A0A5K4EEL0_SCHMA Loading...

Tex protein-relatedtranscription accessory protein (S1 rna binding domain)

AlphaFold DB , UniProt , Accession A0A5K4EEL0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 772 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	41	Very low	70.8	Confident	244 Å²	244	121.4 Å²	121.4	100%	1.202	67%	0.673	S	S	*	*				0	41.1	0	-82.2	-166.2	175	0	0	112.3
2	T	45	Very low	72.4	Confident	130 Å²	130	118.7 Å²	118.7	80%	0.798	66%	0.656	S	S	*	*			trans	-142.4	61	-173.2	40.5	0	0	0	0	111.7
3	A	49.2	Very low	73.9	Confident	99 Å²	99	115.4 Å²	115.4	82%	0.818	63%	0.632	S	S	*	*	S	Bend	trans	-130.7	14	178.8	0	0	0	0	0	115
4	K	60.5	Low	75.1	Confident	191 Å²	191	113.9 Å²	113.9	83%	0.83	62%	0.624	S	S	*	*			trans	-147.3	29.7	178.9	-71.1	-167.7	177.8	-179.1	0	115.2
5	T	68.9	Low	76.2	Confident	108 Å²	108	107.7 Å²	107.7	66%	0.663	59%	0.593	S	S	*	*	S	Bend	trans	-77.8	-31.1	-173.4	-15.5	0	0	0	0	113.7
6	F	77.7	Confident	77.2	Confident	106 Å²	106	104.8 Å²	104.8	47%	0.465	58%	0.579	S	S	.	*			trans	-117	107.6	-179.9	-54.6	-66.6	0	0	0	109.9	A11 L12 A15	F6-A11 HydrophobicContact CB-CB 4.38Å; F6-A11 HydrophobicContact CD1-CB 4.22Å; F6-A11 WeakPolarHBondContact CD1-O 3.43Å; F6-L12 HydrophobicContact CB-CB 4.24Å; F6-L12 HydrophobicContact CD2-CD1 3.79Å; F6-L12 HydrophobicContact CE2-CD1 4.2Å; F6-L12 HydrophobicContact CG-CB 4.43Å; F6-L12 HydrophobicContact CG-CD1 4.23Å; F6-A15 HydrophobicContact CD1-CB 4.1Å; F6-A15 HydrophobicContact CE1-CB 3.29Å; F6-A15 HydrophobicContact CE2-CB 4.37Å; F6-A15 HydrophobicContact CZ-CB 3.45Å; F6-A15 VanDerWaalsContact CZ-CB 3.45Å
7	T	81.2	Confident	78.2	Confident	138 Å²	138	99.4 Å²	99.4	85%	0.847	55%	0.55	S	S	*	*			trans	-86.7	-8.8	-175.5	50.4	0	0	0	0	113.7
8	S	87.1	Confident	79.1	Confident	52 Å²	52	98.5 Å²	98.5	36%	0.364	54%	0.541	S	S	.	.	S	Bend	trans	-141.8	157.4	177.5	67	0	0	0	0	111	T10 A11 L12	S8-T10 PolarHBondContact O-N 3.16Å; S8-T10 PolarHBondContact OG-OG1 3.42Å; S8-A11 PolarHBondContact O-N 3.44Å; S8-A11 WeakPolarHBondContact OG-CB 3.37Å; S8-A11 PolarHBondContact OG-N 3.28Å; S8-A11 VanDerWaalsContact OG-N 3.08Å; S8-L12 PolarHBondContact O-N 3.07Å
9	K	88.7	Confident	80	Confident	157 Å²	157	98.9 Å²	98.9	68%	0.683	54%	0.541	S	S	*	.	H	α-helix	trans	-56.7	-39.7	172	-170.7	-171.4	-179	-144.2	0	111.5	A11 L12 E13	K9-A11 PolarHBondContact O-N 3.15Å; K9-L12 WeakPolarHBondContact O-CB 3.28Å; K9-L12 PolarHBondContact O-N 3.12Å; K9-E13 WeakPolarHBondContact CE-OE1 3.3Å; K9-E13 IonicContact NZ-OE1 3.07Å; K9-E13 PolarHBondContact NZ-OE1 3.02Å; K9-E13 VanDerWaalsContact NZ-OE1 3.07Å; K9-E13 WeakPolarHBondContact O-CG 3.4Å; K9-E13 PolarHBondContact O-N 2.85Å
10	T	90.1	Very high	80.7	Confident	83 Å²	83	95.8 Å²	95.8	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-62	-42.4	177.4	53.7	0	0	0	0	112.1	S8 L12 E13 D14	S8-T10 PolarHBondContact O-N 3.16Å; S8-T10 PolarHBondContact OG-OG1 3.42Å; T10-L12 VanDerWaalsContact C-N 3.27Å; T10-L12 PolarHBondContact O-N 3.36Å; T10-E13 PolarHBondContact O-N 3.22Å; T10-D14 WeakPolarHBondContact O-CB 3.41Å; T10-D14 VanDerWaalsContact O-CG 3.3Å; T10-D14 PolarHBondContact O-N 3.17Å
11	A	89.4	Confident	81.4	Confident	27 Å²	27	91.2 Å²	91.2	22%	0.223	50%	0.499	C	S	.	.	H	α-helix	trans	-64.2	-33.8	177.6	0	0	0	0	0	112.1	F6 S8 K9 A15	F6-A11 HydrophobicContact CB-CB 4.38Å; F6-A11 HydrophobicContact CD1-CB 4.22Å; F6-A11 WeakPolarHBondContact CD1-O 3.43Å; S8-A11 PolarHBondContact O-N 3.44Å; S8-A11 WeakPolarHBondContact OG-CB 3.37Å; S8-A11 PolarHBondContact OG-N 3.28Å; S8-A11 VanDerWaalsContact OG-N 3.08Å; K9-A11 PolarHBondContact O-N 3.15Å; A11-A15 WeakPolarHBondContact O-CB 3.35Å; A11-A15 PolarHBondContact O-N 3.32Å; A11-A15 VanDerWaalsContact O-N 3.11Å
12	L	90.6	Very high	84	Confident	89 Å²	89	82.5 Å²	82.5	47%	0.466	46%	0.457	S	S	.	.	H	α-helix	trans	-70.4	-45.1	173.8	-177.8	65.5	0	0	0	111.5	F6 S8 K9 T10 A15 V16	F6-L12 HydrophobicContact CB-CB 4.24Å; F6-L12 HydrophobicContact CD2-CD1 3.79Å; F6-L12 HydrophobicContact CE2-CD1 4.2Å; F6-L12 HydrophobicContact CG-CB 4.43Å; F6-L12 HydrophobicContact CG-CD1 4.23Å; S8-L12 PolarHBondContact O-N 3.07Å; K9-L12 WeakPolarHBondContact O-CB 3.28Å; K9-L12 PolarHBondContact O-N 3.12Å; T10-L12 VanDerWaalsContact C-N 3.27Å; T10-L12 PolarHBondContact O-N 3.36Å; L12-A15 PolarHBondContact O-N 2.89Å; L12-V16 WeakPolarHBondContact O-CG2 3.4Å; L12-V16 PolarHBondContact O-N 2.98Å
13	E	90.7	Very high	86.4	Confident	76 Å²	76	81 Å²	81	36%	0.355	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.3	-74.2	172.6	178.6	0	0	111.3	K9 T10 A15 V16 S17 F170	K9-E13 WeakPolarHBondContact CE-OE1 3.3Å; K9-E13 IonicContact NZ-OE1 3.07Å; K9-E13 PolarHBondContact NZ-OE1 3.02Å; K9-E13 VanDerWaalsContact NZ-OE1 3.07Å; K9-E13 WeakPolarHBondContact O-CG 3.4Å; K9-E13 PolarHBondContact O-N 2.85Å; T10-E13 PolarHBondContact O-N 3.22Å; E13-A15 VanDerWaalsContact C-N 3.35Å; E13-A15 PolarHBondContact O-N 3.26Å; E13-V16 PolarHBondContact O-N 2.83Å; E13-S17 WeakPolarHBondContact O-CB 3.48Å; E13-S17 PolarHBondContact O-N 3.29Å; E13-F170 HydrophobicContact CB-CE2 4.2Å; E13-F170 WeakPolarHBondContact O-CZ 3.41Å
14	D	91	Very high	88.6	Confident	95 Å²	95	76.6 Å²	76.6	51%	0.508	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-41.7	175.3	-71.3	-22.2	0	0	0	111.6	T10 S17 H18	T10-D14 WeakPolarHBondContact O-CB 3.41Å; T10-D14 VanDerWaalsContact O-CG 3.3Å; T10-D14 PolarHBondContact O-N 3.17Å; D14-S17 WeakPolarHBondContact O-CB 3.39Å; D14-S17 PolarHBondContact O-N 3.49Å; D14-H18 PolarHBondContact O-CD2 3.29Å; D14-H18 VanDerWaalsContact O-CD2 3.27Å; D14-H18 PolarHBondContact O-N 3.35Å
15	A	91.8	Very high	90.2	Very high	20 Å²	20	68.6 Å²	68.6	17%	0.165	38%	0.375	C	S	.	.	H	α-helix	trans	-64.1	-43	177.2	0	0	0	0	0	112.4	F6 A11 L12 E13 H18 I19	F6-A15 HydrophobicContact CD1-CB 4.1Å; F6-A15 HydrophobicContact CE1-CB 3.29Å; F6-A15 HydrophobicContact CE2-CB 4.37Å; F6-A15 HydrophobicContact CZ-CB 3.45Å; F6-A15 VanDerWaalsContact CZ-CB 3.45Å; A11-A15 WeakPolarHBondContact O-CB 3.35Å; A11-A15 PolarHBondContact O-N 3.32Å; A11-A15 VanDerWaalsContact O-N 3.11Å; L12-A15 PolarHBondContact O-N 2.89Å; E13-A15 VanDerWaalsContact C-N 3.35Å; E13-A15 PolarHBondContact O-N 3.26Å; A15-H18 PolarHBondContact O-N 2.69Å; A15-I19 WeakPolarHBondContact O-CG1 3.34Å; A15-I19 PolarHBondContact O-N 2.81Å; A15-I19 VanDerWaalsContact O-N 3.08Å
16	V	93.1	Very high	91.5	Very high	61 Å²	61	71.1 Å²	71.1	37%	0.37	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-41.7	175.2	177.2	0	0	0	0	110.5	L12 E13 H18 I19 I20 F170	L12-V16 WeakPolarHBondContact O-CG2 3.4Å; L12-V16 PolarHBondContact O-N 2.98Å; E13-V16 PolarHBondContact O-N 2.83Å; V16-H18 VanDerWaalsContact C-N 3.33Å; V16-H18 PolarHBondContact O-N 3.27Å; V16-I19 PolarHBondContact O-N 3.41Å; V16-I20 HydrophobicContact CG1-CD1 4.07Å; V16-I20 WeakPolarHBondContact O-CG1 3.44Å; V16-I20 PolarHBondContact O-N 2.88Å; V16-F170 HydrophobicContact CB-CE1 4.42Å; V16-F170 HydrophobicContact CB-CZ 4.14Å; V16-F170 HydrophobicContact CG1-CE1 3.85Å; V16-F170 HydrophobicContact CG1-CZ 4.09Å
17	S	93.5	Very high	92.3	Very high	13 Å²	13	67 Å²	67	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-58.4	-44.7	175.7	-177.1	0	0	0	0	111.5	E13 D14 I19 I20 A21	E13-S17 WeakPolarHBondContact O-CB 3.48Å; E13-S17 PolarHBondContact O-N 3.29Å; D14-S17 WeakPolarHBondContact O-CB 3.39Å; D14-S17 PolarHBondContact O-N 3.49Å; S17-I19 PolarHBondContact O-N 2.75Å; S17-I20 PolarHBondContact O-N 3.42Å; S17-A21 WeakPolarHBondContact O-CB 3.46Å; S17-A21 PolarHBondContact O-N 3.08Å
18	H	94.5	Very high	93	Very high	84 Å²	84	65.8 Å²	65.8	39%	0.389	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-37.2	176.2	-72.2	-36.8	0	0	0	113.5	D14 A15 V16 A21 D22 D177 R181	D14-H18 PolarHBondContact O-CD2 3.29Å; D14-H18 VanDerWaalsContact O-CD2 3.27Å; D14-H18 PolarHBondContact O-N 3.35Å; A15-H18 PolarHBondContact O-N 2.69Å; V16-H18 VanDerWaalsContact C-N 3.33Å; V16-H18 PolarHBondContact O-N 3.27Å; H18-A21 PolarHBondContact O-N 3.04Å; H18-D22 PolarHBondContact O-N 2.87Å; H18-D177 IonicContact CE1-OD2 3.92Å; H18-D177 IonicContact ND1-OD2 3.58Å; H18-D177 PolarHBondContact ND1-OD2 3.32Å; H18-R181 PolarHBondContact ND1-NH2 3.11Å
19	I	95.5	Very high	93.4	Very high	106 Å²	106	66.8 Å²	66.8	54%	0.544	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-46.8	174.5	-68.2	165.2	0	0	0	110.4	A15 V16 S17 A21 D22 I23	A15-I19 WeakPolarHBondContact O-CG1 3.34Å; A15-I19 PolarHBondContact O-N 2.81Å; A15-I19 VanDerWaalsContact O-N 3.08Å; V16-I19 PolarHBondContact O-N 3.41Å; S17-I19 PolarHBondContact O-N 2.75Å; I19-A21 VanDerWaalsContact C-N 3.31Å; I19-A21 PolarHBondContact O-N 3.23Å; I19-D22 PolarHBondContact O-N 2.96Å; I19-I23 HydrophobicContact CG2-CD1 4.25Å; I19-I23 WeakPolarHBondContact O-CG1 3.43Å; I19-I23 PolarHBondContact O-N 2.95Å; I19-I23 VanDerWaalsContact O-N 3.07Å
20	I	94.6	Very high	93.7	Very high	36 Å²	36	59.3 Å²	59.3	19%	0.185	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-41.2	177.3	-65.2	171.1	0	0	0	110.5	V16 S17 D22 I23 F24 F170 A174	V16-I20 HydrophobicContact CG1-CD1 4.07Å; V16-I20 WeakPolarHBondContact O-CG1 3.44Å; V16-I20 PolarHBondContact O-N 2.88Å; S17-I20 PolarHBondContact O-N 3.42Å; I20-D22 VanDerWaalsContact C-N 3.33Å; I20-D22 PolarHBondContact O-N 3.08Å; I20-I23 WeakPolarHBondContact O-CB 3.28Å; I20-I23 PolarHBondContact O-N 3.08Å; I20-I23 VanDerWaalsContact O-N 3.14Å; I20-F24 HydrophobicContact CG2-CD2 3.81Å; I20-F24 HydrophobicContact CG2-CE2 3.41Å; I20-F24 VanDerWaalsContact CG2-CE2 3.41Å; I20-F24 HydrophobicContact CG2-CZ 4.1Å; I20-F24 WeakPolarHBondContact O-CD2 3.15Å; I20-F24 PolarHBondContact O-N 3.28Å; I20-F170 HydrophobicContact CD1-CD1 4.25Å; I20-F170 HydrophobicContact CD1-CE1 3.77Å; I20-A174 HydrophobicContact CB-CB 3.82Å; I20-A174 HydrophobicContact CG2-CB 3.61Å
21	A	95.8	Very high	93.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-41.1	177.5	0	0	0	0	0	112.5	S17 H18 I19 I23 F24 A25 A174 D177 A178	S17-A21 WeakPolarHBondContact O-CB 3.46Å; S17-A21 PolarHBondContact O-N 3.08Å; H18-A21 PolarHBondContact O-N 3.04Å; I19-A21 VanDerWaalsContact C-N 3.31Å; I19-A21 PolarHBondContact O-N 3.23Å; A21-I23 VanDerWaalsContact C-N 3.32Å; A21-I23 PolarHBondContact O-N 3.24Å; A21-F24 PolarHBondContact O-N 3.09Å; A21-A25 WeakPolarHBondContact O-CB 3.27Å; A21-A25 PolarHBondContact O-N 3.27Å; A21-A174 WeakPolarHBondContact CB-O 3.49Å; A21-D177 HydrophobicContact CB-CB 4.38Å; A21-A178 HydrophobicContact CB-CB 3.71Å; A21-A178 WeakPolarHBondContact O-CB 3.46Å
22	D	95.7	Very high	94.2	Very high	62 Å²	62	62.3 Å²	62.3	33%	0.332	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-33.5	175	-81.1	12.3	0	0	0	112.2	H18 I19 I20 K26 R181 L182	H18-D22 PolarHBondContact O-N 2.87Å; I19-D22 PolarHBondContact O-N 2.96Å; I20-D22 VanDerWaalsContact C-N 3.33Å; I20-D22 PolarHBondContact O-N 3.08Å; D22-K26 VanDerWaalsContact O-CG 3.3Å; D22-K26 WeakPolarHBondContact O-CG 3.41Å; D22-K26 PolarHBondContact O-N 3.14Å; D22-R181 IonicContact OD1-NH1 2.84Å; D22-R181 IonicContact OD1-NH2 2.76Å; D22-L182 VanDerWaalsContact OD1-CD1 3.28Å; D22-L182 WeakPolarHBondContact OD1-CD1 3.2Å
23	I	95.1	Very high	94.4	Very high	98 Å²	98	60.9 Å²	60.9	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-49.7	173.5	-68	166.3	0	0	0	110	I19 I20 A21 A25 K26 D27	I19-I23 HydrophobicContact CG2-CD1 4.25Å; I19-I23 WeakPolarHBondContact O-CG1 3.43Å; I19-I23 PolarHBondContact O-N 2.95Å; I19-I23 VanDerWaalsContact O-N 3.07Å; I20-I23 WeakPolarHBondContact O-CB 3.28Å; I20-I23 PolarHBondContact O-N 3.08Å; I20-I23 VanDerWaalsContact O-N 3.14Å; A21-I23 VanDerWaalsContact C-N 3.32Å; A21-I23 PolarHBondContact O-N 3.24Å; I23-A25 VanDerWaalsContact C-N 3.31Å; I23-A25 PolarHBondContact O-N 3.46Å; I23-K26 PolarHBondContact O-N 3.34Å; I23-K26 VanDerWaalsContact O-N 3.11Å; I23-D27 PolarHBondContact O-N 3.04Å; I23-D27 VanDerWaalsContact O-N 3.1Å
24	F	95.8	Very high	94.6	Very high	7 Å²	7	57.2 Å²	57.2	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-39.9	177.8	-72.7	-45.5	0	0	0	112.7	I20 A21 K26 D27 I30 V155 Y159 V171 F175 A178	I20-F24 HydrophobicContact CG2-CD2 3.81Å; I20-F24 HydrophobicContact CG2-CE2 3.41Å; I20-F24 VanDerWaalsContact CG2-CE2 3.41Å; I20-F24 HydrophobicContact CG2-CZ 4.1Å; I20-F24 WeakPolarHBondContact O-CD2 3.15Å; I20-F24 PolarHBondContact O-N 3.28Å; A21-F24 PolarHBondContact O-N 3.09Å; F24-K26 PolarHBondContact O-N 3.18Å; F24-D27 PolarHBondContact O-N 2.96Å; F24-I30 HydrophobicContact CB-CD1 4.19Å; F24-I30 HydrophobicContact CD1-CD1 3.56Å; F24-I30 HydrophobicContact CE1-CD1 4.39Å; F24-I30 HydrophobicContact CG-CD1 4.28Å; F24-V155 HydrophobicContact CD1-CG1 4.42Å; F24-V155 HydrophobicContact CE1-CG1 3.78Å; F24-V155 HydrophobicContact CZ-CG1 3.97Å; F24-Y159 HydrophobicContact CD1-CE2 4.17Å; F24-Y159 AromaticContact CE1-CD2 3.79Å; F24-Y159 HydrophobicContact CE1-CD2 3.79Å; F24-Y159 AromaticContact CE1-CE2 3.75Å; F24-Y159 HydrophobicContact CE1-CE2 3.75Å; F24-Y159 HydrophobicContact CE1-CG 4.21Å; F24-V171 HydrophobicContact CE2-CG1 4.08Å; F24-V171 HydrophobicContact CZ-CG1 3.71Å; F24-F175 HydrophobicContact CD2-CB 3.97Å; F24-F175 HydrophobicContact CD2-CD2 4.36Å; F24-F175 HydrophobicContact CE2-CB 3.83Å; F24-F175 HydrophobicContact CG-CD2 4.41Å; F24-A178 HydrophobicContact CB-CB 4Å
25	A	94.3	Very high	94.8	Very high	23 Å²	23	55.7 Å²	55.7	19%	0.19	28%	0.276	C	S	.	.	H	α-helix	trans	-68.3	-20.4	178.4	0	0	0	0	0	113.9	A21 I23 L182 I183	A21-A25 WeakPolarHBondContact O-CB 3.27Å; A21-A25 PolarHBondContact O-N 3.27Å; I23-A25 VanDerWaalsContact C-N 3.31Å; I23-A25 PolarHBondContact O-N 3.46Å; A25-L182 HydrophobicContact CB-CB 3.64Å; A25-L182 HydrophobicContact CB-CD1 3.55Å; A25-L182 HydrophobicContact CB-CG 4.25Å; A25-I183 HydrophobicContact CB-CG1 4.23Å
26	K	94.7	Very high	94.9	Very high	161 Å²	161	59.8 Å²	59.8	70%	0.7	29%	0.292	S	S	*	.	H	α-helix	trans	-98	-8.6	177.6	-70.4	172.3	-175.6	169.4	0	113.5	D22 I23 F24 L28	D22-K26 VanDerWaalsContact O-CG 3.3Å; D22-K26 WeakPolarHBondContact O-CG 3.41Å; D22-K26 PolarHBondContact O-N 3.14Å; I23-K26 PolarHBondContact O-N 3.34Å; I23-K26 VanDerWaalsContact O-N 3.11Å; F24-K26 PolarHBondContact O-N 3.18Å; K26-L28 PolarHBondContact O-N 3.43Å
27	D	95.1	Very high	95	Very high	20 Å²	20	57.3 Å²	57.3	11%	0.107	28%	0.277	C	S	.	.			trans	-71.3	109.3	176.3	-174.7	-19.3	0	0	0	110.2	I23 F24 D29 I30 I31 K158 Y159	I23-D27 PolarHBondContact O-N 3.04Å; I23-D27 VanDerWaalsContact O-N 3.1Å; F24-D27 PolarHBondContact O-N 2.96Å; D27-D29 PolarHBondContact O-N 2.94Å; D27-D29 WeakPolarHBondContact OD1-CB 3.13Å; D27-D29 PolarHBondContact OD1-N 3.12Å; D27-I30 HydrophobicContact CB-CB 4.19Å; D27-I30 HydrophobicContact CB-CD1 3.78Å; D27-I30 HydrophobicContact CB-CG1 3.91Å; D27-I30 PolarHBondContact O-N 3.08Å; D27-I31 WeakPolarHBondContact O-CG1 3.34Å; D27-I31 PolarHBondContact O-N 3.32Å; D27-I31 VanDerWaalsContact O-N 3.09Å; D27-K158 VanDerWaalsContact CG-NZ 3.28Å; D27-K158 IonicContact OD1-NZ 2.71Å; D27-K158 PolarHBondContact OD1-NZ 3.04Å; D27-K158 WeakPolarHBondContact OD2-CE 3.3Å; D27-K158 IonicContact OD2-NZ 2.88Å; D27-K158 PolarHBondContact OD2-NZ 3.28Å; D27-Y159 PolarHBondContact OD2-OH 3.19Å
28	L	95.3	Very high	94.9	Very high	112 Å²	112	57.4 Å²	57.4	59%	0.586	28%	0.277	S	S	*	.	H	α-helix	trans	-59.6	-30.3	-178.4	-71.9	172.1	0	0	0	113	K26 R32	K26-L28 PolarHBondContact O-N 3.43Å; L28-R32 VanDerWaalsContact O-CB 3.29Å; L28-R32 WeakPolarHBondContact O-CB 3.36Å; L28-R32 WeakPolarHBondContact O-CG 3.49Å; L28-R32 PolarHBondContact O-N 3.29Å
29	D	95.8	Very high	94.6	Very high	72 Å²	72	58.4 Å²	58.4	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-72.2	-39.8	-179.7	-59.6	-32.5	0	0	0	110.9	D27 K33 F154 K158	D27-D29 PolarHBondContact O-N 2.94Å; D27-D29 WeakPolarHBondContact OD1-CB 3.13Å; D27-D29 PolarHBondContact OD1-N 3.12Å; D29-K33 VanDerWaalsContact O-CB 3.26Å; D29-K33 WeakPolarHBondContact O-CB 3.43Å; D29-K33 PolarHBondContact O-N 3.33Å; D29-F154 HydrophobicContact CB-CE1 4.11Å; D29-F154 HydrophobicContact CB-CZ 4.02Å; D29-K158 IonicContact OD2-NZ 3.62Å; D29-K158 PolarHBondContact OD2-NZ 3.44Å
30	I	95.1	Very high	94.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-47.8	175.1	-62.3	179.2	0	0	0	109.5	F24 D27 K33 A34 F154 V155 Y159 F175 I183	F24-I30 HydrophobicContact CB-CD1 4.19Å; F24-I30 HydrophobicContact CD1-CD1 3.56Å; F24-I30 HydrophobicContact CE1-CD1 4.39Å; F24-I30 HydrophobicContact CG-CD1 4.28Å; D27-I30 HydrophobicContact CB-CB 4.19Å; D27-I30 HydrophobicContact CB-CD1 3.78Å; D27-I30 HydrophobicContact CB-CG1 3.91Å; D27-I30 PolarHBondContact O-N 3.08Å; I30-K33 PolarHBondContact O-N 3.1Å; I30-A34 WeakPolarHBondContact O-CB 3.48Å; I30-A34 PolarHBondContact O-N 3.46Å; I30-F154 HydrophobicContact CG1-CD1 4.4Å; I30-F154 HydrophobicContact CG1-CE1 4.22Å; I30-V155 HydrophobicContact CD1-CG2 3.55Å; I30-V155 HydrophobicContact CG1-CG2 3.89Å; I30-V155 HydrophobicContact CG2-CG2 4.32Å; I30-Y159 HydrophobicContact CD1-CE2 4.14Å; I30-F175 HydrophobicContact CG2-CE2 4.5Å; I30-I183 HydrophobicContact CG2-CD1 4.13Å
31	I	95	Very high	94.4	Very high	19 Å²	19	61.9 Å²	61.9	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-48.5	180	-62.4	-59.4	0	0	0	111.2	D27 K33 A34 E35 I183	D27-I31 WeakPolarHBondContact O-CG1 3.34Å; D27-I31 PolarHBondContact O-N 3.32Å; D27-I31 VanDerWaalsContact O-N 3.09Å; I31-K33 VanDerWaalsContact C-N 3.31Å; I31-K33 PolarHBondContact O-N 2.8Å; I31-A34 PolarHBondContact O-N 3Å; I31-A34 VanDerWaalsContact O-N 3.17Å; I31-E35 HydrophobicContact CG2-CG 4.46Å; I31-E35 WeakPolarHBondContact O-CG 3.18Å; I31-E35 PolarHBondContact O-N 3.46Å; I31-I183 HydrophobicContact CD1-CG1 4.18Å; I31-I183 HydrophobicContact CD1-CG2 4.1Å
32	R	95.5	Very high	94.2	Very high	154 Å²	154	65.8 Å²	65.8	58%	0.581	32%	0.322	S	S	*	.	H	α-helix	trans	-58.9	-43.1	176.7	-76.6	172.1	179.2	157.9	-1.8	111.7	L28 A34 E35 E36	L28-R32 VanDerWaalsContact O-CB 3.29Å; L28-R32 WeakPolarHBondContact O-CB 3.36Å; L28-R32 WeakPolarHBondContact O-CG 3.49Å; L28-R32 PolarHBondContact O-N 3.29Å; R32-A34 VanDerWaalsContact C-N 3.33Å; R32-A34 PolarHBondContact O-N 3.45Å; R32-E35 PolarHBondContact O-N 3.18Å; R32-E36 WeakPolarHBondContact O-CB 3.39Å; R32-E36 PolarHBondContact O-N 2.91Å
33	K	95.2	Very high	94.1	Very high	59 Å²	59	63 Å²	63	26%	0.257	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-40.4	177.9	-171.5	55.9	174.5	-179.8	0	111.5	D29 I30 I31 E36 L37 F154	D29-K33 VanDerWaalsContact O-CB 3.26Å; D29-K33 WeakPolarHBondContact O-CB 3.43Å; D29-K33 PolarHBondContact O-N 3.33Å; I30-K33 PolarHBondContact O-N 3.1Å; I31-K33 VanDerWaalsContact C-N 3.31Å; I31-K33 PolarHBondContact O-N 2.8Å; K33-E36 VanDerWaalsContact CD-OE2 3.27Å; K33-E36 WeakPolarHBondContact CD-OE2 3.43Å; K33-E36 IonicContact NZ-OE1 3.64Å; K33-E36 PolarHBondContact NZ-OE1 2.93Å; K33-E36 IonicContact NZ-OE2 2.85Å; K33-E36 PolarHBondContact NZ-OE2 3.18Å; K33-E36 PolarHBondContact O-N 2.85Å; K33-L37 HydrophobicContact CG-CD1 4.21Å; K33-L37 WeakPolarHBondContact O-CB 3.49Å; K33-L37 VanDerWaalsContact O-CG 3.23Å; K33-L37 WeakPolarHBondContact O-CG 3.48Å; K33-L37 PolarHBondContact O-N 2.91Å; K33-F154 HydrophobicContact CB-CD1 4.21Å; K33-F154 HydrophobicContact CB-CE1 4.31Å; K33-F154 HydrophobicContact CB-CG 4.42Å; K33-F154 HydrophobicContact CG-CB 4.27Å; K33-F154 HydrophobicContact CG-CD1 4.26Å; K33-F154 HydrophobicContact CG-CD2 4.19Å; K33-F154 HydrophobicContact CG-CG 3.98Å
34	A	94.9	Very high	94.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-40.4	176.4	0	0	0	0	0	111.9	I30 I31 R32 L37 C38 W179 I183 L187	I30-A34 WeakPolarHBondContact O-CB 3.48Å; I30-A34 PolarHBondContact O-N 3.46Å; I31-A34 PolarHBondContact O-N 3Å; I31-A34 VanDerWaalsContact O-N 3.17Å; R32-A34 VanDerWaalsContact C-N 3.33Å; R32-A34 PolarHBondContact O-N 3.45Å; A34-L37 PolarHBondContact O-N 3.31Å; A34-C38 PolarHBondContact O-N 3.17Å; A34-C38 PolarHBondContact O-SG 3.09Å; A34-W179 HydrophobicContact CB-CH2 4.31Å; A34-W179 HydrophobicContact CB-CZ3 4.24Å; A34-I183 HydrophobicContact CB-CG2 4.49Å; A34-L187 HydrophobicContact CB-CD1 3.74Å; A34-L187 HydrophobicContact CB-CD2 4.19Å
35	E	93.7	Very high	94.2	Very high	63 Å²	63	60.7 Å²	60.7	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-41.1	174.6	-71.2	-174.2	151.2	0	0	113.1	I31 R32 L37 C38 S39 L187	I31-E35 HydrophobicContact CG2-CG 4.46Å; I31-E35 WeakPolarHBondContact O-CG 3.18Å; I31-E35 PolarHBondContact O-N 3.46Å; R32-E35 PolarHBondContact O-N 3.18Å; E35-L37 VanDerWaalsContact C-N 3.34Å; E35-C38 PolarHBondContact O-N 3.32Å; E35-S39 PolarHBondContact O-N 3.49Å; E35-S39 VanDerWaalsContact O-N 3.15Å; E35-S39 PolarHBondContact O-OG 3.18Å; E35-S39 VanDerWaalsContact O-OG 3.08Å; E35-L187 HydrophobicContact CG-CD2 3.59Å
36	E	94.6	Very high	94.3	Very high	106 Å²	106	61.6 Å²	61.6	50%	0.495	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-47.3	172.3	-174.9	-155.8	136.8	0	0	110.5	R32 K33 C38 S39 K40	R32-E36 WeakPolarHBondContact O-CB 3.39Å; R32-E36 PolarHBondContact O-N 2.91Å; K33-E36 VanDerWaalsContact CD-OE2 3.27Å; K33-E36 WeakPolarHBondContact CD-OE2 3.43Å; K33-E36 IonicContact NZ-OE1 3.64Å; K33-E36 PolarHBondContact NZ-OE1 2.93Å; K33-E36 IonicContact NZ-OE2 2.85Å; K33-E36 PolarHBondContact NZ-OE2 3.18Å; K33-E36 PolarHBondContact O-N 2.85Å; E36-C38 PolarHBondContact O-N 3.42Å; E36-S39 WeakPolarHBondContact O-CB 3.31Å; E36-S39 PolarHBondContact O-N 3.47Å; E36-S39 VanDerWaalsContact O-N 3.09Å; E36-K40 PolarHBondContact O-N 2.84Å; E36-K40 VanDerWaalsContact O-N 3.17Å
37	L	94.6	Very high	94.3	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-35.9	178.2	-71.9	168.7	0	0	0	112.5	K33 A34 E35 S39 K40 Y41 V147 N150 C151	K33-L37 HydrophobicContact CG-CD1 4.21Å; K33-L37 WeakPolarHBondContact O-CB 3.49Å; K33-L37 VanDerWaalsContact O-CG 3.23Å; K33-L37 WeakPolarHBondContact O-CG 3.48Å; K33-L37 PolarHBondContact O-N 2.91Å; A34-L37 PolarHBondContact O-N 3.31Å; E35-L37 VanDerWaalsContact C-N 3.34Å; L37-S39 PolarHBondContact O-N 3.12Å; L37-K40 PolarHBondContact O-N 2.94Å; L37-Y41 HydrophobicContact CD2-CD2 4.19Å; L37-Y41 HydrophobicContact CD2-CE2 3.87Å; L37-Y41 WeakPolarHBondContact O-CD2 3.42Å; L37-Y41 PolarHBondContact O-N 3.42Å; L37-V147 HydrophobicContact CB-CB 4.48Å; L37-V147 HydrophobicContact CB-CG1 3.82Å; L37-N150 HydrophobicContact CD1-CB 3.62Å; L37-N150 HydrophobicContact CD2-CB 3.88Å; L37-N150 HydrophobicContact CG-CB 4.43Å; L37-C151 HydrophobicContact CD1-CB 4.32Å
38	C	92.2	Very high	94.2	Very high	16 Å²	16	55.3 Å²	55.3	11%	0.108	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-27.5	172.8	-74.1	0	0	0	0	112.8	A34 E35 E36 I191	A34-C38 PolarHBondContact O-N 3.17Å; A34-C38 PolarHBondContact O-SG 3.09Å; E35-C38 PolarHBondContact O-N 3.32Å; E36-C38 PolarHBondContact O-N 3.42Å; C38-I191 HydrophobicContact CB-CD1 4.37Å
39	S	88.5	Confident	94	Very high	104 Å²	104	56.1 Å²	56.1	73%	0.727	28%	0.281	S	S	*	.	H	α-helix	trans	-75	-33.5	174.5	-54.2	0	0	0	0	111.5	E35 E36 L37	E35-S39 PolarHBondContact O-N 3.49Å; E35-S39 VanDerWaalsContact O-N 3.15Å; E35-S39 PolarHBondContact O-OG 3.18Å; E35-S39 VanDerWaalsContact O-OG 3.08Å; E36-S39 WeakPolarHBondContact O-CB 3.31Å; E36-S39 PolarHBondContact O-N 3.47Å; E36-S39 VanDerWaalsContact O-N 3.09Å; L37-S39 PolarHBondContact O-N 3.12Å
40	K	92.1	Very high	93.6	Very high	147 Å²	147	58 Å²	58	64%	0.639	29%	0.286	S	S	*	.	H	α-helix	trans	-79.2	-43.8	177.1	-174.2	176.2	-178.7	178.9	0	113.2	E36 L37	E36-K40 PolarHBondContact O-N 2.84Å; E36-K40 VanDerWaalsContact O-N 3.17Å; L37-K40 PolarHBondContact O-N 2.94Å
41	Y	93	Very high	92.5	Very high	68 Å²	68	62.9 Å²	62.9	27%	0.267	32%	0.32	S	S	.	.	S	Bend	trans	-108.1	94.1	-179	-59.9	-77.3	0	0	0	109.4	L37 A43 Q146 V147 N150	L37-Y41 HydrophobicContact CD2-CD2 4.19Å; L37-Y41 HydrophobicContact CD2-CE2 3.87Å; L37-Y41 WeakPolarHBondContact O-CD2 3.42Å; L37-Y41 PolarHBondContact O-N 3.42Å; Y41-A43 PolarHBondContact O-N 2.85Å; Y41-Q146 HydrophobicContact CD1-CB 4Å; Y41-Q146 HydrophobicContact CD1-CG 4.45Å; Y41-Q146 HydrophobicContact CD2-CB 4.35Å; Y41-Q146 HydrophobicContact CE1-CB 3.96Å; Y41-Q146 HydrophobicContact CE1-CG 4.23Å; Y41-Q146 HydrophobicContact CE2-CB 4.32Å; Y41-Q146 HydrophobicContact CG-CB 4.2Å; Y41-V147 HydrophobicContact CD2-CG2 4.36Å; Y41-V147 HydrophobicContact CG-CG2 4.46Å; Y41-N150 VanDerWaalsContact CE2-ND2 3.34Å; Y41-N150 WeakPolarHBondContact CE2-ND2 3.09Å; Y41-N150 PolarHBondContact OH-ND2 3.42Å
42	I	91.2	Very high	90.8	Very high	83 Å²	83	70.2 Å²	70.2	43%	0.426	35%	0.351	S	S	.	.			trans	-60.1	125.8	-172.3	-62.2	157.5	0	0	0	110.5	P116 V117 S118	I42-P116 HydrophobicContact CG2-CB 3.77Å; I42-V117 HydrophobicContact CG2-CB 4.37Å; I42-S118 WeakPolarHBondContact CD1-OG 3.48Å
43	A	94	Very high	88.4	Confident	4 Å²	4	74.6 Å²	74.6	3%	0.033	37%	0.367	C	S	.	.			trans	-70.4	155.7	174	0	0	0	0	0	111.8	Y41 V117 I141 H142 L143 I191	Y41-A43 PolarHBondContact O-N 2.85Å; A43-V117 HydrophobicContact CB-CG2 4.13Å; A43-V117 WeakPolarHBondContact O-CB 3.35Å; A43-V117 VanDerWaalsContact O-CG2 3.28Å; A43-V117 WeakPolarHBondContact O-CG2 3.34Å; A43-V117 PolarHBondContact O-N 2.82Å; A43-I141 HydrophobicContact CB-CG2 3.67Å; A43-H142 WeakPolarHBondContact CA-O 3.41Å; A43-L143 HydrophobicContact CB-CD2 3.81Å; A43-I191 HydrophobicContact CB-CD1 4.23Å
44	T	96.3	Very high	85.5	Confident	48 Å²	48	74.7 Å²	74.7	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125	178.4	-58.7	0	0	0	0	110.1	V46 I141 H142	T44-V46 HydrophobicContact CG2-CG2 4.04Å; T44-I141 CarbonylContact O-C 3.6Å; T44-I141 WeakPolarHBondContact O-CA 3.49Å; T44-H142 PolarHBondContact N-O 3.5Å; T44-H142 PolarHBondContact O-N 2.91Å
45	L	96.6	Very high	82.4	Confident	8 Å²	8	84.3 Å²	84.3	4%	0.042	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.3	171.3	-174.9	148.6	0	0	0	109	T47 F113 S114 R115 V117 I120 I128 V139 K140 I141	L45-T47 HydrophobicContact CD2-CG2 3.75Å; L45-F113 HydrophobicContact CD2-CD1 4.18Å; L45-F113 HydrophobicContact CD2-CE1 4.3Å; L45-S114 VanDerWaalsContact O-CA 3.3Å; L45-S114 WeakPolarHBondContact O-CA 3.25Å; L45-R115 PolarHBondContact N-O 2.94Å; L45-R115 PolarHBondContact O-N 3.37Å; L45-V117 HydrophobicContact CB-CG2 4.34Å; L45-I120 HydrophobicContact CB-CD1 3.49Å; L45-I120 VanDerWaalsContact CB-CD1 3.49Å; L45-I120 HydrophobicContact CD1-CD1 3.94Å; L45-I120 HydrophobicContact CD2-CD1 4.26Å; L45-I120 HydrophobicContact CG-CD1 4.1Å; L45-I128 HydrophobicContact CD2-CD1 4.02Å; L45-V139 HydrophobicContact CD1-CG1 4.02Å; L45-V139 HydrophobicContact CD2-CG1 4.15Å; L45-V139 HydrophobicContact CG-CG1 4Å; L45-K140 WeakPolarHBondContact CA-O 3.5Å; L45-I141 HydrophobicContact CB-CG1 4.36Å; L45-I141 HydrophobicContact CD1-CD1 4.5Å; L45-I141 HydrophobicContact CD1-CG1 4.29Å; L45-I141 HydrophobicContact CG-CG1 4.3Å
46	V	96.3	Very high	79.3	Confident	42 Å²	42	90.9 Å²	90.9	26%	0.255	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.7	178.8	-175.5	0	0	0	0	109.4	T44 F113 K140	T44-V46 HydrophobicContact CG2-CG2 4.04Å; V46-F113 CarbonylContact C-O 3.32Å; V46-F113 WeakPolarHBondContact CA-O 3.33Å; V46-K140 PolarHBondContact N-O 3.38Å; V46-K140 PolarHBondContact O-N 3.46Å; V46-K140 VanDerWaalsContact O-O 3.1Å
47	T	96.1	Very high	76.2	Confident	3 Å²	3	91.4 Å²	91.4	2%	0.018	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.1	175.7	60.9	0	0	0	0	109.9	L45 Y110 N112 F113 I128 I137 T138 V139	L45-T47 HydrophobicContact CD2-CG2 3.75Å; T47-Y110 WeakPolarHBondContact CB-O 3.44Å; T47-Y110 PolarHBondContact OG1-O 2.86Å; T47-N112 WeakPolarHBondContact O-CA 3.31Å; T47-F113 PolarHBondContact N-O 2.94Å; T47-F113 WeakPolarHBondContact OG1-CA 3.39Å; T47-F113 VanDerWaalsContact OG1-CB 3.24Å; T47-F113 WeakPolarHBondContact OG1-CB 3.34Å; T47-F113 PolarHBondContact OG1-N 3.13Å; T47-F113 PolarHBondContact OG1-O 2.79Å; T47-I128 HydrophobicContact CG2-CD1 4.4Å; T47-I128 HydrophobicContact CG2-CG1 4.39Å; T47-I128 HydrophobicContact CG2-CG2 4.05Å; T47-I137 HydrophobicContact CG2-CD1 4.03Å; T47-T138 VanDerWaalsContact CA-O 3.27Å; T47-T138 WeakPolarHBondContact CA-O 3.25Å; T47-V139 HydrophobicContact CG2-CG2 4.22Å
48	A	93.1	Very high	73	Confident	46 Å²	46	99.9 Å²	99.9	38%	0.38	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	148.7	175.4	0	0	0	0	0	110.1	K50 L111 I137 T138	A48-K50 PolarHBondContact O-N 2.49Å; A48-L111 CarbonylContact C-O 3.31Å; A48-L111 WeakPolarHBondContact CA-O 3.08Å; A48-I137 CarbonylContact O-C 3.54Å; A48-I137 VanDerWaalsContact O-CA 3.29Å; A48-I137 WeakPolarHBondContact O-CA 3.47Å; A48-T138 PolarHBondContact N-O 3.09Å; A48-T138 PolarHBondContact O-N 3.22Å
49	K	90.8	Very high	70.2	Confident	128 Å²	128	107.6 Å²	107.6	56%	0.557	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.5	130.1	171.4	-174.9	177.9	-179.2	178.8	0	110.3	S51 L111	K49-S51 PolarHBondContact O-N 3.29Å; K49-S51 VanDerWaalsContact O-N 3.1Å; K49-L111 HydrophobicContact CB-CD2 4.19Å; K49-L111 HydrophobicContact CG-CD2 4.25Å; K49-L111 PolarHBondContact N-O 2.78Å
50	K	86.1	Confident	67.5	Low	112 Å²	112	107.8 Å²	107.8	49%	0.487	54%	0.54	S	S	.	.			trans	-70.6	109.6	176.1	-161.6	173.8	-170.2	172.5	0	109	A48 G135 V136	A48-K50 PolarHBondContact O-N 2.49Å; K50-G135 WeakPolarHBondContact CB-O 3.45Å; K50-G135 VanDerWaalsContact CD-O 3.25Å; K50-G135 WeakPolarHBondContact CD-O 3.38Å; K50-V136 PolarHBondContact N-O 2.82Å
51	S	72.4	Confident	64.5	Low	103 Å²	103	106.5 Å²	106.5	72%	0.72	55%	0.55	S	S	*	.			trans	-69.6	135.8	172.1	-177.4	0	0	0	0	109.7	K49 R53	K49-S51 PolarHBondContact O-N 3.29Å; K49-S51 VanDerWaalsContact O-N 3.1Å; S51-R53 VanDerWaalsContact C-N 3.35Å; S51-R53 PolarHBondContact O-N 2.97Å
52	K	60.4	Low	61.6	Low	172 Å²	172	107.2 Å²	107.2	75%	0.748	58%	0.578	S	S	*	*			trans	-65	99.7	167.7	-74.8	-175.2	-178.4	176.4	0	106.7	G54	K52-G54 VanDerWaalsContact C-N 3.34Å; K52-G54 PolarHBondContact O-N 3.03Å
53	R	43.7	Very low	58.7	Low	246 Å²	246	106.9 Å²	106.9	93%	0.928	60%	0.595	S	S	*	*			trans	-64.2	100.3	168.9	-137.5	177.6	-173.8	-177.1	0.2	106.5	S51 K55	S51-R53 VanDerWaalsContact C-N 3.35Å; S51-R53 PolarHBondContact O-N 2.97Å; R53-K55 PolarHBondContact O-N 3.12Å
54	G	34.6	Very low	55.8	Low	61 Å²	61	114 Å²	114	63%	0.629	63%	0.632	S	S	*	*			trans	-55.9	128	166.1	0	0	0	0	0	107.4	K52 K56	K52-G54 VanDerWaalsContact C-N 3.34Å; K52-G54 PolarHBondContact O-N 3.03Å; G54-K56 VanDerWaalsContact C-N 3.26Å; G54-K56 PolarHBondContact O-N 3.16Å
55	K	30	Very low	53	Low	202 Å²	202	119 Å²	119	88%	0.878	66%	0.656	S	S	*	*			trans	-57	99.2	162.4	-87.4	180	172.7	178.9	0	106	R53 V57	R53-K55 PolarHBondContact O-N 3.12Å; K55-V57 VanDerWaalsContact C-N 3.27Å; K55-V57 PolarHBondContact O-N 3.26Å
56	K	28.3	Very low	50	Low	202 Å²	202	123.4 Å²	123.4	88%	0.878	69%	0.685	S	S	*	*			trans	-68.2	97.1	161.3	-86.4	-170.8	173.4	-173.4	0	105.5	G54 E58	G54-K56 VanDerWaalsContact C-N 3.26Å; G54-K56 PolarHBondContact O-N 3.16Å; K56-E58 PolarHBondContact O-N 3.25Å
57	V	30.7	Very low	46.9	Very low	116 Å²	116	129.2 Å²	129.2	70%	0.703	72%	0.715	S	S	*	*			trans	-68.4	115.4	155.6	176.7	0	0	0	0	104.5	K55 Q59	K55-V57 VanDerWaalsContact C-N 3.27Å; K55-V57 PolarHBondContact O-N 3.26Å; V57-Q59 PolarHBondContact O-N 3.11Å; V57-Q59 VanDerWaalsContact O-N 3.14Å
58	E	27.5	Very low	43.7	Very low	187 Å²	187	133.8 Å²	133.8	87%	0.874	75%	0.747	S	S	*	*			trans	-63.7	109.5	170.5	-71.8	176.3	159.8	0	0	108	K56	K56-E58 PolarHBondContact O-N 3.25Å
59	Q	33.2	Very low	40.7	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	77%	0.769	S	S	*	*			trans	-128.8	132.1	155.1	-80.9	-173.9	-2.1	0	0	108.6	V57	V57-Q59 PolarHBondContact O-N 3.11Å; V57-Q59 VanDerWaalsContact O-N 3.14Å
60	S	31.4	Very low	37.7	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	78%	0.777	S	S	*	*			trans	-65.2	147.3	-171.1	42.8	0	0	0	0	114.6
61	S	29.9	Very low	35.1	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	78%	0.782	S	S	*	*			trans	59.5	116.5	144.8	60.6	0	0	0	0	120.1
62	G	30.8	Very low	32.9	Very low	83 Å²	83	140.6 Å²	140.6	86%	0.856	78%	0.784	S	S	*	*			trans	135.3	107.9	139.6	0	0	0	0	0	116.5
63	G	30.5	Very low	31.7	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	79%	0.789	S	S	*	*			trans	97.2	95.4	135.8	0	0	0	0	0	119.9
64	N	33.3	Very low	31	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	78%	0.784	S	S	*	*			trans	61.2	113.8	132.5	-75.4	-1.7	0	0	0	124.4
65	L	36.4	Very low	30.8	Very low	153 Å²	153	142.8 Å²	142.8	80%	0.801	79%	0.794	S	S	*	*			trans	79.9	145.3	131.3	-84.4	111.6	0	0	0	122.7
66	P	33.4	Very low	30.7	Very low	101 Å²	101	140.3 Å²	140.3	66%	0.656	79%	0.79	S	S	*	*			trans	-104.5	156	-157.5	38.6	-26.8	0	0	0	111.9
67	N	32.9	Very low	30.8	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	79%	0.791	S	S	*	*			trans	-148.3	133.5	153.2	-108.1	-14.3	0	0	0	112.1
68	S	28.2	Very low	30.6	Very low	99 Å²	99	142 Å²	142	69%	0.692	80%	0.798	S	S	*	*			trans	-56.7	142.3	176.3	50.3	0	0	0	0	113.5
