Low	87 Å²	87	106.6 Å²	106.6	72%	0.719	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	6.6	-179.8	0	0	0	0	0	114.3	F424	F424-A428 PolarHBondContact O-N 3.35Å
429	G	36.2	Very low	51	Low	62 Å²	62	112.7 Å²	112.7	64%	0.639	60%	0.596	S	S	*	*			trans	78.5	50.8	172	0	0	0	0	0	113.7	L427	L427-G429 PolarHBondContact O-N 2.84Å
430	G	33.3	Very low	49	Very low	53 Å²	53	114.4 Å²	114.4	55%	0.546	61%	0.611	S	S	.	*			trans	-80.4	114.1	148.4	0	0	0	0	0	106.8	V432	G430-V432 VanDerWaalsContact C-N 3.3Å; G430-V432 PolarHBondContact O-N 3.23Å
431	D	34.2	Very low	47.1	Very low	149 Å²	149	116.3 Å²	116.3	80%	0.797	63%	0.629	S	S	*	*			trans	-47.2	97.4	166.7	-66.5	-48.3	0	0	0	108.4	D433	D431-D433 PolarHBondContact O-N 2.83Å; D431-D433 VanDerWaalsContact O-N 3.11Å
432	V	35.2	Very low	45.1	Very low	73 Å²	73	117.5 Å²	117.5	44%	0.442	64%	0.639	S	S	.	*			trans	-82	89.8	166.8	-174.1	0	0	0	0	103.5	G430 F434	G430-V432 VanDerWaalsContact C-N 3.3Å; G430-V432 PolarHBondContact O-N 3.23Å; V432-F434 VanDerWaalsContact C-N 3.25Å; V432-F434 HydrophobicContact CB-CD2 4.18Å; V432-F434 HydrophobicContact CB-CE2 3.89Å; V432-F434 HydrophobicContact CG1-CD2 3.93Å; V432-F434 HydrophobicContact CG1-CE1 4.49Å; V432-F434 HydrophobicContact CG1-CE2 3.63Å; V432-F434 HydrophobicContact CG1-CG 4.48Å; V432-F434 HydrophobicContact CG1-CZ 3.94Å; V432-F434 WeakPolarHBondContact O-CD2 3.22Å; V432-F434 PolarHBondContact O-N 3.09Å
433	D	34.3	Very low	43.7	Very low	133 Å²	133	130.1 Å²	130.1	71%	0.711	69%	0.688	S	S	*	*			trans	-51.6	95.3	163.9	-71.7	-36.3	0	0	0	107.6	D431 E435	D431-D433 PolarHBondContact O-N 2.83Å; D431-D433 VanDerWaalsContact O-N 3.11Å; D433-E435 PolarHBondContact O-N 3.11Å; D433-E435 VanDerWaalsContact O-N 3.09Å
434	F	34.7	Very low	42.2	Very low	190 Å²	190	132.2 Å²	132.2	83%	0.833	70%	0.698	S	S	*	*			trans	-80.8	53.8	165.3	-76.3	-84.3	0	0	0	108.9	V432	V432-F434 VanDerWaalsContact C-N 3.25Å; V432-F434 HydrophobicContact CB-CD2 4.18Å; V432-F434 HydrophobicContact CB-CE2 3.89Å; V432-F434 HydrophobicContact CG1-CD2 3.93Å; V432-F434 HydrophobicContact CG1-CE1 4.49Å; V432-F434 HydrophobicContact CG1-CE2 3.63Å; V432-F434 HydrophobicContact CG1-CG 4.48Å; V432-F434 HydrophobicContact CG1-CZ 3.94Å; V432-F434 WeakPolarHBondContact O-CD2 3.22Å; V432-F434 PolarHBondContact O-N 3.09Å
435	E	33.1	Very low	41	Very low	155 Å²	155	136.7 Å²	136.7	72%	0.724	72%	0.724	S	S	*	*			trans	-138.1	96.9	167.5	-68.8	-174.6	172.9	0	0	102.9	D433	D433-E435 PolarHBondContact O-N 3.11Å; D433-E435 VanDerWaalsContact O-N 3.09Å
436	D	37.3	Very low	40	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	72%	0.724	S	S	*	*	S	Bend		-179.7	111.8	71.9	-80.8	-40.6	0	0	0	106.2
437	D	38.3	Very low	39.4	Very low	157 Å²	157	137.2 Å²	137.2	84%	0.84	73%	0.732	S	S	*	*			trans	-171	24.9	151	-109.1	-10.9	0	0	0	114.1	N439	D437-N439 PolarHBondContact O-N 3.04Å; D437-N439 VanDerWaalsContact O-N 3.07Å
438	F	37.1	Very low	38.9	Very low	203 Å²	203	141.3 Å²	141.3	89%	0.89	75%	0.753	S	S	*	*			trans	-84.2	75.8	162.1	-78.6	-79.2	0	0	0	109.3	L440	F438-L440 PolarHBondContact O-N 3.07Å
439	N	41.3	Very low	38.5	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	76%	0.756	S	S	*	*			trans	-67.9	96.6	170.4	-156.1	-3.8	0	0	0	108.6	D437 D441	D437-N439 PolarHBondContact O-N 3.04Å; D437-N439 VanDerWaalsContact O-N 3.07Å; N439-D441 VanDerWaalsContact C-N 3.27Å; N439-D441 PolarHBondContact O-N 3.44Å
440	L	47.5	Very low	38.6	Very low	133 Å²	133	150.8 Å²	150.8	70%	0.696	76%	0.764	S	S	*	*			trans	-87.9	21.4	-174.6	-93.6	164.6	0	0	0	113.7	F438 D442	F438-L440 PolarHBondContact O-N 3.07Å; L440-D442 VanDerWaalsContact C-N 3.33Å; L440-D442 PolarHBondContact O-N 3.39Å
441	D	47.1	Very low	39	Very low	146 Å²	146	158.3 Å²	158.3	78%	0.781	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	13.5	-179	-81.8	-4.4	0	0	0	114.6	N439	N439-D441 VanDerWaalsContact C-N 3.27Å; N439-D441 PolarHBondContact O-N 3.44Å
442	D	41.5	Very low	39.4	Very low	156 Å²	156	159.1 Å²	159.1	83%	0.834	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	28.4	178.4	-99.9	-10	0	0	0	115.2	L440	L440-D442 VanDerWaalsContact C-N 3.33Å; L440-D442 PolarHBondContact O-N 3.39Å
443	Y	45.9	Very low	39.8	Very low	287 Å²	287	166.9 Å²	166.9	100%	1.125	81%	0.81	S	S	*	*			trans	-136.4	0	162.2	-81.3	-81.2	0	0	0	111.3

Retrieved 443 of 443 residues in 89.2 ms (Link to these results)

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