69	M	30.8	Very low	30.8	Very low	170 Å²	170	137.5 Å²	137.5	84%	0.837	79%	0.794	S	S	*	*			trans	-154	101.3	143.7	-115.6	177.9	-81.1	0	0	109
70	S	26.9	Very low	30.6	Very low	105 Å²	105	136 Å²	136	73%	0.734	79%	0.791	S	S	*	*			trans	-60.2	131.2	156.3	42.8	0	0	0	0	108.5
71	I	31.9	Very low	30.5	Very low	116 Å²	116	138.3 Å²	138.3	60%	0.595	80%	0.795	S	S	*	*			trans	-128.1	97.9	166.4	-56.3	177.6	0	0	0	107.1	F73	I71-F73 HydrophobicContact CB-CE2 4.36Å; I71-F73 HydrophobicContact CG2-CD2 3.4Å; I71-F73 VanDerWaalsContact CG2-CD2 3.4Å; I71-F73 HydrophobicContact CG2-CE1 4.27Å; I71-F73 HydrophobicContact CG2-CE2 3.08Å; I71-F73 HydrophobicContact CG2-CG 4.15Å; I71-F73 HydrophobicContact CG2-CZ 3.55Å
72	D	26.5	Very low	30.5	Very low	142 Å²	142	136.6 Å²	136.6	76%	0.759	79%	0.788	S	S	*	*			trans	-67.7	134.1	157	-63.9	-49.8	0	0	0	107.7
73	F	33.9	Very low	30.5	Very low	192 Å²	192	140.8 Å²	140.8	84%	0.842	79%	0.786	S	S	*	*			trans	-125.4	101.6	165	-84.8	-63.3	0	0	0	108.5	I71	I71-F73 HydrophobicContact CB-CE2 4.36Å; I71-F73 HydrophobicContact CG2-CD2 3.4Å; I71-F73 VanDerWaalsContact CG2-CD2 3.4Å; I71-F73 HydrophobicContact CG2-CE1 4.27Å; I71-F73 HydrophobicContact CG2-CE2 3.08Å; I71-F73 HydrophobicContact CG2-CG 4.15Å; I71-F73 HydrophobicContact CG2-CZ 3.55Å
74	D	30.5	Very low	30.2	Very low	157 Å²	157	142.4 Å²	142.4	84%	0.84	78%	0.784	S	S	*	*			trans	-60.7	154.8	168.9	-88.2	-42.1	0	0	0	112.6
75	E	28.9	Very low	30.3	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	78%	0.776	S	S	*	*			trans	-62.4	129.1	171	-58.7	177.2	146.4	0	0	111
76	N	27.7	Very low	29.9	Very low	150 Å²	150	141.8 Å²	141.8	80%	0.802	77%	0.774	S	S	*	*			trans	165.5	127.5	136.2	-86.8	-38.9	0	0	0	108.6
77	E	30.9	Very low	29.8	Very low	191 Å²	191	144.3 Å²	144.3	89%	0.893	78%	0.782	S	S	*	*			trans	-174.3	113.2	133.6	-102.8	167.3	-165.3	0	0	110
78	N	27	Very low	29.5	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	77%	0.773	S	S	*	*			trans	-69	131	152.1	-62.9	-58.2	0	0	0	107.1
79	A	32.6	Very low	29.6	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	78%	0.782	S	S	*	*			trans	-160.2	113.9	153.4	0	0	0	0	0	108.8
80	D	27.9	Very low	29.5	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	78%	0.778	S	S	*	*			trans	-58	164	157.9	-62.9	-58.2	0	0	0	110.7
81	D	29.4	Very low	29.6	Very low	158 Å²	158	141.6 Å²	141.6	85%	0.845	77%	0.772	S	S	*	*			trans	87.8	136.9	158	-54.8	-36.5	0	0	0	121.4
82	A	30.2	Very low	29.5	Very low	84 Å²	84	144.1 Å²	144.1	69%	0.694	78%	0.783	S	S	*	*			trans	93.2	111.4	140.4	0	0	0	0	0	120.8
83	E	29.9	Very low	29.7	Very low	171 Å²	171	143.8 Å²	143.8	80%	0.799	78%	0.781	S	S	*	*				81.9	108.9	124.2	-67.7	-173	163	0	0	120.6
84	C	25.1	Very low	29.7	Very low	110 Å²	110	139.8 Å²	139.8	74%	0.743	77%	0.769	S	S	*	*			trans	-85.2	108.5	159.1	-176.9	0	0	0	0	109.1
85	I	34.5	Very low	30.1	Very low	127 Å²	127	136.4 Å²	136.4	65%	0.651	75%	0.754	S	S	*	*			trans	-125.5	111.8	162.1	-62.5	-178.4	0	0	0	109.7
86	Q	29.4	Very low	30.9	Very low	164 Å²	164	132.5 Å²	132.5	77%	0.766	74%	0.739	S	S	*	*			trans	27.3	110.6	139.6	-57.9	175	-12.5	0	0	117.3
87	N	29.9	Very low	31.9	Very low	154 Å²	154	129.5 Å²	129.5	82%	0.824	72%	0.723	S	S	*	*				-164.5	116.5	119.7	-95.7	-27.6	0	0	0	111.9
88	S	27.6	Very low	33	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	70%	0.703	S	S	*	*			trans	-65.2	141.8	167.5	32.8	0	0	0	0	111.1
89	H	30.6	Very low	34.7	Very low	187 Å²	187	119.3 Å²	119.3	87%	0.866	68%	0.678	S	S	*	*	S	Bend	trans	87.9	57.7	171	-54.9	-71.2	0	0	0	118.9
90	S	28.1	Very low	36.2	Very low	110 Å²	110	120.1 Å²	120.1	77%	0.769	66%	0.664	S	S	*	*			trans	-158.7	9.9	151.4	60	0	0	0	0	116.1	M92	S90-M92 PolarHBondContact O-N 2.94Å
91	S	28.4	Very low	38.1	Very low	86 Å²	86	119.9 Å²	119.9	60%	0.601	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	9	-155	-112	0	0	0	0	119.5	N93	S91-N93 PolarHBondContact O-N 2.75Å
92	M	30.4	Very low	40.4	Very low	170 Å²	170	117.2 Å²	117.2	84%	0.837	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-18.1	-174.9	-96.3	172.6	158.6	0	0	115.1	S90	S90-M92 PolarHBondContact O-N 2.94Å
93	N	31	Very low	42.8	Very low	134 Å²	134	114.4 Å²	114.4	72%	0.717	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-22.3	179.9	-82.2	-16.3	0	0	0	114.5	S91	S91-N93 PolarHBondContact O-N 2.75Å
94	N	32.9	Very low	45.2	Very low	109 Å²	109	109.1 Å²	109.1	58%	0.583	59%	0.592	S	S	*	*	H	α-helix	trans	-81.7	-31.5	-175.1	-118	-3	0	0	0	113.3	N96 N97 N98	N94-N96 VanDerWaalsContact C-N 3.35Å; N94-N96 PolarHBondContact O-N 3.02Å; N94-N97 PolarHBondContact O-N 3.42Å; N94-N98 PolarHBondContact O-N 3.46Å
95	T	40.4	Very low	48	Very low	85 Å²	85	109.1 Å²	109.1	52%	0.521	59%	0.589	S	S	.	*	H	α-helix	trans	-65	-36.1	178.6	51.8	0	0	0	0	112.9	N97 S99	T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 3.14Å; T95-S99 PolarHBondContact O-N 3.43Å; T95-S99 VanDerWaalsContact O-N 3.17Å; T95-S99 PolarHBondContact O-OG 3.31Å
96	N	44.8	Very low	50.3	Low	94 Å²	94	107.2 Å²	107.2	50%	0.503	58%	0.583	S	S	.	*	H	α-helix	trans	-71.3	-25.2	177.5	-83.2	-20.2	0	0	0	113.6	N94 S99 K100	N94-N96 VanDerWaalsContact C-N 3.35Å; N94-N96 PolarHBondContact O-N 3.02Å; N96-S99 WeakPolarHBondContact CA-OG 3.25Å; N96-S99 PolarHBondContact O-OG 2.86Å; N96-K100 WeakPolarHBondContact O-CG 3.47Å
97	N	48.2	Very low	53.1	Low	87 Å²	87	99.6 Å²	99.6	47%	0.465	55%	0.547	S	S	.	.	H	α-helix	trans	-81.8	-38.4	177	-79.1	-19.1	0	0	0	111.7	N94 T95 K101	N94-N97 PolarHBondContact O-N 3.42Å; T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 3.14Å; N97-K101 PolarHBondContact O-N 2.85Å; N97-K101 VanDerWaalsContact O-N 3.16Å
98	N	55.1	Low	55.9	Low	89 Å²	89	99.6 Å²	99.6	48%	0.476	54%	0.54	S	S	.	.	H	α-helix	trans	-67.4	-47.5	176.8	-76.5	-3.3	0	0	0	111.9	N94 K100 K101 D102	N94-N98 PolarHBondContact O-N 3.46Å; N98-K100 VanDerWaalsContact C-N 3.25Å; N98-K100 PolarHBondContact O-N 3.31Å; N98-K101 WeakPolarHBondContact O-CB 3.21Å; N98-K101 PolarHBondContact O-N 2.93Å; N98-D102 PolarHBondContact O-N 2.69Å
99	S	61.5	Low	58.9	Low	49 Å²	49	101.2 Å²	101.2	34%	0.343	54%	0.541	S	S	.	.	H	α-helix	trans	-55.9	-38.8	176.5	49.1	0	0	0	0	113.2	T95 N96 D102 D103	T95-S99 PolarHBondContact O-N 3.43Å; T95-S99 VanDerWaalsContact O-N 3.17Å; T95-S99 PolarHBondContact O-OG 3.31Å; N96-S99 WeakPolarHBondContact CA-OG 3.25Å; N96-S99 PolarHBondContact O-OG 2.86Å; S99-D102 PolarHBondContact O-N 3.22Å; S99-D103 WeakPolarHBondContact O-CB 3.44Å; S99-D103 PolarHBondContact O-N 3Å
100	K	64.6	Low	61.8	Low	112 Å²	112	93.5 Å²	93.5	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-70.9	-32.4	176.2	-75	178.7	-176.7	171.6	0	113.6	N96 N98 L104	N96-K100 WeakPolarHBondContact O-CG 3.47Å; N98-K100 VanDerWaalsContact C-N 3.25Å; N98-K100 PolarHBondContact O-N 3.31Å; K100-L104 VanDerWaalsContact O-CG 3.3Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 3.31Å; K100-L104 VanDerWaalsContact O-N 3.11Å
101	K	68.7	Low	64.7	Low	139 Å²	139	90.1 Å²	90.1	60%	0.604	48%	0.477	S	S	*	.	H	α-helix	trans	-65.8	-45.3	172.1	-75.7	-178.6	178.1	-178.5	0	110	N97 N98 D103 L104 V105	N97-K101 PolarHBondContact O-N 2.85Å; N97-K101 VanDerWaalsContact O-N 3.16Å; N98-K101 WeakPolarHBondContact O-CB 3.21Å; N98-K101 PolarHBondContact O-N 2.93Å; K101-D103 VanDerWaalsContact C-N 3.33Å; K101-D103 PolarHBondContact O-N 3.11Å; K101-L104 PolarHBondContact O-N 2.82Å; K101-V105 WeakPolarHBondContact O-CG2 3.44Å; K101-V105 PolarHBondContact O-N 2.83Å; K101-V105 VanDerWaalsContact O-N 3.07Å
102	D	76.8	Confident	67.7	Low	103 Å²	103	92.8 Å²	92.8	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-62.4	-40.7	178.9	-61.6	-19.6	0	0	0	111.7	N98 S99 V105 T106	N98-D102 PolarHBondContact O-N 2.69Å; S99-D102 PolarHBondContact O-N 3.22Å; D102-V105 PolarHBondContact O-N 3.03Å; D102-T106 WeakPolarHBondContact O-CB 3.47Å; D102-T106 PolarHBondContact O-N 3.11Å; D102-T106 PolarHBondContact O-OG1 3.47Å
103	D	81.2	Confident	70.7	Confident	24 Å²	24	86 Å²	86	13%	0.128	45%	0.451	C	S	.	.	H	α-helix	trans	-62.9	-42.3	174.3	-83.2	-19	0	0	0	112.3	S99 K101 V105 T106 F107 R134 V136	S99-D103 WeakPolarHBondContact O-CB 3.44Å; S99-D103 PolarHBondContact O-N 3Å; K101-D103 VanDerWaalsContact C-N 3.33Å; K101-D103 PolarHBondContact O-N 3.11Å; D103-V105 VanDerWaalsContact C-N 3.31Å; D103-V105 PolarHBondContact O-N 3.17Å; D103-T106 PolarHBondContact O-N 3.25Å; D103-F107 HydrophobicContact CB-CD2 4.27Å; D103-F107 HydrophobicContact CB-CE2 4.29Å; D103-F107 WeakPolarHBondContact O-CD2 3.38Å; D103-F107 PolarHBondContact O-N 2.92Å; D103-R134 IonicContact OD1-CZ 3Å; D103-R134 IonicContact OD1-NH1 3.6Å; D103-R134 PolarHBondContact OD1-NH1 2.99Å; D103-V136 HydrophobicContact CB-CG2 3.84Å
104	L	80.1	Confident	73.8	Confident	60 Å²	60	83 Å²	83	31%	0.314	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-37.2	177.4	-74.9	169.8	0	0	0	112.2	K100 K101 K108 L111 V136	K100-L104 VanDerWaalsContact O-CG 3.3Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 3.31Å; K100-L104 VanDerWaalsContact O-N 3.11Å; K101-L104 PolarHBondContact O-N 2.82Å; L104-K108 WeakPolarHBondContact O-CA 3.08Å; L104-K108 PolarHBondContact O-N 3.09Å; L104-K108 VanDerWaalsContact O-N 3.11Å; L104-L111 HydrophobicContact CD2-CD2 3.99Å; L104-V136 HydrophobicContact CD2-CG1 3.93Å
105	V	82.8	Confident	76.7	Confident	111 Å²	111	82.6 Å²	82.6	67%	0.673	43%	0.431	S	S	*	.	H	α-helix	trans	-66.9	-45.4	173.9	175.5	0	0	0	0	110.1	K101 D102 D103 F107 K108	K101-V105 WeakPolarHBondContact O-CG2 3.44Å; K101-V105 PolarHBondContact O-N 2.83Å; K101-V105 VanDerWaalsContact O-N 3.07Å; D102-V105 PolarHBondContact O-N 3.03Å; D103-V105 VanDerWaalsContact C-N 3.31Å; D103-V105 PolarHBondContact O-N 3.17Å; V105-F107 PolarHBondContact O-N 2.93Å; V105-K108 WeakPolarHBondContact O-CB 2.71Å; V105-K108 PolarHBondContact O-N 3.42Å
106	T	82.9	Confident	79.3	Confident	86 Å²	86	81.4 Å²	81.4	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-43.1	-178.9	-58.3	0	0	0	0	112.2	D102 D103	D102-T106 WeakPolarHBondContact O-CB 3.47Å; D102-T106 PolarHBondContact O-N 3.11Å; D102-T106 PolarHBondContact O-OG1 3.47Å; D103-T106 PolarHBondContact O-N 3.25Å
107	F	89	Confident	81.7	Confident	5 Å²	5	78 Å²	78	2%	0.022	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	17.9	-175.7	-54.7	-64.6	0	0	0	113.7	D103 V105 N109 Y110 R130 A131 V136	D103-F107 HydrophobicContact CB-CD2 4.27Å; D103-F107 HydrophobicContact CB-CE2 4.29Å; D103-F107 WeakPolarHBondContact O-CD2 3.38Å; D103-F107 PolarHBondContact O-N 2.92Å; V105-F107 PolarHBondContact O-N 2.93Å; F107-N109 PolarHBondContact O-N 3.4Å; F107-N109 VanDerWaalsContact O-N 3.1Å; F107-Y110 HydrophobicContact CB-CD2 4.42Å; F107-Y110 HydrophobicContact CD1-CD2 4.38Å; F107-Y110 PolarHBondContact O-N 2.86Å; F107-R130 HydrophobicContact CE1-CB 4.46Å; F107-R130 HydrophobicContact CE1-CG 4.41Å; F107-R130 HydrophobicContact CZ-CB 4.5Å; F107-R130 HydrophobicContact CZ-CG 4.05Å; F107-A131 HydrophobicContact CB-CB 4.08Å; F107-A131 HydrophobicContact CD1-CB 3.62Å; F107-A131 HydrophobicContact CD2-CB 3.94Å; F107-A131 HydrophobicContact CE1-CB 3.96Å; F107-A131 HydrophobicContact CE2-CB 4.3Å; F107-A131 HydrophobicContact CG-CB 3.6Å; F107-A131 HydrophobicContact CZ-CB 4.3Å; F107-V136 HydrophobicContact CB-CG1 4.47Å; F107-V136 HydrophobicContact CD2-CB 4.41Å; F107-V136 HydrophobicContact CD2-CG1 4.39Å; F107-V136 HydrophobicContact CD2-CG2 4.04Å; F107-V136 HydrophobicContact CE2-CG2 4.4Å
108	K	89.2	Confident	83.8	Confident	154 Å²	154	78 Å²	78	67%	0.67	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-49.6	-41.3	-177.4	-176.4	178	178.3	179.2	0	112.7	L104 V105 Y110 L111	L104-K108 WeakPolarHBondContact O-CA 3.08Å; L104-K108 PolarHBondContact O-N 3.09Å; L104-K108 VanDerWaalsContact O-N 3.11Å; V105-K108 WeakPolarHBondContact O-CB 2.71Å; V105-K108 PolarHBondContact O-N 3.42Å; K108-Y110 PolarHBondContact O-N 2.94Å; K108-Y110 VanDerWaalsContact O-N 3.12Å; K108-L111 PolarHBondContact O-N 3.13Å
109	N	89.8	Confident	85.5	Confident	131 Å²	131	75.7 Å²	75.7	70%	0.701	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-66.3	-11.4	-179.1	-65.9	-12.2	0	0	0	114.2	F107	F107-N109 PolarHBondContact O-N 3.4Å; F107-N109 VanDerWaalsContact O-N 3.1Å
110	Y	92.6	Very high	87	Confident	26 Å²	26	74.1 Å²	74.1	10%	0.102	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-116.9	10.4	-174.5	-52.6	-69	0	0	0	113.9	T47 F107 K108 F113 Q124 A127 I128	T47-Y110 WeakPolarHBondContact CB-O 3.44Å; T47-Y110 PolarHBondContact OG1-O 2.86Å; F107-Y110 HydrophobicContact CB-CD2 4.42Å; F107-Y110 HydrophobicContact CD1-CD2 4.38Å; F107-Y110 PolarHBondContact O-N 2.86Å; K108-Y110 PolarHBondContact O-N 2.94Å; K108-Y110 VanDerWaalsContact O-N 3.12Å; Y110-F113 HydrophobicContact CD1-CB 4.4Å; Y110-F113 HydrophobicContact CD1-CD2 4.19Å; Y110-F113 HydrophobicContact CD1-CG 4.25Å; Y110-Q124 HydrophobicContact CE1-CB 4.12Å; Y110-Q124 HydrophobicContact CE1-CG 4.22Å; Y110-A127 HydrophobicContact CD2-CB 4.35Å; Y110-A127 HydrophobicContact CE2-CB 3.53Å; Y110-I128 HydrophobicContact CD1-CD1 3.99Å; Y110-I128 HydrophobicContact CD1-CG1 3.58Å; Y110-I128 HydrophobicContact CE1-CD1 4.27Å; Y110-I128 HydrophobicContact CE1-CG1 4.01Å; Y110-I128 HydrophobicContact CG-CG1 4.03Å
111	L	89.2	Confident	88.3	Confident	38 Å²	38	73 Å²	73	20%	0.199	39%	0.391	C	S	.	.	S	Bend	trans	-72	-30.5	-177.7	-71.8	173.8	0	0	0	113.7	A48 K49 L104 K108 V136 I137	A48-L111 CarbonylContact C-O 3.31Å; A48-L111 WeakPolarHBondContact CA-O 3.08Å; K49-L111 HydrophobicContact CB-CD2 4.19Å; K49-L111 HydrophobicContact CG-CD2 4.25Å; K49-L111 PolarHBondContact N-O 2.78Å; L104-L111 HydrophobicContact CD2-CD2 3.99Å; K108-L111 PolarHBondContact O-N 3.13Å; L111-V136 HydrophobicContact CD2-CG1 4.3Å; L111-I137 HydrophobicContact CD2-CG2 4.1Å
112	N	90.9	Very high	89.5	Confident	143 Å²	143	67.6 Å²	67.6	77%	0.765	37%	0.372	S	S	*	.	S	Bend	trans	-141.2	41	177.3	-69.2	-38.6	0	0	0	110.4	T47	T47-N112 WeakPolarHBondContact O-CA 3.31Å
113	F	93	Very high	90.1	Very high	26 Å²	26	63.7 Å²	63.7	11%	0.114	35%	0.351	C	S	.	.			trans	-78.2	132.7	-177.8	175	-85.6	0	0	0	110.9	L45 V46 T47 Y110 R115 I120 I128	L45-F113 HydrophobicContact CD2-CD1 4.18Å; L45-F113 HydrophobicContact CD2-CE1 4.3Å; V46-F113 CarbonylContact C-O 3.32Å; V46-F113 WeakPolarHBondContact CA-O 3.33Å; T47-F113 PolarHBondContact N-O 2.94Å; T47-F113 WeakPolarHBondContact OG1-CA 3.39Å; T47-F113 VanDerWaalsContact OG1-CB 3.24Å; T47-F113 WeakPolarHBondContact OG1-CB 3.34Å; T47-F113 PolarHBondContact OG1-N 3.13Å; T47-F113 PolarHBondContact OG1-O 2.79Å; Y110-F113 HydrophobicContact CD1-CB 4.4Å; Y110-F113 HydrophobicContact CD1-CD2 4.19Å; Y110-F113 HydrophobicContact CD1-CG 4.25Å; F113-R115 HydrophobicContact CE1-CB 3.96Å; F113-R115 HydrophobicContact CE1-CG 3.85Å; F113-R115 HydrophobicContact CE2-CG 3.88Å; F113-R115 HydrophobicContact CZ-CB 4Å; F113-R115 HydrophobicContact CZ-CG 3.5Å; F113-R115 VanDerWaalsContact CZ-CG 3.5Å; F113-I120 HydrophobicContact CE1-CD1 4.4Å; F113-I120 HydrophobicContact CE1-CG1 4.41Å; F113-I128 HydrophobicContact CD1-CD1 3.94Å; F113-I128 HydrophobicContact CE1-CD1 3.82Å; F113-I128 HydrophobicContact CZ-CD1 4.49Å
114	S	95.5	Very high	90.7	Very high	71 Å²	71	63.7 Å²	63.7	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	122.1	176.9	179.8	0	0	0	0	109.8	L45	L45-S114 VanDerWaalsContact O-CA 3.3Å; L45-S114 WeakPolarHBondContact O-CA 3.25Å
115	R	94.9	Very high	91.5	Very high	101 Å²	101	61.2 Å²	61.2	38%	0.381	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	151.3	176.9	-69.3	-165.9	89.3	150.9	7.2	112.5	L45 F113 V117 I120	L45-R115 PolarHBondContact N-O 2.94Å; L45-R115 PolarHBondContact O-N 3.37Å; F113-R115 HydrophobicContact CE1-CB 3.96Å; F113-R115 HydrophobicContact CE1-CG 3.85Å; F113-R115 HydrophobicContact CE2-CG 3.88Å; F113-R115 HydrophobicContact CZ-CB 4Å; F113-R115 HydrophobicContact CZ-CG 3.5Å; F113-R115 VanDerWaalsContact CZ-CG 3.5Å; R115-V117 PolarHBondContact O-N 2.87Å; R115-I120 HydrophobicContact CB-CD1 4.43Å; R115-I120 HydrophobicContact CB-CG1 3.93Å
116	P	95.2	Very high	92	Very high	61 Å²	61	56 Å²	56	40%	0.396	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	135.1	166.2	-20.7	31.4	0	0	0	110.4	I42 S118 S119 I120	I42-P116 HydrophobicContact CG2-CB 3.77Å; P116-S118 PolarHBondContact O-N 2.77Å; P116-S118 VanDerWaalsContact O-N 3.16Å; P116-S119 PolarHBondContact O-N 2.83Å; P116-S119 PolarHBondContact O-OG 3.15Å; P116-I120 WeakPolarHBondContact O-CG1 3.4Å
117	V	94.5	Very high	92.5	Very high	22 Å²	22	52.2 Å²	52.2	13%	0.133	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-52.1	-39.5	-176.2	160.3	0	0	0	0	112.7	I42 A43 L45 R115 S119 I120 I141 I191 L195	I42-V117 HydrophobicContact CG2-CB 4.37Å; A43-V117 HydrophobicContact CB-CG2 4.13Å; A43-V117 WeakPolarHBondContact O-CB 3.35Å; A43-V117 VanDerWaalsContact O-CG2 3.28Å; A43-V117 WeakPolarHBondContact O-CG2 3.34Å; A43-V117 PolarHBondContact O-N 2.82Å; L45-V117 HydrophobicContact CB-CG2 4.34Å; R115-V117 PolarHBondContact O-N 2.87Å; V117-S119 PolarHBondContact O-N 3.38Å; V117-I120 PolarHBondContact O-N 3.08Å; V117-I141 HydrophobicContact CG2-CG2 4.36Å; V117-I191 HydrophobicContact CG1-CG2 3.94Å; V117-I191 HydrophobicContact CG2-CG2 4.19Å; V117-L195 HydrophobicContact CG1-CD1 3.68Å; V117-L195 HydrophobicContact CG1-CD2 3.78Å; V117-L195 HydrophobicContact CG1-CG 4Å; V117-L195 HydrophobicContact CG2-CD1 4.19Å
118	S	91.4	Very high	92.9	Very high	86 Å²	86	52.1 Å²	52.1	60%	0.601	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-65.5	-20.4	179	59.4	0	0	0	0	114.5	I42 P116	I42-S118 WeakPolarHBondContact CD1-OG 3.48Å; P116-S118 PolarHBondContact O-N 2.77Å; P116-S118 VanDerWaalsContact O-N 3.16Å
119	S	92	Very high	93.2	Very high	41 Å²	41	45.5 Å²	45.5	29%	0.287	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-98.9	-4.1	-175.5	72.9	0	0	0	0	113.9	P116 V117	P116-S119 PolarHBondContact O-N 2.83Å; P116-S119 PolarHBondContact O-OG 3.15Å; V117-S119 PolarHBondContact O-N 3.38Å
120	I	93.3	Very high	93.4	Very high	17 Å²	17	41.7 Å²	41.7	9%	0.087	23%	0.231	C	C	.	.			trans	-82.1	128.4	-176.3	-54.5	174.7	0	0	0	108.8	L45 F113 R115 P116 V117 Q124 V125	L45-I120 HydrophobicContact CB-CD1 3.49Å; L45-I120 VanDerWaalsContact CB-CD1 3.49Å; L45-I120 HydrophobicContact CD1-CD1 3.94Å; L45-I120 HydrophobicContact CD2-CD1 4.26Å; L45-I120 HydrophobicContact CG-CD1 4.1Å; F113-I120 HydrophobicContact CE1-CD1 4.4Å; F113-I120 HydrophobicContact CE1-CG1 4.41Å; R115-I120 HydrophobicContact CB-CD1 4.43Å; R115-I120 HydrophobicContact CB-CG1 3.93Å; P116-I120 WeakPolarHBondContact O-CG1 3.4Å; V117-I120 PolarHBondContact O-N 3.08Å; I120-Q124 HydrophobicContact CG2-CB 3.82Å; I120-V125 HydrophobicContact CB-CG2 4.43Å; I120-V125 HydrophobicContact CG2-CG2 3.67Å
121	L	92.1	Very high	93.4	Very high	89 Å²	89	40.5 Å²	40.5	47%	0.466	23%	0.226	S	C	.	.			trans	-78.9	149.1	-178.7	-55.9	174.4	0	0	0	110.6	H123 Q124 V125	L121-H123 VanDerWaalsContact C-N 3.3Å; L121-H123 VanDerWaalsContact CB-CE1 3.44Å; L121-H123 WeakPolarHBondContact CB-CE1 3.45Å; L121-H123 WeakPolarHBondContact CD1-CE1 3.33Å; L121-H123 PolarHBondContact O-N 3.47Å; L121-Q124 HydrophobicContact CB-CG 4.12Å; L121-Q124 VanDerWaalsContact N-OE1 3.16Å; L121-Q124 WeakPolarHBondContact O-CA 3.44Å; L121-Q124 VanDerWaalsContact O-CB 3.31Å; L121-Q124 WeakPolarHBondContact O-CB 3.47Å; L121-Q124 PolarHBondContact O-N 2.94Å; L121-V125 PolarHBondContact O-N 3.44Å; L121-V125 VanDerWaalsContact O-N 3.1Å
122	A	92.3	Very high	93.7	Very high	25 Å²	25	41.1 Å²	41.1	21%	0.207	23%	0.229	C	C	.	.	H	α-helix	trans	-48.7	-48.6	-179.8	0	0	0	0	0	113.1	Q124 V125 L126 A199 A202	A122-Q124 VanDerWaalsContact C-N 3.26Å; A122-Q124 PolarHBondContact O-N 3.1Å; A122-V125 WeakPolarHBondContact O-CB 3.29Å; A122-V125 PolarHBondContact O-N 3.14Å; A122-V125 VanDerWaalsContact O-N 3.14Å; A122-L126 PolarHBondContact O-N 2.94Å; A122-L126 VanDerWaalsContact O-N 3.1Å; A122-A199 HydrophobicContact CB-CB 3.97Å; A122-A199 WeakPolarHBondContact O-CB 3.38Å; A122-A202 HydrophobicContact CB-CB 4.05Å
123	H	90.5	Very high	93.8	Very high	21 Å²	21	41.5 Å²	41.5	10%	0.097	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-30.3	178.2	65.7	-95.8	0	0	0	113.7	L121 A127 Y411 T688 F689	L121-H123 VanDerWaalsContact C-N 3.3Å; L121-H123 VanDerWaalsContact CB-CE1 3.44Å; L121-H123 WeakPolarHBondContact CB-CE1 3.45Å; L121-H123 WeakPolarHBondContact CD1-CE1 3.33Å; L121-H123 PolarHBondContact O-N 3.47Å; H123-A127 VanDerWaalsContact O-CB 3.31Å; H123-A127 WeakPolarHBondContact O-CB 3.1Å; H123-A127 PolarHBondContact O-N 3.43Å; H123-Y411 HydrophobicContact CB-CD2 4.28Å; H123-Y411 HydrophobicContact CB-CE2 3.36Å; H123-Y411 PolarHBondContact O-OH 3.02Å; H123-T688 PolarHBondContact ND1-OG1 3.08Å; H123-F689 HydrophobicContact CB-CD1 4.11Å; H123-F689 HydrophobicContact CB-CE1 4.49Å; H123-F689 AromaticContact CG-CD1 3.74Å; H123-F689 AromaticContact ND1-CD1 3.77Å
124	Q	93.8	Very high	93.7	Very high	23 Å²	23	47 Å²	47	11%	0.107	25%	0.247	C	C	.	.	H	α-helix	trans	-70.4	-41.1	176	-63.4	175.8	-25.3	0	0	110.1	Y110 I120 L121 A122 L126 A127 I128	Y110-Q124 HydrophobicContact CE1-CB 4.12Å; Y110-Q124 HydrophobicContact CE1-CG 4.22Å; I120-Q124 HydrophobicContact CG2-CB 3.82Å; L121-Q124 HydrophobicContact CB-CG 4.12Å; L121-Q124 VanDerWaalsContact N-OE1 3.16Å; L121-Q124 WeakPolarHBondContact O-CA 3.44Å; L121-Q124 VanDerWaalsContact O-CB 3.31Å; L121-Q124 WeakPolarHBondContact O-CB 3.47Å; L121-Q124 PolarHBondContact O-N 2.94Å; A122-Q124 VanDerWaalsContact C-N 3.26Å; A122-Q124 PolarHBondContact O-N 3.1Å; Q124-L126 VanDerWaalsContact C-N 3.34Å; Q124-L126 PolarHBondContact O-N 2.81Å; Q124-A127 PolarHBondContact O-N 2.94Å; Q124-I128 VanDerWaalsContact O-CB 3.25Å; Q124-I128 WeakPolarHBondContact O-CB 3.47Å; Q124-I128 WeakPolarHBondContact O-CD1 3.25Å; Q124-I128 WeakPolarHBondContact O-CG1 3.42Å; Q124-I128 PolarHBondContact O-N 3.42Å
125	V	95.7	Very high	93.5	Very high	9 Å²	9	45 Å²	45	6%	0.055	24%	0.237	C	C	.	.	H	α-helix	trans	-57.7	-48.5	174.5	179.8	0	0	0	0	110.4	I120 L121 A122 I128 N129 L195 A199	I120-V125 HydrophobicContact CB-CG2 4.43Å; I120-V125 HydrophobicContact CG2-CG2 3.67Å; L121-V125 PolarHBondContact O-N 3.44Å; L121-V125 VanDerWaalsContact O-N 3.1Å; A122-V125 WeakPolarHBondContact O-CB 3.29Å; A122-V125 PolarHBondContact O-N 3.14Å; A122-V125 VanDerWaalsContact O-N 3.14Å; V125-I128 PolarHBondContact O-N 3.38Å; V125-N129 WeakPolarHBondContact O-CB 3.49Å; V125-N129 VanDerWaalsContact O-CG 3.31Å; V125-N129 PolarHBondContact O-N 3.28Å; V125-L195 HydrophobicContact CG1-CB 4.25Å; V125-L195 HydrophobicContact CG2-CB 4.48Å; V125-A199 HydrophobicContact CB-CB 3.8Å; V125-A199 HydrophobicContact CG1-CB 3.97Å; V125-A199 HydrophobicContact CG2-CB 4.42Å
126	L	94.9	Very high	93.3	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-45.4	178.7	-61.7	179.1	0	0	0	111.9	A122 Q124 I128 N129 R130 A199 Q200 Y411 D414	A122-L126 PolarHBondContact O-N 2.94Å; A122-L126 VanDerWaalsContact O-N 3.1Å; Q124-L126 VanDerWaalsContact C-N 3.34Å; Q124-L126 PolarHBondContact O-N 2.81Å; L126-I128 VanDerWaalsContact C-N 3.34Å; L126-I128 PolarHBondContact O-N 2.78Å; L126-N129 PolarHBondContact O-N 3.36Å; L126-R130 WeakPolarHBondContact O-CB 3.35Å; L126-R130 PolarHBondContact O-N 3.17Å; L126-A199 HydrophobicContact CD2-CB 4.03Å; L126-A199 HydrophobicContact CG-CB 4.02Å; L126-Q200 HydrophobicContact CD2-CG 3.87Å; L126-Y411 HydrophobicContact CB-CD1 3.85Å; L126-Y411 HydrophobicContact CB-CE1 4.29Å; L126-Y411 HydrophobicContact CB-CG 4.1Å; L126-Y411 HydrophobicContact CD1-CD1 4.44Å; L126-Y411 HydrophobicContact CD1-CD2 4.18Å; L126-Y411 HydrophobicContact CD1-CG 3.84Å; L126-D414 HydrophobicContact CD2-CB 4.36Å
127	A	93.6	Very high	93.2	Very high	6 Å²	6	38 Å²	38	5%	0.05	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-40.4	176.8	0	0	0	0	0	112.7	Y110 H123 Q124 A131 Y411	Y110-A127 HydrophobicContact CD2-CB 4.35Å; Y110-A127 HydrophobicContact CE2-CB 3.53Å; H123-A127 VanDerWaalsContact O-CB 3.31Å; H123-A127 WeakPolarHBondContact O-CB 3.1Å; H123-A127 PolarHBondContact O-N 3.43Å; Q124-A127 PolarHBondContact O-N 2.94Å; A127-A131 VanDerWaalsContact O-CB 3.3Å; A127-A131 WeakPolarHBondContact O-CB 3.24Å; A127-A131 PolarHBondContact O-N 3.12Å; A127-Y411 HydrophobicContact CB-CE1 4.19Å
128	I	95.8	Very high	93.2	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-43.4	175.9	-73.2	166	0	0	0	110.6	L45 T47 Y110 F113 Q124 V125 L126 A131 N132 I137 V139	L45-I128 HydrophobicContact CD2-CD1 4.02Å; T47-I128 HydrophobicContact CG2-CD1 4.4Å; T47-I128 HydrophobicContact CG2-CG1 4.39Å; T47-I128 HydrophobicContact CG2-CG2 4.05Å; Y110-I128 HydrophobicContact CD1-CD1 3.99Å; Y110-I128 HydrophobicContact CD1-CG1 3.58Å; Y110-I128 HydrophobicContact CE1-CD1 4.27Å; Y110-I128 HydrophobicContact CE1-CG1 4.01Å; Y110-I128 HydrophobicContact CG-CG1 4.03Å; F113-I128 HydrophobicContact CD1-CD1 3.94Å; F113-I128 HydrophobicContact CE1-CD1 3.82Å; F113-I128 HydrophobicContact CZ-CD1 4.49Å; Q124-I128 VanDerWaalsContact O-CB 3.25Å; Q124-I128 WeakPolarHBondContact O-CB 3.47Å; Q124-I128 WeakPolarHBondContact O-CD1 3.25Å; Q124-I128 WeakPolarHBondContact O-CG1 3.42Å; Q124-I128 PolarHBondContact O-N 3.42Å; V125-I128 PolarHBondContact O-N 3.38Å; L126-I128 VanDerWaalsContact C-N 3.34Å; L126-I128 PolarHBondContact O-N 2.78Å; I128-A131 PolarHBondContact O-N 2.94Å; I128-N132 VanDerWaalsContact O-CB 3.32Å; I128-N132 WeakPolarHBondContact O-CB 3.33Å; I128-N132 PolarHBondContact O-N 3.43Å; I128-I137 HydrophobicContact CB-CD1 4.45Å; I128-I137 HydrophobicContact CG2-CD1 4.06Å; I128-V139 HydrophobicContact CG2-CB 4.46Å; I128-V139 HydrophobicContact CG2-CG1 4.11Å; I128-V139 HydrophobicContact CG2-CG2 3.47Å; I128-V139 VanDerWaalsContact CG2-CG2 3.47Å
129	N	95.7	Very high	93.4	Very high	16 Å²	16	36.4 Å²	36.4	9%	0.086	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-48.7	176.2	-76.8	-19.1	0	0	0	111	V125 L126 A131 N132 E133 R192 T196	V125-N129 WeakPolarHBondContact O-CB 3.49Å; V125-N129 VanDerWaalsContact O-CG 3.31Å; V125-N129 PolarHBondContact O-N 3.28Å; L126-N129 PolarHBondContact O-N 3.36Å; N129-A131 VanDerWaalsContact C-N 3.35Å; N129-A131 PolarHBondContact O-N 3.05Å; N129-N132 WeakPolarHBondContact O-CB 3.41Å; N129-N132 PolarHBondContact O-N 3.26Å; N129-N132 VanDerWaalsContact O-N 3.13Å; N129-E133 WeakPolarHBondContact O-CG 3.49Å; N129-E133 PolarHBondContact O-N 3.48Å; N129-R192 PolarHBondContact OD1-NH2 3.36Å; N129-T196 WeakPolarHBondContact ND2-CG2 3.36Å; N129-T196 PolarHBondContact ND2-OG1 3.46Å; N129-T196 VanDerWaalsContact ND2-OG1 3.1Å
130	R	94.1	Very high	93.6	Very high	51 Å²	51	40.5 Å²	40.5	19%	0.192	20%	0.204	C	C	.	.	H	α-helix	trans	-56.7	-46	175.6	-170.3	-169.2	-73.7	-177.9	-6.7	112.1	F107 L126 N132 E133 R134 M410 D414	F107-R130 HydrophobicContact CE1-CB 4.46Å; F107-R130 HydrophobicContact CE1-CG 4.41Å; F107-R130 HydrophobicContact CZ-CB 4.5Å; F107-R130 HydrophobicContact CZ-CG 4.05Å; L126-R130 WeakPolarHBondContact O-CB 3.35Å; L126-R130 PolarHBondContact O-N 3.17Å; R130-N132 VanDerWaalsContact C-N 3.33Å; R130-N132 PolarHBondContact O-N 3.26Å; R130-E133 PolarHBondContact O-N 3.31Å; R130-R134 WeakPolarHBondContact O-CG 3.25Å; R130-R134 PolarHBondContact O-N 3.27Å; R130-M410 PolarHBondContact NH2-O 3.41Å; R130-D414 WeakPolarHBondContact CG-OD1 3.45Å; R130-D414 IonicContact CZ-OD1 2.79Å; R130-D414 IonicContact CZ-OD2 2.81Å; R130-D414 VanDerWaalsContact CZ-OD2 3.22Å; R130-D414 IonicContact NE-OD1 2.97Å; R130-D414 PolarHBondContact NE-OD1 3.05Å; R130-D414 IonicContact NE-OD2 3.55Å; R130-D414 PolarHBondContact NE-OD2 2.8Å; R130-D414 IonicContact NH2-OD1 2.6Å; R130-D414 IonicContact NH2-OD2 2.99Å; R130-D414 PolarHBondContact NH2-OD2 3.49Å
131	A	93.7	Very high	93.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-36.1	178.3	0	0	0	0	0	112.6	F107 A127 I128 N129 G135 V136 I137	F107-A131 HydrophobicContact CB-CB 4.08Å; F107-A131 HydrophobicContact CD1-CB 3.62Å; F107-A131 HydrophobicContact CD2-CB 3.94Å; F107-A131 HydrophobicContact CE1-CB 3.96Å; F107-A131 HydrophobicContact CE2-CB 4.3Å; F107-A131 HydrophobicContact CG-CB 3.6Å; F107-A131 HydrophobicContact CZ-CB 4.3Å; A127-A131 VanDerWaalsContact O-CB 3.3Å; A127-A131 WeakPolarHBondContact O-CB 3.24Å; A127-A131 PolarHBondContact O-N 3.12Å; I128-A131 PolarHBondContact O-N 2.94Å; N129-A131 VanDerWaalsContact C-N 3.35Å; N129-A131 PolarHBondContact O-N 3.05Å; A131-G135 PolarHBondContact O-N 3.28Å; A131-V136 WeakPolarHBondContact O-CB 3.49Å; A131-V136 PolarHBondContact O-N 3.39Å; A131-I137 HydrophobicContact CB-CD1 3.61Å; A131-I137 HydrophobicContact CB-CG1 3.67Å; A131-I137 PolarHBondContact O-N 2.99Å
132	N	94.5	Very high	93.9	Very high	52 Å²	52	40.8 Å²	40.8	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-69.1	-42.3	176.2	-178.3	64.9	0	0	0	111.7	I128 N129 R130 G135 I137 V139	I128-N132 VanDerWaalsContact O-CB 3.32Å; I128-N132 WeakPolarHBondContact O-CB 3.33Å; I128-N132 PolarHBondContact O-N 3.43Å; N129-N132 WeakPolarHBondContact O-CB 3.41Å; N129-N132 PolarHBondContact O-N 3.26Å; N129-N132 VanDerWaalsContact O-N 3.13Å; R130-N132 VanDerWaalsContact C-N 3.33Å; R130-N132 PolarHBondContact O-N 3.26Å; N132-G135 WeakPolarHBondContact O-CA 3.49Å; N132-G135 PolarHBondContact O-N 3.46Å; N132-I137 HydrophobicContact CB-CG1 4.28Å; N132-I137 PolarHBondContact OD1-O 2.93Å; N132-V139 HydrophobicContact CB-CG2 3.88Å
133	E	92.8	Very high	94	Very high	151 Å²	151	40.7 Å²	40.7	71%	0.706	20%	0.198	S	C	*	.	H	α-helix	trans	-64.5	-40.2	176.4	-73.5	170.3	-168.3	0	0	112.3	N129 R130 G135	N129-E133 WeakPolarHBondContact O-CG 3.49Å; N129-E133 PolarHBondContact O-N 3.48Å; R130-E133 PolarHBondContact O-N 3.31Å; E133-G135 PolarHBondContact O-N 2.91Å
134	R	90.9	Very high	94.2	Very high	141 Å²	141	40.6 Å²	40.6	53%	0.532	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.6	171	-68.6	-173.9	-179	-164.3	-0.3	113.7	D103 R130 V136	D103-R134 IonicContact OD1-CZ 3Å; D103-R134 IonicContact OD1-NH1 3.6Å; D103-R134 PolarHBondContact OD1-NH1 2.99Å; R130-R134 WeakPolarHBondContact O-CG 3.25Å; R130-R134 PolarHBondContact O-N 3.27Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-V136 HydrophobicContact CB-CG2 4.02Å; R134-V136 PolarHBondContact O-N 3.44Å
135	G	91	Very high	94.1	Very high	28 Å²	28	44.2 Å²	44.2	29%	0.289	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	22.8	177.9	0	0	0	0	0	114.5	K50 A131 N132 E133	K50-G135 WeakPolarHBondContact CB-O 3.45Å; K50-G135 VanDerWaalsContact CD-O 3.25Å; K50-G135 WeakPolarHBondContact CD-O 3.38Å; A131-G135 PolarHBondContact O-N 3.28Å; N132-G135 WeakPolarHBondContact O-CA 3.49Å; N132-G135 PolarHBondContact O-N 3.46Å; E133-G135 PolarHBondContact O-N 2.91Å
136	V	90.9	Very high	94.1	Very high	17 Å²	17	48.4 Å²	48.4	10%	0.103	24%	0.244	C	C	.	.	S	Bend	trans	-80.4	-41.2	178.5	-175.8	0	0	0	0	110.5	K50 D103 L104 F107 L111 A131 R134	K50-V136 PolarHBondContact N-O 2.82Å; D103-V136 HydrophobicContact CB-CG2 3.84Å; L104-V136 HydrophobicContact CD2-CG1 3.93Å; F107-V136 HydrophobicContact CB-CG1 4.47Å; F107-V136 HydrophobicContact CD2-CB 4.41Å; F107-V136 HydrophobicContact CD2-CG1 4.39Å; F107-V136 HydrophobicContact CD2-CG2 4.04Å; F107-V136 HydrophobicContact CE2-CG2 4.4Å; L111-V136 HydrophobicContact CD2-CG1 4.3Å; A131-V136 WeakPolarHBondContact O-CB 3.49Å; A131-V136 PolarHBondContact O-N 3.39Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-V136 HydrophobicContact CB-CG2 4.02Å; R134-V136 PolarHBondContact O-N 3.44Å
137	I	93.9	Very high	94.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.8	-177.8	67.3	174.9	0	0	0	111.6	T47 A48 L111 I128 A131 N132 V139	T47-I137 HydrophobicContact CG2-CD1 4.03Å; A48-I137 CarbonylContact O-C 3.54Å; A48-I137 VanDerWaalsContact O-CA 3.29Å; A48-I137 WeakPolarHBondContact O-CA 3.47Å; L111-I137 HydrophobicContact CD2-CG2 4.1Å; I128-I137 HydrophobicContact CB-CD1 4.45Å; I128-I137 HydrophobicContact CG2-CD1 4.06Å; A131-I137 HydrophobicContact CB-CD1 3.61Å; A131-I137 HydrophobicContact CB-CG1 3.67Å; A131-I137 PolarHBondContact O-N 2.99Å; N132-I137 HydrophobicContact CB-CG1 4.28Å; N132-I137 PolarHBondContact OD1-O 2.93Å; I137-V139 HydrophobicContact CD1-CG2 4.11Å; I137-V139 HydrophobicContact CG1-CG2 4.3Å
138	T	95	Very high	94.1	Very high	54 Å²	54	51.1 Å²	51.1	33%	0.331	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138	166.2	-54.7	0	0	0	0	108	T47 A48	T47-T138 VanDerWaalsContact CA-O 3.27Å; T47-T138 WeakPolarHBondContact CA-O 3.25Å; A48-T138 PolarHBondContact N-O 3.09Å; A48-T138 PolarHBondContact O-N 3.22Å
139	V	95.7	Very high	94.1	Very high	19 Å²	19	57 Å²	57	12%	0.115	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	130	-177.1	-174.6	0	0	0	0	109.7	L45 T47 I128 N132 I137	L45-V139 HydrophobicContact CD1-CG1 4.02Å; L45-V139 HydrophobicContact CD2-CG1 4.15Å; L45-V139 HydrophobicContact CG-CG1 4Å; T47-V139 HydrophobicContact CG2-CG2 4.22Å; I128-V139 HydrophobicContact CG2-CB 4.46Å; I128-V139 HydrophobicContact CG2-CG1 4.11Å; I128-V139 HydrophobicContact CG2-CG2 3.47Å; I128-V139 VanDerWaalsContact CG2-CG2 3.47Å; N132-V139 HydrophobicContact CB-CG2 3.88Å; I137-V139 HydrophobicContact CD1-CG2 4.11Å; I137-V139 HydrophobicContact CG1-CG2 4.3Å
140	K	95.6	Very high	94.1	Very high	128 Å²	128	58.5 Å²	58.5	56%	0.557	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.1	174.5	-64.7	-174.7	179.6	-179	0	109.6	L45 V46	L45-K140 WeakPolarHBondContact CA-O 3.5Å; V46-K140 PolarHBondContact N-O 3.38Å; V46-K140 PolarHBondContact O-N 3.46Å; V46-K140 VanDerWaalsContact O-O 3.1Å
141	I	96.1	Very high	94.2	Very high	10 Å²	10	56.1 Å²	56.1	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	170.4	-61.3	176.3	0	0	0	106.3	A43 T44 L45 V117 V188 I191 R192	A43-I141 HydrophobicContact CB-CG2 3.67Å; T44-I141 CarbonylContact O-C 3.6Å; T44-I141 WeakPolarHBondContact O-CA 3.49Å; L45-I141 HydrophobicContact CB-CG1 4.36Å; L45-I141 HydrophobicContact CD1-CD1 4.5Å; L45-I141 HydrophobicContact CD1-CG1 4.29Å; L45-I141 HydrophobicContact CG-CG1 4.3Å; V117-I141 HydrophobicContact CG2-CG2 4.36Å; I141-V188 HydrophobicContact CB-CG1 4.01Å; I141-V188 HydrophobicContact CB-CG2 4.27Å; I141-V188 HydrophobicContact CG2-CG2 4.47Å; I141-I191 HydrophobicContact CD1-CG2 4.07Å; I141-R192 HydrophobicContact CD1-CB 4.11Å
142	H	95.7	Very high	94.2	Very high	101 Å²	101	56.7 Å²	56.7	47%	0.468	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.7	177.6	-65.7	-63.7	0	0	0	108.9	A43 T44	A43-H142 WeakPolarHBondContact CA-O 3.41Å; T44-H142 PolarHBondContact N-O 3.5Å; T44-H142 PolarHBondContact O-N 2.91Å
143	L	94.9	Very high	94.3	Very high	23 Å²	23	56.9 Å²	56.9	12%	0.12	29%	0.29	C	S	.	.			trans	-72	149	170.6	-57	-173.3	0	0	0	109.7	A43 W179 D184 L187 V188 I191	A43-L143 HydrophobicContact CB-CD2 3.81Å; L143-W179 HydrophobicContact CD1-CZ2 4.3Å; L143-D184 HydrophobicContact CD1-CB 4.45Å; L143-D184 WeakPolarHBondContact CD1-OD1 3.25Å; L143-D184 WeakPolarHBondContact CG-OD1 3.44Å; L143-L187 HydrophobicContact CD1-CB 3.91Å; L143-L187 HydrophobicContact CD1-CD1 3.77Å; L143-V188 HydrophobicContact CD2-CG2 4.39Å; L143-V188 HydrophobicContact CG-CG2 4.29Å; L143-I191 HydrophobicContact CD2-CD1 3.69Å
144	S	93.3	Very high	94.4	Very high	20 Å²	20	52.1 Å²	52.1	14%	0.14	27%	0.267	C	S	.	.			trans	-66	136.6	175.1	134.9	0	0	0	0	109.6	Q146 V147	S144-Q146 PolarHBondContact O-N 2.92Å; S144-Q146 VanDerWaalsContact O-N 3.09Å; S144-Q146 WeakPolarHBondContact OG-CB 3.44Å; S144-Q146 PolarHBondContact OG-N 3.13Å; S144-Q146 PolarHBondContact OG-OE1 3.3Å; S144-V147 WeakPolarHBondContact O-CB 3.49Å; S144-V147 WeakPolarHBondContact O-CG2 3.32Å; S144-V147 PolarHBondContact O-N 3.39Å
145	P	93.3	Very high	94.6	Very high	99 Å²	99	45.5 Å²	45.5	64%	0.643	24%	0.242	S	C	*	.	H	α-helix	trans	-56.6	-26.9	177.6	-27.1	35.3	0	0	0	113.6	V147 Q148 H149	P145-V147 PolarHBondContact O-N 3.15Å; P145-Q148 PolarHBondContact O-N 3.17Å; P145-H149 PolarHBondContact O-N 3.44Å
146	Q	94.1	Very high	94.7	Very high	96 Å²	96	45.9 Å²	45.9	45%	0.449	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-30.1	174.7	-65.2	81.8	-2.6	0	0	112.5	Y41 S144 N150	Y41-Q146 HydrophobicContact CD1-CB 4Å; Y41-Q146 HydrophobicContact CD1-CG 4.45Å; Y41-Q146 HydrophobicContact CD2-CB 4.35Å; Y41-Q146 HydrophobicContact CE1-CB 3.96Å; Y41-Q146 HydrophobicContact CE1-CG 4.23Å; Y41-Q146 HydrophobicContact CE2-CB 4.32Å; Y41-Q146 HydrophobicContact CG-CB 4.2Å; S144-Q146 PolarHBondContact O-N 2.92Å; S144-Q146 VanDerWaalsContact O-N 3.09Å; S144-Q146 WeakPolarHBondContact OG-CB 3.44Å; S144-Q146 PolarHBondContact OG-N 3.13Å; S144-Q146 PolarHBondContact OG-OE1 3.3Å; Q146-N150 VanDerWaalsContact O-CB 3.26Å; Q146-N150 WeakPolarHBondContact O-CB 3.21Å; Q146-N150 PolarHBondContact O-N 2.95Å; Q146-N150 PolarHBondContact O-ND2 3.3Å; Q146-N150 VanDerWaalsContact O-ND2 3.13Å
147	V	94.7	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-49.7	176.5	-173.5	0	0	0	0	109.9	L37 Y41 S144 P145 C151 W179	L37-V147 HydrophobicContact CB-CB 4.48Å; L37-V147 HydrophobicContact CB-CG1 3.82Å; Y41-V147 HydrophobicContact CD2-CG2 4.36Å; Y41-V147 HydrophobicContact CG-CG2 4.46Å; S144-V147 WeakPolarHBondContact O-CB 3.49Å; S144-V147 WeakPolarHBondContact O-CG2 3.32Å; S144-V147 PolarHBondContact O-N 3.39Å; P145-V147 PolarHBondContact O-N 3.15Å; V147-C151 VanDerWaalsContact O-CB 3.22Å; V147-C151 WeakPolarHBondContact O-CB 3.45Å; V147-C151 PolarHBondContact O-N 3.2Å; V147-W179 HydrophobicContact CB-CH2 4.44Å; V147-W179 HydrophobicContact CB-CZ2 4.42Å; V147-W179 HydrophobicContact CG1-CH2 3.73Å; V147-W179 HydrophobicContact CG1-CZ2 4.1Å
148	Q	95.3	Very high	94.8	Very high	66 Å²	66	55 Å²	55	31%	0.308	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-47.1	177.3	-176.5	177.7	2.4	0	0	111.1	P145 N150 C151 A152 N176 W179	P145-Q148 PolarHBondContact O-N 3.17Å; Q148-N150 PolarHBondContact O-N 3.35Å; Q148-C151 PolarHBondContact O-N 2.91Å; Q148-A152 WeakPolarHBondContact O-CB 3.47Å; Q148-A152 PolarHBondContact O-N 3.34Å; Q148-N176 PolarHBondContact NE2-OD1 2.76Å; Q148-W179 HydrophobicContact CB-CD2 4.06Å; Q148-W179 VanDerWaalsContact CB-CE2 3.48Å; Q148-W179 HydrophobicContact CB-CG 4.48Å; Q148-W179 HydrophobicContact CB-CH2 4.43Å; Q148-W179 HydrophobicContact CB-CZ2 3.7Å; Q148-W179 HydrophobicContact CG-CD2 3.74Å; Q148-W179 HydrophobicContact CG-CE3 4.45Å; Q148-W179 HydrophobicContact CG-CG 3.77Å; Q148-W179 HydrophobicContact CG-CZ2 4.33Å
149	H	95.2	Very high	94.7	Very high	124 Å²	124	55 Å²	55	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-46.4	-178.4	-179	70.5	0	0	0	112.1	P145 C151 A152 T153	P145-H149 PolarHBondContact O-N 3.44Å; H149-C151 VanDerWaalsContact C-N 3.33Å; H149-C151 PolarHBondContact O-N 3.16Å; H149-A152 WeakPolarHBondContact O-CB 3.4Å; H149-A152 PolarHBondContact O-N 3.11Å; H149-T153 PolarHBondContact O-N 3.46Å; H149-T153 PolarHBondContact O-OG1 3.27Å; H149-T153 VanDerWaalsContact O-OG1 3.11Å
150	N	95.9	Very high	94.6	Very high	49 Å²	49	58.4 Å²	58.4	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-69.7	-33.2	179.5	-69.3	-25.9	0	0	0	112.1	L37 Y41 Q146 Q148 T153 F154	L37-N150 HydrophobicContact CD1-CB 3.62Å; L37-N150 HydrophobicContact CD2-CB 3.88Å; L37-N150 HydrophobicContact CG-CB 4.43Å; Y41-N150 VanDerWaalsContact CE2-ND2 3.34Å; Y41-N150 WeakPolarHBondContact CE2-ND2 3.09Å; Y41-N150 PolarHBondContact OH-ND2 3.42Å; Q146-N150 VanDerWaalsContact O-CB 3.26Å; Q146-N150 WeakPolarHBondContact O-CB 3.21Å; Q146-N150 PolarHBondContact O-N 2.95Å; Q146-N150 PolarHBondContact O-ND2 3.3Å; Q146-N150 VanDerWaalsContact O-ND2 3.13Å; Q148-N150 PolarHBondContact O-N 3.35Å; N150-T153 PolarHBondContact O-N 3.43Å; N150-F154 PolarHBondContact O-N 3.04Å
151	C	95.1	Very high	94.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.3	-39.8	174	-161	0	0	0	0	111.3	L37 V147 Q148 H149 T153 F154 V155 F175 W179	L37-C151 HydrophobicContact CD1-CB 4.32Å; V147-C151 VanDerWaalsContact O-CB 3.22Å; V147-C151 WeakPolarHBondContact O-CB 3.45Å; V147-C151 PolarHBondContact O-N 3.2Å; Q148-C151 PolarHBondContact O-N 2.91Å; H149-C151 VanDerWaalsContact C-N 3.33Å; H149-C151 PolarHBondContact O-N 3.16Å; C151-T153 VanDerWaalsContact C-N 3.32Å; C151-T153 PolarHBondContact O-N 3.18Å; C151-F154 WeakPolarHBondContact O-CB 3.12Å; C151-F154 PolarHBondContact O-N 2.86Å; C151-F154 VanDerWaalsContact O-N 3.15Å; C151-V155 WeakPolarHBondContact O-CG2 3.41Å; C151-V155 PolarHBondContact O-N 3.23Å; C151-F175 HydrophobicContact CB-CZ 4.27Å; C151-W179 HydrophobicContact CB-CE3 4.41Å; C151-W179 HydrophobicContact CB-CH2 4.16Å; C151-W179 HydrophobicContact CB-CZ3 3.64Å
152	A	95.4	Very high	94.1	Very high	13 Å²	13	62.3 Å²	62.3	11%	0.107	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-42.6	171	0	0	0	0	0	112.1	Q148 H149 F154 V155 S156 M172 F175	Q148-A152 WeakPolarHBondContact O-CB 3.47Å; Q148-A152 PolarHBondContact O-N 3.34Å; H149-A152 WeakPolarHBondContact O-CB 3.4Å; H149-A152 PolarHBondContact O-N 3.11Å; A152-F154 VanDerWaalsContact C-N 3.35Å; A152-V155 PolarHBondContact O-N 3.44Å; A152-S156 WeakPolarHBondContact O-CB 3.16Å; A152-S156 PolarHBondContact O-N 2.67Å; A152-S156 PolarHBondContact O-OG 2.74Å; A152-M172 HydrophobicContact CB-CE 3.38Å; A152-F175 HydrophobicContact CB-CD1 4.38Å; A152-F175 HydrophobicContact CB-CE1 3.73Å; A152-F175 HydrophobicContact CB-CZ 4.32Å
153	T	95.3	Very high	93.8	Very high	55 Å²	55	59.1 Å²	59.1	34%	0.337	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-41.7	174.4	-59.5	0	0	0	0	111.6	H149 N150 C151 S156 Q157	H149-T153 PolarHBondContact O-N 3.46Å; H149-T153 PolarHBondContact O-OG1 3.27Å; H149-T153 VanDerWaalsContact O-OG1 3.11Å; N150-T153 PolarHBondContact O-N 3.43Å; C151-T153 VanDerWaalsContact C-N 3.32Å; C151-T153 PolarHBondContact O-N 3.18Å; T153-S156 WeakPolarHBondContact O-CB 3.41Å; T153-S156 PolarHBondContact O-N 3.13Å; T153-Q157 WeakPolarHBondContact O-CG 3.2Å; T153-Q157 PolarHBondContact O-N 3.27Å
154	F	95.3	Very high	93.5	Very high	52 Å²	52	62.5 Å²	62.5	23%	0.228	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-44.6	175.4	176.9	-101.3	0	0	0	112.1	D29 I30 K33 N150 C151 A152 S156 Q157 K158	D29-F154 HydrophobicContact CB-CE1 4.11Å; D29-F154 HydrophobicContact CB-CZ 4.02Å; I30-F154 HydrophobicContact CG1-CD1 4.4Å; I30-F154 HydrophobicContact CG1-CE1 4.22Å; K33-F154 HydrophobicContact CB-CD1 4.21Å; K33-F154 HydrophobicContact CB-CE1 4.31Å; K33-F154 HydrophobicContact CB-CG 4.42Å; K33-F154 HydrophobicContact CG-CB 4.27Å; K33-F154 HydrophobicContact CG-CD1 4.26Å; K33-F154 HydrophobicContact CG-CD2 4.19Å; K33-F154 HydrophobicContact CG-CG 3.98Å; N150-F154 PolarHBondContact O-N 3.04Å; C151-F154 WeakPolarHBondContact O-CB 3.12Å; C151-F154 PolarHBondContact O-N 2.86Å; C151-F154 VanDerWaalsContact O-N 3.15Å; A152-F154 VanDerWaalsContact C-N 3.35Å; F154-S156 VanDerWaalsContact C-N 3.3Å; F154-S156 PolarHBondContact O-N 3.19Å; F154-Q157 PolarHBondContact O-N 3.35Å; F154-K158 HydrophobicContact CE1-CD 4.3Å; F154-K158 HydrophobicContact CZ-CD 4.45Å; F154-K158 WeakPolarHBondContact O-CB 3.42Å; F154-K158 PolarHBondContact O-N 3.47Å
155	V	95	Very high	93.4	Very high	1 Å²	1	71.2 Å²	71.2	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-61.7	-40.8	174.7	170.9	0	0	0	0	111.3	F24 I30 C151 A152 K158 Y159 F175	F24-V155 HydrophobicContact CD1-CG1 4.42Å; F24-V155 HydrophobicContact CE1-CG1 3.78Å; F24-V155 HydrophobicContact CZ-CG1 3.97Å; I30-V155 HydrophobicContact CD1-CG2 3.55Å; I30-V155 HydrophobicContact CG1-CG2 3.89Å; I30-V155 HydrophobicContact CG2-CG2 4.32Å; C151-V155 WeakPolarHBondContact O-CG2 3.41Å; C151-V155 PolarHBondContact O-N 3.23Å; A152-V155 PolarHBondContact O-N 3.44Å; V155-K158 PolarHBondContact O-N 2.97Å; V155-Y159 HydrophobicContact CG1-CD2 3.98Å; V155-Y159 PolarHBondContact O-N 3.39Å; V155-F175 HydrophobicContact CB-CD2 4.22Å; V155-F175 HydrophobicContact CB-CE2 4.28Å; V155-F175 HydrophobicContact CG1-CD2 4.09Å; V155-F175 HydrophobicContact CG1-CG 4.47Å; V155-F175 HydrophobicContact CG2-CD2 3.74Å; V155-F175 HydrophobicContact CG2-CE2 3.51Å; V155-F175 HydrophobicContact CG2-CZ 4.31Å
156	S	94	Very high	93.4	Very high	37 Å²	37	73.1 Å²	73.1	26%	0.259	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-49.1	174.2	-56.2	0	0	0	0	111.1	A152 T153 F154 K158 F160	A152-S156 WeakPolarHBondContact O-CB 3.16Å; A152-S156 PolarHBondContact O-N 2.67Å; A152-S156 PolarHBondContact O-OG 2.74Å; T153-S156 WeakPolarHBondContact O-CB 3.41Å; T153-S156 PolarHBondContact O-N 3.13Å; F154-S156 VanDerWaalsContact C-N 3.3Å; F154-S156 PolarHBondContact O-N 3.19Å; S156-K158 VanDerWaalsContact C-N 3.31Å; S156-K158 PolarHBondContact O-N 3.15Å; S156-F160 WeakPolarHBondContact O-CB 3.18Å; S156-F160 PolarHBondContact O-N 3.11Å
157	Q	93.2	Very high	93.3	Very high	139 Å²	139	73.6 Å²	73.6	65%	0.65	37%	0.367	S	S	*	.	H	α-helix	trans	-61.8	-38.2	177.9	-71.3	170.2	-8.7	0	0	112.7	T153 F154	T153-Q157 WeakPolarHBondContact O-CG 3.2Å; T153-Q157 PolarHBondContact O-N 3.27Å; F154-Q157 PolarHBondContact O-N 3.35Å
158	K	93.7	Very high	93.2	Very high	70 Å²	70	75.4 Å²	75.4	30%	0.304	37%	0.374	S	S	.	.	H	α-helix	trans	-75.7	-42.7	-176.8	-174.6	170.9	176.5	179.2	0	113.2	D27 D29 F154 V155 S156	D27-K158 VanDerWaalsContact CG-NZ 3.28Å; D27-K158 IonicContact OD1-NZ 2.71Å; D27-K158 PolarHBondContact OD1-NZ 3.04Å; D27-K158 WeakPolarHBondContact OD2-CE 3.3Å; D27-K158 IonicContact OD2-NZ 2.88Å; D27-K158 PolarHBondContact OD2-NZ 3.28Å; D29-K158 IonicContact OD2-NZ 3.62Å; D29-K158 PolarHBondContact OD2-NZ 3.44Å; F154-K158 HydrophobicContact CE1-CD 4.3Å; F154-K158 HydrophobicContact CZ-CD 4.45Å; F154-K158 WeakPolarHBondContact O-CB 3.42Å; F154-K158 PolarHBondContact O-N 3.47Å; V155-K158 PolarHBondContact O-N 2.97Å; S156-K158 VanDerWaalsContact C-N 3.31Å; S156-K158 PolarHBondContact O-N 3.15Å
159	Y	93.1	Very high	93.1	Very high	53 Å²	53	78.8 Å²	78.8	21%	0.208	39%	0.394	C	S	.	.	H	α-helix	trans	-109.5	-20	-168.5	-69.5	-82.2	0	0	0	114.9	F24 D27 I30 V155 P161 T162 T163	F24-Y159 HydrophobicContact CD1-CE2 4.17Å; F24-Y159 AromaticContact CE1-CD2 3.79Å; F24-Y159 HydrophobicContact CE1-CD2 3.79Å; F24-Y159 AromaticContact CE1-CE2 3.75Å; F24-Y159 HydrophobicContact CE1-CE2 3.75Å; F24-Y159 HydrophobicContact CE1-CG 4.21Å; D27-Y159 PolarHBondContact OD2-OH 3.19Å; I30-Y159 HydrophobicContact CD1-CE2 4.14Å; V155-Y159 HydrophobicContact CG1-CD2 3.98Å; V155-Y159 PolarHBondContact O-N 3.39Å; Y159-P161 VanDerWaalsContact C-CD 3.45Å; Y159-T162 PolarHBondContact O-N 2.63Å; Y159-T162 PolarHBondContact O-OG1 3.16Å; Y159-T162 VanDerWaalsContact O-OG1 3.14Å; Y159-T163 WeakPolarHBondContact O-CB 3.49Å; Y159-T163 PolarHBondContact O-N 2.93Å; Y159-T163 VanDerWaalsContact O-N 3.13Å; Y159-T163 PolarHBondContact O-OG1 3.28Å
160	F	91.8	Very high	93.1	Very high	91 Å²	91	76 Å²	76	40%	0.399	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-58.6	-39.5	178.4	-172.3	-100	0	0	0	113.5	S156 T162 T163 W168	S156-F160 WeakPolarHBondContact O-CB 3.18Å; S156-F160 PolarHBondContact O-N 3.11Å; F160-T162 PolarHBondContact O-N 2.99Å; F160-T163 PolarHBondContact O-N 2.93Å; F160-W168 HydrophobicContact CB-CH2 4.1Å; F160-W168 HydrophobicContact CB-CZ2 4.38Å; F160-W168 HydrophobicContact CB-CZ3 4.2Å; F160-W168 AromaticContact CD2-CD2 3.62Å; F160-W168 HydrophobicContact CD2-CD2 3.62Å; F160-W168 AromaticContact CD2-CE2 3.67Å; F160-W168 AromaticContact CD2-CE3 3.93Å; F160-W168 HydrophobicContact CD2-CE3 3.93Å; F160-W168 HydrophobicContact CD2-CG 4.05Å; F160-W168 HydrophobicContact CD2-CH2 4.38Å; F160-W168 HydrophobicContact CD2-CZ2 4.07Å; F160-W168 HydrophobicContact CD2-CZ3 4.3Å; F160-W168 HydrophobicContact CE2-CD2 4.17Å; F160-W168 HydrophobicContact CE2-CG 4.1Å
161	P	91.3	Very high	93	Very high	104 Å²	104	74.5 Å²	74.5	68%	0.675	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-63.8	-25	179.1	-23.5	35.3	0	0	0	114.3	Y159	Y159-P161 VanDerWaalsContact C-CD 3.45Å
162	T	90.4	Very high	93	Very high	115 Å²	115	76.2 Å²	76.2	71%	0.706	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-105.6	-5.8	-174.8	54.7	0	0	0	0	113.6	Y159 F160	Y159-T162 PolarHBondContact O-N 2.63Å; Y159-T162 PolarHBondContact O-OG1 3.16Å; Y159-T162 VanDerWaalsContact O-OG1 3.14Å; F160-T162 PolarHBondContact O-N 2.99Å
163	T	89.1	Confident	92.9	Very high	35 Å²	35	78.8 Å²	78.8	22%	0.215	40%	0.399	C	S	.	.	S	Bend	trans	-103.4	136.6	-176	-55.7	0	0	0	0	111.1	Y159 F160 R165 W168 V171	Y159-T163 WeakPolarHBondContact O-CB 3.49Å; Y159-T163 PolarHBondContact O-N 2.93Å; Y159-T163 VanDerWaalsContact O-N 3.13Å; Y159-T163 PolarHBondContact O-OG1 3.28Å; F160-T163 PolarHBondContact O-N 2.93Å; T163-R165 PolarHBondContact O-N 2.74Å; T163-W168 HydrophobicContact CG2-CE3 4Å; T163-V171 HydrophobicContact CG2-CG2 3.89Å
164	N	89.7	Confident	92.9	Very high	93 Å²	93	76.1 Å²	76.1	50%	0.497	38%	0.382	S	S	.	.			trans	-63.7	129.9	173.8	-173.3	-31.9	0	0	0	110.4	I166 H167 W168	N164-I166 PolarHBondContact O-N 2.93Å; N164-I166 VanDerWaalsContact O-N 3.13Å; N164-I166 PolarHBondContact OD1-N 2.76Å; N164-H167 PolarHBondContact O-N 3.31Å; N164-W168 PolarHBondContact O-N 3.01Å
165	R	90.8	Very high	93	Very high	203 Å²	203	73.7 Å²	73.7	77%	0.766	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-52.7	-35.5	-178.3	-65.9	-175.4	177.9	-173.3	-0.2	113.5	T163 H167 W168	T163-R165 PolarHBondContact O-N 2.74Å; R165-H167 PolarHBondContact O-N 2.89Å; R165-W168 WeakPolarHBondContact O-CB 3.31Å; R165-W168 PolarHBondContact O-N 3.16Å
166	I	92.3	Very high	93	Very high	140 Å²	140	77 Å²	77	72%	0.718	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-64.6	-26.5	-179.4	-60	172.1	0	0	0	111.7	N164	N164-I166 PolarHBondContact O-N 2.93Å; N164-I166 VanDerWaalsContact O-N 3.13Å; N164-I166 PolarHBondContact OD1-N 2.76Å
167	H	92	Very high	93.1	Very high	106 Å²	106	77.2 Å²	77.2	49%	0.491	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-101.1	-0.1	-178	-56.9	-45.9	0	0	0	113.2	N164 R165 D169 F170 V171	N164-H167 PolarHBondContact O-N 3.31Å; R165-H167 PolarHBondContact O-N 2.89Å; H167-D169 PolarHBondContact O-N 2.68Å; H167-F170 WeakPolarHBondContact O-CB 3.42Å; H167-F170 PolarHBondContact O-N 3.29Å; H167-F170 VanDerWaalsContact O-N 3.14Å; H167-V171 WeakPolarHBondContact O-CG2 3.4Å; H167-V171 PolarHBondContact O-N 3.38Å
168	W	93.9	Very high	93.2	Very high	38 Å²	38	70.6 Å²	70.6	14%	0.144	36%	0.357	C	S	.	.	H	α-helix	trans	-61.2	-42.5	-173.3	-176.3	-112.2	0	0	0	112.8	F160 T163 N164 R165 F170 V171 M172	F160-W168 HydrophobicContact CB-CH2 4.1Å; F160-W168 HydrophobicContact CB-CZ2 4.38Å; F160-W168 HydrophobicContact CB-CZ3 4.2Å; F160-W168 AromaticContact CD2-CD2 3.62Å; F160-W168 HydrophobicContact CD2-CD2 3.62Å; F160-W168 AromaticContact CD2-CE2 3.67Å; F160-W168 AromaticContact CD2-CE3 3.93Å; F160-W168 HydrophobicContact CD2-CE3 3.93Å; F160-W168 HydrophobicContact CD2-CG 4.05Å; F160-W168 HydrophobicContact CD2-CH2 4.38Å; F160-W168 HydrophobicContact CD2-CZ2 4.07Å; F160-W168 HydrophobicContact CD2-CZ3 4.3Å; F160-W168 HydrophobicContact CE2-CD2 4.17Å; F160-W168 HydrophobicContact CE2-CG 4.1Å; T163-W168 HydrophobicContact CG2-CE3 4Å; N164-W168 PolarHBondContact O-N 3.01Å; R165-W168 WeakPolarHBondContact O-CB 3.31Å; R165-W168 PolarHBondContact O-N 3.16Å; W168-F170 VanDerWaalsContact C-N 3.27Å; W168-F170 PolarHBondContact O-N 3.03Å; W168-V171 HydrophobicContact CE3-CB 4.45Å; W168-V171 HydrophobicContact CE3-CG1 4.44Å; W168-V171 HydrophobicContact CZ3-CG1 4.15Å; W168-V171 PolarHBondContact O-N 2.81Å; W168-M172 WeakPolarHBondContact O-CB 3.22Å; W168-M172 PolarHBondContact O-N 2.8Å
169	D	93.2	Very high	93.4	Very high	137 Å²	137	67.8 Å²	67.8	73%	0.733	34%	0.344	S	S	*	.	H	α-helix	trans	-62.5	-37.3	177.9	-66.7	-19.8	0	0	0	111.7	H167 S173	H167-D169 PolarHBondContact O-N 2.68Å; D169-S173 VanDerWaalsContact O-CB 3.28Å; D169-S173 WeakPolarHBondContact O-CB 2.93Å; D169-S173 PolarHBondContact O-N 3.25Å
170	F	93.9	Very high	93.5	Very high	65 Å²	65	73.3 Å²	73.3	29%	0.285	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-43.3	175.4	-179.9	-97.9	0	0	0	111.7	E13 V16 I20 H167 W168 S173 A174	E13-F170 HydrophobicContact CB-CE2 4.2Å; E13-F170 WeakPolarHBondContact O-CZ 3.41Å; V16-F170 HydrophobicContact CB-CE1 4.42Å; V16-F170 HydrophobicContact CB-CZ 4.14Å; V16-F170 HydrophobicContact CG1-CE1 3.85Å; V16-F170 HydrophobicContact CG1-CZ 4.09Å; I20-F170 HydrophobicContact CD1-CD1 4.25Å; I20-F170 HydrophobicContact CD1-CE1 3.77Å; H167-F170 WeakPolarHBondContact O-CB 3.42Å; H167-F170 PolarHBondContact O-N 3.29Å; H167-F170 VanDerWaalsContact O-N 3.14Å; W168-F170 VanDerWaalsContact C-N 3.27Å; W168-F170 PolarHBondContact O-N 3.03Å; F170-S173 WeakPolarHBondContact O-CB 2.9Å; F170-S173 PolarHBondContact O-N 3.41Å; F170-A174 PolarHBondContact O-N 2.65Å
171	V	94.2	Very high	93.7	Very high	17 Å²	17	73.4 Å²	73.4	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-63.7	-42.2	176.2	172.2	0	0	0	0	111.4	F24 T163 H167 W168 S173 A174 F175	F24-V171 HydrophobicContact CE2-CG1 4.08Å; F24-V171 HydrophobicContact CZ-CG1 3.71Å; T163-V171 HydrophobicContact CG2-CG2 3.89Å; H167-V171 WeakPolarHBondContact O-CG2 3.4Å; H167-V171 PolarHBondContact O-N 3.38Å; W168-V171 HydrophobicContact CE3-CB 4.45Å; W168-V171 HydrophobicContact CE3-CG1 4.44Å; W168-V171 HydrophobicContact CZ3-CG1 4.15Å; W168-V171 PolarHBondContact O-N 2.81Å; V171-S173 VanDerWaalsContact C-N 3.35Å; V171-A174 WeakPolarHBondContact O-CB 3.31Å; V171-A174 PolarHBondContact O-N 3.38Å; V171-F175 PolarHBondContact O-N 3.25Å
172	M	94.7	Very high	93.9	Very high	36 Å²	36	71 Å²	71	18%	0.177	35%	0.348	C	S	.	.	H	α-helix	trans	-70.8	-32.5	178.1	-164.7	60	-150.6	0	0	112	A152 W168 F175 N176	A152-M172 HydrophobicContact CB-CE 3.38Å; W168-M172 WeakPolarHBondContact O-CB 3.22Å; W168-M172 PolarHBondContact O-N 2.8Å; M172-F175 HydrophobicContact CE-CB 4.36Å; M172-F175 HydrophobicContact CE-CD1 3.27Å; M172-F175 HydrophobicContact CE-CE1 3.83Å; M172-F175 HydrophobicContact CE-CG 4.08Å; M172-F175 PolarHBondContact O-N 3.43Å; M172-F175 HydrophobicContact SD-CB 4.24Å; M172-F175 HydrophobicContact SD-CD1 4.16Å; M172-F175 HydrophobicContact SD-CG 4.42Å; M172-N176 PolarHBondContact O-N 2.66Å; M172-N176 PolarHBondContact O-ND2 3.39Å; M172-N176 VanDerWaalsContact O-ND2 3.14Å
173	S	94.5	Very high	94.2	Very high	67 Å²	67	65.5 Å²	65.5	47%	0.469	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-44	168.1	-172.7	0	0	0	0	111.5	D169 F170 V171 F175 N176 D177	D169-S173 VanDerWaalsContact O-CB 3.28Å; D169-S173 WeakPolarHBondContact O-CB 2.93Å; D169-S173 PolarHBondContact O-N 3.25Å; F170-S173 WeakPolarHBondContact O-CB 2.9Å; F170-S173 PolarHBondContact O-N 3.41Å; V171-S173 VanDerWaalsContact C-N 3.35Å; S173-F175 PolarHBondContact O-N 3.36Å; S173-N176 WeakPolarHBondContact O-CB 3.24Å; S173-N176 PolarHBondContact O-N 3.5Å; S173-N176 VanDerWaalsContact O-N 3.13Å; S173-D177 PolarHBondContact O-N 3.46Å
174	A	95.5	Very high	94.5	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-36.9	174.4	0	0	0	0	0	112.6	I20 A21 F170 V171 N176 D177 A178	I20-A174 HydrophobicContact CB-CB 3.82Å; I20-A174 HydrophobicContact CG2-CB 3.61Å; A21-A174 WeakPolarHBondContact CB-O 3.49Å; F170-A174 PolarHBondContact O-N 2.65Å; V171-A174 WeakPolarHBondContact O-CB 3.31Å; V171-A174 PolarHBondContact O-N 3.38Å; A174-N176 VanDerWaalsContact C-N 3.35Å; A174-D177 PolarHBondContact O-N 3.27Å; A174-A178 WeakPolarHBondContact O-CB 3.35Å; A174-A178 PolarHBondContact O-N 2.99Å
175	F	96.3	Very high	94.8	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-41.9	170.6	172.2	-93.5	0	0	0	111.8	F24 I30 C151 A152 V155 V171 M172 S173 D177 A178 W179 I183	F24-F175 HydrophobicContact CD2-CB 3.97Å; F24-F175 HydrophobicContact CD2-CD2 4.36Å; F24-F175 HydrophobicContact CE2-CB 3.83Å; F24-F175 HydrophobicContact CG-CD2 4.41Å; I30-F175 HydrophobicContact CG2-CE2 4.5Å; C151-F175 HydrophobicContact CB-CZ 4.27Å; A152-F175 HydrophobicContact CB-CD1 4.38Å; A152-F175 HydrophobicContact CB-CE1 3.73Å; A152-F175 HydrophobicContact CB-CZ 4.32Å; V155-F175 HydrophobicContact CB-CD2 4.22Å; V155-F175 HydrophobicContact CB-CE2 4.28Å; V155-F175 HydrophobicContact CG1-CD2 4.09Å; V155-F175 HydrophobicContact CG1-CG 4.47Å; V155-F175 HydrophobicContact CG2-CD2 3.74Å; V155-F175 HydrophobicContact CG2-CE2 3.51Å; V155-F175 HydrophobicContact CG2-CZ 4.31Å; V171-F175 PolarHBondContact O-N 3.25Å; M172-F175 HydrophobicContact CE-CB 4.36Å; M172-F175 HydrophobicContact CE-CD1 3.27Å; M172-F175 HydrophobicContact CE-CE1 3.83Å; M172-F175 HydrophobicContact CE-CG 4.08Å; M172-F175 PolarHBondContact O-N 3.43Å; M172-F175 HydrophobicContact SD-CB 4.24Å; M172-F175 HydrophobicContact SD-CD1 4.16Å; M172-F175 HydrophobicContact SD-CG 4.42Å; S173-F175 PolarHBondContact O-N 3.36Å; F175-D177 VanDerWaalsContact C-N 3.33Å; F175-D177 PolarHBondContact O-N 2.91Å; F175-A178 WeakPolarHBondContact O-CB 3.13Å; F175-A178 PolarHBondContact O-N 3.44Å; F175-W179 HydrophobicContact CE1-CB 4.48Å; F175-W179 HydrophobicContact CE1-CE3 4.47Å; F175-W179 HydrophobicContact CE2-CE3 4.41Å; F175-W179 AromaticContact CZ-CE3 3.8Å; F175-W179 HydrophobicContact CZ-CE3 3.8Å; F175-W179 HydrophobicContact CZ-CZ3 4.47Å; F175-W179 WeakPolarHBondContact O-CB 3.3Å; F175-W179 PolarHBondContact O-N 3.05Å; F175-I183 HydrophobicContact CE2-CD1 4.39Å
176	N	95.9	Very high	95	Very high	70 Å²	70	58.7 Å²	58.7	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-65.2	-36.4	177	-72.4	-41.5	0	0	0	112.1	Q148 M172 S173 A174 K180	Q148-N176 PolarHBondContact NE2-OD1 2.76Å; M172-N176 PolarHBondContact O-N 2.66Å; M172-N176 PolarHBondContact O-ND2 3.39Å; M172-N176 VanDerWaalsContact O-ND2 3.14Å; S173-N176 WeakPolarHBondContact O-CB 3.24Å; S173-N176 PolarHBondContact O-N 3.5Å; S173-N176 VanDerWaalsContact O-N 3.13Å; A174-N176 VanDerWaalsContact C-N 3.35Å; N176-K180 WeakPolarHBondContact O-CB 3.37Å; N176-K180 PolarHBondContact O-N 2.8Å; N176-K180 VanDerWaalsContact O-N 3.1Å
177	D	95	Very high	95.2	Very high	42 Å²	42	52.1 Å²	52.1	23%	0.225	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-48.7	168.9	-177.4	59.7	0	0	0	111.1	H18 A21 S173 A174 F175 W179 K180 R181	H18-D177 IonicContact CE1-OD2 3.92Å; H18-D177 IonicContact ND1-OD2 3.58Å; H18-D177 PolarHBondContact ND1-OD2 3.32Å; A21-D177 HydrophobicContact CB-CB 4.38Å; S173-D177 PolarHBondContact O-N 3.46Å; A174-D177 PolarHBondContact O-N 3.27Å; F175-D177 VanDerWaalsContact C-N 3.33Å; F175-D177 PolarHBondContact O-N 2.91Å; D177-W179 VanDerWaalsContact C-N 3.29Å; D177-W179 PolarHBondContact O-N 3.32Å; D177-K180 PolarHBondContact O-N 2.86Å; D177-R181 VanDerWaalsContact O-CB 3.27Å; D177-R181 WeakPolarHBondContact O-CB 3.36Å; D177-R181 PolarHBondContact O-N 2.93Å; D177-R181 IonicContact OD1-NE 3.18Å; D177-R181 IonicContact OD2-CZ 2.88Å; D177-R181 IonicContact OD2-NE 2.65Å; D177-R181 PolarHBondContact OD2-NE 3.03Å; D177-R181 VanDerWaalsContact OD2-NE 3.13Å; D177-R181 IonicContact OD2-NH2 3.54Å; D177-R181 PolarHBondContact OD2-NH2 2.61Å
178	A	96.5	Very high	95.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.5	-45.8	177.3	0	0	0	0	0	111.7	A21 F24 A174 F175 L182 I183	A21-A178 HydrophobicContact CB-CB 3.71Å; A21-A178 WeakPolarHBondContact O-CB 3.46Å; F24-A178 HydrophobicContact CB-CB 4Å; A174-A178 WeakPolarHBondContact O-CB 3.35Å; A174-A178 PolarHBondContact O-N 2.99Å; F175-A178 WeakPolarHBondContact O-CB 3.13Å; F175-A178 PolarHBondContact O-N 3.44Å; A178-L182 WeakPolarHBondContact O-CA 3.13Å; A178-L182 WeakPolarHBondContact O-CB 3.31Å; A178-L182 PolarHBondContact O-N 2.75Å; A178-I183 HydrophobicContact CB-CD1 4.21Å; A178-I183 PolarHBondContact O-N 3.14Å
179	W	96.9	Very high	95.4	Very high	11 Å²	11	55.4 Å²	55.4	4%	0.042	27%	0.27	C	S	.	.	I	π-helix	trans	-58.8	-55.3	179.1	-172.2	-91.2	0	0	0	110.8	A34 L143 V147 Q148 C151 F175 D177 I183 D184 L187	A34-W179 HydrophobicContact CB-CH2 4.31Å; A34-W179 HydrophobicContact CB-CZ3 4.24Å; L143-W179 HydrophobicContact CD1-CZ2 4.3Å; V147-W179 HydrophobicContact CB-CH2 4.44Å; V147-W179 HydrophobicContact CB-CZ2 4.42Å; V147-W179 HydrophobicContact CG1-CH2 3.73Å; V147-W179 HydrophobicContact CG1-CZ2 4.1Å; Q148-W179 HydrophobicContact CB-CD2 4.06Å; Q148-W179 VanDerWaalsContact CB-CE2 3.48Å; Q148-W179 HydrophobicContact CB-CG 4.48Å; Q148-W179 HydrophobicContact CB-CH2 4.43Å; Q148-W179 HydrophobicContact CB-CZ2 3.7Å; Q148-W179 HydrophobicContact CG-CD2 3.74Å; Q148-W179 HydrophobicContact CG-CE3 4.45Å; Q148-W179 HydrophobicContact CG-CG 3.77Å; Q148-W179 HydrophobicContact CG-CZ2 4.33Å; C151-W179 HydrophobicContact CB-CE3 4.41Å; C151-W179 HydrophobicContact CB-CH2 4.16Å; C151-W179 HydrophobicContact CB-CZ3 3.64Å; F175-W179 HydrophobicContact CE1-CB 4.48Å; F175-W179 HydrophobicContact CE1-CE3 4.47Å; F175-W179 HydrophobicContact CE2-CE3 4.41Å; F175-W179 AromaticContact CZ-CE3 3.8Å; F175-W179 HydrophobicContact CZ-CE3 3.8Å; F175-W179 HydrophobicContact CZ-CZ3 4.47Å; F175-W179 WeakPolarHBondContact O-CB 3.3Å; F175-W179 PolarHBondContact O-N 3.05Å; D177-W179 VanDerWaalsContact C-N 3.29Å; D177-W179 PolarHBondContact O-N 3.32Å; W179-I183 HydrophobicContact CE3-CB 4.16Å; W179-I183 HydrophobicContact CE3-CD1 4.29Å; W179-I183 HydrophobicContact CE3-CG2 3.8Å; W179-I183 HydrophobicContact CH2-CG2 4.37Å; W179-I183 HydrophobicContact CZ3-CG2 3.71Å; W179-D184 VanDerWaalsContact O-CB 3.22Å; W179-D184 WeakPolarHBondContact O-CB 3.41Å; W179-D184 PolarHBondContact O-N 3.18Å; W179-L187 HydrophobicContact CH2-CD1 4.08Å
180	K	95.3	Very high	95.5	Very high	169 Å²	169	50.2 Å²	50.2	74%	0.735	24%	0.244	S	C	*	.	I	π-helix	trans	-66.7	-40.5	-175.1	-176.8	-179.3	177.3	-175.9	0	113.1	N176 D177	N176-K180 WeakPolarHBondContact O-CB 3.37Å; N176-K180 PolarHBondContact O-N 2.8Å; N176-K180 VanDerWaalsContact O-N 3.1Å; D177-K180 PolarHBondContact O-N 2.86Å
181	R	95.4	Very high	95.6	Very high	94 Å²	94	48.3 Å²	48.3	36%	0.355	24%	0.237	S	C	.	.	I	π-helix	trans	-91.8	-31.1	-170.3	-175.6	169.9	55.5	83.8	3.1	113.3	H18 D22 D177	H18-R181 PolarHBondContact ND1-NH2 3.11Å; D22-R181 IonicContact OD1-NH1 2.84Å; D22-R181 IonicContact OD1-NH2 2.76Å; D177-R181 VanDerWaalsContact O-CB 3.27Å; D177-R181 WeakPolarHBondContact O-CB 3.36Å; D177-R181 PolarHBondContact O-N 2.93Å; D177-R181 IonicContact OD1-NE 3.18Å; D177-R181 IonicContact OD2-CZ 2.88Å; D177-R181 IonicContact OD2-NE 2.65Å; D177-R181 PolarHBondContact OD2-NE 3.03Å; D177-R181 VanDerWaalsContact OD2-NE 3.13Å; D177-R181 IonicContact OD2-NH2 3.54Å; D177-R181 PolarHBondContact OD2-NH2 2.61Å
182	L	96.4	Very high	95.6	Very high	52 Å²	52	50.7 Å²	50.7	27%	0.272	24%	0.244	S	C	.	.	I	π-helix	trans	-126.4	-55.8	-167.2	-57	173.8	0	0	0	112.9	D22 A25 A178 H186	D22-L182 VanDerWaalsContact OD1-CD1 3.28Å; D22-L182 WeakPolarHBondContact OD1-CD1 3.2Å; A25-L182 HydrophobicContact CB-CB 3.64Å; A25-L182 HydrophobicContact CB-CD1 3.55Å; A25-L182 HydrophobicContact CB-CG 4.25Å; A178-L182 WeakPolarHBondContact O-CA 3.13Å; A178-L182 WeakPolarHBondContact O-CB 3.31Å; A178-L182 PolarHBondContact O-N 2.75Å; L182-H186 VanDerWaalsContact O-CB 3.23Å; L182-H186 WeakPolarHBondContact O-CB 3.33Å; L182-H186 PolarHBondContact O-N 2.87Å
183	I	96.2	Very high	95.7	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.258	C	S	.	.	I	π-helix	trans	-70.7	-51.3	-171.3	-57.9	170.3	0	0	0	111.2	A25 I30 I31 A34 F175 A178 W179 H186 L187	A25-I183 HydrophobicContact CB-CG1 4.23Å; I30-I183 HydrophobicContact CG2-CD1 4.13Å; I31-I183 HydrophobicContact CD1-CG1 4.18Å; I31-I183 HydrophobicContact CD1-CG2 4.1Å; A34-I183 HydrophobicContact CB-CG2 4.49Å; F175-I183 HydrophobicContact CE2-CD1 4.39Å; A178-I183 HydrophobicContact CB-CD1 4.21Å; A178-I183 PolarHBondContact O-N 3.14Å; W179-I183 HydrophobicContact CE3-CB 4.16Å; W179-I183 HydrophobicContact CE3-CD1 4.29Å; W179-I183 HydrophobicContact CE3-CG2 3.8Å; W179-I183 HydrophobicContact CH2-CG2 4.37Å; W179-I183 HydrophobicContact CZ3-CG2 3.71Å; I183-H186 WeakPolarHBondContact O-CB 3.46Å; I183-H186 PolarHBondContact O-N 3.1Å; I183-L187 HydrophobicContact CG2-CD1 3.81Å; I183-L187 HydrophobicContact CG2-CG 4.31Å; I183-L187 VanDerWaalsContact O-CG 3.3Å; I183-L187 WeakPolarHBondContact O-CG 3.24Å; I183-L187 PolarHBondContact O-N 3.16Å
184	D	95.6	Very high	95.7	Very high	46 Å²	46	55.9 Å²	55.9	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-48.7	178.6	174.3	90.9	0	0	0	111.9	L143 W179 H186 L187 V188	L143-D184 HydrophobicContact CD1-CB 4.45Å; L143-D184 WeakPolarHBondContact CD1-OD1 3.25Å; L143-D184 WeakPolarHBondContact CG-OD1 3.44Å; W179-D184 VanDerWaalsContact O-CB 3.22Å; W179-D184 WeakPolarHBondContact O-CB 3.41Å; W179-D184 PolarHBondContact O-N 3.18Å; D184-H186 VanDerWaalsContact C-N 3.31Å; D184-H186 PolarHBondContact O-N 2.86Å; D184-L187 PolarHBondContact O-N 3Å; D184-V188 WeakPolarHBondContact O-CB 2.98Å; D184-V188 WeakPolarHBondContact O-CG2 3.39Å; D184-V188 PolarHBondContact O-N 2.66Å
185	P	96.2	Very high	95.7	Very high	53 Å²	53	57.4 Å²	57.4	34%	0.344	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-36.9	174	-28.4	37.5	0	0	0	114.4	R189	P185-R189 WeakPolarHBondContact O-CB 3.25Å; P185-R189 PolarHBondContact O-N 3.31Å
186	H	95.5	Very high	95.7	Very high	88 Å²	88	58.6 Å²	58.6	41%	0.407	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-49	175.8	173.2	-93.5	0	0	0	111.4	L182 I183 D184 R189 S190	L182-H186 VanDerWaalsContact O-CB 3.23Å; L182-H186 WeakPolarHBondContact O-CB 3.33Å; L182-H186 PolarHBondContact O-N 2.87Å; I183-H186 WeakPolarHBondContact O-CB 3.46Å; I183-H186 PolarHBondContact O-N 3.1Å; D184-H186 VanDerWaalsContact C-N 3.31Å; D184-H186 PolarHBondContact O-N 2.86Å; H186-R189 PolarHBondContact O-N 3.47Å; H186-S190 WeakPolarHBondContact O-CB 3.19Å; H186-S190 PolarHBondContact O-N 3.48Å
187	L	95.3	Very high	95.7	Very high	3 Å²	3	58 Å²	58	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-45.2	178.3	-67.4	169.9	0	0	0	111.5	A34 E35 L143 W179 I183 D184 R189 S190 I191	A34-L187 HydrophobicContact CB-CD1 3.74Å; A34-L187 HydrophobicContact CB-CD2 4.19Å; E35-L187 HydrophobicContact CG-CD2 3.59Å; L143-L187 HydrophobicContact CD1-CB 3.91Å; L143-L187 HydrophobicContact CD1-CD1 3.77Å; W179-L187 HydrophobicContact CH2-CD1 4.08Å; I183-L187 HydrophobicContact CG2-CD1 3.81Å; I183-L187 HydrophobicContact CG2-CG 4.31Å; I183-L187 VanDerWaalsContact O-CG 3.3Å; I183-L187 WeakPolarHBondContact O-CG 3.24Å; I183-L187 PolarHBondContact O-N 3.16Å; D184-L187 PolarHBondContact O-N 3Å; L187-R189 VanDerWaalsContact C-N 3.31Å; L187-R189 PolarHBondContact O-N 2.98Å; L187-S190 WeakPolarHBondContact O-CB 3.4Å; L187-S190 PolarHBondContact O-N 3.45Å; L187-I191 VanDerWaalsContact O-CG1 3.3Å; L187-I191 WeakPolarHBondContact O-CG1 3.42Å; L187-I191 PolarHBondContact O-N 3.07Å
188	V	96.3	Very high	95.7	Very high	32 Å²	32	59.6 Å²	59.6	19%	0.194	29%	0.292	C	S	.	.	H	α-helix	trans	-58.3	-44	175.6	164.6	0	0	0	0	111.2	I141 L143 D184 R192	I141-V188 HydrophobicContact CB-CG1 4.01Å; I141-V188 HydrophobicContact CB-CG2 4.27Å; I141-V188 HydrophobicContact CG2-CG2 4.47Å; L143-V188 HydrophobicContact CD2-CG2 4.39Å; L143-V188 HydrophobicContact CG-CG2 4.29Å; D184-V188 WeakPolarHBondContact O-CB 2.98Å; D184-V188 WeakPolarHBondContact O-CG2 3.39Å; D184-V188 PolarHBondContact O-N 2.66Å; V188-R192 WeakPolarHBondContact O-CB 3.36Å; V188-R192 PolarHBondContact O-N 3.33Å
189	R	95.4	Very high	95.6	Very high	181 Å²	181	59.7 Å²	59.7	68%	0.683	29%	0.293	S	S	*	.	H	α-helix	trans	-62.9	-46.5	175.8	-175.4	-177.9	-66.4	165.8	0.1	111.3	P185 H186 L187 R192 T193	P185-R189 WeakPolarHBondContact O-CB 3.25Å; P185-R189 PolarHBondContact O-N 3.31Å; H186-R189 PolarHBondContact O-N 3.47Å; L187-R189 VanDerWaalsContact C-N 3.31Å; L187-R189 PolarHBondContact O-N 2.98Å; R189-R192 PolarHBondContact O-N 3.07Å; R189-T193 PolarHBondContact O-N 3.37Å; R189-T193 PolarHBondContact O-OG1 3.09Å; R189-T193 VanDerWaalsContact O-OG1 3.06Å
190	S	94.7	Very high	95.5	Very high	28 Å²	28	60.5 Å²	60.5	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-49	178.2	-178.1	0	0	0	0	111.7	H186 L187 R192 T193 K194	H186-S190 WeakPolarHBondContact O-CB 3.19Å; H186-S190 PolarHBondContact O-N 3.48Å; L187-S190 WeakPolarHBondContact O-CB 3.4Å; L187-S190 PolarHBondContact O-N 3.45Å; S190-R192 PolarHBondContact O-N 3.14Å; S190-T193 PolarHBondContact O-N 2.82Å; S190-K194 WeakPolarHBondContact O-CG 3.45Å; S190-K194 PolarHBondContact O-N 3.05Å
191	I	95.3	Very high	95.5	Very high	25 Å²	25	56.1 Å²	56.1	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-46.5	176.3	-67	166.7	0	0	0	110.7	C38 A43 V117 I141 L143 L187 T193 K194 L195	C38-I191 HydrophobicContact CB-CD1 4.37Å; A43-I191 HydrophobicContact CB-CD1 4.23Å; V117-I191 HydrophobicContact CG1-CG2 3.94Å; V117-I191 HydrophobicContact CG2-CG2 4.19Å; I141-I191 HydrophobicContact CD1-CG2 4.07Å; L143-I191 HydrophobicContact CD2-CD1 3.69Å; L187-I191 VanDerWaalsContact O-CG1 3.3Å; L187-I191 WeakPolarHBondContact O-CG1 3.42Å; L187-I191 PolarHBondContact O-N 3.07Å; I191-T193 PolarHBondContact O-N 2.9Å; I191-K194 PolarHBondContact O-N 3.01Å; I191-L195 HydrophobicContact CG2-CD1 3.99Å; I191-L195 HydrophobicContact CG2-CG 4.47Å; I191-L195 WeakPolarHBondContact O-CG 3.31Å; I191-L195 PolarHBondContact O-N 3.21Å
192	R	95	Very high	95.2	Very high	66 Å²	66	53.1 Å²	53.1	25%	0.249	28%	0.277	C	S	.	.	H	α-helix	trans	-61.9	-42.7	179.4	-169.9	-172.6	-177.7	96.9	9.3	112.1	N129 I141 V188 R189 S190 L195 T196	N129-R192 PolarHBondContact OD1-NH2 3.36Å; I141-R192 HydrophobicContact CD1-CB 4.11Å; V188-R192 WeakPolarHBondContact O-CB 3.36Å; V188-R192 PolarHBondContact O-N 3.33Å; R189-R192 PolarHBondContact O-N 3.07Å; S190-R192 PolarHBondContact O-N 3.14Å; R192-L195 PolarHBondContact O-N 3.42Å; R192-T196 WeakPolarHBondContact O-CB 3.39Å; R192-T196 PolarHBondContact O-N 3.36Å; R192-T196 PolarHBondContact O-OG1 2.86Å
193	T	95.9	Very high	94.9	Very high	79 Å²	79	51.2 Å²	51.2	49%	0.485	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-50.5	176.9	-61.1	0	0	0	0	110.3	R189 S190 I191 L195 T196 T197	R189-T193 PolarHBondContact O-N 3.37Å; R189-T193 PolarHBondContact O-OG1 3.09Å; R189-T193 VanDerWaalsContact O-OG1 3.06Å; S190-T193 PolarHBondContact O-N 2.82Å; I191-T193 PolarHBondContact O-N 2.9Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3.48Å; T193-T196 PolarHBondContact O-N 2.56Å; T193-T196 VanDerWaalsContact O-N 3.1Å; T193-T197 PolarHBondContact O-N 2.88Å; T193-T197 PolarHBondContact O-OG1 2.97Å; T193-T197 VanDerWaalsContact O-OG1 3.12Å
194	K	95.2	Very high	94.7	Very high	134 Å²	134	52.4 Å²	52.4	58%	0.583	27%	0.274	S	S	*	.	H	α-helix	trans	-56.5	-45.3	177.9	-72	178.2	-177.2	177.9	0	112.5	S190 I191 T196 S198	S190-K194 WeakPolarHBondContact O-CG 3.45Å; S190-K194 PolarHBondContact O-N 3.05Å; I191-K194 PolarHBondContact O-N 3.01Å; K194-T196 VanDerWaalsContact C-N 3.35Å; K194-T196 PolarHBondContact O-N 3.36Å; K194-S198 VanDerWaalsContact O-CB 3.29Å; K194-S198 WeakPolarHBondContact O-CB 3.46Å; K194-S198 PolarHBondContact O-N 3.04Å
195	L	95.4	Very high	94.5	Very high	32 Å²	32	53.4 Å²	53.4	17%	0.168	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-43.2	176.2	-75.1	168.8	0	0	0	112.5	V117 V125 I191 R192 T193 A199	V117-L195 HydrophobicContact CG1-CD1 3.68Å; V117-L195 HydrophobicContact CG1-CD2 3.78Å; V117-L195 HydrophobicContact CG1-CG 4Å; V117-L195 HydrophobicContact CG2-CD1 4.19Å; V125-L195 HydrophobicContact CG1-CB 4.25Å; V125-L195 HydrophobicContact CG2-CB 4.48Å; I191-L195 HydrophobicContact CG2-CD1 3.99Å; I191-L195 HydrophobicContact CG2-CG 4.47Å; I191-L195 WeakPolarHBondContact O-CG 3.31Å; I191-L195 PolarHBondContact O-N 3.21Å; R192-L195 PolarHBondContact O-N 3.42Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3.48Å; L195-A199 WeakPolarHBondContact O-CB 3.47Å; L195-A199 PolarHBondContact O-N 2.89Å
196	T	96.6	Very high	94.1	Very high	25 Å²	25	51.6 Å²	51.6	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-47	-178.4	-58.2	0	0	0	0	110.7	N129 R192 T193 K194 A199 Q200	N129-T196 WeakPolarHBondContact ND2-CG2 3.36Å; N129-T196 PolarHBondContact ND2-OG1 3.46Å; N129-T196 VanDerWaalsContact ND2-OG1 3.1Å; R192-T196 WeakPolarHBondContact O-CB 3.39Å; R192-T196 PolarHBondContact O-N 3.36Å; R192-T196 PolarHBondContact O-OG1 2.86Å; T193-T196 PolarHBondContact O-N 2.56Å; T193-T196 VanDerWaalsContact O-N 3.1Å; K194-T196 VanDerWaalsContact C-N 3.35Å; K194-T196 PolarHBondContact O-N 3.36Å; T196-A199 PolarHBondContact O-N 2.94Å; T196-Q200 HydrophobicContact CG2-CG 4.42Å; T196-Q200 WeakPolarHBondContact O-CB 3.44Å; T196-Q200 VanDerWaalsContact O-CG 3.26Å; T196-Q200 WeakPolarHBondContact O-CG 3.3Å; T196-Q200 PolarHBondContact O-N 2.96Å
197	T	96.1	Very high	93.9	Very high	57 Å²	57	47.5 Å²	47.5	35%	0.35	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-51	177.1	-57.7	0	0	0	0	111.1	T193 A199 Q200 D201	T193-T197 PolarHBondContact O-N 2.88Å; T193-T197 PolarHBondContact O-OG1 2.97Å; T193-T197 VanDerWaalsContact O-OG1 3.12Å; T197-A199 VanDerWaalsContact C-N 3.26Å; T197-A199 PolarHBondContact O-N 3.12Å; T197-Q200 PolarHBondContact O-N 3.32Å; T197-Q200 VanDerWaalsContact O-N 3.1Å; T197-D201 VanDerWaalsContact O-CG 3.23Å; T197-D201 PolarHBondContact O-N 3.17Å
198	S	94.8	Very high	93.7	Very high	76 Å²	76	48.6 Å²	48.6	53%	0.531	25%	0.254	S	S	.	.	H	α-helix	trans	-58.8	-37.7	177.7	175.7	0	0	0	0	112.7	K194 A202	K194-S198 VanDerWaalsContact O-CB 3.29Å; K194-S198 WeakPolarHBondContact O-CB 3.46Å; K194-S198 PolarHBondContact O-N 3.04Å; S198-A202 WeakPolarHBondContact O-CB 3.23Å; S198-A202 PolarHBondContact O-N 2.82Å; S198-A202 VanDerWaalsContact O-N 3.07Å
199	A	94.5	Very high	93.4	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-70.6	-38.2	177	0	0	0	0	0	113.1	A122 V125 L126 L195 T196 T197 S203	A122-A199 HydrophobicContact CB-CB 3.97Å; A122-A199 WeakPolarHBondContact O-CB 3.38Å; V125-A199 HydrophobicContact CB-CB 3.8Å; V125-A199 HydrophobicContact CG1-CB 3.97Å; V125-A199 HydrophobicContact CG2-CB 4.42Å; L126-A199 HydrophobicContact CD2-CB 4.03Å; L126-A199 HydrophobicContact CG-CB 4.02Å; L195-A199 WeakPolarHBondContact O-CB 3.47Å; L195-A199 PolarHBondContact O-N 2.89Å; T196-A199 PolarHBondContact O-N 2.94Å; T197-A199 VanDerWaalsContact C-N 3.26Å; T197-A199 PolarHBondContact O-N 3.12Å; A199-S203 WeakPolarHBondContact O-CB 3.24Å; A199-S203 PolarHBondContact O-N 3.22Å; A199-S203 VanDerWaalsContact O-N 3.07Å
200	Q	95	Very high	93.1	Very high	29 Å²	29	42 Å²	42	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-47	174.8	-74.8	169.1	-23.7	0	0	110.8	L126 T196 T197 S203 L204 D414	L126-Q200 HydrophobicContact CD2-CG 3.87Å; T196-Q200 HydrophobicContact CG2-CG 4.42Å; T196-Q200 WeakPolarHBondContact O-CB 3.44Å; T196-Q200 VanDerWaalsContact O-CG 3.26Å; T196-Q200 WeakPolarHBondContact O-CG 3.3Å; T196-Q200 PolarHBondContact O-N 2.96Å; T197-Q200 PolarHBondContact O-N 3.32Å; T197-Q200 VanDerWaalsContact O-N 3.1Å; Q200-S203 CarbonylContact O-C 3.5Å; Q200-S203 PolarHBondContact O-N 3.4Å; Q200-L204 WeakPolarHBondContact O-CB 3.39Å; Q200-L204 PolarHBondContact O-N 2.98Å; Q200-D414 PolarHBondContact NE2-O 3.24Å
201	D	93.6	Very high	93	Very high	77 Å²	77	40.6 Å²	40.6	41%	0.412	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-47.8	178.8	-64.2	-22.6	0	0	0	111.3	T197 S203 L204 E205	T197-D201 VanDerWaalsContact O-CG 3.23Å; T197-D201 PolarHBondContact O-N 3.17Å; D201-S203 VanDerWaalsContact C-N 3.28Å; D201-S203 PolarHBondContact O-N 3.25Å; D201-L204 WeakPolarHBondContact O-CB 3.19Å; D201-L204 PolarHBondContact O-N 3.34Å; D201-L204 VanDerWaalsContact O-N 3.1Å; D201-E205 PolarHBondContact O-N 3.5Å
202	A	91.1	Very high	92.8	Very high	31 Å²	31	43.3 Å²	43.3	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-35.6	176.4	0	0	0	0	0	112.6	A122 S198 V206	A122-A202 HydrophobicContact CB-CB 4.05Å; S198-A202 WeakPolarHBondContact O-CB 3.23Å; S198-A202 PolarHBondContact O-N 2.82Å; S198-A202 VanDerWaalsContact O-N 3.07Å; A202-V206 WeakPolarHBondContact O-CG2 3.49Å; A202-V206 PolarHBondContact O-N 3.33Å
203	S	89.9	Confident	92.4	Very high	12 Å²	12	41.2 Å²	41.2	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-73	-33.1	175	-171	0	0	0	0	112.3	A199 Q200 D201 F207	A199-S203 WeakPolarHBondContact O-CB 3.24Å; A199-S203 PolarHBondContact O-N 3.22Å; A199-S203 VanDerWaalsContact O-N 3.07Å; Q200-S203 CarbonylContact O-C 3.5Å; Q200-S203 PolarHBondContact O-N 3.4Å; D201-S203 VanDerWaalsContact C-N 3.28Å; D201-S203 PolarHBondContact O-N 3.25Å; S203-F207 VanDerWaalsContact O-CB 3.24Å; S203-F207 WeakPolarHBondContact O-CB 3.31Å; S203-F207 PolarHBondContact O-N 3.18Å
204	L	92.1	Very high	92	Very high	25 Å²	25	39.4 Å²	39.4	13%	0.131	21%	0.208	C	C	.	.	H	α-helix	trans	-71.5	-37.7	178.8	-171.5	61.6	0	0	0	111.5	Q200 D201 F207 S208 I415 Q419 L420 A423	Q200-L204 WeakPolarHBondContact O-CB 3.39Å; Q200-L204 PolarHBondContact O-N 2.98Å; D201-L204 WeakPolarHBondContact O-CB 3.19Å; D201-L204 PolarHBondContact O-N 3.34Å; D201-L204 VanDerWaalsContact O-N 3.1Å; L204-F207 PolarHBondContact O-N 2.95Å; L204-S208 WeakPolarHBondContact O-CB 3.49Å; L204-S208 PolarHBondContact O-N 3.21Å; L204-S208 PolarHBondContact O-OG 3.48Å; L204-I415 HydrophobicContact CB-CD1 4.21Å; L204-I415 HydrophobicContact CD1-CD1 4.2Å; L204-I415 HydrophobicContact CD1-CG2 4.28Å; L204-Q419 HydrophobicContact CD2-CB 4.3Å; L204-L420 HydrophobicContact CD1-CD1 4.12Å; L204-A423 HydrophobicContact CD1-CB 3.56Å; L204-A423 HydrophobicContact CD2-CB 4.11Å; L204-A423 HydrophobicContact CG-CB 3.94Å
205	E	90.7	Very high	91.7	Very high	67 Å²	67	33 Å²	33	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-61.6	-51.6	174.3	-175.5	179.8	-178.3	0	0	111.2	D201 F207 S208 E209 H737	D201-E205 PolarHBondContact O-N 3.5Å; E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 3.1Å; E205-S208 PolarHBondContact O-N 3.07Å; E205-S208 VanDerWaalsContact O-N 3.15Å; E205-E209 PolarHBondContact O-N 2.86Å; E205-H737 IonicContact OE1-CE1 3.07Å; E205-H737 PolarHBondContact OE1-CE1 3.49Å; E205-H737 IonicContact OE1-CG 2.86Å; E205-H737 IonicContact OE1-ND1 3.17Å; E205-H737 PolarHBondContact OE1-ND1 3.14Å
206	V	87.8	Confident	91.5	Very high	16 Å²	16	32.4 Å²	32.4	10%	0.097	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-41.9	176	173.7	0	0	0	0	111.2	A202 S208 N210 V686 T688 F741	A202-V206 WeakPolarHBondContact O-CG2 3.49Å; A202-V206 PolarHBondContact O-N 3.33Å; V206-S208 VanDerWaalsContact C-N 3.35Å; V206-S208 PolarHBondContact O-N 3.04Å; V206-N210 WeakPolarHBondContact O-CB 3.3Å; V206-N210 PolarHBondContact O-N 2.79Å; V206-N210 PolarHBondContact O-ND2 3.48Å; V206-V686 WeakPolarHBondContact CG1-O 3.43Å; V206-T688 HydrophobicContact CG2-CG2 3.93Å; V206-F741 HydrophobicContact CG2-CE2 3.83Å; V206-F741 HydrophobicContact CG2-CZ 4.03Å
207	F	90.5	Very high	90.9	Very high	1 Å²	1	31.6 Å²	31.6	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-44.6	176.2	173.5	-78.7	0	0	0	111.7	S203 L204 E205 N210 L211 L406 V408 Q412 L420 V424	S203-F207 VanDerWaalsContact O-CB 3.24Å; S203-F207 WeakPolarHBondContact O-CB 3.31Å; S203-F207 PolarHBondContact O-N 3.18Å; L204-F207 PolarHBondContact O-N 2.95Å; E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 3.1Å; F207-N210 PolarHBondContact O-N 3.06Å; F207-L211 HydrophobicContact CE1-CD2 4.15Å; F207-L211 WeakPolarHBondContact O-CB 3.41Å; F207-L211 PolarHBondContact O-N 2.82Å; F207-L406 HydrophobicContact CZ-CD1 4.24Å; F207-V408 HydrophobicContact CD1-CG2 4.36Å; F207-V408 HydrophobicContact CD2-CG2 3.52Å; F207-V408 HydrophobicContact CE1-CG2 4.06Å; F207-V408 HydrophobicContact CE2-CG2 3.2Å; F207-V408 HydrophobicContact CG-CG2 4.08Å; F207-V408 HydrophobicContact CZ-CG2 3.48Å; F207-V408 VanDerWaalsContact CZ-CG2 3.48Å; F207-Q412 HydrophobicContact CD2-CB 3.99Å; F207-Q412 HydrophobicContact CE2-CB 3.97Å; F207-L420 HydrophobicContact CD1-CD1 3.96Å; F207-L420 HydrophobicContact CD2-CD1 4.14Å; F207-L420 HydrophobicContact CE1-CD1 3.72Å; F207-L420 HydrophobicContact CE2-CD1 3.87Å; F207-L420 HydrophobicContact CG-CD1 4.2Å; F207-L420 HydrophobicContact CZ-CD1 3.67Å; F207-V424 HydrophobicContact CE1-CG2 3.36Å; F207-V424 HydrophobicContact CZ-CG2 3.64Å
208	S	92.2	Very high	90.1	Very high	26 Å²	26	29.1 Å²	29.1	18%	0.182	16%	0.157	C	C	.	.	H	α-helix	trans	-67.3	-42.6	-177.4	-58.5	0	0	0	0	111.4	L204 E205 V206 L211 R212	L204-S208 WeakPolarHBondContact O-CB 3.49Å; L204-S208 PolarHBondContact O-N 3.21Å; L204-S208 PolarHBondContact O-OG 3.48Å; E205-S208 PolarHBondContact O-N 3.07Å; E205-S208 VanDerWaalsContact O-N 3.15Å; V206-S208 VanDerWaalsContact C-N 3.35Å; V206-S208 PolarHBondContact O-N 3.04Å; S208-L211 PolarHBondContact O-N 2.97Å; S208-R212 WeakPolarHBondContact O-CB 3.27Å; S208-R212 PolarHBondContact O-N 3.31Å
209	E	88.9	Confident	89.5	Confident	70 Å²	70	25.8 Å²	25.8	33%	0.327	13%	0.133	S	C	.	.	H	α-helix	trans	-65.4	-42.1	176	179.3	60.4	-166.8	0	0	112	E205 R212 R213	E205-E209 PolarHBondContact O-N 2.86Å; E209-R212 PolarHBondContact O-N 3.34Å; E209-R213 WeakPolarHBondContact O-CG 3.31Å; E209-R213 PolarHBondContact O-N 3.42Å; E209-R213 VanDerWaalsContact O-N 3.14Å; E209-R213 IonicContact OE1-CZ 3.85Å; E209-R213 VanDerWaalsContact OE1-CZ 3.22Å; E209-R213 IonicContact OE1-NE 3.22Å; E209-R213 PolarHBondContact OE1-NE 3.46Å; E209-R213 IonicContact OE1-NH2 2.74Å; E209-R213 PolarHBondContact OE1-NH2 3.48Å
210	N	90	Very high	88.8	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-44.8	174.1	-72.4	-13.5	0	0	0	111	V206 F207 R213 L214 V408 N685 V686 L745	V206-N210 WeakPolarHBondContact O-CB 3.3Å; V206-N210 PolarHBondContact O-N 2.79Å; V206-N210 PolarHBondContact O-ND2 3.48Å; F207-N210 PolarHBondContact O-N 3.06Å; N210-R213 PolarHBondContact O-N 2.89Å; N210-L214 WeakPolarHBondContact O-CB 3.35Å; N210-L214 PolarHBondContact O-N 2.92Å; N210-L214 VanDerWaalsContact O-N 3.08Å; N210-V408 HydrophobicContact CB-CB 4.21Å; N210-V408 PolarHBondContact ND2-O 3.02Å; N210-N685 PolarHBondContact ND2-OD1 3.2Å; N210-V686 PolarHBondContact ND2-O 3.34Å; N210-L745 HydrophobicContact CB-CD2 4.33Å; N210-L745 WeakPolarHBondContact O-CD2 3.23Å
211	L	91.4	Very high	87.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-47.8	177.9	-177.1	57.2	0	0	0	111.6	F207 S208 R213 L214 L215 L406 V408 V424 V427	F207-L211 HydrophobicContact CE1-CD2 4.15Å; F207-L211 WeakPolarHBondContact O-CB 3.41Å; F207-L211 PolarHBondContact O-N 2.82Å; S208-L211 PolarHBondContact O-N 2.97Å; L211-R213 VanDerWaalsContact C-N 3.3Å; L211-R213 PolarHBondContact O-N 3.11Å; L211-L214 WeakPolarHBondContact O-CB 3.35Å; L211-L214 PolarHBondContact O-N 3.26Å; L211-L214 VanDerWaalsContact O-N 3.14Å; L211-L215 HydrophobicContact CD1-CD1 4.09Å; L211-L215 HydrophobicContact CD1-CD2 4.31Å; L211-L215 HydrophobicContact CD1-CG 3.95Å; L211-L215 HydrophobicContact CG-CD1 3.99Å; L211-L215 HydrophobicContact CG-CG 4.24Å; L211-L215 WeakPolarHBondContact O-CG 3.33Å; L211-L215 PolarHBondContact O-N 3Å; L211-L406 HydrophobicContact CD1-CD1 3.88Å; L211-L406 HydrophobicContact CD1-CD2 4.27Å; L211-L406 HydrophobicContact CD2-CD1 3.91Å; L211-V408 HydrophobicContact CB-CG2 4.09Å; L211-V424 HydrophobicContact CD2-CB 4.24Å; L211-V424 HydrophobicContact CD2-CG1 4.04Å; L211-V424 HydrophobicContact CD2-CG2 3.88Å; L211-V427 HydrophobicContact CB-CG1 4.19Å; L211-V427 HydrophobicContact CD2-CB 4.2Å; L211-V427 HydrophobicContact CD2-CG1 4.04Å; L211-V427 HydrophobicContact CG-CG1 3.91Å
212	R	91.2	Very high	86.3	Confident	82 Å²	82	25.1 Å²	25.1	31%	0.309	13%	0.129	S	C	.	.	H	α-helix	trans	-53.2	-49.9	179.5	-173.4	-158.1	-175.5	95.3	6.2	110.8	S208 E209 L214 L215 M216 V427 E430	S208-R212 WeakPolarHBondContact O-CB 3.27Å; S208-R212 PolarHBondContact O-N 3.31Å; E209-R212 PolarHBondContact O-N 3.34Å; R212-L214 PolarHBondContact O-N 3.08Å; R212-L215 PolarHBondContact O-N 3.31Å; R212-M216 HydrophobicContact CG-CG 4.41Å; R212-M216 VanDerWaalsContact O-CB 3.28Å; R212-M216 WeakPolarHBondContact O-CB 3.31Å; R212-M216 VanDerWaalsContact O-CG 3.24Å; R212-M216 WeakPolarHBondContact O-CG 3.08Å; R212-M216 PolarHBondContact O-N 2.71Å; R212-V427 HydrophobicContact CB-CG1 3.93Å; R212-E430 IonicContact CZ-OE1 3.19Å; R212-E430 IonicContact CZ-OE2 3.65Å; R212-E430 IonicContact NH1-OE1 2.6Å; R212-E430 PolarHBondContact NH1-OE1 2.98Å; R212-E430 IonicContact NH1-OE2 2.71Å; R212-E430 PolarHBondContact NH1-OE2 2.81Å; R212-E430 IonicContact NH2-OE1 3.77Å; R212-E430 PolarHBondContact NH2-OE1 3.33Å
213	R	87.2	Confident	84.5	Confident	22 Å²	22	26.8 Å²	26.8	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-42.2	179	-71	171	176.5	-79.2	-20.3	112.8	E209 N210 L211 L215 M216 T217 F659 R744 L745	E209-R213 WeakPolarHBondContact O-CG 3.31Å; E209-R213 PolarHBondContact O-N 3.42Å; E209-R213 VanDerWaalsContact O-N 3.14Å; E209-R213 IonicContact OE1-CZ 3.85Å; E209-R213 VanDerWaalsContact OE1-CZ 3.22Å; E209-R213 IonicContact OE1-NE 3.22Å; E209-R213 PolarHBondContact OE1-NE 3.46Å; E209-R213 IonicContact OE1-NH2 2.74Å; E209-R213 PolarHBondContact OE1-NH2 3.48Å; N210-R213 PolarHBondContact O-N 2.89Å; L211-R213 VanDerWaalsContact C-N 3.3Å; L211-R213 PolarHBondContact O-N 3.11Å; R213-L215 VanDerWaalsContact C-N 3.33Å; R213-L215 PolarHBondContact O-N 2.75Å; R213-M216 CarbonylContact O-C 3.58Å; R213-M216 PolarHBondContact O-N 3.39Å; R213-T217 PolarHBondContact O-N 3.2Å; R213-T217 PolarHBondContact O-OG1 3.12Å; R213-T217 VanDerWaalsContact O-OG1 3.12Å; R213-F659 HydrophobicContact CB-CD1 4.42Å; R213-F659 HydrophobicContact CB-CE1 4.05Å; R213-F659 HydrophobicContact CB-CZ 4.42Å; R213-F659 HydrophobicContact CG-CE1 4.04Å; R213-F659 HydrophobicContact CG-CZ 4.25Å; R213-R744 VanDerWaalsContact CZ-CB 3.43Å; R213-L745 HydrophobicContact CB-CB 4.08Å; R213-L745 HydrophobicContact CB-CD2 4.11Å; R213-L745 VanDerWaalsContact CD-CB 3.5Å; R213-L745 HydrophobicContact CG-CB 4.47Å; R213-L745 PolarHBondContact NH1-O 3.33Å
214	L	87.1	Confident	82.3	Confident	40 Å²	40	30 Å²	30	21%	0.209	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-42.4	178.1	-176.8	62.1	0	0	0	111.4	N210 L211 R212 T217 P394 L398 V408 L745	N210-L214 WeakPolarHBondContact O-CB 3.35Å; N210-L214 PolarHBondContact O-N 2.92Å; N210-L214 VanDerWaalsContact O-N 3.08Å; L211-L214 WeakPolarHBondContact O-CB 3.35Å; L211-L214 PolarHBondContact O-N 3.26Å; L211-L214 VanDerWaalsContact O-N 3.14Å; R212-L214 PolarHBondContact O-N 3.08Å; L214-T217 WeakPolarHBondContact O-CB 3.2Å; L214-T217 PolarHBondContact O-N 3.32Å; L214-T217 PolarHBondContact O-OG1 3.45Å; L214-T217 VanDerWaalsContact O-OG1 3.08Å; L214-P394 WeakPolarHBondContact O-CB 3.32Å; L214-L398 HydrophobicContact CD1-CD1 4.29Å; L214-L398 HydrophobicContact CD2-CD1 3.46Å; L214-L398 VanDerWaalsContact CD2-CD1 3.46Å; L214-L398 HydrophobicContact CG-CD1 3.5Å; L214-V408 HydrophobicContact CD2-CG1 3.59Å; L214-L745 HydrophobicContact CB-CD2 4.15Å
215	L	90.2	Very high	79.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.3	-32.7	177	-65.6	-176.7	0	0	0	112.7	L211 R212 R213 T217 L395 L398 V427 M428 C431	L211-L215 HydrophobicContact CD1-CD1 4.09Å; L211-L215 HydrophobicContact CD1-CD2 4.31Å; L211-L215 HydrophobicContact CD1-CG 3.95Å; L211-L215 HydrophobicContact CG-CD1 3.99Å; L211-L215 HydrophobicContact CG-CG 4.24Å; L211-L215 WeakPolarHBondContact O-CG 3.33Å; L211-L215 PolarHBondContact O-N 3Å; R212-L215 PolarHBondContact O-N 3.31Å; R213-L215 VanDerWaalsContact C-N 3.33Å; R213-L215 PolarHBondContact O-N 2.75Å; L215-T217 PolarHBondContact O-N 3.3Å; L215-L395 HydrophobicContact CB-CD1 3.97Å; L215-L395 HydrophobicContact CD1-CD1 4.36Å; L215-L395 HydrophobicContact CD2-CD1 4.12Å; L215-L395 HydrophobicContact CG-CD1 4.36Å; L215-L398 HydrophobicContact CD2-CB 3.79Å; L215-L398 HydrophobicContact CD2-CD1 4.06Å; L215-V427 HydrophobicContact CD1-CG1 4.27Å; L215-M428 HydrophobicContact CD1-CG 3.85Å; L215-C431 HydrophobicContact CB-CB 4.15Å; L215-C431 HydrophobicContact CD1-CB 4.29Å
216	M	89.4	Confident	77	Confident	19 Å²	19	34.5 Å²	34.5	9%	0.094	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	7.9	177.1	-71.1	-56.1	-61.2	0	0	113.9	R212 R213 A218 C431 F434 V435 R655 F659	R212-M216 HydrophobicContact CG-CG 4.41Å; R212-M216 VanDerWaalsContact O-CB 3.28Å; R212-M216 WeakPolarHBondContact O-CB 3.31Å; R212-M216 VanDerWaalsContact O-CG 3.24Å; R212-M216 WeakPolarHBondContact O-CG 3.08Å; R212-M216 PolarHBondContact O-N 2.71Å; R213-M216 CarbonylContact O-C 3.58Å; R213-M216 PolarHBondContact O-N 3.39Å; M216-A218 PolarHBondContact O-N 2.92Å; M216-C431 HydrophobicContact SD-CB 4.2Å; M216-F434 HydrophobicContact CE-CD1 3.32Å; M216-F434 HydrophobicContact CE-CE1 3.49Å; M216-F434 VanDerWaalsContact CE-CE1 3.49Å; M216-F434 HydrophobicContact SD-CD1 4.05Å; M216-V435 HydrophobicContact CE-CG2 4.31Å; M216-V435 HydrophobicContact SD-CG2 4.01Å; M216-R655 HydrophobicContact CE-CB 4.43Å; M216-R655 HydrophobicContact CE-CG 3.62Å; M216-R655 WeakPolarHBondContact O-CB 3.37Å; M216-R655 WeakPolarHBondContact O-CG 3.41Å; M216-R655 HydrophobicContact SD-CG 4.13Å; M216-F659 HydrophobicContact CB-CE2 4.31Å; M216-F659 WeakPolarHBondContact O-CD2 3.39Å
217	T	84.2	Confident	74.2	Confident	9 Å²	9	41.6 Å²	41.6	6%	0.055	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-68.7	125.4	171.8	-60.1	0	0	0	0	109.8	R213 L214 L215 P394 F659	R213-T217 PolarHBondContact O-N 3.2Å; R213-T217 PolarHBondContact O-OG1 3.12Å; R213-T217 VanDerWaalsContact O-OG1 3.12Å; L214-T217 WeakPolarHBondContact O-CB 3.2Å; L214-T217 PolarHBondContact O-N 3.32Å; L214-T217 PolarHBondContact O-OG1 3.45Å; L214-T217 VanDerWaalsContact O-OG1 3.08Å; L215-T217 PolarHBondContact O-N 3.3Å; T217-P394 HydrophobicContact CG2-CG 3.95Å; T217-F659 HydrophobicContact CG2-CB 3.81Å; T217-F659 WeakPolarHBondContact CG2-O 3.37Å; T217-F659 WeakPolarHBondContact OG1-CB 3.3Å
218	A	79.7	Confident	71.2	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.033	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-58.7	144.2	178.4	0	0	0	0	0	111.5	M216 R655 D657	M216-A218 PolarHBondContact O-N 2.92Å; A218-R655 HydrophobicContact CB-CB 4.11Å; A218-D657 WeakPolarHBondContact CB-OD1 3.33Å
219	P	81.7	Confident	68.2	Low	6 Å²	6	50.6 Å²	50.6	4%	0.039	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-69.4	148.5	177.3	31.5	-33.4	0	0	0	109.8	R221 Q392 D393	P219-R221 PolarHBondContact O-N 2.88Å; P219-Q392 CarbonylContact C-O 3.6Å; P219-Q392 WeakPolarHBondContact CA-O 3.46Å; P219-Q392 WeakPolarHBondContact CB-O 3.13Å; P219-D393 HydrophobicContact CB-CB 4.18Å
220	L	80.7	Confident	65.3	Low	12 Å²	12	52 Å²	52	6%	0.063	30%	0.303	C	S	.	.			trans	-74.5	112.1	179.7	-172.7	70.8	0	0	0	110.4	R250 L251 V253 T321 L391 Q392 F663	L220-R250 VanDerWaalsContact O-CA 3.31Å; L220-R250 WeakPolarHBondContact O-CA 3.26Å; L220-L251 HydrophobicContact CD1-CD1 4.48Å; L220-L251 HydrophobicContact CD2-CB 4.19Å; L220-L251 HydrophobicContact CD2-CD1 3.97Å; L220-L251 HydrophobicContact CG-CB 4.41Å; L220-L251 HydrophobicContact CG-CD1 3.93Å; L220-L251 HydrophobicContact CG-CG 4.45Å; L220-L251 PolarHBondContact O-N 3.08Å; L220-L251 VanDerWaalsContact O-N 3.14Å; L220-V253 HydrophobicContact CD2-CG2 4.38Å; L220-T321 HydrophobicContact CD2-CG2 3.82Å; L220-L391 HydrophobicContact CD2-CD2 4.39Å; L220-L391 HydrophobicContact CD2-CG 4.17Å; L220-Q392 PolarHBondContact N-O 2.93Å; L220-F663 HydrophobicContact CD1-CE2 4.13Å; L220-F663 HydrophobicContact CD1-CZ 3.9Å; L220-F663 HydrophobicContact CD2-CZ 4.1Å
221	R	72.9	Confident	62.6	Low	10 Å²	10	57.4 Å²	57.4	4%	0.038	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-106.8	172.1	-178.3	-61.4	-177.9	-172	-153.4	7.6	112.8	P219 I240 G245 A246 D249 L251 D653	P219-R221 PolarHBondContact O-N 2.88Å; R221-I240 HydrophobicContact CB-CG2 3.91Å; R221-I240 WeakPolarHBondContact O-CD1 3.18Å; R221-G245 PolarHBondContact NH1-O 2.98Å; R221-A246 PolarHBondContact NH1-O 3.26Å; R221-D249 CarbonylContact C-O 3.47Å; R221-D249 VanDerWaalsContact C-O 3.25Å; R221-D249 WeakPolarHBondContact CA-O 3.45Å; R221-D249 HydrophobicContact CB-CB 4.46Å; R221-L251 WeakPolarHBondContact O-CD1 2.86Å; R221-L251 WeakPolarHBondContact O-CG 3.42Å; R221-D653 VanDerWaalsContact NH2-CB 3.26Å; R221-D653 IonicContact NH2-OD2 2.81Å; R221-D653 PolarHBondContact NH2-OD2 3.15Å
222	I	63.2	Low	59.5	Low	72 Å²	72	66.5 Å²	66.5	37%	0.369	38%	0.375	S	S	.	.			trans	-70.3	137.6	170.7	-64.3	161	0	0	0	108.9	V224 I240 D249 L251	I222-V224 PolarHBondContact O-N 2.7Å; I222-I240 WeakPolarHBondContact O-CG2 3.12Å; I222-D249 HydrophobicContact CB-CB 4.14Å; I222-D249 HydrophobicContact CD1-CB 4Å; I222-D249 HydrophobicContact CG1-CB 4.19Å; I222-D249 WeakPolarHBondContact CG1-O 3.23Å; I222-D249 PolarHBondContact N-O 2.96Å; I222-L251 HydrophobicContact CB-CD2 4.26Å; I222-L251 HydrophobicContact CG1-CD2 3.53Å; I222-L251 HydrophobicContact CG1-CG 4.38Å
223	P	52.6	Low	56.5	Low	65 Å²	65	67.7 Å²	67.7	42%	0.422	39%	0.387	S	S	.	.			trans	-60.9	120	173.5	-13.6	25.7	0	0	0	110.2	S225 I240	P223-S225 PolarHBondContact O-N 2.95Å; P223-S225 VanDerWaalsContact O-N 3.08Å; P223-I240 HydrophobicContact CB-CD1 4.22Å; P223-I240 HydrophobicContact CB-CG1 3.93Å; P223-I240 HydrophobicContact CG-CD1 3.61Å; P223-I240 HydrophobicContact CG-CG1 3.86Å
224	V	45.5	Very low	53.7	Low	79 Å²	79	75.3 Å²	75.3	48%	0.479	42%	0.424	S	S	.	.			trans	-65.8	110.6	166.7	-170.9	0	0	0	0	106.2	I222 S226	I222-V224 PolarHBondContact O-N 2.7Å; V224-S226 VanDerWaalsContact C-N 3.34Å; V224-S226 PolarHBondContact O-N 3.2Å
225	S	37.7	Very low	51.2	Low	97 Å²	97	81 Å²	81	68%	0.678	46%	0.455	S	S	*	.			trans	-64.9	98.6	170.8	51	0	0	0	0	107.7	P223 N227	P223-S225 PolarHBondContact O-N 2.95Å; P223-S225 VanDerWaalsContact O-N 3.08Å; S225-N227 PolarHBondContact O-N 3.16Å; S225-N227 VanDerWaalsContact O-N 3.13Å
226	S	32.6	Very low	48.7	Very low	91 Å²	91	86.7 Å²	86.7	64%	0.636	49%	0.485	S	S	*	.			trans	-58.7	119.2	161.3	53.1	0	0	0	0	106.6	V224 D228	V224-S226 VanDerWaalsContact C-N 3.34Å; V224-S226 PolarHBondContact O-N 3.2Å; S226-D228 PolarHBondContact O-N 2.9Å
227	N	29.2	Very low	46.5	Very low	165 Å²	165	91.1 Å²	91.1	88%	0.882	51%	0.508	S	S	*	.	S	Bend	trans	-62.3	13.5	168.8	-80.5	-29.1	0	0	0	113.2	S225 S229	S225-N227 PolarHBondContact O-N 3.16Å; S225-N227 VanDerWaalsContact O-N 3.13Å; N227-S229 PolarHBondContact O-N 2.76Å
228	D	28.6	Very low	44.3	Very low	107 Å²	107	92.2 Å²	92.2	57%	0.572	52%	0.521	S	S	*	.			trans	-90.8	103.6	176.7	-145.1	-20.4	0	0	0	109.5	S226 T230	S226-D228 PolarHBondContact O-N 2.9Å; D228-T230 PolarHBondContact O-N 3.22Å; D228-T230 PolarHBondContact OD1-OG1 2.74Å
229	S	28.3	Very low	42.4	Very low	108 Å²	108	97.3 Å²	97.3	76%	0.755	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	10.1	-175.1	49.8	0	0	0	0	114.1	N227	N227-S229 PolarHBondContact O-N 2.76Å
230	T	29.1	Very low	40.6	Very low	101 Å²	101	97.9 Å²	97.9	62%	0.62	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-7.2	-161	51.8	0	0	0	0	115.8	D228	D228-T230 PolarHBondContact O-N 3.22Å; D228-T230 PolarHBondContact OD1-OG1 2.74Å
231	V	31.8	Very low	38.7	Very low	117 Å²	117	100 Å²	100	71%	0.709	56%	0.564	S	S	*	*			trans	-139.5	68.7	176.5	-166.3	0	0	0	0	111.9	N233	V231-N233 PolarHBondContact O-N 3.07Å
232	K	26.7	Very low	37.2	Very low	190 Å²	190	100 Å²	100	83%	0.826	57%	0.566	S	S	*	*			trans	-89.6	84.8	162.8	-73.7	-173.5	178.6	-179.5	0	109.2	E234	K232-E234 PolarHBondContact O-N 2.86Å
233	N	28.8	Very low	36.2	Very low	107 Å²	107	98.7 Å²	98.7	57%	0.572	57%	0.566	S	S	*	*			trans	-72.5	108.2	160.5	-90.2	-14.4	0	0	0	107.6	V231 N235 D236	V231-N233 PolarHBondContact O-N 3.07Å; N233-N235 PolarHBondContact O-N 2.7Å; N233-D236 HydrophobicContact CB-CB 4.22Å; N233-D236 PolarHBondContact O-N 3.29Å
234	E	28.5	Very low	35.6	Very low	182 Å²	182	99.7 Å²	99.7	85%	0.85	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-4.8	-174.7	-68.1	-175.7	147	0	0	115.2	K232	K232-E234 PolarHBondContact O-N 2.86Å
235	N	34.4	Very low	35.1	Very low	161 Å²	161	96.7 Å²	96.7	86%	0.861	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	1.1	177.4	-68.6	-43.9	0	0	0	114.4	N233	N233-N235 PolarHBondContact O-N 2.7Å
236	D	37.6	Very low	35.3	Very low	118 Å²	118	93.4 Å²	93.4	63%	0.631	54%	0.538	S	S	*	.			trans	-110.3	77	173.5	-91.6	-34.3	0	0	0	109.2	N233 G238	N233-D236 HydrophobicContact CB-CB 4.22Å; N233-D236 PolarHBondContact O-N 3.29Å; D236-G238 VanDerWaalsContact C-N 3.29Å; D236-G238 PolarHBondContact O-N 3.2Å
237	I	42.8	Very low	35.7	Very low	113 Å²	113	91.3 Å²	91.3	58%	0.579	52%	0.522	S	S	*	.			trans	-77	85.1	176.5	-55.2	175.9	0	0	0	108.8
238	G	38.9	Very low	36.5	Very low	32 Å²	32	85.6 Å²	85.6	33%	0.33	50%	0.502	S	S	.	.			trans	65.9	81	153.8	0	0	0	0	0	116.5	D236	D236-G238 VanDerWaalsContact C-N 3.29Å; D236-G238 PolarHBondContact O-N 3.2Å
239	M	38.6	Very low	38	Very low	110 Å²	110	82.4 Å²	82.4	54%	0.542	49%	0.485	S	S	.	.			trans	-70	121.7	148.9	-81.3	-90.1	-67.4	0	0	107.5	D657 T660 R748	M239-D657 HydrophobicContact CE-CB 4.17Å; M239-T660 PolarHBondContact SD-OG1 3.14Å; M239-T660 VanDerWaalsContact SD-OG1 3.37Å; M239-R748 PolarHBondContact SD-NH2 3.23Å; M239-R748 VanDerWaalsContact SD-NH2 3.41Å
240	I	44.4	Very low	40.2	Very low	18 Å²	18	81 Å²	81	9%	0.092	46%	0.463	C	S	.	.			trans	-101.6	107.8	-171.1	-57.7	164	0	0	0	105.7	R221 I222 P223 S242 L251 D657	R221-I240 HydrophobicContact CB-CG2 3.91Å; R221-I240 WeakPolarHBondContact O-CD1 3.18Å; I222-I240 WeakPolarHBondContact O-CG2 3.12Å; P223-I240 HydrophobicContact CB-CD1 4.22Å; P223-I240 HydrophobicContact CB-CG1 3.93Å; P223-I240 HydrophobicContact CG-CD1 3.61Å; P223-I240 HydrophobicContact CG-CG1 3.86Å; I240-S242 PolarHBondContact O-N 3.37Å; I240-L251 HydrophobicContact CD1-CD1 4.42Å; I240-D657 VanDerWaalsContact O-OD1 3.11Å
241	S	40.5	Very low	42.8	Very low	56 Å²	56	77.3 Å²	77.3	39%	0.392	44%	0.44	S	S	.	.			trans	-67.2	112.5	-177.9	-177.5	0	0	0	0	110.8	A243 S244 D657	S241-A243 PolarHBondContact O-N 3.29Å; S241-A243 VanDerWaalsContact O-N 3.14Å; S241-A243 WeakPolarHBondContact OG-CB 3.34Å; S241-A243 PolarHBondContact OG-N 3.38Å; S241-S244 PolarHBondContact O-N 3.32Å; S241-D657 VanDerWaalsContact CA-OD2 3.26Å; S241-D657 WeakPolarHBondContact CA-OD2 3.42Å
242	S	40.9	Very low	45.6	Very low	11 Å²	11	73 Å²	73	8%	0.077	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-45.5	-30.1	162	48.1	0	0	0	0	113.1	I240 S244 R655 D657	I240-S242 PolarHBondContact O-N 3.37Å; S242-S244 VanDerWaalsContact C-N 3.25Å; S242-S244 PolarHBondContact O-N 3.14Å; S242-R655 WeakPolarHBondContact CB-O 3.27Å; S242-R655 PolarHBondContact OG-O 3.33Å; S242-R655 VanDerWaalsContact OG-O 3.13Å; S242-D657 WeakPolarHBondContact CB-OD2 3.3Å; S242-D657 PolarHBondContact N-OD1 3.38Å; S242-D657 PolarHBondContact N-OD2 2.79Å; S242-D657 PolarHBondContact OG-OD2 3.25Å
243	A	42.5	Very low	48.9	Very low	45 Å²	45	64 Å²	64	37%	0.372	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-73	-12.4	-176.4	0	0	0	0	0	114.6	S241 F652	S241-A243 PolarHBondContact O-N 3.29Å; S241-A243 VanDerWaalsContact O-N 3.14Å; S241-A243 WeakPolarHBondContact OG-CB 3.34Å; S241-A243 PolarHBondContact OG-N 3.38Å; A243-F652 HydrophobicContact CB-CE2 4.01Å
244	S	39.9	Very low	52.1	Low	86 Å²	86	58.9 Å²	58.9	60%	0.601	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-120.1	3.2	-171.4	-55.7	0	0	0	0	115	S241 S242	S241-S244 PolarHBondContact O-N 3.32Å; S242-S244 VanDerWaalsContact C-N 3.25Å; S242-S244 PolarHBondContact O-N 3.14Å
245	G	35.7	Very low	55.4	Low	15 Å²	15	50.2 Å²	50.2	16%	0.155	31%	0.307	C	S	.	.			trans	-116.6	135.4	-177.7	0	0	0	0	0	113.3	R221	R221-G245 PolarHBondContact NH1-O 2.98Å
246	A	41.2	Very low	58.4	Low	29 Å²	29	42.7 Å²	42.7	24%	0.24	27%	0.267	C	S	.	.			trans	-68.3	147.1	162.6	0	0	0	0	0	109.5	R221 G248 V512	R221-A246 PolarHBondContact NH1-O 3.26Å; A246-G248 PolarHBondContact O-N 3.23Å; A246-V512 HydrophobicContact CB-CG1 3.71Å; A246-V512 HydrophobicContact CB-CG2 4.45Å
247	P	40.7	Very low	61.1	Low	47 Å²	47	38.1 Å²	38.1	31%	0.305	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	87	-177.6	-15.3	34	0	0	0	111	K498 D651	P247-K498 PolarHBondContact O-NZ 3.27Å; P247-D651 WeakPolarHBondContact CD-OD2 3.28Å; P247-D651 HydrophobicContact CG-CB 4.3Å; P247-D651 WeakPolarHBondContact CG-O 3.41Å; P247-D651 WeakPolarHBondContact CG-OD2 3.33Å
248	G	47.6	Very low	63.5	Low	45 Å²	45	33.1 Å²	33.1	46%	0.464	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-144.3	-8.6	167.3	0	0	0	0	0	113.5	A246	A246-G248 PolarHBondContact O-N 3.23Å
249	D	59.9	Low	65.8	Low	39 Å²	39	32 Å²	32	21%	0.209	21%	0.206	C	C	.	.			trans	-107.4	32.8	-158.6	-59	-27.2	0	0	0	114.7	R221 I222 L251	R221-D249 CarbonylContact C-O 3.47Å; R221-D249 VanDerWaalsContact C-O 3.25Å; R221-D249 WeakPolarHBondContact CA-O 3.45Å; R221-D249 HydrophobicContact CB-CB 4.46Å; I222-D249 HydrophobicContact CB-CB 4.14Å; I222-D249 HydrophobicContact CD1-CB 4Å; I222-D249 HydrophobicContact CG1-CB 4.19Å; I222-D249 WeakPolarHBondContact CG1-O 3.23Å; I222-D249 PolarHBondContact N-O 2.96Å; D249-L251 PolarHBondContact O-N 3.18Å
250	R	74.6	Confident	67.9	Low	78 Å²	78	30.9 Å²	30.9	29%	0.294	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-61.8	144.8	178.2	-72.9	179.2	-166.5	-167.8	-1.1	110.4	L220 P271 D393	L220-R250 VanDerWaalsContact O-CA 3.31Å; L220-R250 WeakPolarHBondContact O-CA 3.26Å; R250-P271 HydrophobicContact CB-CB 4.25Å; R250-P271 WeakPolarHBondContact CB-O 3.34Å; R250-P271 WeakPolarHBondContact CD-O 3.39Å; R250-P271 WeakPolarHBondContact O-CB 3.2Å; R250-P271 VanDerWaalsContact O-CG 3.29Å; R250-P271 WeakPolarHBondContact O-CG 3.38Å; R250-D393 IonicContact CZ-OD2 3.3Å; R250-D393 VanDerWaalsContact NH1-CB 3.34Å; R250-D393 IonicContact NH1-OD2 3.58Å; R250-D393 IonicContact NH2-OD2 3.53Å; R250-D393 PolarHBondContact NH2-OD2 2.91Å
251	L	82.7	Confident	69.8	Low	25 Å²	25	38.2 Å²	38.2	13%	0.131	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-76.6	144.2	175.2	-71.2	176.3	0	0	0	111.1	L220 R221 I222 I240 D249 Q392	L220-L251 HydrophobicContact CD1-CD1 4.48Å; L220-L251 HydrophobicContact CD2-CB 4.19Å; L220-L251 HydrophobicContact CD2-CD1 3.97Å; L220-L251 HydrophobicContact CG-CB 4.41Å; L220-L251 HydrophobicContact CG-CD1 3.93Å; L220-L251 HydrophobicContact CG-CG 4.45Å; L220-L251 PolarHBondContact O-N 3.08Å; L220-L251 VanDerWaalsContact O-N 3.14Å; R221-L251 WeakPolarHBondContact O-CD1 2.86Å; R221-L251 WeakPolarHBondContact O-CG 3.42Å; I222-L251 HydrophobicContact CB-CD2 4.26Å; I222-L251 HydrophobicContact CG1-CD2 3.53Å; I222-L251 HydrophobicContact CG1-CG 4.38Å; I240-L251 HydrophobicContact CD1-CD1 4.42Å; D249-L251 PolarHBondContact O-N 3.18Å; L251-Q392 PolarHBondContact O-NE2 3.49Å
252	P	91.4	Very high	71.9	Confident	26 Å²	26	40.7 Å²	40.7	17%	0.169	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-64.6	143.5	162.8	30.4	-33.6	0	0	0	109.3	C269 I319	P252-C269 CarbonylContact C-O 3.51Å; P252-C269 VanDerWaalsContact CA-O 3.25Å; P252-C269 WeakPolarHBondContact CA-O 3.5Å; P252-C269 WeakPolarHBondContact CB-O 3.31Å; P252-I319 HydrophobicContact CB-CD1 4.28Å; P252-I319 HydrophobicContact CB-CG1 3.96Å; P252-I319 HydrophobicContact CB-CG2 4.41Å; P252-I319 HydrophobicContact CG-CG1 4.21Å
253	V	94.7	Very high	74.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.9	-173.3	174.5	0	0	0	0	110.6	L220 C269 T321 A323 A388 L391 Q392	L220-V253 HydrophobicContact CD2-CG2 4.38Å; V253-C269 PolarHBondContact N-O 3.12Å; V253-C269 PolarHBondContact O-N 3.18Å; V253-T321 HydrophobicContact CG2-CG2 4.18Å; V253-A323 HydrophobicContact CG1-CB 3.87Å; V253-A388 HydrophobicContact CB-CB 4.46Å; V253-A388 HydrophobicContact CG1-CB 4.06Å; V253-L391 HydrophobicContact CG1-CB 4.36Å; V253-L391 HydrophobicContact CG1-CD2 3.96Å; V253-L391 HydrophobicContact CG2-CD2 4.38Å; V253-Q392 HydrophobicContact CB-CG 4.07Å; V253-Q392 HydrophobicContact CG2-CG 3.62Å
254	I	97.5	Very high	76.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.9	162.5	-58.9	-55.9	0	0	0	109.1	L256 W266 A267 A268 L310 M314 I319 T321 I322 A323	I254-L256 HydrophobicContact CG2-CD2 3.87Å; I254-L256 HydrophobicContact CG2-CG 4.34Å; I254-W266 HydrophobicContact CG2-CB 4.29Å; I254-A267 CarbonylContact C-O 3.25Å; I254-A267 WeakPolarHBondContact CA-O 3.44Å; I254-A268 HydrophobicContact CD1-CB 3.34Å; I254-L310 HydrophobicContact CD1-CD1 4.16Å; I254-L310 HydrophobicContact CG1-CD1 4.13Å; I254-L310 HydrophobicContact CG2-CD1 3.9Å; I254-M314 HydrophobicContact CD1-CG 4.22Å; I254-M314 HydrophobicContact CG1-CG 3.94Å; I254-M314 HydrophobicContact CG1-SD 4.41Å; I254-I319 HydrophobicContact CD1-CD1 3.75Å; I254-I319 HydrophobicContact CD1-CG2 4.24Å; I254-I319 HydrophobicContact CG1-CB 4.49Å; I254-I319 HydrophobicContact CG1-CG2 3.87Å; I254-T321 PolarHBondContact N-O 2.83Å; I254-I322 HydrophobicContact CB-CG1 4.15Å; I254-I322 HydrophobicContact CB-CG2 4.49Å; I254-I322 HydrophobicContact CG2-CG2 4.5Å; I254-I322 CarbonylContact O-C 3.56Å; I254-I322 WeakPolarHBondContact O-CA 3.5Å; I254-A323 PolarHBondContact O-N 3.13Å
255	G	97.2	Very high	79.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.1	166.6	0	0	0	0	0	111	W266 A267 A323	G255-W266 CarbonylContact O-C 3.57Å; G255-W266 WeakPolarHBondContact O-CA 3.47Å; G255-A267 PolarHBondContact N-O 3.48Å; G255-A267 PolarHBondContact O-N 3.49Å; G255-A323 CarbonylContact C-O 3.58Å; G255-A323 WeakPolarHBondContact CA-O 3.41Å
256	L	96.4	Very high	82	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.8	173.2	-60.5	-176.4	0	0	0	109.6	I254 P258 K265 W266 L281 I322 A323 L324 G325 T333 L337	I254-L256 HydrophobicContact CG2-CD2 3.87Å; I254-L256 HydrophobicContact CG2-CG 4.34Å; L256-P258 WeakPolarHBondContact O-CD 3.45Å; L256-K265 CarbonylContact C-O 3.59Å; L256-K265 WeakPolarHBondContact CA-O 3.36Å; L256-W266 HydrophobicContact CD2-CB 3.42Å; L256-W266 VanDerWaalsContact CD2-CB 3.42Å; L256-L281 HydrophobicContact CD2-CD1 3.74Å; L256-I322 HydrophobicContact CD1-CG2 3.55Å; L256-I322 HydrophobicContact CG-CG2 3.67Å; L256-A323 PolarHBondContact N-O 2.6Å; L256-L324 HydrophobicContact CB-CD1 3.91Å; L256-L324 HydrophobicContact CD1-CD1 4.26Å; L256-G325 PolarHBondContact O-N 2.85Å; L256-T333 HydrophobicContact CD1-CG2 4.38Å; L256-L337 HydrophobicContact CD1-CD2 4.1Å
257	D	95.5	Very high	84.7	Confident	23 Å²	23	33 Å²	33	12%	0.123	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	95	171.5	-176.3	19.3	0	0	0	108.9	C264 K265 A384 I387	D257-C264 CarbonylContact O-C 3.57Å; D257-C264 WeakPolarHBondContact O-CA 3.14Å; D257-K265 HydrophobicContact CB-CB 4.33Å; D257-K265 PolarHBondContact N-O 2.93Å; D257-K265 PolarHBondContact O-N 3.49Å; D257-A384 HydrophobicContact CB-CB 3.98Å; D257-I387 HydrophobicContact CB-CD1 3.85Å
258	P	92.2	Very high	87.4	Confident	8 Å²	8	30.8 Å²	30.8	5%	0.052	15%	0.153	C	C	.	.			trans	-65.4	149.3	-173	28.8	-35.1	0	0	0	111.8	L256 L324 G325 Q328	L256-P258 WeakPolarHBondContact O-CD 3.45Å; P258-L324 HydrophobicContact CG-CD1 4.42Å; P258-G325 WeakPolarHBondContact CG-O 3.31Å; P258-Q328 CarbonylContact C-O 3.49Å; P258-Q328 VanDerWaalsContact C-O 3.25Å; P258-Q328 VanDerWaalsContact O-O 3.13Å
259	G	87.8	Confident	89.6	Confident	9 Å²	9	28.7 Å²	28.7	9%	0.093	13%	0.131	C	C	.	.			trans	-164.3	160.7	177.3	0	0	0	0	0	112.4	Q328	G259-Q328 PolarHBondContact N-O 2.92Å
260	W	82.8	Confident	91.1	Very high	85 Å²	85	28.1 Å²	28.1	32%	0.322	13%	0.128	S	C	.	.	S	Bend	trans	-90	-91.7	179	-62	107	0	0	0	111.3	N262 G263 T286 Q332	W260-N262 PolarHBondContact O-N 3.03Å; W260-N262 VanDerWaalsContact O-N 3.07Å; W260-G263 PolarHBondContact O-N 2.64Å; W260-G263 VanDerWaalsContact O-N 3.1Å; W260-T286 HydrophobicContact CE3-CG2 4.06Å; W260-T286 HydrophobicContact CZ3-CG2 4.43Å; W260-Q332 HydrophobicContact CH2-CB 4.35Å; W260-Q332 HydrophobicContact CH2-CG 3.6Å; W260-Q332 HydrophobicContact CZ2-CG 4.42Å; W260-Q332 HydrophobicContact CZ3-CG 4.22Å
261	R	83.6	Confident	91.7	Very high	172 Å²	172	26.3 Å²	26.3	65%	0.649	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.8	-173.1	-64.3	180	179	-178.3	-1.8	114.6
262	N	85	Confident	91.7	Very high	108 Å²	108	32.1 Å²	32.1	58%	0.578	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106	9.6	-176	-64.6	-18.3	0	0	0	112.6	W260 K265	W260-N262 PolarHBondContact O-N 3.03Å; W260-N262 VanDerWaalsContact O-N 3.07Å; N262-K265 VanDerWaalsContact CB-NZ 3.32Å; N262-K265 WeakPolarHBondContact O-CE 3.36Å; N262-K265 PolarHBondContact O-NZ 3.35Å; N262-K265 VanDerWaalsContact O-NZ 3.11Å
263	G	87	Confident	91.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.			trans	68.4	173.3	-174.6	0	0	0	0	0	113.6	W260 K265	W260-G263 PolarHBondContact O-N 2.64Å; W260-G263 VanDerWaalsContact O-N 3.1Å; G263-K265 PolarHBondContact O-NZ 2.87Å
264	C	92.3	Very high	91.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.7	172.3	175.7	0	0	0	0	108.7	D257 I280 L281 P283	D257-C264 CarbonylContact O-C 3.57Å; D257-C264 WeakPolarHBondContact O-CA 3.14Å; C264-I280 CarbonylContact O-C 3.6Å; C264-I280 WeakPolarHBondContact O-CA 3.1Å; C264-L281 HydrophobicContact CB-CB 4.18Å; C264-L281 PolarHBondContact N-O 3.02Å; C264-L281 PolarHBondContact O-N 3.3Å; C264-P283 HydrophobicContact CB-CG 4.32Å
265	K	95.1	Very high	91.2	Very high	21 Å²	21	37.7 Å²	37.7	9%	0.091	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	144.2	179.4	-63.4	90.6	-162.2	156.2	0	108.6	L256 D257 N262 G263 G279 I280 F381 A384	L256-K265 CarbonylContact C-O 3.59Å; L256-K265 WeakPolarHBondContact CA-O 3.36Å; D257-K265 HydrophobicContact CB-CB 4.33Å; D257-K265 PolarHBondContact N-O 2.93Å; D257-K265 PolarHBondContact O-N 3.49Å; N262-K265 VanDerWaalsContact CB-NZ 3.32Å; N262-K265 WeakPolarHBondContact O-CE 3.36Å; N262-K265 PolarHBondContact O-NZ 3.35Å; N262-K265 VanDerWaalsContact O-NZ 3.11Å; G263-K265 PolarHBondContact O-NZ 2.87Å; K265-G279 WeakPolarHBondContact CA-O 3.48Å; K265-I280 HydrophobicContact CG-CG1 4.48Å; K265-F381 HydrophobicContact CB-CD1 3.98Å; K265-F381 HydrophobicContact CB-CE1 4.3Å; K265-F381 HydrophobicContact CG-CD1 4.08Å; K265-F381 HydrophobicContact CG-CE1 4.11Å; K265-A384 HydrophobicContact CB-CB 4.33Å
266	W	96.8	Very high	91.1	Very high	5 Å²	5	40.8 Å²	40.8	2%	0.019	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.5	174.3	67.5	-93.2	0	0	0	112.1	I254 G255 L256 A268 S277 T278 G279 L281 L310 V313	I254-W266 HydrophobicContact CG2-CB 4.29Å; G255-W266 CarbonylContact O-C 3.57Å; G255-W266 WeakPolarHBondContact O-CA 3.47Å; L256-W266 HydrophobicContact CD2-CB 3.42Å; L256-W266 VanDerWaalsContact CD2-CB 3.42Å; W266-A268 HydrophobicContact CZ3-CB 4.13Å; W266-S277 WeakPolarHBondContact CH2-OG 3.11Å; W266-S277 WeakPolarHBondContact CZ3-O 3.37Å; W266-T278 VanDerWaalsContact O-CA 3.25Å; W266-T278 WeakPolarHBondContact O-CA 3.46Å; W266-G279 VanDerWaalsContact CE2-CA 3.44Å; W266-G279 VanDerWaalsContact CE2-N 3.34Å; W266-G279 PolarHBondContact N-O 3.2Å; W266-G279 VanDerWaalsContact NE1-CA 3.32Å; W266-G279 PolarHBondContact O-N 3.04Å; W266-L281 HydrophobicContact CB-CD1 4.34Å; W266-L281 HydrophobicContact CG-CD1 4.28Å; W266-L310 HydrophobicContact CD2-CD1 3.96Å; W266-L310 HydrophobicContact CE3-CD1 4.01Å; W266-L310 HydrophobicContact CG-CD1 4.31Å; W266-V313 HydrophobicContact CH2-CB 4.36Å; W266-V313 HydrophobicContact CH2-CG1 4.5Å; W266-V313 HydrophobicContact CH2-CG2 3.99Å; W266-V313 HydrophobicContact CZ3-CG1 4.28Å
267	A	97.6	Very high	91.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	126.1	174.1	0	0	0	0	0	110.4	I254 G255 S277 T278 A384 V385	I254-A267 CarbonylContact C-O 3.25Å; I254-A267 WeakPolarHBondContact CA-O 3.44Å; G255-A267 PolarHBondContact N-O 3.48Å; G255-A267 PolarHBondContact O-N 3.49Å; A267-S277 WeakPolarHBondContact CA-O 3.47Å; A267-T278 HydrophobicContact CB-CG2 3.9Å; A267-A384 HydrophobicContact CB-CB 3.9Å; A267-V385 HydrophobicContact CB-CB 4.42Å; A267-V385 HydrophobicContact CB-CG2 3.55Å
268	A	97.5	Very high	91.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.6	172.4	0	0	0	0	0	109.7	I254 W266 L276 S277 V313 I319	I254-A268 HydrophobicContact CD1-CB 3.34Å; W266-A268 HydrophobicContact CZ3-CB 4.13Å; A268-L276 HydrophobicContact CB-CB 4.04Å; A268-L276 PolarHBondContact O-N 3.48Å; A268-S277 PolarHBondContact N-O 3.49Å; A268-V313 HydrophobicContact CB-CG1 3.73Å; A268-I319 HydrophobicContact CB-CD1 4.01Å
269	C	95.1	Very high	91.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.3	176.8	-61.9	0	0	0	0	110.6	P252 V253 N274 A388	P252-C269 CarbonylContact C-O 3.51Å; P252-C269 VanDerWaalsContact CA-O 3.25Å; P252-C269 WeakPolarHBondContact CA-O 3.5Å; P252-C269 WeakPolarHBondContact CB-O 3.31Å; V253-C269 PolarHBondContact N-O 3.12Å; V253-C269 PolarHBondContact O-N 3.18Å; C269-N274 CarbonylContact C-O 3.5Å; C269-N274 VanDerWaalsContact CA-O 3.24Å; C269-N274 WeakPolarHBondContact CA-O 3.47Å; C269-A388 HydrophobicContact CB-CB 4.21Å
270	D	91.3	Very high	91.6	Very high	28 Å²	28	46.3 Å²	46.3	15%	0.15	23%	0.234	C	C	.	.			trans	-71.1	173.4	171.1	80.5	0.1	0	0	0	111.2	H272 G273 N274 L276 Q392	D270-H272 PolarHBondContact O-N 3.36Å; D270-H272 VanDerWaalsContact O-N 3.13Å; D270-H272 WeakPolarHBondContact OD1-CA 3.32Å; D270-H272 WeakPolarHBondContact OD1-CB 2.96Å; D270-H272 PolarHBondContact OD1-N 3.47Å; D270-G273 PolarHBondContact O-N 2.95Å; D270-G273 PolarHBondContact OD1-N 3.41Å; D270-N274 PolarHBondContact N-O 3.43Å; D270-N274 PolarHBondContact OD1-N 3.34Å; D270-N274 PolarHBondContact OD1-ND2 3.12Å; D270-N274 WeakPolarHBondContact OD2-CB 3.49Å; D270-N274 PolarHBondContact OD2-ND2 3.05Å; D270-L276 HydrophobicContact CB-CD1 4.09Å; D270-L276 HydrophobicContact CB-CD2 4.04Å; D270-L276 HydrophobicContact CB-CG 4.09Å; D270-Q392 PolarHBondContact O-NE2 3.34Å
271	P	86.1	Confident	92	Very high	40 Å²	40	42.3 Å²	42.3	26%	0.26	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-33.7	174.6	-35.5	42.5	0	0	0	115.6	R250 G273	R250-P271 HydrophobicContact CB-CB 4.25Å; R250-P271 WeakPolarHBondContact CB-O 3.34Å; R250-P271 WeakPolarHBondContact CD-O 3.39Å; R250-P271 WeakPolarHBondContact O-CB 3.2Å; R250-P271 VanDerWaalsContact O-CG 3.29Å; R250-P271 WeakPolarHBondContact O-CG 3.38Å; P271-G273 VanDerWaalsContact C-N 3.29Å
272	H	82.4	Confident	92.1	Very high	146 Å²	146	36.4 Å²	36.4	68%	0.676	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-5.8	-179.1	-56.8	-64.3	0	0	0	112.9	D270	D270-H272 PolarHBondContact O-N 3.36Å; D270-H272 VanDerWaalsContact O-N 3.13Å; D270-H272 WeakPolarHBondContact OD1-CA 3.32Å; D270-H272 WeakPolarHBondContact OD1-CB 2.96Å; D270-H272 PolarHBondContact OD1-N 3.47Å
273	G	86.9	Confident	92	Very high	4 Å²	4	31.2 Å²	31.2	4%	0.041	17%	0.169	C	C	.	.			trans	86.4	11.3	-177.4	0	0	0	0	0	113.7	D270 P271 R389	D270-G273 PolarHBondContact O-N 2.95Å; D270-G273 PolarHBondContact OD1-N 3.41Å; P271-G273 VanDerWaalsContact C-N 3.29Å; G273-R389 PolarHBondContact O-NE 2.84Å; G273-R389 PolarHBondContact O-NH2 2.97Å
274	N	91.4	Very high	91.4	Very high	90 Å²	90	34 Å²	34	48%	0.481	19%	0.188	S	C	.	.			trans	-71.7	142.9	172.6	-53.9	-55.4	0	0	0	110	C269 D270 L276	C269-N274 CarbonylContact C-O 3.5Å; C269-N274 VanDerWaalsContact CA-O 3.24Å; C269-N274 WeakPolarHBondContact CA-O 3.47Å; D270-N274 PolarHBondContact N-O 3.43Å; D270-N274 PolarHBondContact OD1-N 3.34Å; D270-N274 PolarHBondContact OD1-ND2 3.12Å; D270-N274 WeakPolarHBondContact OD2-CB 3.49Å; D270-N274 PolarHBondContact OD2-ND2 3.05Å; N274-L276 PolarHBondContact O-N 3.48Å
275	V	95.6	Very high	90.3	Very high	50 Å²	50	39.3 Å²	39.3	30%	0.303	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	119	-177.6	-176	0	0	0	0	109.6	T278 L374 V385	V275-T278 HydrophobicContact CG1-CG2 3.69Å; V275-L374 HydrophobicContact CG2-CD2 3.92Å; V275-V385 HydrophobicContact CG1-CG2 4.48Å; V275-V385 HydrophobicContact CG2-CB 4.49Å; V275-V385 HydrophobicContact CG2-CG1 3.9Å; V275-V385 HydrophobicContact CG2-CG2 3.68Å
276	L	95.2	Very high	88.7	Confident	64 Å²	64	38.3 Å²	38.3	34%	0.335	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-46.2	178.5	-64	172.3	0	0	0	111.9	A268 D270 N274 H317 I319	A268-L276 HydrophobicContact CB-CB 4.04Å; A268-L276 PolarHBondContact O-N 3.48Å; D270-L276 HydrophobicContact CB-CD1 4.09Å; D270-L276 HydrophobicContact CB-CD2 4.04Å; D270-L276 HydrophobicContact CB-CG 4.09Å; N274-L276 PolarHBondContact O-N 3.48Å; L276-H317 HydrophobicContact CD1-CB 4.13Å; L276-I319 HydrophobicContact CD1-CD1 4.21Å
277	S	96.2	Very high	86.8	Confident	42 Å²	42	42 Å²	42	29%	0.294	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	158.1	-178.9	-170.7	0	0	0	0	110.6	W266 A267 A268	W266-S277 WeakPolarHBondContact CH2-OG 3.11Å; W266-S277 WeakPolarHBondContact CZ3-O 3.37Å; A267-S277 WeakPolarHBondContact CA-O 3.47Å; A268-S277 PolarHBondContact N-O 3.49Å
278	T	96.6	Very high	84.8	Confident	43 Å²	43	47.6 Å²	47.6	26%	0.264	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.6	178.2	59.9	0	0	0	0	110.8	W266 A267 V275 L377 F381	W266-T278 VanDerWaalsContact O-CA 3.25Å; W266-T278 WeakPolarHBondContact O-CA 3.46Å; A267-T278 HydrophobicContact CB-CG2 3.9Å; V275-T278 HydrophobicContact CG1-CG2 3.69Å; T278-L377 HydrophobicContact CG2-CD1 3.82Å; T278-L377 HydrophobicContact CG2-CD2 4.48Å; T278-F381 HydrophobicContact CG2-CB 4.29Å
279	G	94.7	Very high	82.7	Confident	15 Å²	15	49.5 Å²	49.5	16%	0.155	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	-172.1	174.7	0	0	0	0	0	113.1	K265 W266 F381	K265-G279 WeakPolarHBondContact CA-O 3.48Å; W266-G279 VanDerWaalsContact CE2-CA 3.44Å; W266-G279 VanDerWaalsContact CE2-N 3.34Å; W266-G279 PolarHBondContact N-O 3.2Å; W266-G279 VanDerWaalsContact NE1-CA 3.32Å; W266-G279 PolarHBondContact O-N 3.04Å; G279-F381 WeakPolarHBondContact O-CE1 3.37Å
280	I	93.8	Very high	80.7	Confident	59 Å²	59	50.9 Å²	50.9	30%	0.303	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.8	-179.6	-55.3	177.5	0	0	0	108.5	C264 K265 W282 F381	C264-I280 CarbonylContact O-C 3.6Å; C264-I280 WeakPolarHBondContact O-CA 3.1Å; K265-I280 HydrophobicContact CG-CG1 4.48Å; I280-W282 HydrophobicContact CG2-CD2 4.47Å; I280-W282 HydrophobicContact CG2-CZ2 4.05Å; I280-F381 HydrophobicContact CD1-CE1 4.43Å; I280-F381 HydrophobicContact CD1-CZ 4.23Å; I280-F381 HydrophobicContact CG1-CE1 3.76Å; I280-F381 HydrophobicContact CG1-CZ 3.99Å
281	L	90.9	Very high	78.8	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	143.7	169.9	-68	157	0	0	0	109.6	L256 C264 W266 P283 N305 G306 L307 L310 W336	L256-L281 HydrophobicContact CD2-CD1 3.74Å; C264-L281 HydrophobicContact CB-CB 4.18Å; C264-L281 PolarHBondContact N-O 3.02Å; C264-L281 PolarHBondContact O-N 3.3Å; W266-L281 HydrophobicContact CB-CD1 4.34Å; W266-L281 HydrophobicContact CG-CD1 4.28Å; L281-P283 WeakPolarHBondContact O-CD 3.42Å; L281-N305 WeakPolarHBondContact CA-O 3.45Å; L281-G306 VanDerWaalsContact CD2-C 3.48Å; L281-L307 HydrophobicContact CD2-CB 4.32Å; L281-L307 HydrophobicContact CD2-CD1 4.49Å; L281-L310 HydrophobicContact CD1-CD2 3.8Å; L281-L310 HydrophobicContact CD2-CB 4.2Å; L281-L310 HydrophobicContact CD2-CD2 4.22Å; L281-W336 HydrophobicContact CB-CZ3 4.42Å; L281-W336 HydrophobicContact CD2-CH2 4.27Å; L281-W336 HydrophobicContact CD2-CZ3 4.5Å
282	W	87.2	Confident	76.8	Confident	48 Å²	48	56.8 Å²	56.8	18%	0.182	33%	0.329	C	S	.	.			trans	-118.9	81.3	173.5	-63.5	96.5	0	0	0	109.4	I280 L287 I290 N305	I280-W282 HydrophobicContact CG2-CD2 4.47Å; I280-W282 HydrophobicContact CG2-CZ2 4.05Å; W282-L287 HydrophobicContact CB-CD2 4.16Å; W282-I290 HydrophobicContact CD2-CD1 4.25Å; W282-I290 HydrophobicContact CE3-CD1 3.59Å; W282-I290 HydrophobicContact CE3-CG1 4.26Å; W282-I290 HydrophobicContact CZ3-CD1 3.79Å; W282-I290 HydrophobicContact CZ3-CG1 4.03Å; W282-N305 PolarHBondContact N-O 2.9Å
283	P	82.5	Confident	75.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.336	C	S	.	.			trans	-54.2	144.8	176	-23.1	31.4	0	0	0	110.8	C264 L281 H285 T286 T333 W336	C264-P283 HydrophobicContact CB-CG 4.32Å; L281-P283 WeakPolarHBondContact O-CD 3.42Å; P283-H285 VanDerWaalsContact C-N 3.25Å; P283-H285 PolarHBondContact O-N 2.74Å; P283-T286 HydrophobicContact CB-CG2 4.2Å; P283-T286 HydrophobicContact CG-CG2 4.23Å; P283-T286 WeakPolarHBondContact O-CB 3.46Å; P283-T286 PolarHBondContact O-N 2.96Å; P283-T286 PolarHBondContact O-OG1 3.28Å; P283-T333 HydrophobicContact CG-CG2 4.4Å; P283-W336 HydrophobicContact CB-CD2 3.91Å; P283-W336 HydrophobicContact CB-CE3 3.57Å; P283-W336 HydrophobicContact CB-CG 4.38Å; P283-W336 HydrophobicContact CB-CZ3 4.02Å; P283-W336 HydrophobicContact CG-CD2 4.5Å; P283-W336 HydrophobicContact CG-CE3 3.67Å; P283-W336 HydrophobicContact CG-CZ3 3.79Å
284	P	74.3	Confident	73.2	Confident	59 Å²	59	65.6 Å²	65.6	38%	0.383	37%	0.365	S	S	.	.	H	α-helix	trans	-50.9	-40	-173.6	-29.7	34.7	0	0	0	114.7	T286 L287	P284-T286 PolarHBondContact O-N 2.74Å; P284-L287 WeakPolarHBondContact O-CB 3.38Å; P284-L287 PolarHBondContact O-N 2.94Å
285	H	68.3	Low	71	Confident	110 Å²	110	66 Å²	66	51%	0.509	37%	0.366	S	S	.	.	H	α-helix	trans	-68	-16	178.9	-59.7	-62.6	0	0	0	114.5	P283 Q332	P283-H285 VanDerWaalsContact C-N 3.25Å; P283-H285 PolarHBondContact O-N 2.74Å; H285-Q332 HydrophobicContact CB-CB 4.08Å; H285-Q332 HydrophobicContact CB-CG 4.17Å
286	T	62.3	Low	68.3	Low	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-86.5	-17.5	176.8	67.1	0	0	0	0	112.5	W260 P283 P284 S288 A289	W260-T286 HydrophobicContact CE3-CG2 4.06Å; W260-T286 HydrophobicContact CZ3-CG2 4.43Å; P283-T286 HydrophobicContact CB-CG2 4.2Å; P283-T286 HydrophobicContact CG-CG2 4.23Å; P283-T286 WeakPolarHBondContact O-CB 3.46Å; P283-T286 PolarHBondContact O-N 2.96Å; P283-T286 PolarHBondContact O-OG1 3.28Å; P284-T286 PolarHBondContact O-N 2.74Å; T286-S288 VanDerWaalsContact C-N 3.32Å; T286-S288 PolarHBondContact O-N 2.99Å; T286-A289 PolarHBondContact O-N 2.99Å; T286-A289 VanDerWaalsContact O-N 3.13Å
287	L	57.4	Low	65.8	Low	82 Å²	82	71 Å²	71	43%	0.429	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-34.9	-176.4	-64.7	171.1	0	0	0	112.2	W282 P284 A289 I290	W282-L287 HydrophobicContact CB-CD2 4.16Å; P284-L287 WeakPolarHBondContact O-CB 3.38Å; P284-L287 PolarHBondContact O-N 2.94Å; L287-A289 PolarHBondContact O-N 3.14Å; L287-A289 VanDerWaalsContact O-N 3.12Å; L287-I290 HydrophobicContact CD2-CD1 3.72Å; L287-I290 WeakPolarHBondContact O-CB 3.43Å; L287-I290 PolarHBondContact O-N 2.84Å; L287-I290 VanDerWaalsContact O-N 3.09Å
288	S	55.4	Low	62.9	Low	118 Å²	118	75.4 Å²	75.4	83%	0.825	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16.1	177	-50.4	0	0	0	0	113.6	T286	T286-S288 VanDerWaalsContact C-N 3.32Å; T286-S288 PolarHBondContact O-N 2.99Å
289	A	53.6	Low	59.8	Low	41 Å²	41	81.3 Å²	81.3	34%	0.339	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	0.1	177.8	0	0	0	0	0	113.7	T286 L287	T286-A289 PolarHBondContact O-N 2.99Å; T286-A289 VanDerWaalsContact O-N 3.13Å; L287-A289 PolarHBondContact O-N 3.14Å; L287-A289 VanDerWaalsContact O-N 3.12Å
290	I	53.6	Low	56.9	Low	28 Å²	28	82.8 Å²	82.8	14%	0.144	46%	0.464	C	S	.	.	S	Bend	trans	-88.8	126.1	-177.3	-56.8	177.4	0	0	0	109.7	W282 L287 K294 L295	W282-I290 HydrophobicContact CD2-CD1 4.25Å; W282-I290 HydrophobicContact CE3-CD1 3.59Å; W282-I290 HydrophobicContact CE3-CG1 4.26Å; W282-I290 HydrophobicContact CZ3-CD1 3.79Å; W282-I290 HydrophobicContact CZ3-CG1 4.03Å; L287-I290 HydrophobicContact CD2-CD1 3.72Å; L287-I290 WeakPolarHBondContact O-CB 3.43Å; L287-I290 PolarHBondContact O-N 2.84Å; L287-I290 VanDerWaalsContact O-N 3.09Å; I290-K294 HydrophobicContact CG2-CB 3.97Å; I290-L295 HydrophobicContact CB-CD1 4.23Å; I290-L295 HydrophobicContact CD1-CD1 4.28Å; I290-L295 HydrophobicContact CG2-CD1 3.86Å
291	P	49.8	Very low	53.9	Low	80 Å²	80	85.9 Å²	85.9	52%	0.519	49%	0.488	S	S	.	.			trans	-61.7	136.3	171.9	-18.1	29.5	0	0	0	110.7	K293 K294	P291-K293 PolarHBondContact O-N 2.79Å; P291-K294 PolarHBondContact O-N 2.91Å
292	P	45.8	Very low	51.4	Low	112 Å²	112	95.4 Å²	95.4	73%	0.727	54%	0.535	S	S	*	.	H	α-helix	trans	-56.3	-26.1	-173.5	15.6	-28.3	0	0	0	114.2	K294 L295	P292-K294 VanDerWaalsContact C-N 3.25Å; P292-K294 PolarHBondContact O-N 3.26Å; P292-L295 WeakPolarHBondContact O-CB 3.45Å; P292-L295 PolarHBondContact O-N 2.79Å; P292-L295 VanDerWaalsContact O-N 3.17Å
293	K	46.8	Very low	49.5	Very low	189 Å²	189	97.8 Å²	97.8	82%	0.822	56%	0.559	S	S	*	*	H	α-helix	trans	-64.6	-18.2	175.6	-78.2	-174.9	174.9	-179.1	0	115.3	P291	P291-K293 PolarHBondContact O-N 2.79Å
294	K	46.6	Very low	48.4	Very low	147 Å²	147	102.9 Å²	102.9	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-93.7	-14.2	174.8	-83.9	-172	175.3	-174.5	0	113.3	I290 P291 P292 S296	I290-K294 HydrophobicContact CG2-CB 3.97Å; P291-K294 PolarHBondContact O-N 2.91Å; P292-K294 VanDerWaalsContact C-N 3.25Å; P292-K294 PolarHBondContact O-N 3.26Å; K294-S296 VanDerWaalsContact C-N 3.31Å
295	L	44.7	Very low	48.2	Very low	98 Å²	98	102.6 Å²	102.6	51%	0.513	58%	0.582	S	S	.	*	H	α-helix	trans	-76.1	-20.4	-179.9	-130.7	74.2	0	0	0	112.5	I290 P292	I290-L295 HydrophobicContact CB-CD1 4.23Å; I290-L295 HydrophobicContact CD1-CD1 4.28Å; I290-L295 HydrophobicContact CG2-CD1 3.86Å; P292-L295 WeakPolarHBondContact O-CB 3.45Å; P292-L295 PolarHBondContact O-N 2.79Å; P292-L295 VanDerWaalsContact O-N 3.17Å
296	S	39.2	Very low	48.9	Very low	97 Å²	97	97.9 Å²	97.9	68%	0.678	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-1	-172.1	60.2	0	0	0	0	115.6	K294	K294-S296 VanDerWaalsContact C-N 3.31Å
297	V	41.3	Very low	50.2	Low	122 Å²	122	98.6 Å²	98.6	74%	0.739	57%	0.566	S	S	*	*	S	Bend	trans	-103.3	-4.4	-178.2	-175.8	0	0	0	0	112.5
298	Q	35.7	Very low	51.7	Low	135 Å²	135	96.7 Å²	96.7	63%	0.631	57%	0.567	S	S	*	*	S	Bend	trans	-118.5	118.1	172	-67.5	-175.6	-6.2	0	0	108.5	G300	Q298-G300 PolarHBondContact O-N 3.11Å; Q298-G300 VanDerWaalsContact O-N 3.1Å
299	N	32.1	Very low	53.4	Low	167 Å²	167	93.5 Å²	93.5	89%	0.893	55%	0.548	S	S	*	.	S	Bend	trans	-50	113.6	-177.6	-66.9	-39.2	0	0	0	112.3
300	G	33.1	Very low	55.3	Low	45 Å²	45	91.7 Å²	91.7	46%	0.464	53%	0.532	S	S	.	.			trans	92.6	119.2	162.9	0	0	0	0	0	116.1	Q298 M302	Q298-G300 PolarHBondContact O-N 3.11Å; Q298-G300 VanDerWaalsContact O-N 3.1Å; G300-M302 PolarHBondContact O-N 3.1Å
301	P	30.8	Very low	57.2	Low	124 Å²	124	91.1 Å²	91.1	81%	0.805	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	126.2	164.7	30.4	-29.1	0	0	0	107.2
302	M	39.3	Very low	59.3	Low	201 Å²	201	89.9 Å²	89.9	99%	0.99	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-7.1	-179.1	-67.9	163.1	57.8	0	0	120.4	G300	G300-M302 PolarHBondContact O-N 3.1Å
303	S	47	Very low	61.7	Low	98 Å²	98	85.5 Å²	85.5	69%	0.685	50%	0.498	S	S	*	.	S	Bend	trans	-101.6	-16.8	-172.2	-166.4	0	0	0	0	118.6
304	N	58.4	Low	64	Low	107 Å²	107	76.5 Å²	76.5	57%	0.572	46%	0.458	S	S	*	.			trans	-152	71.5	178.6	-140.8	-9.5	0	0	0	113.7	G306	N304-G306 PolarHBondContact O-N 2.85Å
305	N	71	Confident	66.3	Low	54 Å²	54	73.2 Å²	73.2	29%	0.289	45%	0.445	S	S	.	.	S	Bend	trans	-67.5	15.3	171.1	62.8	-6	0	0	0	114	L281 W282 L307 W336	L281-N305 WeakPolarHBondContact CA-O 3.45Å; W282-N305 PolarHBondContact N-O 2.9Å; N305-L307 PolarHBondContact O-N 3.25Å; N305-L307 WeakPolarHBondContact OD1-CB 3.36Å; N305-L307 PolarHBondContact OD1-N 2.94Å; N305-W336 WeakPolarHBondContact ND2-CZ2 3.34Å
306	G	83.6	Confident	68.7	Low	11 Å²	11	78.2 Å²	78.2	11%	0.113	46%	0.457	C	S	.	.	S	Bend	trans	78.4	-9.3	-172.1	0	0	0	0	0	114.6	L281 N304 G308 A309 L310	L281-G306 VanDerWaalsContact CD2-C 3.48Å; N304-G306 PolarHBondContact O-N 2.85Å; G306-G308 PolarHBondContact O-N 2.75Å; G306-A309 PolarHBondContact O-N 3.15Å; G306-L310 PolarHBondContact O-N 2.96Å; G306-L310 VanDerWaalsContact O-N 3.12Å
307	L	89.1	Confident	71.2	Confident	14 Å²	14	76.9 Å²	76.9	7%	0.073	44%	0.44	C	S	.	.	H	α-helix	trans	-65.7	-39.3	-175.6	-175.4	61.7	0	0	0	111.8	L281 N305 A309 L310 T311 W336 L340 F346	L281-L307 HydrophobicContact CD2-CB 4.32Å; L281-L307 HydrophobicContact CD2-CD1 4.49Å; N305-L307 PolarHBondContact O-N 3.25Å; N305-L307 WeakPolarHBondContact OD1-CB 3.36Å; N305-L307 PolarHBondContact OD1-N 2.94Å; L307-A309 VanDerWaalsContact C-N 3.32Å; L307-A309 PolarHBondContact O-N 2.95Å; L307-L310 HydrophobicContact CD1-CD2 4.35Å; L307-L310 PolarHBondContact O-N 3.17Å; L307-T311 WeakPolarHBondContact O-CB 3.46Å; L307-T311 PolarHBondContact O-N 3.17Å; L307-T311 PolarHBondContact O-OG1 2.86Å; L307-W336 HydrophobicContact CB-CH2 4.42Å; L307-W336 HydrophobicContact CD1-CH2 4.23Å; L307-W336 HydrophobicContact CD2-CH2 4.49Å; L307-W336 HydrophobicContact CD2-CZ2 4.09Å; L307-L340 HydrophobicContact CD1-CD1 3.81Å; L307-L340 HydrophobicContact CD2-CD1 3.89Å; L307-L340 HydrophobicContact CD2-CD2 3.91Å; L307-F346 HydrophobicContact CD1-CE1 4.34Å; L307-F346 HydrophobicContact CD1-CZ 4.37Å
308	G	89.1	Confident	73.6	Confident	43 Å²	43	77 Å²	77	44%	0.443	43%	0.433	S	S	.	.	H	α-helix	trans	-60.2	-41.4	177.4	0	0	0	0	0	112.6	G306 T311 A312	G306-G308 PolarHBondContact O-N 2.75Å; G308-T311 PolarHBondContact O-N 3Å; G308-A312 WeakPolarHBondContact O-CB 3.29Å; G308-A312 PolarHBondContact O-N 2.9Å
309	A	91.2	Very high	76.3	Confident	51 Å²	51	70.6 Å²	70.6	42%	0.421	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-43.3	175.7	0	0	0	0	0	111.8	G306 L307 V313	G306-A309 PolarHBondContact O-N 3.15Å; L307-A309 VanDerWaalsContact C-N 3.32Å; L307-A309 PolarHBondContact O-N 2.95Å; A309-V313 WeakPolarHBondContact O-CG2 3.24Å; A309-V313 PolarHBondContact O-N 2.97Å; A309-V313 VanDerWaalsContact O-N 3.12Å
310	L	93.5	Very high	79.2	Confident	3 Å²	3	66.6 Å²	66.6	2%	0.016	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-51.8	174.9	174.4	67.6	0	0	0	111.1	I254 W266 L281 G306 L307 A312 V313 M314	I254-L310 HydrophobicContact CD1-CD1 4.16Å; I254-L310 HydrophobicContact CG1-CD1 4.13Å; I254-L310 HydrophobicContact CG2-CD1 3.9Å; W266-L310 HydrophobicContact CD2-CD1 3.96Å; W266-L310 HydrophobicContact CE3-CD1 4.01Å; W266-L310 HydrophobicContact CG-CD1 4.31Å; L281-L310 HydrophobicContact CD1-CD2 3.8Å; L281-L310 HydrophobicContact CD2-CB 4.2Å; L281-L310 HydrophobicContact CD2-CD2 4.22Å; G306-L310 PolarHBondContact O-N 2.96Å; G306-L310 VanDerWaalsContact O-N 3.12Å; L307-L310 HydrophobicContact CD1-CD2 4.35Å; L307-L310 PolarHBondContact O-N 3.17Å; L310-A312 VanDerWaalsContact C-N 3.3Å; L310-A312 PolarHBondContact O-N 3.12Å; L310-V313 PolarHBondContact O-N 3.38Å; L310-V313 VanDerWaalsContact O-N 3.17Å; L310-M314 HydrophobicContact CD1-CG 4.07Å; L310-M314 HydrophobicContact CD1-SD 3.98Å; L310-M314 HydrophobicContact CD2-SD 4.14Å; L310-M314 HydrophobicContact CG-CG 4.28Å; L310-M314 HydrophobicContact CG-SD 3.77Å; L310-M314 VanDerWaalsContact O-CG 3.31Å; L310-M314 WeakPolarHBondContact O-CG 3.49Å; L310-M314 PolarHBondContact O-N 3.36Å
311	T	93.9	Very high	81.9	Confident	15 Å²	15	64.6 Å²	64.6	9%	0.092	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-41.3	-179	-58.8	0	0	0	0	111.4	L307 G308 M314 Q315 H345	L307-T311 WeakPolarHBondContact O-CB 3.46Å; L307-T311 PolarHBondContact O-N 3.17Å; L307-T311 PolarHBondContact O-OG1 2.86Å; G308-T311 PolarHBondContact O-N 3Å; T311-M314 PolarHBondContact O-N 3.45Å; T311-Q315 HydrophobicContact CG2-CG 4.49Å; T311-Q315 WeakPolarHBondContact O-CB 3.42Å; T311-Q315 WeakPolarHBondContact O-CG 3.38Å; T311-Q315 PolarHBondContact O-N 3.18Å; T311-H345 PolarHBondContact OG1-NE2 3.16Å
312	A	93.6	Very high	85	Confident	55 Å²	55	58.7 Å²	58.7	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-42.7	176.5	0	0	0	0	0	112.5	G308 L310 R316	G308-A312 WeakPolarHBondContact O-CB 3.29Å; G308-A312 PolarHBondContact O-N 2.9Å; L310-A312 VanDerWaalsContact C-N 3.3Å; L310-A312 PolarHBondContact O-N 3.12Å; A312-R316 VanDerWaalsContact O-CB 3.25Å; A312-R316 WeakPolarHBondContact O-CB 3.42Å; A312-R316 PolarHBondContact O-N 3.19Å
313	V	95.3	Very high	87.6	Confident	19 Å²	19	49.1 Å²	49.1	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-43.1	176.5	169.8	0	0	0	0	111.3	W266 A268 A309 L310 Q315 R316 H317	W266-V313 HydrophobicContact CH2-CB 4.36Å; W266-V313 HydrophobicContact CH2-CG1 4.5Å; W266-V313 HydrophobicContact CH2-CG2 3.99Å; W266-V313 HydrophobicContact CZ3-CG1 4.28Å; A268-V313 HydrophobicContact CB-CG1 3.73Å; A309-V313 WeakPolarHBondContact O-CG2 3.24Å; A309-V313 PolarHBondContact O-N 2.97Å; A309-V313 VanDerWaalsContact O-N 3.12Å; L310-V313 PolarHBondContact O-N 3.38Å; L310-V313 VanDerWaalsContact O-N 3.17Å; V313-Q315 PolarHBondContact O-N 3.13Å; V313-R316 PolarHBondContact O-N 3.31Å; V313-H317 PolarHBondContact O-CD2 3.41Å; V313-H317 PolarHBondContact O-N 3.3Å
314	M	95.6	Very high	89.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-45.5	177.3	-70	177.5	71.6	0	0	111.5	I254 L310 T311 Q318 I319 I322 F346 L349 V351	I254-M314 HydrophobicContact CD1-CG 4.22Å; I254-M314 HydrophobicContact CG1-CG 3.94Å; I254-M314 HydrophobicContact CG1-SD 4.41Å; L310-M314 HydrophobicContact CD1-CG 4.07Å; L310-M314 HydrophobicContact CD1-SD 3.98Å; L310-M314 HydrophobicContact CD2-SD 4.14Å; L310-M314 HydrophobicContact CG-CG 4.28Å; L310-M314 HydrophobicContact CG-SD 3.77Å; L310-M314 VanDerWaalsContact O-CG 3.31Å; L310-M314 WeakPolarHBondContact O-CG 3.49Å; L310-M314 PolarHBondContact O-N 3.36Å; T311-M314 PolarHBondContact O-N 3.45Å; M314-Q318 CarbonylContact O-C 3.57Å; M314-Q318 WeakPolarHBondContact O-CA 3.34Å; M314-Q318 PolarHBondContact O-N 3.38Å; M314-I319 VanDerWaalsContact CE-O 3.24Å; M314-I319 WeakPolarHBondContact CE-O 3.32Å; M314-I319 PolarHBondContact O-N 2.99Å; M314-I322 HydrophobicContact CE-CD1 3.88Å; M314-I322 HydrophobicContact CE-CG1 4.12Å; M314-I322 HydrophobicContact SD-CD1 4.34Å; M314-F346 HydrophobicContact CE-CD1 4.13Å; M314-F346 HydrophobicContact CE-CE1 4.32Å; M314-F346 HydrophobicContact SD-CD1 3.99Å; M314-F346 HydrophobicContact SD-CE1 3.81Å; M314-L349 HydrophobicContact CB-CD1 3.82Å; M314-V351 HydrophobicContact CE-CB 4.37Å; M314-V351 HydrophobicContact CE-CG1 3.92Å; M314-V351 HydrophobicContact CE-CG2 3.44Å; M314-V351 VanDerWaalsContact CE-CG2 3.44Å
315	Q	94.2	Very high	91.5	Very high	78 Å²	78	39.5 Å²	39.5	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-66.4	-43.4	177.3	-73.2	176.3	-17	0	0	112.1	T311 V313 H317 Q318 K347 L349	T311-Q315 HydrophobicContact CG2-CG 4.49Å; T311-Q315 WeakPolarHBondContact O-CB 3.42Å; T311-Q315 WeakPolarHBondContact O-CG 3.38Å; T311-Q315 PolarHBondContact O-N 3.18Å; V313-Q315 PolarHBondContact O-N 3.13Å; Q315-H317 VanDerWaalsContact C-N 3.31Å; Q315-H317 PolarHBondContact O-N 2.96Å; Q315-Q318 PolarHBondContact O-N 2.88Å; Q315-Q318 PolarHBondContact O-NE2 3.21Å; Q315-K347 PolarHBondContact NE2-O 2.99Å; Q315-L349 HydrophobicContact CG-CD1 4.09Å
316	R	95.1	Very high	92.3	Very high	203 Å²	203	39.8 Å²	39.8	77%	0.766	22%	0.215	S	C	*	.	H	α-helix	trans	-60.2	-39.2	179.6	-178.7	176.8	-178.1	146.9	2.2	112.9	A312 V313	A312-R316 VanDerWaalsContact O-CB 3.25Å; A312-R316 WeakPolarHBondContact O-CB 3.42Å; A312-R316 PolarHBondContact O-N 3.19Å; V313-R316 PolarHBondContact O-N 3.31Å
317	H	92.8	Very high	92.4	Very high	69 Å²	69	40.3 Å²	40.3	32%	0.319	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	10.2	-175.8	-65.8	-78.6	0	0	0	113.6	L276 V313 Q315 I319	L276-H317 HydrophobicContact CD1-CB 4.13Å; V313-H317 PolarHBondContact O-CD2 3.41Å; V313-H317 PolarHBondContact O-N 3.3Å; Q315-H317 VanDerWaalsContact C-N 3.31Å; Q315-H317 PolarHBondContact O-N 2.96Å; H317-I319 VanDerWaalsContact C-N 3.28Å; H317-I319 HydrophobicContact CB-CD1 3.83Å; H317-I319 HydrophobicContact CB-CG1 3.68Å; H317-I319 PolarHBondContact O-N 3.49Å
318	Q	91.9	Very high	92.2	Very high	126 Å²	126	46.7 Å²	46.7	59%	0.589	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	45	-178.9	-59	-65.3	-28.3	0	0	113	M314 Q315 E320 L349	M314-Q318 CarbonylContact O-C 3.57Å; M314-Q318 WeakPolarHBondContact O-CA 3.34Å; M314-Q318 PolarHBondContact O-N 3.38Å; Q315-Q318 PolarHBondContact O-N 2.88Å; Q315-Q318 PolarHBondContact O-NE2 3.21Å; Q318-E320 PolarHBondContact O-N 3.16Å; Q318-L349 VanDerWaalsContact OE1-CD2 3.25Å
319	I	92.6	Very high	92	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.			trans	-90.3	108.4	-176.8	-48.1	-175.4	0	0	0	110	P252 I254 A268 L276 M314 H317	P252-I319 HydrophobicContact CB-CD1 4.28Å; P252-I319 HydrophobicContact CB-CG1 3.96Å; P252-I319 HydrophobicContact CB-CG2 4.41Å; P252-I319 HydrophobicContact CG-CG1 4.21Å; I254-I319 HydrophobicContact CD1-CD1 3.75Å; I254-I319 HydrophobicContact CD1-CG2 4.24Å; I254-I319 HydrophobicContact CG1-CB 4.49Å; I254-I319 HydrophobicContact CG1-CG2 3.87Å; A268-I319 HydrophobicContact CB-CD1 4.01Å; L276-I319 HydrophobicContact CD1-CD1 4.21Å; M314-I319 VanDerWaalsContact CE-O 3.24Å; M314-I319 WeakPolarHBondContact CE-O 3.32Å; M314-I319 PolarHBondContact O-N 2.99Å; H317-I319 VanDerWaalsContact C-N 3.28Å; H317-I319 HydrophobicContact CB-CD1 3.83Å; H317-I319 HydrophobicContact CB-CG1 3.68Å; H317-I319 PolarHBondContact O-N 3.49Å
320	E	91.3	Very high	91.8	Very high	82 Å²	82	43.4 Å²	43.4	38%	0.383	22%	0.217	S	C	.	.			trans	-98.6	-7.2	179.8	-58.2	-166.3	136.5	0	0	113.6	Q318 L349 N350 V351 R352	Q318-E320 PolarHBondContact O-N 3.16Å; E320-L349 HydrophobicContact CG-CB 4.39Å; E320-L349 HydrophobicContact CG-CD2 4.21Å; E320-N350 PolarHBondContact OE1-N 2.72Å; E320-N350 VanDerWaalsContact OE1-N 3.14Å; E320-V351 WeakPolarHBondContact O-CA 3.45Å; E320-R352 PolarHBondContact O-N 3.5Å
321	T	91.5	Very high	91.1	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.025	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.1	-171.7	-57.7	0	0	0	0	112.5	L220 V253 I254 L391 F663	L220-T321 HydrophobicContact CD2-CG2 3.82Å; V253-T321 HydrophobicContact CG2-CG2 4.18Å; I254-T321 PolarHBondContact N-O 2.83Å; T321-L391 HydrophobicContact CG2-CD2 3.69Å; T321-F663 HydrophobicContact CG2-CE1 3.78Å; T321-F663 HydrophobicContact CG2-CZ 4.31Å
322	I	94.9	Very high	90.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129	177.7	-57.2	175.1	0	0	0	110.6	I254 L256 M314 L337 V351 R352 Y353 A354	I254-I322 HydrophobicContact CB-CG1 4.15Å; I254-I322 HydrophobicContact CB-CG2 4.49Å; I254-I322 HydrophobicContact CG2-CG2 4.5Å; I254-I322 CarbonylContact O-C 3.56Å; I254-I322 WeakPolarHBondContact O-CA 3.5Å; L256-I322 HydrophobicContact CD1-CG2 3.55Å; L256-I322 HydrophobicContact CG-CG2 3.67Å; M314-I322 HydrophobicContact CE-CD1 3.88Å; M314-I322 HydrophobicContact CE-CG1 4.12Å; M314-I322 HydrophobicContact SD-CD1 4.34Å; I322-L337 HydrophobicContact CB-CD2 4.36Å; I322-L337 HydrophobicContact CD1-CD1 3.7Å; I322-L337 HydrophobicContact CD1-CD2 4.08Å; I322-L337 HydrophobicContact CD1-CG 4.46Å; I322-L337 HydrophobicContact CG2-CD2 3.92Å; I322-V351 HydrophobicContact CD1-CG1 3.57Å; I322-V351 HydrophobicContact CG1-CG1 4.13Å; I322-R352 PolarHBondContact N-O 2.89Å; I322-Y353 CarbonylContact O-C 3.56Å; I322-Y353 WeakPolarHBondContact O-CA 3.11Å; I322-Y353 WeakPolarHBondContact O-CB 2.71Å; I322-A354 PolarHBondContact O-N 3.21Å
323	A	94.7	Very high	90.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.5	168.6	0	0	0	0	0	109.6	V253 I254 G255 L256 V356 I387 L391	V253-A323 HydrophobicContact CG1-CB 3.87Å; I254-A323 PolarHBondContact O-N 3.13Å; G255-A323 CarbonylContact C-O 3.58Å; G255-A323 WeakPolarHBondContact CA-O 3.41Å; L256-A323 PolarHBondContact N-O 2.6Å; A323-V356 HydrophobicContact CB-CG2 3.92Å; A323-I387 HydrophobicContact CB-CG2 3.79Å; A323-L391 HydrophobicContact CB-CB 3.84Å; A323-L391 HydrophobicContact CB-CD2 3.65Å; A323-L391 HydrophobicContact CB-CG 4.36Å
324	L	93.7	Very high	89.9	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.5	177.6	175.7	62.5	0	0	0	110.7	L256 P258 T333 G334 Y353 A354 V355 V356	L256-L324 HydrophobicContact CB-CD1 3.91Å; L256-L324 HydrophobicContact CD1-CD1 4.26Å; P258-L324 HydrophobicContact CG-CD1 4.42Å; L324-T333 HydrophobicContact CD1-CG2 3.76Å; L324-G334 VanDerWaalsContact CD2-CA 3.43Å; L324-Y353 HydrophobicContact CB-CD2 4.36Å; L324-Y353 HydrophobicContact CD2-CD2 4.31Å; L324-Y353 HydrophobicContact CD2-CE2 4.26Å; L324-A354 PolarHBondContact N-O 3.48Å; L324-V355 CarbonylContact O-C 3.37Å; L324-V355 WeakPolarHBondContact O-CA 3.41Å; L324-V356 PolarHBondContact O-N 2.88Å
325	G	92.3	Very high	89.2	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	143.8	172.5	0	0	0	0	0	112.3	L256 P258 S330 V356	L256-G325 PolarHBondContact O-N 2.85Å; P258-G325 WeakPolarHBondContact CG-O 3.31Å; G325-S330 WeakPolarHBondContact O-CB 3.42Å; G325-V356 CarbonylContact C-O 3.54Å; G325-V356 WeakPolarHBondContact CA-O 3.48Å
326	N	88.5	Confident	88.8	Confident	59 Å²	59	44.4 Å²	44.4	32%	0.316	21%	0.211	S	C	.	.	S	Bend	trans	-95.3	16.7	-173	74.3	-20.4	0	0	0	115.9	V355 V356 S357 E358	N326-V355 HydrophobicContact CB-CG1 3.56Å; N326-V356 PolarHBondContact N-O 3.04Å; N326-S357 WeakPolarHBondContact OD1-CA 3.22Å; N326-E358 PolarHBondContact OD1-N 2.9Å
327	G	85.7	Confident	88.5	Confident	22 Å²	22	35 Å²	35	23%	0.227	18%	0.176	C	C	.	.	S	Bend	trans	-99.3	-136.8	179.6	0	0	0	0	0	115.1	G329 S330 E358	G327-G329 PolarHBondContact O-N 3.46Å; G327-S330 WeakPolarHBondContact O-CB 3.41Å; G327-S330 PolarHBondContact O-N 3.23Å; G327-S330 VanDerWaalsContact O-N 3.15Å; G327-S330 PolarHBondContact O-OG 3.36Å; G327-E358 VanDerWaalsContact CA-OE1 3.27Å; G327-E358 WeakPolarHBondContact CA-OE1 3.42Å; G327-E358 WeakPolarHBondContact CA-OE2 3.19Å; G327-E358 PolarHBondContact N-OE2 3.22Å
328	Q	85.1	Confident	88.1	Confident	149 Å²	149	31.8 Å²	31.8	70%	0.696	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	119.8	-165.3	-67.8	-166.3	-8.7	0	0	112	P258 G259 S330	P258-Q328 CarbonylContact C-O 3.49Å; P258-Q328 VanDerWaalsContact C-O 3.25Å; P258-Q328 VanDerWaalsContact O-O 3.13Å; G259-Q328 PolarHBondContact N-O 2.92Å; Q328-S330 VanDerWaalsContact C-N 3.3Å
329	G	83.8	Confident	87.8	Confident	6 Å²	6	31.8 Å²	31.8	6%	0.062	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	1.7	-178.4	0	0	0	0	0	114	G327 R331 Q332 T333	G327-G329 PolarHBondContact O-N 3.46Å; G329-R331 VanDerWaalsContact C-N 3.29Å; G329-R331 PolarHBondContact O-N 2.92Å; G329-Q332 PolarHBondContact O-N 3.34Å; G329-T333 WeakPolarHBondContact O-CB 3.28Å; G329-T333 PolarHBondContact O-N 3.49Å; G329-T333 PolarHBondContact O-OG1 3Å
330	S	87.8	Confident	87.6	Confident	18 Å²	18	32.2 Å²	32.2	13%	0.126	16%	0.159	C	C	.	.	H	α-helix	trans	-55.9	-43.5	177.6	57.7	0	0	0	0	111.9	G325 G327 Q328 T333 G334	G325-S330 WeakPolarHBondContact O-CB 3.42Å; G327-S330 WeakPolarHBondContact O-CB 3.41Å; G327-S330 PolarHBondContact O-N 3.23Å; G327-S330 VanDerWaalsContact O-N 3.15Å; G327-S330 PolarHBondContact O-OG 3.36Å; Q328-S330 VanDerWaalsContact C-N 3.3Å; S330-T333 CarbonylContact O-C 3.54Å; S330-T333 PolarHBondContact O-N 3.4Å; S330-G334 PolarHBondContact O-N 2.65Å
331	R	78.1	Confident	87.5	Confident	72 Å²	72	29.4 Å²	29.4	27%	0.272	15%	0.146	S	C	.	.	H	α-helix	trans	-61.2	-51.3	-178	-59	-176.5	-178.7	177	0.8	112.9	G329 T333 G334 S335 E698 E699	G329-R331 VanDerWaalsContact C-N 3.29Å; G329-R331 PolarHBondContact O-N 2.92Å; R331-T333 VanDerWaalsContact C-N 3.29Å; R331-T333 PolarHBondContact O-N 3.35Å; R331-G334 PolarHBondContact O-N 3.18Å; R331-S335 WeakPolarHBondContact O-CB 3.5Å; R331-S335 PolarHBondContact O-N 2.89Å; R331-E698 HydrophobicContact CB-CB 4.43Å; R331-E698 HydrophobicContact CB-CG 4.38Å; R331-E698 HydrophobicContact CG-CB 3.98Å; R331-E698 HydrophobicContact CG-CG 4.44Å; R331-E698 PolarHBondContact NE-O 2.65Å; R331-E698 PolarHBondContact NH2-O 3.28Å; R331-E699 VanDerWaalsContact CZ-CD 3.47Å; R331-E699 IonicContact CZ-OE1 3.48Å; R331-E699 IonicContact CZ-OE2 3.5Å; R331-E699 IonicContact NH1-OE1 3.13Å; R331-E699 PolarHBondContact NH1-OE1 3.36Å; R331-E699 IonicContact NH2-OE1 2.95Å; R331-E699 PolarHBondContact NH2-OE1 3.25Å; R331-E699 IonicContact NH2-OE2 3.05Å; R331-E699 PolarHBondContact NH2-OE2 3.44Å
332	Q	82.9	Confident	87.1	Confident	60 Å²	60	35.3 Å²	35.3	28%	0.28	17%	0.174	S	C	.	.	H	α-helix	trans	-65.5	-38.4	179.4	-65.3	77.2	11.5	0	0	110.7	W260 H285 G329 W336	W260-Q332 HydrophobicContact CH2-CB 4.35Å; W260-Q332 HydrophobicContact CH2-CG 3.6Å; W260-Q332 HydrophobicContact CZ2-CG 4.42Å; W260-Q332 HydrophobicContact CZ3-CG 4.22Å; H285-Q332 HydrophobicContact CB-CB 4.08Å; H285-Q332 HydrophobicContact CB-CG 4.17Å; G329-Q332 PolarHBondContact O-N 3.34Å; Q332-W336 VanDerWaalsContact O-CB 3.25Å; Q332-W336 WeakPolarHBondContact O-CB 3.44Å; Q332-W336 PolarHBondContact O-N 2.68Å; Q332-W336 VanDerWaalsContact O-N 3.08Å
333	T	88.2	Confident	86.8	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-42.5	176.1	-54.6	0	0	0	0	111.3	L256 P283 L324 G329 S330 R331 W336 L337	L256-T333 HydrophobicContact CD1-CG2 4.38Å; P283-T333 HydrophobicContact CG-CG2 4.4Å; L324-T333 HydrophobicContact CD1-CG2 3.76Å; G329-T333 WeakPolarHBondContact O-CB 3.28Å; G329-T333 PolarHBondContact O-N 3.49Å; G329-T333 PolarHBondContact O-OG1 3Å; S330-T333 CarbonylContact O-C 3.54Å; S330-T333 PolarHBondContact O-N 3.4Å; R331-T333 VanDerWaalsContact C-N 3.29Å; R331-T333 PolarHBondContact O-N 3.35Å; T333-W336 PolarHBondContact O-N 2.91Å; T333-L337 VanDerWaalsContact O-CB 3.3Å; T333-L337 WeakPolarHBondContact O-CB 3.33Å; T333-L337 PolarHBondContact O-N 3.4Å
334	G	87.1	Confident	86.5	Confident	6 Å²	6	44.9 Å²	44.9	6%	0.062	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-44.6	179.3	0	0	0	0	0	112.8	L324 S330 R331 W336 L337 A338	L324-G334 VanDerWaalsContact CD2-CA 3.43Å; S330-G334 PolarHBondContact O-N 2.65Å; R331-G334 PolarHBondContact O-N 3.18Å; G334-W336 VanDerWaalsContact C-N 3.31Å; G334-W336 PolarHBondContact O-N 3.27Å; G334-L337 PolarHBondContact O-N 3.43Å; G334-A338 VanDerWaalsContact O-CB 3.31Å; G334-A338 WeakPolarHBondContact O-CB 3.26Å; G334-A338 PolarHBondContact O-N 3.43Å
335	S	81.5	Confident	86.2	Confident	29 Å²	29	48.3 Å²	48.3	20%	0.203	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-42.9	174	-173.6	0	0	0	0	111.4	R331 Y339	R331-S335 WeakPolarHBondContact O-CB 3.5Å; R331-S335 PolarHBondContact O-N 2.89Å; S335-Y339 WeakPolarHBondContact O-CB 3.45Å; S335-Y339 PolarHBondContact O-N 2.94Å
336	W	85.8	Confident	86.1	Confident	24 Å²	24	48.5 Å²	48.5	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-44.2	174.8	-179.9	55.7	0	0	0	112.4	L281 P283 N305 L307 Q332 T333 G334 A338 Y339 L340	L281-W336 HydrophobicContact CB-CZ3 4.42Å; L281-W336 HydrophobicContact CD2-CH2 4.27Å; L281-W336 HydrophobicContact CD2-CZ3 4.5Å; P283-W336 HydrophobicContact CB-CD2 3.91Å; P283-W336 HydrophobicContact CB-CE3 3.57Å; P283-W336 HydrophobicContact CB-CG 4.38Å; P283-W336 HydrophobicContact CB-CZ3 4.02Å; P283-W336 HydrophobicContact CG-CD2 4.5Å; P283-W336 HydrophobicContact CG-CE3 3.67Å; P283-W336 HydrophobicContact CG-CZ3 3.79Å; N305-W336 WeakPolarHBondContact ND2-CZ2 3.34Å; L307-W336 HydrophobicContact CB-CH2 4.42Å; L307-W336 HydrophobicContact CD1-CH2 4.23Å; L307-W336 HydrophobicContact CD2-CH2 4.49Å; L307-W336 HydrophobicContact CD2-CZ2 4.09Å; Q332-W336 VanDerWaalsContact O-CB 3.25Å; Q332-W336 WeakPolarHBondContact O-CB 3.44Å; Q332-W336 PolarHBondContact O-N 2.68Å; Q332-W336 VanDerWaalsContact O-N 3.08Å; T333-W336 PolarHBondContact O-N 2.91Å; G334-W336 VanDerWaalsContact C-N 3.31Å; G334-W336 PolarHBondContact O-N 3.27Å; W336-A338 PolarHBondContact O-N 2.94Å; W336-Y339 WeakPolarHBondContact O-CB 3.47Å; W336-Y339 PolarHBondContact O-N 3.48Å; W336-L340 HydrophobicContact CD2-CD1 4.1Å; W336-L340 HydrophobicContact CE3-CD1 4.42Å; W336-L340 HydrophobicContact CH2-CD1 4.23Å; W336-L340 HydrophobicContact CZ2-CD1 3.86Å; W336-L340 HydrophobicContact CZ3-CD1 4.49Å; W336-L340 WeakPolarHBondContact O-CG 3.17Å; W336-L340 PolarHBondContact O-N 2.95Å
337	L	88.9	Confident	86.1	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-44.4	178.2	-178.8	60.5	0	0	0	112.1	L256 I322 T333 G334 L340 I341 F346 Y353	L256-L337 HydrophobicContact CD1-CD2 4.1Å; I322-L337 HydrophobicContact CB-CD2 4.36Å; I322-L337 HydrophobicContact CD1-CD1 3.7Å; I322-L337 HydrophobicContact CD1-CD2 4.08Å; I322-L337 HydrophobicContact CD1-CG 4.46Å; I322-L337 HydrophobicContact CG2-CD2 3.92Å; T333-L337 VanDerWaalsContact O-CB 3.3Å; T333-L337 WeakPolarHBondContact O-CB 3.33Å; T333-L337 PolarHBondContact O-N 3.4Å; G334-L337 PolarHBondContact O-N 3.43Å; L337-L340 WeakPolarHBondContact O-CB 3.39Å; L337-L340 PolarHBondContact O-N 2.98Å; L337-I341 HydrophobicContact CG-CD1 4.2Å; L337-I341 WeakPolarHBondContact O-CG1 3.37Å; L337-I341 PolarHBondContact O-N 3.32Å; L337-F346 HydrophobicContact CD1-CE2 4.08Å; L337-F346 HydrophobicContact CD1-CZ 4.03Å; L337-Y353 HydrophobicContact CD2-CD1 4.01Å; L337-Y353 HydrophobicContact CD2-CD2 4.17Å; L337-Y353 HydrophobicContact CD2-CG 3.65Å; L337-Y353 HydrophobicContact CG-CD1 4.29Å; L337-Y353 HydrophobicContact CG-CG 4.42Å
338	A	84	Confident	86.4	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-35.9	178.6	0	0	0	0	0	112.3	G334 W336 I341 Q342 Y353 V667	G334-A338 VanDerWaalsContact O-CB 3.31Å; G334-A338 WeakPolarHBondContact O-CB 3.26Å; G334-A338 PolarHBondContact O-N 3.43Å; W336-A338 PolarHBondContact O-N 2.94Å; A338-I341 PolarHBondContact O-N 3.3Å; A338-Q342 WeakPolarHBondContact O-CB 3.25Å; A338-Q342 PolarHBondContact O-N 3.3Å; A338-Y353 HydrophobicContact CB-CE1 3.86Å; A338-V667 HydrophobicContact CB-CB 4.5Å; A338-V667 HydrophobicContact CB-CG2 3.24Å
339	Y	85.3	Confident	86.6	Confident	127 Å²	127	49.5 Å²	49.5	50%	0.498	24%	0.242	S	C	.	.	H	α-helix	trans	-59.1	-45.9	168.2	169.4	-101.5	0	0	0	111.7	S335 W336 I341 Q342 I343	S335-Y339 WeakPolarHBondContact O-CB 3.45Å; S335-Y339 PolarHBondContact O-N 2.94Å; W336-Y339 WeakPolarHBondContact O-CB 3.47Å; W336-Y339 PolarHBondContact O-N 3.48Å; Y339-I341 VanDerWaalsContact C-N 3.32Å; Y339-I341 PolarHBondContact O-N 3.41Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Y339-I343 HydrophobicContact CD1-CD1 4.43Å; Y339-I343 HydrophobicContact CD2-CG2 4.11Å; Y339-I343 HydrophobicContact CE1-CD1 3.82Å; Y339-I343 HydrophobicContact CE1-CG2 4.34Å; Y339-I343 HydrophobicContact CE2-CG2 3.61Å; Y339-I343 WeakPolarHBondContact O-CG1 3.49Å; Y339-I343 PolarHBondContact O-N 3.47Å
340	L	88.8	Confident	86.8	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-39.9	177.4	-68.8	174.1	0	0	0	112.6	L307 W336 L337 I343 Q344 H345 F346	L307-L340 HydrophobicContact CD1-CD1 3.81Å; L307-L340 HydrophobicContact CD2-CD1 3.89Å; L307-L340 HydrophobicContact CD2-CD2 3.91Å; W336-L340 HydrophobicContact CD2-CD1 4.1Å; W336-L340 HydrophobicContact CE3-CD1 4.42Å; W336-L340 HydrophobicContact CH2-CD1 4.23Å; W336-L340 HydrophobicContact CZ2-CD1 3.86Å; W336-L340 HydrophobicContact CZ3-CD1 4.49Å; W336-L340 WeakPolarHBondContact O-CG 3.17Å; W336-L340 PolarHBondContact O-N 2.95Å; L337-L340 WeakPolarHBondContact O-CB 3.39Å; L337-L340 PolarHBondContact O-N 2.98Å; L340-I343 HydrophobicContact CD2-CD1 4.28Å; L340-I343 WeakPolarHBondContact O-CG1 3.17Å; L340-Q344 PolarHBondContact O-N 3.44Å; L340-H345 HydrophobicContact CB-CB 4.24Å; L340-H345 HydrophobicContact CD2-CB 4.21Å; L340-H345 WeakPolarHBondContact O-CB 3.49Å; L340-H345 PolarHBondContact O-N 2.91Å; L340-F346 HydrophobicContact CB-CE2 3.71Å; L340-F346 HydrophobicContact CB-CZ 4.2Å; L340-F346 HydrophobicContact CD1-CE2 4.5Å; L340-F346 HydrophobicContact CD1-CZ 4.18Å
341	I	87.9	Confident	86.8	Confident	24 Å²	24	53 Å²	53	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-46.4	174.9	-67.3	165.4	0	0	0	110.3	L337 A338 Y339 I343 Q344 F346 V351 Y353	L337-I341 HydrophobicContact CG-CD1 4.2Å; L337-I341 WeakPolarHBondContact O-CG1 3.37Å; L337-I341 PolarHBondContact O-N 3.32Å; A338-I341 PolarHBondContact O-N 3.3Å; Y339-I341 VanDerWaalsContact C-N 3.32Å; Y339-I341 PolarHBondContact O-N 3.41Å; I341-I343 PolarHBondContact O-N 3.17Å; I341-Q344 WeakPolarHBondContact O-CA 3.36Å; I341-Q344 PolarHBondContact O-N 3.19Å; I341-F346 HydrophobicContact CG1-CD2 4.17Å; I341-F346 HydrophobicContact CG1-CE2 4.1Å; I341-V351 HydrophobicContact CD1-CG1 4.15Å; I341-V351 HydrophobicContact CG1-CB 4.34Å; I341-V351 HydrophobicContact CG1-CG1 4.12Å; I341-Y353 HydrophobicContact CD1-CD1 3.71Å; I341-Y353 HydrophobicContact CD1-CE1 4.32Å
342	Q	84.7	Confident	87.3	Confident	128 Å²	128	51.3 Å²	51.3	60%	0.598	25%	0.252	S	S	*	.	H	α-helix	trans	-61.7	-39.7	-179.3	-174.5	178.6	0.5	0	0	112.8	A338 Y339 Q344	A338-Q342 WeakPolarHBondContact O-CB 3.25Å; A338-Q342 PolarHBondContact O-N 3.3Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Q342-Q344 PolarHBondContact O-N 3.42Å
343	I	87.9	Confident	87.6	Confident	85 Å²	85	49.4 Å²	49.4	44%	0.436	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5	175.4	70.1	170.7	0	0	0	113.3	Y339 L340 I341 H345	Y339-I343 HydrophobicContact CD1-CD1 4.43Å; Y339-I343 HydrophobicContact CD2-CG2 4.11Å; Y339-I343 HydrophobicContact CE1-CD1 3.82Å; Y339-I343 HydrophobicContact CE1-CG2 4.34Å; Y339-I343 HydrophobicContact CE2-CG2 3.61Å; Y339-I343 WeakPolarHBondContact O-CG1 3.49Å; Y339-I343 PolarHBondContact O-N 3.47Å; L340-I343 HydrophobicContact CD2-CD1 4.28Å; L340-I343 WeakPolarHBondContact O-CG1 3.17Å; I341-I343 PolarHBondContact O-N 3.17Å; I343-H345 VanDerWaalsContact C-N 3.29Å; I343-H345 HydrophobicContact CD1-CB 4.38Å; I343-H345 HydrophobicContact CG1-CB 4.16Å; I343-H345 PolarHBondContact O-N 2.93Å
344	Q	87.6	Confident	87.5	Confident	115 Å²	115	49.4 Å²	49.4	54%	0.537	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	31.6	177.5	-55	177.7	-11.9	0	0	114.2	L340 I341 Q342 F346 K347	L340-Q344 PolarHBondContact O-N 3.44Å; I341-Q344 WeakPolarHBondContact O-CA 3.36Å; I341-Q344 PolarHBondContact O-N 3.19Å; Q342-Q344 PolarHBondContact O-N 3.42Å; Q344-F346 PolarHBondContact O-N 3.32Å; Q344-F346 VanDerWaalsContact O-N 3.15Å; Q344-K347 HydrophobicContact CB-CD 3.91Å; Q344-K347 HydrophobicContact CB-CG 4.09Å; Q344-K347 PolarHBondContact O-N 3.13Å
345	H	88.6	Confident	87.5	Confident	75 Å²	75	51.2 Å²	51.2	35%	0.347	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.6	-179.1	179.5	82.1	0	0	0	113.1	T311 L340 I343	T311-H345 PolarHBondContact OG1-NE2 3.16Å; L340-H345 HydrophobicContact CB-CB 4.24Å; L340-H345 HydrophobicContact CD2-CB 4.21Å; L340-H345 WeakPolarHBondContact O-CB 3.49Å; L340-H345 PolarHBondContact O-N 2.91Å; I343-H345 VanDerWaalsContact C-N 3.29Å; I343-H345 HydrophobicContact CD1-CB 4.38Å; I343-H345 HydrophobicContact CG1-CB 4.16Å; I343-H345 PolarHBondContact O-N 2.93Å
346	F	90.4	Very high	87.9	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.022	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	4.8	-173.9	-59.7	-74.7	0	0	0	115.2	L307 M314 L337 L340 I341 Q344 L349 V351	L307-F346 HydrophobicContact CD1-CE1 4.34Å; L307-F346 HydrophobicContact CD1-CZ 4.37Å; M314-F346 HydrophobicContact CE-CD1 4.13Å; M314-F346 HydrophobicContact CE-CE1 4.32Å; M314-F346 HydrophobicContact SD-CD1 3.99Å; M314-F346 HydrophobicContact SD-CE1 3.81Å; L337-F346 HydrophobicContact CD1-CE2 4.08Å; L337-F346 HydrophobicContact CD1-CZ 4.03Å; L340-F346 HydrophobicContact CB-CE2 3.71Å; L340-F346 HydrophobicContact CB-CZ 4.2Å; L340-F346 HydrophobicContact CD1-CE2 4.5Å; L340-F346 HydrophobicContact CD1-CZ 4.18Å; I341-F346 HydrophobicContact CG1-CD2 4.17Å; I341-F346 HydrophobicContact CG1-CE2 4.1Å; Q344-F346 PolarHBondContact O-N 3.32Å; Q344-F346 VanDerWaalsContact O-N 3.15Å; F346-L349 VanDerWaalsContact O-CB 3.31Å; F346-L349 WeakPolarHBondContact O-CB 3.33Å; F346-L349 PolarHBondContact O-N 2.66Å; F346-V351 HydrophobicContact CB-CB 4.07Å; F346-V351 HydrophobicContact CB-CG2 3.34Å; F346-V351 HydrophobicContact CD1-CG2 4.19Å; F346-V351 HydrophobicContact CD2-CB 3.9Å; F346-V351 HydrophobicContact CD2-CG1 4.09Å; F346-V351 HydrophobicContact CD2-CG2 3.95Å; F346-V351 HydrophobicContact CE2-CG1 4.33Å; F346-V351 HydrophobicContact CG-CB 4.08Å; F346-V351 HydrophobicContact CG-CG1 4.46Å; F346-V351 HydrophobicContact CG-CG2 3.58Å
347	K	87.8	Confident	88	Confident	124 Å²	124	51.2 Å²	51.2	54%	0.539	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	140.5	178.4	-87.2	-176.9	166.8	-179.4	0	111.5	Q315 Q344	Q315-K347 PolarHBondContact NE2-O 2.99Å; Q344-K347 HydrophobicContact CB-CD 3.91Å; Q344-K347 HydrophobicContact CB-CG 4.09Å; Q344-K347 PolarHBondContact O-N 3.13Å
348	P	91.8	Very high	88.1	Confident	114 Å²	114	53.2 Å²	53.2	74%	0.74	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	cis	-82.4	-0.3	9	34.3	-36.8	0	0	0	115.7
349	L	89.2	Confident	88.4	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	28%	0.279	C	S	.	.	S	Bend	trans	-71.5	141.6	-176.8	-57.1	171.7	0	0	0	112.2	M314 Q315 Q318 E320 F346 V351	M314-L349 HydrophobicContact CB-CD1 3.82Å; Q315-L349 HydrophobicContact CG-CD1 4.09Å; Q318-L349 VanDerWaalsContact OE1-CD2 3.25Å; E320-L349 HydrophobicContact CG-CB 4.39Å; E320-L349 HydrophobicContact CG-CD2 4.21Å; F346-L349 VanDerWaalsContact O-CB 3.31Å; F346-L349 WeakPolarHBondContact O-CB 3.33Å; F346-L349 PolarHBondContact O-N 2.66Å; L349-V351 HydrophobicContact CB-CG2 3.92Å; L349-V351 PolarHBondContact O-N 3.27Å
350	N	88.2	Confident	88.6	Confident	94 Å²	94	50 Å²	50	50%	0.503	26%	0.262	S	S	.	.			trans	-92.3	76.2	172.8	-170.2	12.9	0	0	0	111.1	E320	E320-N350 PolarHBondContact OE1-N 2.72Å; E320-N350 VanDerWaalsContact OE1-N 3.14Å
351	V	89.3	Confident	88.8	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.03	26%	0.261	C	S	.	.			trans	-72.4	131.9	-172.2	177.1	0	0	0	0	112.4	M314 E320 I322 I341 F346 L349	M314-V351 HydrophobicContact CE-CB 4.37Å; M314-V351 HydrophobicContact CE-CG1 3.92Å; M314-V351 HydrophobicContact CE-CG2 3.44Å; M314-V351 VanDerWaalsContact CE-CG2 3.44Å; E320-V351 WeakPolarHBondContact O-CA 3.45Å; I322-V351 HydrophobicContact CD1-CG1 3.57Å; I322-V351 HydrophobicContact CG1-CG1 4.13Å; I341-V351 HydrophobicContact CD1-CG1 4.15Å; I341-V351 HydrophobicContact CG1-CB 4.34Å; I341-V351 HydrophobicContact CG1-CG1 4.12Å; F346-V351 HydrophobicContact CB-CB 4.07Å; F346-V351 HydrophobicContact CB-CG2 3.34Å; F346-V351 HydrophobicContact CD1-CG2 4.19Å; F346-V351 HydrophobicContact CD2-CB 3.9Å; F346-V351 HydrophobicContact CD2-CG1 4.09Å; F346-V351 HydrophobicContact CD2-CG2 3.95Å; F346-V351 HydrophobicContact CE2-CG1 4.33Å; F346-V351 HydrophobicContact CG-CB 4.08Å; F346-V351 HydrophobicContact CG-CG1 4.46Å; F346-V351 HydrophobicContact CG-CG2 3.58Å; L349-V351 HydrophobicContact CB-CG2 3.92Å; L349-V351 PolarHBondContact O-N 3.27Å
352	R	87.4	Confident	89	Confident	35 Å²	35	52.6 Å²	52.6	13%	0.132	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.7	171.2	60.6	-177.8	-179.2	168.1	-0.6	110.6	E320 I322 F663	E320-R352 PolarHBondContact O-N 3.5Å; I322-R352 PolarHBondContact N-O 2.89Å; R352-F663 HydrophobicContact CB-CB 4.49Å; R352-F663 HydrophobicContact CB-CD1 4.22Å; R352-F663 HydrophobicContact CG-CD1 3.83Å; R352-F663 HydrophobicContact CG-CE1 4.31Å; R352-F663 HydrophobicContact CG-CG 4.43Å
353	Y	89.4	Confident	89.4	Confident	21 Å²	21	50.6 Å²	50.6	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.9	174.7	78.4	-81	0	0	0	112.7	I322 L324 L337 A338 I341 V355 F663 H664	I322-Y353 CarbonylContact O-C 3.56Å; I322-Y353 WeakPolarHBondContact O-CA 3.11Å; I322-Y353 WeakPolarHBondContact O-CB 2.71Å; L324-Y353 HydrophobicContact CB-CD2 4.36Å; L324-Y353 HydrophobicContact CD2-CD2 4.31Å; L324-Y353 HydrophobicContact CD2-CE2 4.26Å; L337-Y353 HydrophobicContact CD2-CD1 4.01Å; L337-Y353 HydrophobicContact CD2-CD2 4.17Å; L337-Y353 HydrophobicContact CD2-CG 3.65Å; L337-Y353 HydrophobicContact CG-CD1 4.29Å; L337-Y353 HydrophobicContact CG-CG 4.42Å; A338-Y353 HydrophobicContact CB-CE1 3.86Å; I341-Y353 HydrophobicContact CD1-CD1 3.71Å; I341-Y353 HydrophobicContact CD1-CE1 4.32Å; Y353-V355 HydrophobicContact CE2-CG2 4.25Å; Y353-F663 CarbonylContact O-C 3.59Å; Y353-F663 VanDerWaalsContact O-CA 3.32Å; Y353-F663 WeakPolarHBondContact O-CA 3.35Å; Y353-H664 HydrophobicContact CD1-CB 4.18Å; Y353-H664 VanDerWaalsContact CD1-O 3.23Å; Y353-H664 WeakPolarHBondContact CD1-O 3.37Å; Y353-H664 HydrophobicContact CE1-CB 3.52Å; Y353-H664 WeakPolarHBondContact CE1-O 3.34Å; Y353-H664 HydrophobicContact CE2-CB 4.11Å; Y353-H664 VanDerWaalsContact CZ-CB 3.48Å; Y353-H664 PolarHBondContact N-O 3.14Å; Y353-H664 PolarHBondContact O-N 2.79Å
354	A	86.9	Confident	89.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.1	172.5	0	0	0	0	0	109.4	I322 L324 L391 P661 F663	I322-A354 PolarHBondContact O-N 3.21Å; L324-A354 PolarHBondContact N-O 3.48Å; A354-L391 HydrophobicContact CB-CD1 4.21Å; A354-L391 HydrophobicContact CB-CD2 4.34Å; A354-P661 HydrophobicContact CB-CB 3.87Å; A354-P661 HydrophobicContact CB-CG 4.03Å; A354-F663 HydrophobicContact CB-CD1 3.8Å; A354-F663 HydrophobicContact CB-CE1 3.67Å; A354-F663 HydrophobicContact CB-CZ 4.31Å
355	V	86.5	Confident	90	Very high	45 Å²	45	41.7 Å²	41.7	27%	0.273	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.5	170.8	-179.9	0	0	0	0	108.7	L324 N326 Y353	L324-V355 CarbonylContact O-C 3.37Å; L324-V355 WeakPolarHBondContact O-CA 3.41Å; N326-V355 HydrophobicContact CB-CG1 3.56Å; Y353-V355 HydrophobicContact CE2-CG2 4.25Å
356	V	89.5	Confident	90.3	Very high	14 Å²	14	41.5 Å²	41.5	9%	0.085	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	138.3	-176.1	178.6	0	0	0	0	108.7	A323 L324 G325 N326 E358 I387 R390 L391	A323-V356 HydrophobicContact CB-CG2 3.92Å; L324-V356 PolarHBondContact O-N 2.88Å; G325-V356 CarbonylContact C-O 3.54Å; G325-V356 WeakPolarHBondContact CA-O 3.48Å; N326-V356 PolarHBondContact N-O 3.04Å; V356-E358 PolarHBondContact O-N 3.43Å; V356-I387 HydrophobicContact CB-CG2 4.31Å; V356-R390 HydrophobicContact CG1-CB 4.07Å; V356-R390 HydrophobicContact CG1-CG 3.95Å; V356-L391 HydrophobicContact CG2-CB 4.14Å; V356-L391 HydrophobicContact CG2-CD1 4.21Å
357	S	88.2	Confident	90.5	Very high	38 Å²	38	42.1 Å²	42.1	27%	0.266	24%	0.244	S	C	.	.			trans	-57.4	126.8	174.9	175.2	0	0	0	0	110.4	N326 C359 R390	N326-S357 WeakPolarHBondContact OD1-CA 3.22Å; S357-C359 VanDerWaalsContact C-N 3.31Å; S357-C359 WeakPolarHBondContact OG-CB 3.37Å; S357-C359 PolarHBondContact OG-N 3.06Å; S357-C359 PolarHBondContact OG-SG 2.88Å; S357-C359 VanDerWaalsContact OG-SG 3.39Å; S357-R390 WeakPolarHBondContact O-CD 3.32Å; S357-R390 VanDerWaalsContact O-CZ 3.29Å; S357-R390 PolarHBondContact O-NH1 2.86Å
358	E	90.5	Very high	90.8	Very high	48 Å²	48	45.1 Å²	45.1	22%	0.224	26%	0.257	C	S	.	.			trans	-89.2	1.2	171.2	72.4	174.4	-141.6	0	0	112.4	N326 G327 V356 G360 A361 I387	N326-E358 PolarHBondContact OD1-N 2.9Å; G327-E358 VanDerWaalsContact CA-OE1 3.27Å; G327-E358 WeakPolarHBondContact CA-OE1 3.42Å; G327-E358 WeakPolarHBondContact CA-OE2 3.19Å; G327-E358 PolarHBondContact N-OE2 3.22Å; V356-E358 PolarHBondContact O-N 3.43Å; E358-G360 PolarHBondContact O-N 2.89Å; E358-G360 VanDerWaalsContact O-N 3.17Å; E358-A361 WeakPolarHBondContact O-CB 3.36Å; E358-A361 PolarHBondContact O-N 2.92Å; E358-I387 HydrophobicContact CB-CD1 4.28Å
359	C	89.9	Confident	90.8	Very high	46 Å²	46	42.6 Å²	42.6	31%	0.311	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	126.6	-177.3	-67.2	0	0	0	0	110.5	S357 A361 R390 H405 L406	S357-C359 VanDerWaalsContact C-N 3.31Å; S357-C359 WeakPolarHBondContact OG-CB 3.37Å; S357-C359 PolarHBondContact OG-N 3.06Å; S357-C359 PolarHBondContact OG-SG 2.88Å; S357-C359 VanDerWaalsContact OG-SG 3.39Å; C359-A361 VanDerWaalsContact C-N 3.26Å; C359-A361 PolarHBondContact O-N 3.04Å; C359-R390 PolarHBondContact O-NH1 3.44Å; C359-R390 PolarHBondContact O-NH2 2.87Å; C359-H405 CarbonylContact C-O 3.47Å; C359-H405 VanDerWaalsContact C-O 3.31Å; C359-L406 WeakPolarHBondContact CB-O 3.44Å
360	G	90.6	Very high	91	Very high	14 Å²	14	42 Å²	42	14%	0.144	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	-8	-178.2	0	0	0	0	0	116.1	E358 S362 Y363 Y364 L401 H405	E358-G360 PolarHBondContact O-N 2.89Å; E358-G360 VanDerWaalsContact O-N 3.17Å; G360-S362 VanDerWaalsContact C-N 3.34Å; G360-S362 PolarHBondContact O-N 3.09Å; G360-Y363 PolarHBondContact O-N 3.17Å; G360-Y364 WeakPolarHBondContact O-CB 3.49Å; G360-Y364 PolarHBondContact O-N 2.84Å; G360-L401 WeakPolarHBondContact O-CD2 3.42Å; G360-H405 WeakPolarHBondContact CA-O 3.13Å; G360-H405 PolarHBondContact N-O 3.45Å; G360-H405 VanDerWaalsContact N-O 3.16Å
361	A	92.7	Very high	91.3	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.017	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-41.3	-179.5	0	0	0	0	0	112.3	E358 C359 Y363 Y364 S365	E358-A361 WeakPolarHBondContact O-CB 3.36Å; E358-A361 PolarHBondContact O-N 2.92Å; C359-A361 VanDerWaalsContact C-N 3.26Å; C359-A361 PolarHBondContact O-N 3.04Å; A361-Y363 VanDerWaalsContact C-N 3.31Å; A361-Y363 PolarHBondContact O-N 3.28Å; A361-Y364 PolarHBondContact O-N 2.84Å; A361-S365 PolarHBondContact O-N 3.46Å; A361-S365 PolarHBondContact O-OG 2.9Å
362	S	91.9	Very high	91.4	Very high	85 Å²	85	45.9 Å²	45.9	59%	0.594	27%	0.266	S	S	*	.	H	α-helix	trans	-66.6	-28.2	173.9	-71.4	0	0	0	0	113.7	G360 S365	G360-S362 VanDerWaalsContact C-N 3.34Å; G360-S362 PolarHBondContact O-N 3.09Å; S362-S365 PolarHBondContact O-OG 3.38Å
363	Y	92.8	Very high	91.6	Very high	86 Å²	86	47.5 Å²	47.5	34%	0.337	28%	0.275	S	S	.	.	H	α-helix	trans	-78.6	-42.7	175.7	-173.2	-95.3	0	0	0	110.6	G360 A361 S365 A366 S367 E402 H405	G360-Y363 PolarHBondContact O-N 3.17Å; A361-Y363 VanDerWaalsContact C-N 3.31Å; A361-Y363 PolarHBondContact O-N 3.28Å; Y363-S365 VanDerWaalsContact C-N 3.34Å; Y363-S365 PolarHBondContact O-N 2.99Å; Y363-A366 PolarHBondContact O-N 2.87Å; Y363-S367 PolarHBondContact O-N 2.99Å; Y363-S367 VanDerWaalsContact O-N 3.1Å; Y363-E402 HydrophobicContact CE1-CB 4.35Å; Y363-E402 HydrophobicContact CE1-CG 3.8Å; Y363-E402 VanDerWaalsContact CE1-OE1 3.3Å; Y363-E402 WeakPolarHBondContact CE1-OE1 3.35Å; Y363-E402 VanDerWaalsContact CZ-CD 3.47Å; Y363-E402 VanDerWaalsContact CZ-OE1 3.32Å; Y363-E402 PolarHBondContact OH-OE1 3.37Å; Y363-E402 PolarHBondContact OH-OE2 2.68Å; Y363-H405 AromaticContact CD1-CD2 3.59Å; Y363-H405 AromaticContact CD2-CD2 3.66Å; Y363-H405 AromaticContact CD2-NE2 3.42Å; Y363-H405 WeakPolarHBondContact CD2-NE2 3.31Å; Y363-H405 AromaticContact CE1-CD2 3.94Å; Y363-H405 AromaticContact CE2-NE2 3.6Å; Y363-H405 AromaticContact CG-CD2 3.42Å; Y363-H405 VanDerWaalsContact CG-CD2 3.42Å; Y363-H405 AromaticContact CG-NE2 3.73Å
364	Y	94.9	Very high	91.9	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-55.9	-48.3	173.4	166.4	-102.1	0	0	0	111.2	G360 A361 A366 S367 V369 A370 E373 K400	G360-Y364 WeakPolarHBondContact O-CB 3.49Å; G360-Y364 PolarHBondContact O-N 2.84Å; A361-Y364 PolarHBondContact O-N 2.84Å; Y364-A366 PolarHBondContact O-N 2.9Å; Y364-A366 VanDerWaalsContact O-N 3.16Å; Y364-S367 WeakPolarHBondContact O-CB 3.16Å; Y364-S367 PolarHBondContact O-N 3.18Å; Y364-S367 PolarHBondContact O-OG 3.41Å; Y364-V369 HydrophobicContact CE2-CG1 4.49Å; Y364-A370 HydrophobicContact CD1-CB 4.25Å; Y364-A370 HydrophobicContact CD2-CB 4.09Å; Y364-A370 HydrophobicContact CE1-CB 3.92Å; Y364-A370 HydrophobicContact CE2-CB 3.72Å; Y364-A370 HydrophobicContact CG-CB 4.34Å; Y364-A370 WeakPolarHBondContact O-CB 3.35Å; Y364-E373 PolarHBondContact OH-OE2 2.83Å; Y364-K400 HydrophobicContact CD2-CB 4.28Å; Y364-K400 HydrophobicContact CD2-CD 4.41Å; Y364-K400 HydrophobicContact CE2-CB 4.41Å; Y364-K400 HydrophobicContact CE2-CD 3.79Å
365	S	94.5	Very high	92.2	Very high	12 Å²	12	51.4 Å²	51.4	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-56.4	-36.1	-177.1	62.1	0	0	0	0	113.6	A361 S362 Y363 V379 R382	A361-S365 PolarHBondContact O-N 3.46Å; A361-S365 PolarHBondContact O-OG 2.9Å; S362-S365 PolarHBondContact O-OG 3.38Å; Y363-S365 VanDerWaalsContact C-N 3.34Å; Y363-S365 PolarHBondContact O-N 2.99Å; S365-V379 WeakPolarHBondContact CB-O 3.3Å; S365-R382 VanDerWaalsContact O-CD 3.25Å; S365-R382 WeakPolarHBondContact O-CD 3.49Å; S365-R382 PolarHBondContact O-NH1 3.22Å; S365-R382 VanDerWaalsContact O-NH1 3.07Å
366	A	94.5	Very high	92.5	Very high	70 Å²	70	57 Å²	57	58%	0.579	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.3	176.5	0	0	0	0	0	114.2	Y363 Y364	Y363-A366 PolarHBondContact O-N 2.87Å; Y364-A366 PolarHBondContact O-N 2.9Å; Y364-A366 VanDerWaalsContact O-N 3.16Å
367	S	94.3	Very high	92.7	Very high	18 Å²	18	57.7 Å²	57.7	13%	0.126	33%	0.333	C	S	.	.	S	Bend	trans	-77	157.4	-177.1	77.6	0	0	0	0	112.6	Y363 Y364 V369 A370 C371	Y363-S367 PolarHBondContact O-N 2.99Å; Y363-S367 VanDerWaalsContact O-N 3.1Å; Y364-S367 WeakPolarHBondContact O-CB 3.16Å; Y364-S367 PolarHBondContact O-N 3.18Å; Y364-S367 PolarHBondContact O-OG 3.41Å; S367-V369 PolarHBondContact O-N 3.02Å; S367-V369 PolarHBondContact OG-N 3.4Å; S367-A370 PolarHBondContact O-N 2.97Å; S367-A370 PolarHBondContact OG-N 2.76Å; S367-C371 PolarHBondContact O-N 3.36Å; S367-C371 VanDerWaalsContact O-N 3.08Å; S367-C371 PolarHBondContact O-SG 3.33Å; S367-C371 VanDerWaalsContact O-SG 3.37Å
368	K	93	Very high	92.9	Very high	187 Å²	187	60.3 Å²	60.3	81%	0.813	34%	0.344	S	S	*	.	H	α-helix	trans	-61.3	-31.8	173.1	-63.9	-178.4	-178.2	178.6	0	112.5	C371 T372	K368-C371 PolarHBondContact O-N 2.85Å; K368-T372 PolarHBondContact O-N 3.34Å; K368-T372 VanDerWaalsContact O-N 3.11Å; K368-T372 PolarHBondContact O-OG1 3.13Å
369	V	92.3	Very high	93.1	Very high	62 Å²	62	61.1 Å²	61.1	38%	0.376	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-51.2	177.9	-179.4	0	0	0	0	109.4	Y364 S367 C371 T372 E373	Y364-V369 HydrophobicContact CE2-CG1 4.49Å; S367-V369 PolarHBondContact O-N 3.02Å; S367-V369 PolarHBondContact OG-N 3.4Å; V369-C371 PolarHBondContact O-N 3.36Å; V369-T372 PolarHBondContact O-N 3.02Å; V369-T372 VanDerWaalsContact O-N 3.09Å; V369-E373 WeakPolarHBondContact O-CB 3.41Å; V369-E373 PolarHBondContact O-N 3.39Å
370	A	93.9	Very high	93.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-34.8	178.7	0	0	0	0	0	113.1	Y364 S367 T372 E373 L374	Y364-A370 HydrophobicContact CD1-CB 4.25Å; Y364-A370 HydrophobicContact CD2-CB 4.09Å; Y364-A370 HydrophobicContact CE1-CB 3.92Å; Y364-A370 HydrophobicContact CE2-CB 3.72Å; Y364-A370 HydrophobicContact CG-CB 4.34Å; Y364-A370 WeakPolarHBondContact O-CB 3.35Å; S367-A370 PolarHBondContact O-N 2.97Å; S367-A370 PolarHBondContact OG-N 2.76Å; A370-T372 PolarHBondContact O-N 2.99Å; A370-E373 PolarHBondContact O-N 3.07Å; A370-L374 PolarHBondContact O-N 3.07Å
371	C	94.1	Very high	93.4	Very high	61 Å²	61	62.1 Å²	62.1	41%	0.412	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-32.5	172.8	-68.4	0	0	0	0	113	S367 K368 V369 P375 R382	S367-C371 PolarHBondContact O-N 3.36Å; S367-C371 VanDerWaalsContact O-N 3.08Å; S367-C371 PolarHBondContact O-SG 3.33Å; S367-C371 VanDerWaalsContact O-SG 3.37Å; K368-C371 PolarHBondContact O-N 2.85Å; V369-C371 PolarHBondContact O-N 3.36Å; C371-P375 WeakPolarHBondContact O-CA 3.37Å; C371-R382 PolarHBondContact SG-NH1 3.33Å
372	T	92.4	Very high	93.6	Very high	119 Å²	119	62.8 Å²	62.8	73%	0.73	36%	0.355	S	S	*	.	H	α-helix	trans	-81	-36.5	179	-51.3	0	0	0	0	111.1	K368 V369 A370	K368-T372 PolarHBondContact O-N 3.34Å; K368-T372 VanDerWaalsContact O-N 3.11Å; K368-T372 PolarHBondContact O-OG1 3.13Å; V369-T372 PolarHBondContact O-N 3.02Å; V369-T372 VanDerWaalsContact O-N 3.09Å; A370-T372 PolarHBondContact O-N 2.99Å
373	E	91.4	Very high	93.7	Very high	68 Å²	68	58.8 Å²	58.8	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-77.9	-36.8	-177.8	-169.7	175.1	170.2	0	0	112.9	Y364 V369 A370 R389 K400	Y364-E373 PolarHBondContact OH-OE2 2.83Å; V369-E373 WeakPolarHBondContact O-CB 3.41Å; V369-E373 PolarHBondContact O-N 3.39Å; A370-E373 PolarHBondContact O-N 3.07Å; E373-R389 VanDerWaalsContact CD-NH1 3.34Å; E373-R389 IonicContact OE1-CZ 2.7Å; E373-R389 VanDerWaalsContact OE1-CZ 3.28Å; E373-R389 IonicContact OE1-NH1 3.9Å; E373-R389 PolarHBondContact OE1-NH1 2.64Å; E373-R389 IonicContact OE1-NH2 3.22Å; E373-R389 IonicContact OE2-NH1 2.92Å; E373-K400 VanDerWaalsContact CD-NZ 3.31Å; E373-K400 IonicContact OE1-NZ 2.81Å; E373-K400 PolarHBondContact OE1-NZ 2.73Å; E373-K400 IonicContact OE2-NZ 3.77Å; E373-K400 PolarHBondContact OE2-NZ 3Å
374	L	94.2	Very high	93.9	Very high	19 Å²	19	54.7 Å²	54.7	10%	0.099	31%	0.312	C	S	.	.			trans	-133.1	63.8	-173.7	-59	170.7	0	0	0	110.6	V275 A370 D376 L377 R382 V385	V275-L374 HydrophobicContact CG2-CD2 3.92Å; A370-L374 PolarHBondContact O-N 3.07Å; L374-D376 VanDerWaalsContact C-N 3.34Å; L374-D376 PolarHBondContact O-N 3.12Å; L374-L377 HydrophobicContact CB-CB 4.09Å; L374-L377 HydrophobicContact CD1-CD2 4.18Å; L374-L377 PolarHBondContact O-N 3.18Å; L374-R382 HydrophobicContact CB-CG 4.41Å; L374-R382 HydrophobicContact CD1-CG 4.14Å; L374-R382 PolarHBondContact O-NE 3.36Å; L374-R382 PolarHBondContact O-NH2 3.28Å; L374-R382 VanDerWaalsContact O-NH2 3.14Å; L374-V385 HydrophobicContact CD1-CB 4.19Å; L374-V385 HydrophobicContact CD1-CG1 3.89Å; L374-V385 HydrophobicContact CD1-CG2 4.3Å
375	P	93.4	Very high	94.1	Very high	84 Å²	84	54.7 Å²	54.7	55%	0.545	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-37.9	-173.7	25.6	-34.1	0	0	0	112.8	C371 L377	C371-P375 WeakPolarHBondContact O-CA 3.37Å; P375-L377 VanDerWaalsContact C-N 3.31Å; P375-L377 PolarHBondContact O-N 3.09Å
376	D	93.5	Very high	94.1	Very high	164 Å²	164	54.1 Å²	54.1	88%	0.877	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.4	-175.3	-56	-45.3	0	0	0	113.4	L374	L374-D376 VanDerWaalsContact C-N 3.34Å; L374-D376 PolarHBondContact O-N 3.12Å
377	L	93.7	Very high	94.2	Very high	28 Å²	28	50.8 Å²	50.8	15%	0.147	28%	0.28	C	S	.	.	S	Bend	trans	-97.8	131.1	-177.7	-167.5	67.1	0	0	0	111.4	T278 L374 P375 F381 R382 V385	T278-L377 HydrophobicContact CG2-CD1 3.82Å; T278-L377 HydrophobicContact CG2-CD2 4.48Å; L374-L377 HydrophobicContact CB-CB 4.09Å; L374-L377 HydrophobicContact CD1-CD2 4.18Å; L374-L377 PolarHBondContact O-N 3.18Å; P375-L377 VanDerWaalsContact C-N 3.31Å; P375-L377 PolarHBondContact O-N 3.09Å; L377-F381 HydrophobicContact CD1-CB 3.79Å; L377-F381 HydrophobicContact CD1-CD2 4.13Å; L377-F381 HydrophobicContact CD1-CG 4.27Å; L377-F381 HydrophobicContact CD2-CB 3.83Å; L377-F381 HydrophobicContact CG-CB 3.81Å; L377-R382 HydrophobicContact CD2-CG 4.09Å; L377-R382 HydrophobicContact CG-CG 4.4Å; L377-R382 PolarHBondContact O-NE 2.63Å; L377-R382 PolarHBondContact O-NH2 3.2Å; L377-R382 VanDerWaalsContact O-NH2 3.1Å; L377-V385 HydrophobicContact CD2-CG2 3.7Å
378	D	92.9	Very high	94.3	Very high	92 Å²	92	49.9 Å²	49.9	49%	0.492	27%	0.274	S	S	.	.			trans	-59.4	146.5	174.7	178.9	71.4	0	0	0	111.8	S380 F381	D378-S380 PolarHBondContact O-N 3.24Å; D378-S380 VanDerWaalsContact O-N 3.09Å; D378-S380 WeakPolarHBondContact OD2-CB 3.47Å; D378-S380 PolarHBondContact OD2-N 3.34Å; D378-S380 PolarHBondContact OD2-OG 2.82Å; D378-F381 HydrophobicContact CB-CD2 3.95Å; D378-F381 HydrophobicContact CB-CE2 4.28Å; D378-F381 PolarHBondContact O-N 3.46Å
379	V	94	Very high	94.4	Very high	66 Å²	66	42.3 Å²	42.3	40%	0.4	24%	0.24	S	C	.	.	H	α-helix	trans	-54.6	-33.6	-176.9	178.7	0	0	0	0	111.8	S365 F381 R382	S365-V379 WeakPolarHBondContact CB-O 3.3Å; V379-F381 VanDerWaalsContact C-N 3.31Å; V379-F381 PolarHBondContact O-N 3.22Å; V379-R382 PolarHBondContact O-N 3.27Å
380	S	91.6	Very high	94.4	Very high	46 Å²	46	39.9 Å²	39.9	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-68.2	-24.7	-178.6	67.2	0	0	0	0	114.5	D378	D378-S380 PolarHBondContact O-N 3.24Å; D378-S380 VanDerWaalsContact O-N 3.09Å; D378-S380 WeakPolarHBondContact OD2-CB 3.47Å; D378-S380 PolarHBondContact OD2-N 3.34Å; D378-S380 PolarHBondContact OD2-OG 2.82Å
381	F	95.5	Very high	94.3	Very high	34 Å²	34	40.3 Å²	40.3	15%	0.149	23%	0.227	C	C	.	.	H	α-helix	trans	-92.5	-21.8	179.7	-61.7	-67.9	0	0	0	113.2	K265 T278 G279 I280 L377 D378 V379 G383 A384 V385	K265-F381 HydrophobicContact CB-CD1 3.98Å; K265-F381 HydrophobicContact CB-CE1 4.3Å; K265-F381 HydrophobicContact CG-CD1 4.08Å; K265-F381 HydrophobicContact CG-CE1 4.11Å; T278-F381 HydrophobicContact CG2-CB 4.29Å; G279-F381 WeakPolarHBondContact O-CE1 3.37Å; I280-F381 HydrophobicContact CD1-CE1 4.43Å; I280-F381 HydrophobicContact CD1-CZ 4.23Å; I280-F381 HydrophobicContact CG1-CE1 3.76Å; I280-F381 HydrophobicContact CG1-CZ 3.99Å; L377-F381 HydrophobicContact CD1-CB 3.79Å; L377-F381 HydrophobicContact CD1-CD2 4.13Å; L377-F381 HydrophobicContact CD1-CG 4.27Å; L377-F381 HydrophobicContact CD2-CB 3.83Å; L377-F381 HydrophobicContact CG-CB 3.81Å; D378-F381 HydrophobicContact CB-CD2 3.95Å; D378-F381 HydrophobicContact CB-CE2 4.28Å; D378-F381 PolarHBondContact O-N 3.46Å; V379-F381 VanDerWaalsContact C-N 3.31Å; V379-F381 PolarHBondContact O-N 3.22Å; F381-G383 PolarHBondContact O-N 3.07Å; F381-A384 WeakPolarHBondContact O-CB 3.35Å; F381-A384 PolarHBondContact O-N 3.44Å; F381-A384 VanDerWaalsContact O-N 3.07Å; F381-V385 PolarHBondContact O-N 3.31Å; F381-V385 VanDerWaalsContact O-N 3.14Å
382	R	96.6	Very high	94.1	Very high	16 Å²	16	37.6 Å²	37.6	6%	0.06	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-29.2	-179.9	-62.8	173.3	-171.4	-176.9	-5.9	112.7	S365 C371 L374 L377 V379 V385 S386	S365-R382 VanDerWaalsContact O-CD 3.25Å; S365-R382 WeakPolarHBondContact O-CD 3.49Å; S365-R382 PolarHBondContact O-NH1 3.22Å; S365-R382 VanDerWaalsContact O-NH1 3.07Å; C371-R382 PolarHBondContact SG-NH1 3.33Å; L374-R382 HydrophobicContact CB-CG 4.41Å; L374-R382 HydrophobicContact CD1-CG 4.14Å; L374-R382 PolarHBondContact O-NE 3.36Å; L374-R382 PolarHBondContact O-NH2 3.28Å; L374-R382 VanDerWaalsContact O-NH2 3.14Å; L377-R382 HydrophobicContact CD2-CG 4.09Å; L377-R382 HydrophobicContact CG-CG 4.4Å; L377-R382 PolarHBondContact O-NE 2.63Å; L377-R382 PolarHBondContact O-NH2 3.2Å; L377-R382 VanDerWaalsContact O-NH2 3.1Å; V379-R382 PolarHBondContact O-N 3.27Å; R382-V385 PolarHBondContact O-N 3.48Å; R382-S386 PolarHBondContact O-N 3.12Å
383	G	95.2	Very high	93.9	Very high	2 Å²	2	32.3 Å²	32.3	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-48.2	172.6	0	0	0	0	0	112.1	F381 V385 S386 I387	F381-G383 PolarHBondContact O-N 3.07Å; G383-V385 VanDerWaalsContact C-N 3.33Å; G383-V385 PolarHBondContact O-N 3.34Å; G383-S386 WeakPolarHBondContact O-CB 3.46Å; G383-S386 PolarHBondContact O-N 3.47Å; G383-S386 VanDerWaalsContact O-N 3.12Å; G383-I387 WeakPolarHBondContact O-CG1 3.36Å; G383-I387 PolarHBondContact O-N 3.03Å
384	A	96.9	Very high	93.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-38.8	176.5	0	0	0	0	0	112.4	D257 K265 A267 F381 S386 I387 A388	D257-A384 HydrophobicContact CB-CB 3.98Å; K265-A384 HydrophobicContact CB-CB 4.33Å; A267-A384 HydrophobicContact CB-CB 3.9Å; F381-A384 WeakPolarHBondContact O-CB 3.35Å; F381-A384 PolarHBondContact O-N 3.44Å; F381-A384 VanDerWaalsContact O-N 3.07Å; A384-S386 VanDerWaalsContact C-N 3.34Å; A384-S386 PolarHBondContact O-N 3.32Å; A384-I387 PolarHBondContact O-N 3.39Å; A384-A388 PolarHBondContact O-N 2.92Å
385	V	97.4	Very high	93.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-43.1	173.4	178	0	0	0	0	111.2	A267 V275 L374 L377 F381 R382 G383 I387 A388 R389	A267-V385 HydrophobicContact CB-CB 4.42Å; A267-V385 HydrophobicContact CB-CG2 3.55Å; V275-V385 HydrophobicContact CG1-CG2 4.48Å; V275-V385 HydrophobicContact CG2-CB 4.49Å; V275-V385 HydrophobicContact CG2-CG1 3.9Å; V275-V385 HydrophobicContact CG2-CG2 3.68Å; L374-V385 HydrophobicContact CD1-CB 4.19Å; L374-V385 HydrophobicContact CD1-CG1 3.89Å; L374-V385 HydrophobicContact CD1-CG2 4.3Å; L377-V385 HydrophobicContact CD2-CG2 3.7Å; F381-V385 PolarHBondContact O-N 3.31Å; F381-V385 VanDerWaalsContact O-N 3.14Å; R382-V385 PolarHBondContact O-N 3.48Å; G383-V385 VanDerWaalsContact C-N 3.33Å; G383-V385 PolarHBondContact O-N 3.34Å; V385-I387 VanDerWaalsContact C-N 3.34Å; V385-I387 PolarHBondContact O-N 3.2Å; V385-A388 PolarHBondContact O-N 2.63Å; V385-R389 HydrophobicContact CG1-CG 4.4Å; V385-R389 WeakPolarHBondContact O-CG 3.45Å; V385-R389 PolarHBondContact O-N 2.8Å
386	S	96.4	Very high	93.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.2	-40	177.3	-169.3	0	0	0	0	112.2	R382 G383 A384 R389 R390 E397	R382-S386 PolarHBondContact O-N 3.12Å; G383-S386 WeakPolarHBondContact O-CB 3.46Å; G383-S386 PolarHBondContact O-N 3.47Å; G383-S386 VanDerWaalsContact O-N 3.12Å; A384-S386 VanDerWaalsContact C-N 3.34Å; A384-S386 PolarHBondContact O-N 3.32Å; S386-R389 PolarHBondContact O-N 3Å; S386-R390 WeakPolarHBondContact O-CB 3.37Å; S386-R390 PolarHBondContact O-N 3.43Å; S386-E397 VanDerWaalsContact CA-OE1 3.26Å; S386-E397 WeakPolarHBondContact CA-OE1 3.41Å; S386-E397 VanDerWaalsContact CB-OE1 3.23Å; S386-E397 WeakPolarHBondContact CB-OE1 3.35Å; S386-E397 PolarHBondContact OG-OE1 3.14Å
387	I	95.9	Very high	93.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63	-44.1	176.6	-68.4	165.5	0	0	0	111	D257 A323 V356 E358 G383 A384 V385 R390 L391	D257-I387 HydrophobicContact CB-CD1 3.85Å; A323-I387 HydrophobicContact CB-CG2 3.79Å; V356-I387 HydrophobicContact CB-CG2 4.31Å; E358-I387 HydrophobicContact CB-CD1 4.28Å; G383-I387 WeakPolarHBondContact O-CG1 3.36Å; G383-I387 PolarHBondContact O-N 3.03Å; A384-I387 PolarHBondContact O-N 3.39Å; V385-I387 VanDerWaalsContact C-N 3.34Å; V385-I387 PolarHBondContact O-N 3.2Å; I387-R390 PolarHBondContact O-N 3Å; I387-L391 PolarHBondContact O-N 2.86Å
388	A	95.8	Very high	93.6	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-52.4	176.4	0	0	0	0	0	111.8	V253 C269 A384 V385 R390 L391 Q392	V253-A388 HydrophobicContact CB-CB 4.46Å; V253-A388 HydrophobicContact CG1-CB 4.06Å; C269-A388 HydrophobicContact CB-CB 4.21Å; A384-A388 PolarHBondContact O-N 2.92Å; V385-A388 PolarHBondContact O-N 2.63Å; A388-R390 VanDerWaalsContact C-N 3.28Å; A388-R390 PolarHBondContact O-N 3.47Å; A388-L391 WeakPolarHBondContact O-CB 3.43Å; A388-L391 PolarHBondContact O-N 3.33Å; A388-L391 VanDerWaalsContact O-N 3.12Å; A388-Q392 PolarHBondContact O-N 3.14Å
389	R	94.5	Very high	93.6	Very high	27 Å²	27	13.2 Å²	13.2	10%	0.102	8%	0.075	C	C	.	.	H	α-helix	trans	-65.4	-31.5	-177.7	-71.2	173.4	178.3	173.9	-12.1	112.9	G273 E373 V385 S386 L391 Q392 D393 E397	G273-R389 PolarHBondContact O-NE 2.84Å; G273-R389 PolarHBondContact O-NH2 2.97Å; E373-R389 VanDerWaalsContact CD-NH1 3.34Å; E373-R389 IonicContact OE1-CZ 2.7Å; E373-R389 VanDerWaalsContact OE1-CZ 3.28Å; E373-R389 IonicContact OE1-NH1 3.9Å; E373-R389 PolarHBondContact OE1-NH1 2.64Å; E373-R389 IonicContact OE1-NH2 3.22Å; E373-R389 IonicContact OE2-NH1 2.92Å; V385-R389 HydrophobicContact CG1-CG 4.4Å; V385-R389 WeakPolarHBondContact O-CG 3.45Å; V385-R389 PolarHBondContact O-N 2.8Å; S386-R389 PolarHBondContact O-N 3Å; R389-L391 VanDerWaalsContact C-N 3.31Å; R389-L391 PolarHBondContact O-N 3.45Å; R389-Q392 PolarHBondContact O-N 3.02Å; R389-D393 PolarHBondContact O-N 3.49Å; R389-E397 HydrophobicContact CB-CB 4.29Å; R389-E397 HydrophobicContact CB-CG 4.01Å
390	R	93.2	Very high	93.5	Very high	11 Å²	11	11.3 Å²	11.3	4%	0.042	6%	0.061	C	C	.	.	H	α-helix	trans	-65.4	-34.4	174.9	-169.2	178.3	-55.6	-165.2	-1.8	112	V356 S357 C359 S386 I387 A388 P394 E397 L398	V356-R390 HydrophobicContact CG1-CB 4.07Å; V356-R390 HydrophobicContact CG1-CG 3.95Å; S357-R390 WeakPolarHBondContact O-CD 3.32Å; S357-R390 VanDerWaalsContact O-CZ 3.29Å; S357-R390 PolarHBondContact O-NH1 2.86Å; C359-R390 PolarHBondContact O-NH1 3.44Å; C359-R390 PolarHBondContact O-NH2 2.87Å; S386-R390 WeakPolarHBondContact O-CB 3.37Å; S386-R390 PolarHBondContact O-N 3.43Å; I387-R390 PolarHBondContact O-N 3Å; A388-R390 VanDerWaalsContact C-N 3.28Å; A388-R390 PolarHBondContact O-N 3.47Å; R390-P394 WeakPolarHBondContact O-CD 3.35Å; R390-P394 VanDerWaalsContact O-CG 3.25Å; R390-P394 WeakPolarHBondContact O-CG 3.46Å; R390-E397 HydrophobicContact CB-CB 4.41Å; R390-E397 HydrophobicContact CB-CG 4.13Å; R390-L398 HydrophobicContact CG-CD2 4.32Å; R390-L398 HydrophobicContact CG-CG 4.38Å
391	L	91.2	Very high	93.6	Very high	10 Å²	10	9.6 Å²	9.6	5%	0.052	5%	0.049	C	C	.	.	H	α-helix	trans	-70.6	-37.6	172.1	-176.5	57.3	0	0	0	111.7	L220 V253 T321 A323 A354 V356 I387 A388 R389 P661 F663	L220-L391 HydrophobicContact CD2-CD2 4.39Å; L220-L391 HydrophobicContact CD2-CG 4.17Å; V253-L391 HydrophobicContact CG1-CB 4.36Å; V253-L391 HydrophobicContact CG1-CD2 3.96Å; V253-L391 HydrophobicContact CG2-CD2 4.38Å; T321-L391 HydrophobicContact CG2-CD2 3.69Å; A323-L391 HydrophobicContact CB-CB 3.84Å; A323-L391 HydrophobicContact CB-CD2 3.65Å; A323-L391 HydrophobicContact CB-CG 4.36Å; A354-L391 HydrophobicContact CB-CD1 4.21Å; A354-L391 HydrophobicContact CB-CD2 4.34Å; V356-L391 HydrophobicContact CG2-CB 4.14Å; V356-L391 HydrophobicContact CG2-CD1 4.21Å; I387-L391 PolarHBondContact O-N 2.86Å; A388-L391 WeakPolarHBondContact O-CB 3.43Å; A388-L391 PolarHBondContact O-N 3.33Å; A388-L391 VanDerWaalsContact O-N 3.12Å; R389-L391 VanDerWaalsContact C-N 3.31Å; R389-L391 PolarHBondContact O-N 3.45Å; L391-P661 HydrophobicContact CD1-CB 4.44Å; L391-P661 HydrophobicContact CD1-CG 3.39Å; L391-F663 HydrophobicContact CD2-CE1 4.49Å
392	Q	89.9	Confident	93.3	Very high	3 Å²	3	11.6 Å²	11.6	1%	0.014	6%	0.058	C	C	.	.	H	α-helix	trans	-67.7	-48.2	179.2	-67.4	179	-46.5	0	0	112.5	P219 L220 L251 V253 D270 A388 R389	P219-Q392 CarbonylContact C-O 3.6Å; P219-Q392 WeakPolarHBondContact CA-O 3.46Å; P219-Q392 WeakPolarHBondContact CB-O 3.13Å; L220-Q392 PolarHBondContact N-O 2.93Å; L251-Q392 PolarHBondContact O-NE2 3.49Å; V253-Q392 HydrophobicContact CB-CG 4.07Å; V253-Q392 HydrophobicContact CG2-CG 3.62Å; D270-Q392 PolarHBondContact O-NE2 3.34Å; A388-Q392 PolarHBondContact O-N 3.14Å; R389-Q392 PolarHBondContact O-N 3.02Å
393	D	89.3	Confident	93	Very high	9 Å²	9	11.6 Å²	11.6	5%	0.048	6%	0.06	C	C	.	.			trans	-153.2	97.6	177.7	-175.7	-5.1	0	0	0	110.7	P219 R250 R389 L395 A396 E397 R655	P219-D393 HydrophobicContact CB-CB 4.18Å; R250-D393 IonicContact CZ-OD2 3.3Å; R250-D393 VanDerWaalsContact NH1-CB 3.34Å; R250-D393 IonicContact NH1-OD2 3.58Å; R250-D393 IonicContact NH2-OD2 3.53Å; R250-D393 PolarHBondContact NH2-OD2 2.91Å; R389-D393 PolarHBondContact O-N 3.49Å; D393-L395 VanDerWaalsContact C-N 3.26Å; D393-L395 PolarHBondContact O-N 3.3Å; D393-L395 WeakPolarHBondContact OD1-CB 3.5Å; D393-L395 PolarHBondContact OD1-N 3.46Å; D393-L395 VanDerWaalsContact OD1-N 3.14Å; D393-A396 HydrophobicContact CB-CB 4.03Å; D393-A396 PolarHBondContact O-N 3.22Å; D393-A396 PolarHBondContact OD1-N 3.05Å; D393-A396 WeakPolarHBondContact OD2-CB 3.38Å; D393-E397 PolarHBondContact O-N 3.14Å; D393-R655 IonicContact OD1-CZ 2.66Å; D393-R655 IonicContact OD1-NH1 2.8Å; D393-R655 PolarHBondContact OD1-NH1 3.29Å; D393-R655 IonicContact OD2-NH1 2.93Å
394	P	90.7	Very high	92.6	Very high	10 Å²	10	15.2 Å²	15.2	7%	0.065	8%	0.075	C	C	.	.	H	α-helix	trans	-54.9	-39.4	179.1	-28.1	35.3	0	0	0	113.3	L214 T217 R390 L398	L214-P394 WeakPolarHBondContact O-CB 3.32Å; T217-P394 HydrophobicContact CG2-CG 3.95Å; R390-P394 WeakPolarHBondContact O-CD 3.35Å; R390-P394 VanDerWaalsContact O-CG 3.25Å; R390-P394 WeakPolarHBondContact O-CG 3.46Å; P394-L398 HydrophobicContact CB-CD1 4.16Å; P394-L398 WeakPolarHBondContact O-CB 3.32Å; P394-L398 WeakPolarHBondContact O-CD1 3.32Å; P394-L398 WeakPolarHBondContact O-CG 3.37Å; P394-L398 PolarHBondContact O-N 3.41Å
395	L	91.7	Very high	92.3	Very high	10 Å²	10	17.5 Å²	17.5	5%	0.052	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-52.1	-178.8	178.5	63.5	0	0	0	110.9	L215 D393 E397 V399 C431 I432 V435	L215-L395 HydrophobicContact CB-CD1 3.97Å; L215-L395 HydrophobicContact CD1-CD1 4.36Å; L215-L395 HydrophobicContact CD2-CD1 4.12Å; L215-L395 HydrophobicContact CG-CD1 4.36Å; D393-L395 VanDerWaalsContact C-N 3.26Å; D393-L395 PolarHBondContact O-N 3.3Å; D393-L395 WeakPolarHBondContact OD1-CB 3.5Å; D393-L395 PolarHBondContact OD1-N 3.46Å; D393-L395 VanDerWaalsContact OD1-N 3.14Å; L395-E397 PolarHBondContact O-N 2.92Å; L395-V399 HydrophobicContact CD1-CG2 4Å; L395-V399 WeakPolarHBondContact O-CG2 3.24Å; L395-V399 PolarHBondContact O-N 3.08Å; L395-C431 HydrophobicContact CD1-CB 4.22Å; L395-I432 HydrophobicContact CD1-CG1 3.94Å; L395-I432 HydrophobicContact CD2-CG1 4.38Å; L395-I432 HydrophobicContact CG-CG1 4.43Å; L395-V435 HydrophobicContact CD2-CB 4.19Å; L395-V435 HydrophobicContact CD2-CG1 4.34Å; L395-V435 HydrophobicContact CD2-CG2 3.99Å
396	A	90.2	Very high	91.9	Very high	23 Å²	23	17.6 Å²	17.6	19%	0.19	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-30.1	-175.4	0	0	0	0	0	113.4	D393 H445	D393-A396 HydrophobicContact CB-CB 4.03Å; D393-A396 PolarHBondContact O-N 3.22Å; D393-A396 PolarHBondContact OD1-N 3.05Å; D393-A396 WeakPolarHBondContact OD2-CB 3.38Å; A396-H445 PolarHBondContact O-NE2 3.42Å
397	E	93.3	Very high	91.4	Very high	3 Å²	3	19.2 Å²	19.2	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-92.2	-43.1	-177.6	-171.7	60.5	-162.9	0	0	112.9	S386 R389 R390 D393 L395 V399 K400	S386-E397 VanDerWaalsContact CA-OE1 3.26Å; S386-E397 WeakPolarHBondContact CA-OE1 3.41Å; S386-E397 VanDerWaalsContact CB-OE1 3.23Å; S386-E397 WeakPolarHBondContact CB-OE1 3.35Å; S386-E397 PolarHBondContact OG-OE1 3.14Å; R389-E397 HydrophobicContact CB-CB 4.29Å; R389-E397 HydrophobicContact CB-CG 4.01Å; R390-E397 HydrophobicContact CB-CB 4.41Å; R390-E397 HydrophobicContact CB-CG 4.13Å; D393-E397 PolarHBondContact O-N 3.14Å; L395-E397 PolarHBondContact O-N 2.92Å; E397-V399 VanDerWaalsContact C-N 3.32Å; E397-V399 PolarHBondContact O-N 3.08Å; E397-K400 WeakPolarHBondContact O-CB 3.28Å; E397-K400 WeakPolarHBondContact O-CG 3.45Å; E397-K400 PolarHBondContact O-N 3.12Å; E397-K400 WeakPolarHBondContact OE2-CE 3.49Å; E397-K400 IonicContact OE2-NZ 3.93Å; E397-K400 PolarHBondContact OE2-NZ 3.05Å
398	L	93.2	Very high	90.8	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-70.7	-26.1	-176.2	-68.7	172.1	0	0	0	113.5	L214 L215 R390 P394 K400 L401 L406	L214-L398 HydrophobicContact CD1-CD1 4.29Å; L214-L398 HydrophobicContact CD2-CD1 3.46Å; L214-L398 VanDerWaalsContact CD2-CD1 3.46Å; L214-L398 HydrophobicContact CG-CD1 3.5Å; L215-L398 HydrophobicContact CD2-CB 3.79Å; L215-L398 HydrophobicContact CD2-CD1 4.06Å; R390-L398 HydrophobicContact CG-CD2 4.32Å; R390-L398 HydrophobicContact CG-CG 4.38Å; P394-L398 HydrophobicContact CB-CD1 4.16Å; P394-L398 WeakPolarHBondContact O-CB 3.32Å; P394-L398 WeakPolarHBondContact O-CD1 3.32Å; P394-L398 WeakPolarHBondContact O-CG 3.37Å; P394-L398 PolarHBondContact O-N 3.41Å; L398-K400 PolarHBondContact O-N 3.49Å; L398-K400 VanDerWaalsContact O-N 3.14Å; L398-L401 HydrophobicContact CD2-CD1 3.83Å; L398-L401 WeakPolarHBondContact O-CB 3.39Å; L398-L401 PolarHBondContact O-N 3.49Å; L398-L406 HydrophobicContact CB-CD2 4.3Å; L398-L406 HydrophobicContact CD2-CD2 4.4Å
399	V	93.1	Very high	90.2	Very high	6 Å²	6	20.5 Å²	20.5	4%	0.036	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.2	175.5	173.2	0	0	0	0	112.3	L395 E397 L401 M428 I432 I446 R449	L395-V399 HydrophobicContact CD1-CG2 4Å; L395-V399 WeakPolarHBondContact O-CG2 3.24Å; L395-V399 PolarHBondContact O-N 3.08Å; E397-V399 VanDerWaalsContact C-N 3.32Å; E397-V399 PolarHBondContact O-N 3.08Å; V399-L401 VanDerWaalsContact C-N 3.3Å; V399-M428 HydrophobicContact CG1-SD 4.44Å; V399-M428 HydrophobicContact CG2-CG 4.28Å; V399-M428 HydrophobicContact CG2-SD 4.37Å; V399-I432 HydrophobicContact CG1-CD1 4.29Å; V399-I432 HydrophobicContact CG2-CD1 4.07Å; V399-I446 HydrophobicContact CB-CD1 4.03Å; V399-I446 HydrophobicContact CG1-CD1 4.06Å; V399-I446 HydrophobicContact CG2-CD1 4.14Å; V399-R449 HydrophobicContact CG1-CG 4.08Å
400	K	92.6	Very high	89.7	Confident	27 Å²	27	23 Å²	23	12%	0.117	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.8	175.6	-55.9	176.2	-177.1	178.5	0	113.3	Y364 E373 E397 L398 H445	Y364-K400 HydrophobicContact CD2-CB 4.28Å; Y364-K400 HydrophobicContact CD2-CD 4.41Å; Y364-K400 HydrophobicContact CE2-CB 4.41Å; Y364-K400 HydrophobicContact CE2-CD 3.79Å; E373-K400 VanDerWaalsContact CD-NZ 3.31Å; E373-K400 IonicContact OE1-NZ 2.81Å; E373-K400 PolarHBondContact OE1-NZ 2.73Å; E373-K400 IonicContact OE2-NZ 3.77Å; E373-K400 PolarHBondContact OE2-NZ 3Å; E397-K400 WeakPolarHBondContact O-CB 3.28Å; E397-K400 WeakPolarHBondContact O-CG 3.45Å; E397-K400 PolarHBondContact O-N 3.12Å; E397-K400 WeakPolarHBondContact OE2-CE 3.49Å; E397-K400 IonicContact OE2-NZ 3.93Å; E397-K400 PolarHBondContact OE2-NZ 3.05Å; L398-K400 PolarHBondContact O-N 3.49Å; L398-K400 VanDerWaalsContact O-N 3.14Å; K400-H445 WeakPolarHBondContact CE-CE1 3.06Å; K400-H445 VanDerWaalsContact CE-NE2 3.3Å; K400-H445 WeakPolarHBondContact CE-NE2 3.44Å
401	L	92.6	Very high	89.3	Confident	10 Å²	10	23.5 Å²	23.5	5%	0.052	13%	0.13	C	C	.	.	S	Bend	trans	-89.4	151.2	-174.3	-61.2	179.9	0	0	0	112.8	G360 L398 V399 L406	G360-L401 WeakPolarHBondContact O-CD2 3.42Å; L398-L401 HydrophobicContact CD2-CD1 3.83Å; L398-L401 WeakPolarHBondContact O-CB 3.39Å; L398-L401 PolarHBondContact O-N 3.49Å; V399-L401 VanDerWaalsContact C-N 3.3Å; L401-L406 HydrophobicContact CB-CD2 4.06Å; L401-L406 HydrophobicContact CD1-CD2 4.2Å
402	E	89.4	Confident	89.1	Confident	76 Å²	76	23.6 Å²	23.6	36%	0.355	13%	0.13	S	C	.	.			trans	-74.9	145.2	170.1	-69.7	179.5	-168.7	0	0	111.4	Y363 K404 H405	Y363-E402 HydrophobicContact CE1-CB 4.35Å; Y363-E402 HydrophobicContact CE1-CG 3.8Å; Y363-E402 VanDerWaalsContact CE1-OE1 3.3Å; Y363-E402 WeakPolarHBondContact CE1-OE1 3.35Å; Y363-E402 VanDerWaalsContact CZ-CD 3.47Å; Y363-E402 VanDerWaalsContact CZ-OE1 3.32Å; Y363-E402 PolarHBondContact OH-OE1 3.37Å; Y363-E402 PolarHBondContact OH-OE2 2.68Å; E402-K404 VanDerWaalsContact C-N 3.29Å; E402-K404 HydrophobicContact CB-CG 4.36Å; E402-K404 PolarHBondContact O-N 2.83Å; E402-K404 VanDerWaalsContact O-N 3.09Å; E402-K404 WeakPolarHBondContact OE2-CE 3.44Å; E402-K404 IonicContact OE2-NZ 3.28Å; E402-K404 PolarHBondContact OE2-NZ 3.45Å; E402-H405 PolarHBondContact O-N 3.41Å
403	P	89.6	Confident	89	Confident	15 Å²	15	29.6 Å²	29.6	10%	0.097	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-43.6	-46.5	-177.9	-35.5	37	0	0	0	115.7	H405 L406 L420 T421 V424	P403-H405 PolarHBondContact O-N 3.48Å; P403-L406 PolarHBondContact O-N 2.86Å; P403-L420 HydrophobicContact CB-CD2 4.29Å; P403-L420 HydrophobicContact CB-CG 4.11Å; P403-T421 HydrophobicContact CG-CG2 4.32Å; P403-V424 HydrophobicContact CB-CB 4.01Å; P403-V424 HydrophobicContact CB-CG1 4.25Å; P403-V424 HydrophobicContact CB-CG2 3.69Å; P403-V424 HydrophobicContact CG-CB 3.89Å; P403-V424 HydrophobicContact CG-CG1 3.87Å; P403-V424 HydrophobicContact CG-CG2 4.14Å
404	K	87.5	Confident	89.1	Confident	78 Å²	78	30.4 Å²	30.4	34%	0.339	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-67.4	-10.9	-178.9	54.9	168.1	166.6	156.7	0	114.8	E402 Q412 H413	E402-K404 VanDerWaalsContact C-N 3.29Å; E402-K404 HydrophobicContact CB-CG 4.36Å; E402-K404 PolarHBondContact O-N 2.83Å; E402-K404 VanDerWaalsContact O-N 3.09Å; E402-K404 WeakPolarHBondContact OE2-CE 3.44Å; E402-K404 IonicContact OE2-NZ 3.28Å; E402-K404 PolarHBondContact OE2-NZ 3.45Å; K404-Q412 PolarHBondContact O-NE2 3.25Å; K404-H413 PolarHBondContact O-CE1 3.17Å
405	H	90.6	Very high	89.2	Confident	48 Å²	48	30.3 Å²	30.3	22%	0.222	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-112.6	-2.6	-174.1	-63.5	-46.3	0	0	0	113.3	C359 G360 Y363 E402 P403 G407	C359-H405 CarbonylContact C-O 3.47Å; C359-H405 VanDerWaalsContact C-O 3.31Å; G360-H405 WeakPolarHBondContact CA-O 3.13Å; G360-H405 PolarHBondContact N-O 3.45Å; G360-H405 VanDerWaalsContact N-O 3.16Å; Y363-H405 AromaticContact CD1-CD2 3.59Å; Y363-H405 AromaticContact CD2-CD2 3.66Å; Y363-H405 AromaticContact CD2-NE2 3.42Å; Y363-H405 WeakPolarHBondContact CD2-NE2 3.31Å; Y363-H405 AromaticContact CE1-CD2 3.94Å; Y363-H405 AromaticContact CE2-NE2 3.6Å; Y363-H405 AromaticContact CG-CD2 3.42Å; Y363-H405 VanDerWaalsContact CG-CD2 3.42Å; Y363-H405 AromaticContact CG-NE2 3.73Å; E402-H405 PolarHBondContact O-N 3.41Å; P403-H405 PolarHBondContact O-N 3.48Å; H405-G407 VanDerWaalsContact C-N 3.32Å; H405-G407 PolarHBondContact O-N 3.47Å
406	L	90.3	Very high	89.2	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.174	C	C	.	.	S	Bend	trans	-64.5	-35	178	-71	165.1	0	0	0	112.6	F207 L211 C359 L398 L401 P403 V408 V424 M428	F207-L406 HydrophobicContact CZ-CD1 4.24Å; L211-L406 HydrophobicContact CD1-CD1 3.88Å; L211-L406 HydrophobicContact CD1-CD2 4.27Å; L211-L406 HydrophobicContact CD2-CD1 3.91Å; C359-L406 WeakPolarHBondContact CB-O 3.44Å; L398-L406 HydrophobicContact CB-CD2 4.3Å; L398-L406 HydrophobicContact CD2-CD2 4.4Å; L401-L406 HydrophobicContact CB-CD2 4.06Å; L401-L406 HydrophobicContact CD1-CD2 4.2Å; P403-L406 PolarHBondContact O-N 2.86Å; L406-V408 VanDerWaalsContact C-N 3.33Å; L406-V408 HydrophobicContact CB-CG1 4.42Å; L406-V408 HydrophobicContact CB-CG2 4.32Å; L406-V408 PolarHBondContact O-N 3.16Å; L406-V424 HydrophobicContact CD1-CG1 3.85Å; L406-V424 HydrophobicContact CD1-CG2 3.89Å; L406-M428 HydrophobicContact CD1-CE 4.18Å; L406-M428 HydrophobicContact CD2-CE 4.38Å
407	G	84.6	Confident	89.4	Confident	35 Å²	35	36.1 Å²	36.1	36%	0.361	20%	0.195	S	C	.	.			trans	74.4	21	174.3	0	0	0	0	0	114.4	H405	H405-G407 VanDerWaalsContact C-N 3.32Å; H405-G407 PolarHBondContact O-N 3.47Å
408	V	83.6	Confident	89.5	Confident	14 Å²	14	42.3 Å²	42.3	9%	0.085	23%	0.228	C	C	.	.			trans	-90.5	1.1	-177.1	-60.5	0	0	0	0	113.7	F207 N210 L211 L214 L406	F207-V408 HydrophobicContact CD1-CG2 4.36Å; F207-V408 HydrophobicContact CD2-CG2 3.52Å; F207-V408 HydrophobicContact CE1-CG2 4.06Å; F207-V408 HydrophobicContact CE2-CG2 3.2Å; F207-V408 HydrophobicContact CG-CG2 4.08Å; F207-V408 HydrophobicContact CZ-CG2 3.48Å; F207-V408 VanDerWaalsContact CZ-CG2 3.48Å; N210-V408 HydrophobicContact CB-CB 4.21Å; N210-V408 PolarHBondContact ND2-O 3.02Å; L211-V408 HydrophobicContact CB-CG2 4.09Å; L214-V408 HydrophobicContact CD2-CG1 3.59Å; L406-V408 VanDerWaalsContact C-N 3.33Å; L406-V408 HydrophobicContact CB-CG1 4.42Å; L406-V408 HydrophobicContact CB-CG2 4.32Å; L406-V408 PolarHBondContact O-N 3.16Å
409	G	83.8	Confident	89.5	Confident	13 Å²	13	45.9 Å²	45.9	13%	0.134	25%	0.245	C	C	.	.			trans	-145	136.2	176.3	0	0	0	0	0	114	Y411 Q412	G409-Y411 VanDerWaalsContact C-N 3.3Å; G409-Y411 PolarHBondContact O-N 3.29Å; G409-Q412 WeakPolarHBondContact O-CG 3.46Å; G409-Q412 PolarHBondContact O-N 3.41Å; G409-Q412 PolarHBondContact O-OE1 3.39Å
410	M	83.2	Confident	89.5	Confident	79 Å²	79	45.9 Å²	45.9	39%	0.389	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-27.9	-174.9	-156.9	178.8	76.1	0	0	114	R130 F689	R130-M410 PolarHBondContact NH2-O 3.41Å; M410-F689 HydrophobicContact CE-CE1 3.6Å; M410-F689 HydrophobicContact CE-CZ 3.7Å; M410-F689 HydrophobicContact SD-CE1 4.3Å; M410-F689 HydrophobicContact SD-CZ 3.9Å
411	Y	84.7	Confident	89.6	Confident	21 Å²	21	46.5 Å²	46.5	8%	0.082	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	19.4	-179.6	-57.6	-77.9	0	0	0	113	H123 L126 A127 G409 H413 D414 F689	H123-Y411 HydrophobicContact CB-CD2 4.28Å; H123-Y411 HydrophobicContact CB-CE2 3.36Å; H123-Y411 PolarHBondContact O-OH 3.02Å; L126-Y411 HydrophobicContact CB-CD1 3.85Å; L126-Y411 HydrophobicContact CB-CE1 4.29Å; L126-Y411 HydrophobicContact CB-CG 4.1Å; L126-Y411 HydrophobicContact CD1-CD1 4.44Å; L126-Y411 HydrophobicContact CD1-CD2 4.18Å; L126-Y411 HydrophobicContact CD1-CG 3.84Å; A127-Y411 HydrophobicContact CB-CE1 4.19Å; G409-Y411 VanDerWaalsContact C-N 3.3Å; G409-Y411 PolarHBondContact O-N 3.29Å; Y411-H413 PolarHBondContact O-N 3.21Å; Y411-H413 VanDerWaalsContact O-N 3.07Å; Y411-D414 WeakPolarHBondContact CA-OD2 3.44Å; Y411-D414 VanDerWaalsContact CB-OD2 3.31Å; Y411-D414 WeakPolarHBondContact CB-OD2 3.35Å; Y411-D414 VanDerWaalsContact CD1-OD2 3.29Å; Y411-D414 WeakPolarHBondContact CD1-OD2 3.36Å; Y411-D414 PolarHBondContact O-N 2.91Å; Y411-F689 HydrophobicContact CE2-CE1 4.36Å
412	Q	87.3	Confident	89.7	Confident	12 Å²	12	49.2 Å²	49.2	6%	0.056	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-58.1	-26.7	-178.6	70.2	-172.3	34	0	0	113.1	F207 K404 G409 D414 L420	F207-Q412 HydrophobicContact CD2-CB 3.99Å; F207-Q412 HydrophobicContact CE2-CB 3.97Å; K404-Q412 PolarHBondContact O-NE2 3.25Å; G409-Q412 WeakPolarHBondContact O-CG 3.46Å; G409-Q412 PolarHBondContact O-N 3.41Å; G409-Q412 PolarHBondContact O-OE1 3.39Å; Q412-D414 VanDerWaalsContact C-N 3.34Å; Q412-L420 HydrophobicContact CB-CD2 4.47Å
413	H	88.3	Confident	89.9	Confident	130 Å²	130	46.3 Å²	46.3	60%	0.602	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-79	-11.6	176.1	-65.6	-68.2	0	0	0	114.3	K404 Y411	K404-H413 PolarHBondContact O-CE1 3.17Å; Y411-H413 PolarHBondContact O-N 3.21Å; Y411-H413 VanDerWaalsContact O-N 3.07Å
414	D	91.4	Very high	90.1	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.134	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-99	0.3	176.4	-42.6	-71.9	0	0	0	112.5	L126 R130 Q200 Y411 Q412	L126-D414 HydrophobicContact CD2-CB 4.36Å; R130-D414 WeakPolarHBondContact CG-OD1 3.45Å; R130-D414 IonicContact CZ-OD1 2.79Å; R130-D414 IonicContact CZ-OD2 2.81Å; R130-D414 VanDerWaalsContact CZ-OD2 3.22Å; R130-D414 IonicContact NE-OD1 2.97Å; R130-D414 PolarHBondContact NE-OD1 3.05Å; R130-D414 IonicContact NE-OD2 3.55Å; R130-D414 PolarHBondContact NE-OD2 2.8Å; R130-D414 IonicContact NH2-OD1 2.6Å; R130-D414 IonicContact NH2-OD2 2.99Å; R130-D414 PolarHBondContact NH2-OD2 3.49Å; Q200-D414 PolarHBondContact NE2-O 3.24Å; Y411-D414 WeakPolarHBondContact CA-OD2 3.44Å; Y411-D414 VanDerWaalsContact CB-OD2 3.31Å; Y411-D414 WeakPolarHBondContact CB-OD2 3.35Å; Y411-D414 VanDerWaalsContact CD1-OD2 3.29Å; Y411-D414 WeakPolarHBondContact CD1-OD2 3.36Å; Y411-D414 PolarHBondContact O-N 2.91Å; Q412-D414 VanDerWaalsContact C-N 3.34Å
415	I	91.7	Very high	90.4	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.041	25%	0.251	C	S	.	.	S	Bend	trans	-91.1	139	174.6	-60.5	175	0	0	0	108.4	L204 V417 Q419 L420	L204-I415 HydrophobicContact CB-CD1 4.21Å; L204-I415 HydrophobicContact CD1-CD1 4.2Å; L204-I415 HydrophobicContact CD1-CG2 4.28Å; I415-V417 PolarHBondContact O-N 3Å; I415-Q419 HydrophobicContact CG2-CB 4.3Å; I415-L420 HydrophobicContact CG2-CB 4.14Å
416	P	93.5	Very high	90.5	Very high	50 Å²	50	47.2 Å²	47.2	33%	0.325	27%	0.267	S	S	.	.			trans	-55.7	130.1	174.3	-24.3	35.1	0	0	0	111.5	N418 Q419 L420	P416-N418 VanDerWaalsContact C-N 3.26Å; P416-N418 PolarHBondContact O-N 2.87Å; P416-N418 VanDerWaalsContact O-N 3.14Å; P416-Q419 HydrophobicContact CB-CB 4.48Å; P416-Q419 HydrophobicContact CB-CG 4.34Å; P416-Q419 PolarHBondContact O-N 3.47Å; P416-L420 PolarHBondContact O-N 2.73Å; P416-L420 VanDerWaalsContact O-N 3.07Å
417	V	93.6	Very high	90.7	Very high	106 Å²	106	47.7 Å²	47.7	64%	0.642	27%	0.27	S	S	*	.	H	α-helix	trans	-53.1	-42.4	-172.8	180	0	0	0	0	112.3	I415 Q419 L420 T421	I415-V417 PolarHBondContact O-N 3Å; V417-Q419 PolarHBondContact O-N 3.25Å; V417-L420 PolarHBondContact O-N 3.15Å; V417-T421 WeakPolarHBondContact O-CB 3.32Å; V417-T421 PolarHBondContact O-N 3.38Å; V417-T421 PolarHBondContact O-OG1 3.29Å; V417-T421 VanDerWaalsContact O-OG1 3.05Å
418	N	94.7	Very high	91.1	Very high	132 Å²	132	46.1 Å²	46.1	71%	0.706	25%	0.253	S	S	*	.	H	α-helix	trans	-63.2	-41.7	-179.8	-64.7	-9.9	0	0	0	112.4	P416 T421 S422	P416-N418 VanDerWaalsContact C-N 3.26Å; P416-N418 PolarHBondContact O-N 2.87Å; P416-N418 VanDerWaalsContact O-N 3.14Å; N418-T421 PolarHBondContact O-N 2.78Å; N418-S422 PolarHBondContact O-N 2.85Å; N418-S422 PolarHBondContact O-OG 3.43Å; N418-S422 VanDerWaalsContact O-OG 3.12Å
419	Q	94	Very high	91.6	Very high	76 Å²	76	49.5 Å²	49.5	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-66.5	-44	177.8	-70.4	-179	-11.4	0	0	110.9	L204 I415 P416 V417 S422 A423	L204-Q419 HydrophobicContact CD2-CB 4.3Å; I415-Q419 HydrophobicContact CG2-CB 4.3Å; P416-Q419 HydrophobicContact CB-CB 4.48Å; P416-Q419 HydrophobicContact CB-CG 4.34Å; P416-Q419 PolarHBondContact O-N 3.47Å; V417-Q419 PolarHBondContact O-N 3.25Å; Q419-S422 PolarHBondContact O-N 3.3Å; Q419-A423 WeakPolarHBondContact O-CB 3.03Å; Q419-A423 PolarHBondContact O-N 3.23Å
420	L	93.5	Very high	92.1	Very high	6 Å²	6	53 Å²	53	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-45.4	176.7	-175.9	67.1	0	0	0	111.7	L204 F207 P403 Q412 I415 P416 V417 A423 V424	L204-L420 HydrophobicContact CD1-CD1 4.12Å; F207-L420 HydrophobicContact CD1-CD1 3.96Å; F207-L420 HydrophobicContact CD2-CD1 4.14Å; F207-L420 HydrophobicContact CE1-CD1 3.72Å; F207-L420 HydrophobicContact CE2-CD1 3.87Å; F207-L420 HydrophobicContact CG-CD1 4.2Å; F207-L420 HydrophobicContact CZ-CD1 3.67Å; P403-L420 HydrophobicContact CB-CD2 4.29Å; P403-L420 HydrophobicContact CB-CG 4.11Å; Q412-L420 HydrophobicContact CB-CD2 4.47Å; I415-L420 HydrophobicContact CG2-CB 4.14Å; P416-L420 PolarHBondContact O-N 2.73Å; P416-L420 VanDerWaalsContact O-N 3.07Å; V417-L420 PolarHBondContact O-N 3.15Å; L420-A423 PolarHBondContact O-N 3.49Å; L420-V424 WeakPolarHBondContact O-CG2 3.38Å; L420-V424 PolarHBondContact O-N 3.05Å
421	T	94.2	Very high	92.5	Very high	41 Å²	41	49.3 Å²	49.3	25%	0.252	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-46	179.5	-66.4	0	0	0	0	112	P403 V417 N418 V424 H425	P403-T421 HydrophobicContact CG-CG2 4.32Å; V417-T421 WeakPolarHBondContact O-CB 3.32Å; V417-T421 PolarHBondContact O-N 3.38Å; V417-T421 PolarHBondContact O-OG1 3.29Å; V417-T421 VanDerWaalsContact O-OG1 3.05Å; N418-T421 PolarHBondContact O-N 2.78Å; T421-V424 PolarHBondContact O-N 2.73Å; T421-H425 WeakPolarHBondContact CG2-NE2 3.07Å; T421-H425 WeakPolarHBondContact O-CB 3.38Å; T421-H425 PolarHBondContact O-CD2 3.08Å; T421-H425 VanDerWaalsContact O-CD2 3.3Å; T421-H425 PolarHBondContact O-N 2.85Å
422	S	94.5	Very high	92.9	Very high	67 Å²	67	48.4 Å²	48.4	47%	0.469	26%	0.259	S	S	.	.	H	α-helix	trans	-61.7	-45.2	176.6	-63.8	0	0	0	0	111.8	N418 Q419 V424 H425 N426	N418-S422 PolarHBondContact O-N 2.85Å; N418-S422 PolarHBondContact O-OG 3.43Å; N418-S422 VanDerWaalsContact O-OG 3.12Å; Q419-S422 PolarHBondContact O-N 3.3Å; S422-V424 PolarHBondContact O-N 2.87Å; S422-H425 PolarHBondContact O-N 3.5Å; S422-N426 WeakPolarHBondContact O-CB 3.27Å; S422-N426 PolarHBondContact O-N 3.01Å; S422-N426 PolarHBondContact O-OD1 2.7Å
423	A	93.7	Very high	93.1	Very high	14 Å²	14	48.7 Å²	48.7	12%	0.116	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-45.6	178	0	0	0	0	0	112.2	L204 Q419 L420 H425 N426 V427	L204-A423 HydrophobicContact CD1-CB 3.56Å; L204-A423 HydrophobicContact CD2-CB 4.11Å; L204-A423 HydrophobicContact CG-CB 3.94Å; Q419-A423 WeakPolarHBondContact O-CB 3.03Å; Q419-A423 PolarHBondContact O-N 3.23Å; L420-A423 PolarHBondContact O-N 3.49Å; A423-H425 PolarHBondContact O-N 3.47Å; A423-N426 PolarHBondContact O-N 3.19Å; A423-V427 VanDerWaalsContact O-CG2 3.32Å; A423-V427 WeakPolarHBondContact O-CG2 3.2Å; A423-V427 PolarHBondContact O-N 3.07Å
424	V	93.6	Very high	93.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-45.3	176.7	168.2	0	0	0	0	111.7	F207 L211 P403 L406 L420 T421 S422 V427 M428	F207-V424 HydrophobicContact CE1-CG2 3.36Å; F207-V424 HydrophobicContact CZ-CG2 3.64Å; L211-V424 HydrophobicContact CD2-CB 4.24Å; L211-V424 HydrophobicContact CD2-CG1 4.04Å; L211-V424 HydrophobicContact CD2-CG2 3.88Å; P403-V424 HydrophobicContact CB-CB 4.01Å; P403-V424 HydrophobicContact CB-CG1 4.25Å; P403-V424 HydrophobicContact CB-CG2 3.69Å; P403-V424 HydrophobicContact CG-CB 3.89Å; P403-V424 HydrophobicContact CG-CG1 3.87Å; P403-V424 HydrophobicContact CG-CG2 4.14Å; L406-V424 HydrophobicContact CD1-CG1 3.85Å; L406-V424 HydrophobicContact CD1-CG2 3.89Å; L420-V424 WeakPolarHBondContact O-CG2 3.38Å; L420-V424 PolarHBondContact O-N 3.05Å; T421-V424 PolarHBondContact O-N 2.73Å; S422-V424 PolarHBondContact O-N 2.87Å; V424-V427 PolarHBondContact O-N 3.33Å; V424-M428 HydrophobicContact CG1-CE 3.5Å; V424-M428 HydrophobicContact CG1-CG 4.27Å; V424-M428 HydrophobicContact CG1-SD 3.69Å; V424-M428 WeakPolarHBondContact O-CB 3.31Å; V424-M428 VanDerWaalsContact O-CG 3.28Å; V424-M428 WeakPolarHBondContact O-CG 3.25Å; V424-M428 PolarHBondContact O-N 2.86Å
425	H	93	Very high	93	Very high	56 Å²	56	46.9 Å²	46.9	26%	0.259	25%	0.253	S	S	.	.	H	α-helix	trans	-64.4	-42.1	-179.8	-72.1	-27.5	0	0	0	112.3	T421 S422 A423 M428 E429 R449	T421-H425 WeakPolarHBondContact CG2-NE2 3.07Å; T421-H425 WeakPolarHBondContact O-CB 3.38Å; T421-H425 PolarHBondContact O-CD2 3.08Å; T421-H425 VanDerWaalsContact O-CD2 3.3Å; T421-H425 PolarHBondContact O-N 2.85Å; S422-H425 PolarHBondContact O-N 3.5Å; A423-H425 PolarHBondContact O-N 3.47Å; H425-M428 PolarHBondContact O-N 3.44Å; H425-E429 WeakPolarHBondContact O-CB 3.39Å; H425-E429 PolarHBondContact O-N 3.15Å; H425-R449 PolarHBondContact CE1-NH1 3.07Å; H425-R449 PolarHBondContact CE1-NH2 2.9Å; H425-R449 PolarHBondContact ND1-NH1 3.17Å
426	N	94	Very high	93	Very high	104 Å²	104	47.3 Å²	47.3	56%	0.556	26%	0.259	S	S	*	.	H	α-helix	trans	-61.1	-46.3	176.1	-65.9	-5.3	0	0	0	111.3	S422 A423 M428 E429 E430	S422-N426 WeakPolarHBondContact O-CB 3.27Å; S422-N426 PolarHBondContact O-N 3.01Å; S422-N426 PolarHBondContact O-OD1 2.7Å; A423-N426 PolarHBondContact O-N 3.19Å; N426-M428 PolarHBondContact O-N 2.93Å; N426-E429 PolarHBondContact O-N 3.49Å; N426-E430 WeakPolarHBondContact O-CB 3.23Å; N426-E430 PolarHBondContact O-N 3.23Å
427	V	94.3	Very high	92.8	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-41.8	178	173.9	0	0	0	0	111.4	L211 R212 L215 A423 V424 C431	L211-V427 HydrophobicContact CB-CG1 4.19Å; L211-V427 HydrophobicContact CD2-CB 4.2Å; L211-V427 HydrophobicContact CD2-CG1 4.04Å; L211-V427 HydrophobicContact CG-CG1 3.91Å; R212-V427 HydrophobicContact CB-CG1 3.93Å; L215-V427 HydrophobicContact CD1-CG1 4.27Å; A423-V427 VanDerWaalsContact O-CG2 3.32Å; A423-V427 WeakPolarHBondContact O-CG2 3.2Å; A423-V427 PolarHBondContact O-N 3.07Å; V424-V427 PolarHBondContact O-N 3.33Å; V427-C431 WeakPolarHBondContact O-CB 3.43Å; V427-C431 PolarHBondContact O-N 2.75Å; V427-C431 PolarHBondContact O-SG 2.74Å
428	M	93.7	Very high	92.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-46	177.5	-73.9	175.5	173.4	0	0	112.1	L215 V399 L406 V424 H425 N426 E430 C431 I432	L215-M428 HydrophobicContact CD1-CG 3.85Å; V399-M428 HydrophobicContact CG1-SD 4.44Å; V399-M428 HydrophobicContact CG2-CG 4.28Å; V399-M428 HydrophobicContact CG2-SD 4.37Å; L406-M428 HydrophobicContact CD1-CE 4.18Å; L406-M428 HydrophobicContact CD2-CE 4.38Å; V424-M428 HydrophobicContact CG1-CE 3.5Å; V424-M428 HydrophobicContact CG1-CG 4.27Å; V424-M428 HydrophobicContact CG1-SD 3.69Å; V424-M428 WeakPolarHBondContact O-CB 3.31Å; V424-M428 VanDerWaalsContact O-CG 3.28Å; V424-M428 WeakPolarHBondContact O-CG 3.25Å; V424-M428 PolarHBondContact O-N 2.86Å; H425-M428 PolarHBondContact O-N 3.44Å; N426-M428 PolarHBondContact O-N 2.93Å; M428-E430 VanDerWaalsContact C-N 3.34Å; M428-C431 PolarHBondContact O-N 3.46Å; M428-I432 WeakPolarHBondContact O-CB 3.4Å; M428-I432 WeakPolarHBondContact O-CG1 3.37Å; M428-I432 PolarHBondContact O-N 3.32Å
429	E	93.1	Very high	92.5	Very high	84 Å²	84	35.2 Å²	35.2	39%	0.393	19%	0.189	S	C	.	.	H	α-helix	trans	-61.2	-43.1	177.2	178.9	170.7	179.7	0	0	111.2	H425 N426 S433	H425-E429 WeakPolarHBondContact O-CB 3.39Å; H425-E429 PolarHBondContact O-N 3.15Å; N426-E429 PolarHBondContact O-N 3.49Å; E429-S433 VanDerWaalsContact O-CB 3.23Å; E429-S433 WeakPolarHBondContact O-CB 3.34Å; E429-S433 PolarHBondContact O-N 3.44Å; E429-S433 PolarHBondContact O-OG 3.49Å
430	E	93.5	Very high	92.3	Very high	87 Å²	87	33 Å²	33	41%	0.407	18%	0.179	S	C	.	.	H	α-helix	trans	-61.8	-51.8	175.9	-171.3	-173.5	173.9	0	0	111.7	R212 N426 M428 I432 S433 F434	R212-E430 IonicContact CZ-OE1 3.19Å; R212-E430 IonicContact CZ-OE2 3.65Å; R212-E430 IonicContact NH1-OE1 2.6Å; R212-E430 PolarHBondContact NH1-OE1 2.98Å; R212-E430 IonicContact NH1-OE2 2.71Å; R212-E430 PolarHBondContact NH1-OE2 2.81Å; R212-E430 IonicContact NH2-OE1 3.77Å; R212-E430 PolarHBondContact NH2-OE1 3.33Å; N426-E430 WeakPolarHBondContact O-CB 3.23Å; N426-E430 PolarHBondContact O-N 3.23Å; M428-E430 VanDerWaalsContact C-N 3.34Å; E430-I432 PolarHBondContact O-N 2.91Å; E430-S433 PolarHBondContact O-N 3Å; E430-F434 WeakPolarHBondContact O-CB 3.48Å; E430-F434 PolarHBondContact O-N 3.39Å
431	C	92.8	Very high	91.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-43	179.5	-72.5	0	0	0	0	112.1	L215 M216 L395 V427 M428 F434 V435	L215-C431 HydrophobicContact CB-CB 4.15Å; L215-C431 HydrophobicContact CD1-CB 4.29Å; M216-C431 HydrophobicContact SD-CB 4.2Å; L395-C431 HydrophobicContact CD1-CB 4.22Å; V427-C431 WeakPolarHBondContact O-CB 3.43Å; V427-C431 PolarHBondContact O-N 2.75Å; V427-C431 PolarHBondContact O-SG 2.74Å; M428-C431 PolarHBondContact O-N 3.46Å; C431-F434 PolarHBondContact O-N 3.18Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.24Å; C431-V435 PolarHBondContact O-N 3.29Å
432	I	92.8	Very high	91.6	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-41.8	179.3	-70.3	170.4	0	0	0	110.9	L395 V399 M428 E430 F434 G436 V437 I446 R449 V450	L395-I432 HydrophobicContact CD1-CG1 3.94Å; L395-I432 HydrophobicContact CD2-CG1 4.38Å; L395-I432 HydrophobicContact CG-CG1 4.43Å; V399-I432 HydrophobicContact CG1-CD1 4.29Å; V399-I432 HydrophobicContact CG2-CD1 4.07Å; M428-I432 WeakPolarHBondContact O-CB 3.4Å; M428-I432 WeakPolarHBondContact O-CG1 3.37Å; M428-I432 PolarHBondContact O-N 3.32Å; E430-I432 PolarHBondContact O-N 2.91Å; I432-F434 VanDerWaalsContact C-N 3.33Å; I432-G436 PolarHBondContact O-N 3.35Å; I432-V437 HydrophobicContact CG2-CG2 3.44Å; I432-V437 VanDerWaalsContact CG2-CG2 3.44Å; I432-I446 HydrophobicContact CD1-CD1 4.15Å; I432-I446 HydrophobicContact CG2-CG2 4.23Å; I432-R449 HydrophobicContact CD1-CB 3.43Å; I432-R449 VanDerWaalsContact CD1-CB 3.43Å; I432-R449 HydrophobicContact CD1-CG 4.01Å; I432-V450 HydrophobicContact CG2-CG2 4.04Å
433	S	90.9	Very high	91.3	Very high	19 Å²	19	33.9 Å²	33.9	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-40	177.9	-59.2	0	0	0	0	111.4	E429 E430 F494	E429-S433 VanDerWaalsContact O-CB 3.23Å; E429-S433 WeakPolarHBondContact O-CB 3.34Å; E429-S433 PolarHBondContact O-N 3.44Å; E429-S433 PolarHBondContact O-OG 3.49Å; E430-S433 PolarHBondContact O-N 3Å; S433-F494 VanDerWaalsContact O-CD1 3.3Å; S433-F494 WeakPolarHBondContact O-CD1 3.41Å
434	F	90.1	Very high	91.2	Very high	105 Å²	105	35.9 Å²	35.9	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-68.5	-41.4	178.5	-172	-100.4	0	0	0	112.9	M216 E430 C431 I432 E654	M216-F434 HydrophobicContact CE-CD1 3.32Å; M216-F434 HydrophobicContact CE-CE1 3.49Å; M216-F434 VanDerWaalsContact CE-CE1 3.49Å; M216-F434 HydrophobicContact SD-CD1 4.05Å; E430-F434 WeakPolarHBondContact O-CB 3.48Å; E430-F434 PolarHBondContact O-N 3.39Å; C431-F434 PolarHBondContact O-N 3.18Å; I432-F434 VanDerWaalsContact C-N 3.33Å; F434-E654 HydrophobicContact CD1-CB 3.76Å; F434-E654 HydrophobicContact CD1-CG 4.35Å; F434-E654 HydrophobicContact CE1-CB 3.24Å; F434-E654 HydrophobicContact CE1-CG 3.98Å; F434-E654 HydrophobicContact CZ-CB 3.85Å; F434-E654 HydrophobicContact CZ-CG 4.22Å
435	V	88.6	Confident	91.1	Very high	12 Å²	12	37.7 Å²	37.7	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-71.8	-37.5	176.3	176.5	0	0	0	0	111.4	M216 L395 C431 R496 R655	M216-V435 HydrophobicContact CE-CG2 4.31Å; M216-V435 HydrophobicContact SD-CG2 4.01Å; L395-V435 HydrophobicContact CD2-CB 4.19Å; L395-V435 HydrophobicContact CD2-CG1 4.34Å; L395-V435 HydrophobicContact CD2-CG2 3.99Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.24Å; C431-V435 PolarHBondContact O-N 3.29Å; V435-R496 PolarHBondContact O-NH2 2.9Å; V435-R655 HydrophobicContact CG2-CG 3.66Å
436	G	90.2	Very high	91.1	Very high	16 Å²	16	35.8 Å²	35.8	17%	0.165	20%	0.2	C	C	.	.			trans	78.4	156.6	-172.4	0	0	0	0	0	113.1	I432 F494	I432-G436 PolarHBondContact O-N 3.35Å; G436-F494 CarbonylContact C-O 3.58Å; G436-F494 WeakPolarHBondContact CA-O 3.2Å
437	V	91.2	Very high	91.1	Very high	9 Å²	9	30.8 Å²	30.8	6%	0.055	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.4	-167.4	-179.8	0	0	0	0	111.1	I432 L439 A442 I446 L447 V450 F494 V495 R496	I432-V437 HydrophobicContact CG2-CG2 3.44Å; I432-V437 VanDerWaalsContact CG2-CG2 3.44Å; V437-L439 PolarHBondContact O-N 3.37Å; V437-A442 HydrophobicContact CG1-CB 3.19Å; V437-I446 HydrophobicContact CB-CG2 4.48Å; V437-I446 HydrophobicContact CG1-CG2 3.85Å; V437-I446 HydrophobicContact CG2-CG2 3.71Å; V437-L447 HydrophobicContact CG1-CD2 4Å; V437-V450 HydrophobicContact CB-CG2 4.15Å; V437-V450 HydrophobicContact CG1-CG2 4.48Å; V437-V450 HydrophobicContact CG2-CG2 3.76Å; V437-F494 PolarHBondContact N-O 2.85Å; V437-V495 CarbonylContact O-C 3.56Å; V437-V495 VanDerWaalsContact O-CA 3.3Å; V437-V495 WeakPolarHBondContact O-CA 3.24Å; V437-R496 PolarHBondContact O-N 3.19Å
438	D	89.7	Confident	91	Very high	25 Å²	25	31.5 Å²	31.5	13%	0.134	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	116.6	172.7	177.8	12.7	0	0	0	111.3	N440 A441 A442 R496 K498	D438-N440 PolarHBondContact O-N 3.32Å; D438-N440 PolarHBondContact OD1-N 3.12Å; D438-A441 HydrophobicContact CB-CB 4.29Å; D438-A441 PolarHBondContact O-N 2.87Å; D438-A441 WeakPolarHBondContact OD2-CB 3.39Å; D438-A442 WeakPolarHBondContact O-CB 3.21Å; D438-A442 PolarHBondContact O-N 3.07Å; D438-R496 WeakPolarHBondContact CA-O 3.41Å; D438-K498 WeakPolarHBondContact OD2-CD 3.35Å
439	L	91	Very high	91	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.6	179.6	-70.1	178.3	0	0	0	112.9	V437 L447 R465 F471 L477 V495 R496 V497	V437-L439 PolarHBondContact O-N 3.37Å; L439-L447 HydrophobicContact CD2-CD2 4.16Å; L439-R465 PolarHBondContact O-NH1 3.27Å; L439-F471 HydrophobicContact CB-CD2 3.85Å; L439-F471 HydrophobicContact CB-CE2 4.41Å; L439-F471 HydrophobicContact CB-CG 4.3Å; L439-F471 HydrophobicContact CD1-CB 4.42Å; L439-F471 HydrophobicContact CD1-CD1 4.47Å; L439-F471 HydrophobicContact CD1-CD2 4.45Å; L439-F471 HydrophobicContact CD1-CG 4.2Å; L439-L477 HydrophobicContact CD1-CD1 3.92Å; L439-L477 HydrophobicContact CD1-CD2 3.78Å; L439-L477 HydrophobicContact CD1-CG 3.75Å; L439-L477 HydrophobicContact CD2-CD2 4.01Å; L439-V495 HydrophobicContact CD1-CB 4.23Å; L439-V495 HydrophobicContact CD1-CG2 4.2Å; L439-V495 HydrophobicContact CD2-CB 3.83Å; L439-V495 HydrophobicContact CD2-CG1 3.67Å; L439-V495 HydrophobicContact CD2-CG2 4.46Å; L439-V495 HydrophobicContact CG-CB 3.86Å; L439-V495 HydrophobicContact CG-CG1 4.29Å; L439-V495 HydrophobicContact CG-CG2 4.38Å; L439-R496 PolarHBondContact N-O 2.85Å; L439-V497 HydrophobicContact CD1-CG2 3.95Å
440	N	89.4	Confident	91	Very high	30 Å²	30	31 Å²	31	16%	0.16	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-28.2	-174.1	-71.8	-32	0	0	0	112.4	D438 R465 P470 F471 K498	D438-N440 PolarHBondContact O-N 3.32Å; D438-N440 PolarHBondContact OD1-N 3.12Å; N440-R465 WeakPolarHBondContact O-CD 3.26Å; N440-R465 PolarHBondContact O-NH1 3.41Å; N440-R465 VanDerWaalsContact O-NH1 3.17Å; N440-P470 WeakPolarHBondContact OD1-CA 3.45Å; N440-F471 PolarHBondContact ND2-O 2.84Å; N440-F471 WeakPolarHBondContact OD1-CD2 3.4Å; N440-F471 PolarHBondContact OD1-N 3.18Å; N440-K498 PolarHBondContact ND2-O 3.39Å
441	A	85.3	Confident	91	Very high	72 Å²	72	27.3 Å²	27.3	60%	0.595	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-27	-178.7	0	0	0	0	0	114.1	D438	D438-A441 HydrophobicContact CB-CB 4.29Å; D438-A441 PolarHBondContact O-N 2.87Å; D438-A441 WeakPolarHBondContact OD2-CB 3.39Å
442	A	88.2	Confident	90.9	Very high	8 Å²	8	29 Å²	29	7%	0.066	17%	0.174	C	C	.	.			trans	-64.9	139.8	-166.2	0	0	0	0	0	113.8	V437 D438 L447 R465	V437-A442 HydrophobicContact CG1-CB 3.19Å; D438-A442 WeakPolarHBondContact O-CB 3.21Å; D438-A442 PolarHBondContact O-N 3.07Å; A442-L447 HydrophobicContact CB-CD1 4.36Å; A442-L447 HydrophobicContact CB-CD2 3.94Å; A442-L447 HydrophobicContact CB-CG 3.82Å; A442-R465 PolarHBondContact O-NH1 2.75Å
443	P	89.2	Confident	91	Very high	53 Å²	53	29.5 Å²	29.5	34%	0.344	18%	0.177	S	C	.	.			trans	-81	165.5	175	34.3	-36.6	0	0	0	112	H445 I446 L447	P443-H445 VanDerWaalsContact C-N 3.31Å; P443-H445 VanDerWaalsContact CB-CE1 3.45Å; P443-H445 WeakPolarHBondContact CB-CE1 3.45Å; P443-H445 WeakPolarHBondContact CG-CE1 3.46Å; P443-H445 PolarHBondContact O-N 2.79Å; P443-I446 HydrophobicContact CG-CB 4.18Å; P443-I446 HydrophobicContact CG-CG1 3.79Å; P443-I446 PolarHBondContact O-N 2.8Å; P443-I446 VanDerWaalsContact O-N 3.17Å; P443-L447 PolarHBondContact O-N 3.18Å; P443-L447 VanDerWaalsContact O-N 3.11Å
444	L	91.4	Very high	91.1	Very high	55 Å²	55	31.2 Å²	31.2	29%	0.288	19%	0.189	S	C	.	.	H	α-helix	trans	-53	-45.2	-176.7	178.2	60	0	0	0	113.2	I446 L447 S448 A458 K459 L462	L444-I446 VanDerWaalsContact C-N 3.26Å; L444-I446 PolarHBondContact O-N 3.41Å; L444-L447 PolarHBondContact O-N 3.24Å; L444-S448 WeakPolarHBondContact O-CB 3.33Å; L444-S448 PolarHBondContact O-N 2.97Å; L444-S448 PolarHBondContact O-OG 2.74Å; L444-A458 HydrophobicContact CD1-CB 3.67Å; L444-K459 HydrophobicContact CD1-CB 4.48Å; L444-K459 HydrophobicContact CD1-CG 3.63Å; L444-K459 HydrophobicContact CD2-CG 4.12Å; L444-L462 HydrophobicContact CB-CD1 3.6Å; L444-L462 HydrophobicContact CD1-CD1 3.91Å; L444-L462 HydrophobicContact CG-CD1 4.27Å
445	H	90.8	Very high	91.3	Very high	39 Å²	39	31.4 Å²	31.4	18%	0.181	19%	0.192	C	C	.	.	H	α-helix	trans	-72.7	-15.9	-173.8	60.7	-83.6	0	0	0	114.1	A396 K400 P443 S448 R449	A396-H445 PolarHBondContact O-NE2 3.42Å; K400-H445 WeakPolarHBondContact CE-CE1 3.06Å; K400-H445 VanDerWaalsContact CE-NE2 3.3Å; K400-H445 WeakPolarHBondContact CE-NE2 3.44Å; P443-H445 VanDerWaalsContact C-N 3.31Å; P443-H445 VanDerWaalsContact CB-CE1 3.45Å; P443-H445 WeakPolarHBondContact CB-CE1 3.45Å; P443-H445 WeakPolarHBondContact CG-CE1 3.46Å; P443-H445 PolarHBondContact O-N 2.79Å; H445-S448 PolarHBondContact O-OG 3.1Å; H445-R449 VanDerWaalsContact O-CG 3.31Å; H445-R449 WeakPolarHBondContact O-CG 3.35Å
446	I	92.9	Very high	91.6	Very high	15 Å²	15	38.2 Å²	38.2	8%	0.077	22%	0.224	C	C	.	.	H	α-helix	trans	-90.2	-46.5	172	-63.8	-66.4	0	0	0	109.8	V399 I432 V437 P443 L444 S448 R449	V399-I446 HydrophobicContact CB-CD1 4.03Å; V399-I446 HydrophobicContact CG1-CD1 4.06Å; V399-I446 HydrophobicContact CG2-CD1 4.14Å; I432-I446 HydrophobicContact CD1-CD1 4.15Å; I432-I446 HydrophobicContact CG2-CG2 4.23Å; V437-I446 HydrophobicContact CB-CG2 4.48Å; V437-I446 HydrophobicContact CG1-CG2 3.85Å; V437-I446 HydrophobicContact CG2-CG2 3.71Å; P443-I446 HydrophobicContact CG-CB 4.18Å; P443-I446 HydrophobicContact CG-CG1 3.79Å; P443-I446 PolarHBondContact O-N 2.8Å; P443-I446 VanDerWaalsContact O-N 3.17Å; L444-I446 VanDerWaalsContact C-N 3.26Å; L444-I446 PolarHBondContact O-N 3.41Å; I446-S448 PolarHBondContact O-N 3.48Å; I446-R449 WeakPolarHBondContact O-CB 3.48Å; I446-R449 PolarHBondContact O-N 2.82Å
447	L	93.3	Very high	91.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.8	-35.3	177.6	-74	172.9	0	0	0	112.7	V437 L439 A442 P443 L444 R449 V450 L453 A458 I461 L462	V437-L447 HydrophobicContact CG1-CD2 4Å; L439-L447 HydrophobicContact CD2-CD2 4.16Å; A442-L447 HydrophobicContact CB-CD1 4.36Å; A442-L447 HydrophobicContact CB-CD2 3.94Å; A442-L447 HydrophobicContact CB-CG 3.82Å; P443-L447 PolarHBondContact O-N 3.18Å; P443-L447 VanDerWaalsContact O-N 3.11Å; L444-L447 PolarHBondContact O-N 3.24Å; L447-R449 PolarHBondContact O-N 3.33Å; L447-R449 VanDerWaalsContact O-N 3.16Å; L447-V450 PolarHBondContact O-N 2.87Å; L447-L453 VanDerWaalsContact O-CB 3.31Å; L447-L453 WeakPolarHBondContact O-CB 3.36Å; L447-L453 WeakPolarHBondContact O-CD1 3.16Å; L447-A458 HydrophobicContact CB-CB 3.7Å; L447-I461 HydrophobicContact CD1-CG2 4.09Å; L447-L462 HydrophobicContact CD1-CD2 3.94Å; L447-L462 HydrophobicContact CD1-CG 4.16Å
448	S	93.4	Very high	92.1	Very high	27 Å²	27	39.4 Å²	39.4	19%	0.189	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-5	178.6	66.8	0	0	0	0	114.6	L444 H445 I446	L444-S448 WeakPolarHBondContact O-CB 3.33Å; L444-S448 PolarHBondContact O-N 2.97Å; L444-S448 PolarHBondContact O-OG 2.74Å; H445-S448 PolarHBondContact O-OG 3.1Å; I446-S448 PolarHBondContact O-N 3.48Å
449	R	93.1	Very high	92.4	Very high	74 Å²	74	42.9 Å²	42.9	28%	0.279	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114	-4	-178.7	-57.4	-63.7	-170.8	171.1	0.8	113.4	V399 H425 I432 H445 I446 L447	V399-R449 HydrophobicContact CG1-CG 4.08Å; H425-R449 PolarHBondContact CE1-NH1 3.07Å; H425-R449 PolarHBondContact CE1-NH2 2.9Å; H425-R449 PolarHBondContact ND1-NH1 3.17Å; I432-R449 HydrophobicContact CD1-CB 3.43Å; I432-R449 VanDerWaalsContact CD1-CB 3.43Å; I432-R449 HydrophobicContact CD1-CG 4.01Å; H445-R449 VanDerWaalsContact O-CG 3.31Å; H445-R449 WeakPolarHBondContact O-CG 3.35Å; I446-R449 WeakPolarHBondContact O-CB 3.48Å; I446-R449 PolarHBondContact O-N 2.82Å; L447-R449 PolarHBondContact O-N 3.33Å; L447-R449 VanDerWaalsContact O-N 3.16Å
450	V	93.7	Very high	92.7	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	25%	0.249	C	C	.	.	S	Bend	trans	-69.3	137.8	172.8	176.6	0	0	0	0	108.4	I432 V437 L447 G452 L453 C491 F494 V495	I432-V450 HydrophobicContact CG2-CG2 4.04Å; V437-V450 HydrophobicContact CB-CG2 4.15Å; V437-V450 HydrophobicContact CG1-CG2 4.48Å; V437-V450 HydrophobicContact CG2-CG2 3.76Å; L447-V450 PolarHBondContact O-N 2.87Å; V450-G452 PolarHBondContact O-N 3.38Å; V450-L453 HydrophobicContact CB-CB 4.35Å; V450-L453 HydrophobicContact CB-CD1 3.92Å; V450-L453 HydrophobicContact CB-CG 4.14Å; V450-L453 HydrophobicContact CG1-CD1 4.2Å; V450-L453 HydrophobicContact CG1-CG 4.31Å; V450-L453 HydrophobicContact CG2-CD1 4.5Å; V450-L453 WeakPolarHBondContact O-CB 3.42Å; V450-L453 PolarHBondContact O-N 3.37Å; V450-C491 HydrophobicContact CG1-CB 4.08Å; V450-F494 HydrophobicContact CG1-CB 4Å; V450-V495 HydrophobicContact CG1-CG1 4.16Å
451	A	92.4	Very high	93	Very high	10 Å²	10	42.7 Å²	42.7	8%	0.083	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	130.6	179.3	0	0	0	0	0	111.8	L453 C491 F494	A451-L453 VanDerWaalsContact C-N 3.26Å; A451-L453 PolarHBondContact O-N 3.19Å; A451-C491 WeakPolarHBondContact O-CA 3.44Å; A451-C491 WeakPolarHBondContact O-CB 3.28Å; A451-F494 HydrophobicContact CB-CD2 3.75Å; A451-F494 HydrophobicContact CB-CE2 3.61Å
452	G	91.8	Very high	93.4	Very high	35 Å²	35	41 Å²	41	36%	0.361	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-11.6	-178	0	0	0	0	0	116.2	V450 K457	V450-G452 PolarHBondContact O-N 3.38Å; G452-K457 PolarHBondContact O-NZ 2.78Å
453	L	94.2	Very high	93.8	Very high	13 Å²	13	43.9 Å²	43.9	7%	0.068	24%	0.239	C	C	.	.			trans	-95.1	132	176.1	-58.4	-168.8	0	0	0	111.4	L447 V450 A451 K457 I461 I483 T487 C491	L447-L453 VanDerWaalsContact O-CB 3.31Å; L447-L453 WeakPolarHBondContact O-CB 3.36Å; L447-L453 WeakPolarHBondContact O-CD1 3.16Å; V450-L453 HydrophobicContact CB-CB 4.35Å; V450-L453 HydrophobicContact CB-CD1 3.92Å; V450-L453 HydrophobicContact CB-CG 4.14Å; V450-L453 HydrophobicContact CG1-CD1 4.2Å; V450-L453 HydrophobicContact CG1-CG 4.31Å; V450-L453 HydrophobicContact CG2-CD1 4.5Å; V450-L453 WeakPolarHBondContact O-CB 3.42Å; V450-L453 PolarHBondContact O-N 3.37Å; A451-L453 VanDerWaalsContact C-N 3.26Å; A451-L453 PolarHBondContact O-N 3.19Å; L453-K457 HydrophobicContact CD2-CB 4.33Å; L453-K457 HydrophobicContact CD2-CD 4.37Å; L453-I461 HydrophobicContact CD1-CD1 3.6Å; L453-I461 HydrophobicContact CD2-CD1 4.2Å; L453-I483 HydrophobicContact CD2-CD1 4.42Å; L453-T487 HydrophobicContact CD2-CG2 4.02Å; L453-C491 HydrophobicContact CD2-CB 4.09Å; L453-C491 HydrophobicContact CG-CB 4.04Å
454	S	93.7	Very high	94.1	Very high	55 Å²	55	43.1 Å²	43.1	39%	0.385	23%	0.229	S	C	.	.			trans	-103	167.5	170.5	70	0	0	0	0	110.2	M456 K457 A458	S454-M456 PolarHBondContact O-N 3.45Å; S454-M456 VanDerWaalsContact O-N 3.14Å; S454-K457 PolarHBondContact O-N 3.05Å; S454-K457 PolarHBondContact OG-N 2.9Å; S454-A458 WeakPolarHBondContact O-CB 3.38Å; S454-A458 PolarHBondContact O-N 3.02Å
455	E	93.5	Very high	94.1	Very high	110 Å²	110	43.5 Å²	43.5	51%	0.514	23%	0.227	S	C	.	.	H	α-helix	trans	-53.8	-36.2	175.1	-166.1	-170.1	152.1	0	0	112.4	K459	E455-K459 WeakPolarHBondContact O-CG 3.45Å; E455-K459 PolarHBondContact O-N 2.94Å; E455-K459 VanDerWaalsContact OE1-CE 3.25Å; E455-K459 WeakPolarHBondContact OE1-CE 3.45Å; E455-K459 IonicContact OE1-NZ 2.69Å; E455-K459 PolarHBondContact OE1-NZ 2.89Å
456	M	95.8	Very high	94.1	Very high	154 Å²	154	46.7 Å²	46.7	76%	0.759	25%	0.254	S	S	*	.	H	α-helix	trans	-66.2	-44.8	176.4	-173.4	-176.9	-65.2	0	0	112	S454 K459 A460	S454-M456 PolarHBondContact O-N 3.45Å; S454-M456 VanDerWaalsContact O-N 3.14Å; M456-K459 PolarHBondContact O-N 3.26Å; M456-A460 PolarHBondContact O-N 2.6Å; M456-A460 VanDerWaalsContact O-N 3.1Å
457	K	96.3	Very high	94.2	Very high	50 Å²	50	53.3 Å²	53.3	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-40.2	177.7	-65.8	178	-178.6	176.8	0	111.4	G452 L453 S454 K459 A460 I461 T487	G452-K457 PolarHBondContact O-NZ 2.78Å; L453-K457 HydrophobicContact CD2-CB 4.33Å; L453-K457 HydrophobicContact CD2-CD 4.37Å; S454-K457 PolarHBondContact O-N 3.05Å; S454-K457 PolarHBondContact OG-N 2.9Å; K457-K459 PolarHBondContact O-N 2.78Å; K457-A460 WeakPolarHBondContact O-CA 3.39Å; K457-A460 WeakPolarHBondContact O-CB 3.49Å; K457-A460 PolarHBondContact O-N 3.19Å; K457-A460 VanDerWaalsContact O-N 3.08Å; K457-I461 WeakPolarHBondContact O-CG1 3.31Å; K457-I461 PolarHBondContact O-N 2.8Å; K457-T487 HydrophobicContact CD-CG2 3.9Å; K457-T487 VanDerWaalsContact NZ-CG2 3.29Å; K457-T487 PolarHBondContact NZ-OG1 2.87Å
458	A	95.8	Very high	94.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.2	-41.8	175.6	0	0	0	0	0	112	L444 L447 S454 A460 I461 L462	L444-A458 HydrophobicContact CD1-CB 3.67Å; L447-A458 HydrophobicContact CB-CB 3.7Å; S454-A458 WeakPolarHBondContact O-CB 3.38Å; S454-A458 PolarHBondContact O-N 3.02Å; A458-A460 VanDerWaalsContact C-N 3.31Å; A458-A460 PolarHBondContact O-N 3.2Å; A458-I461 PolarHBondContact O-N 2.83Å; A458-L462 WeakPolarHBondContact O-CG 3.34Å; A458-L462 PolarHBondContact O-N 2.94Å
459	K	96.1	Very high	93.9	Very high	98 Å²	98	57.6 Å²	57.6	43%	0.426	31%	0.314	S	S	.	.	H	α-helix	trans	-61.4	-38.4	171.5	-73.7	174.7	-173.6	167	0	112.4	L444 E455 M456 K457 L462 T463	L444-K459 HydrophobicContact CD1-CB 4.48Å; L444-K459 HydrophobicContact CD1-CG 3.63Å; L444-K459 HydrophobicContact CD2-CG 4.12Å; E455-K459 WeakPolarHBondContact O-CG 3.45Å; E455-K459 PolarHBondContact O-N 2.94Å; E455-K459 VanDerWaalsContact OE1-CE 3.25Å; E455-K459 WeakPolarHBondContact OE1-CE 3.45Å; E455-K459 IonicContact OE1-NZ 2.69Å; E455-K459 PolarHBondContact OE1-NZ 2.89Å; M456-K459 PolarHBondContact O-N 3.26Å; K457-K459 PolarHBondContact O-N 2.78Å; K459-L462 PolarHBondContact O-N 2.86Å; K459-T463 WeakPolarHBondContact O-CB 3.34Å; K459-T463 PolarHBondContact O-N 2.96Å; K459-T463 PolarHBondContact O-OG1 3.22Å
460	A	96.6	Very high	93.7	Very high	27 Å²	27	56.5 Å²	56.5	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.3	0	0	0	0	0	112.1	M456 K457 A458 T463 Y464 V480	M456-A460 PolarHBondContact O-N 2.6Å; M456-A460 VanDerWaalsContact O-N 3.1Å; K457-A460 WeakPolarHBondContact O-CA 3.39Å; K457-A460 WeakPolarHBondContact O-CB 3.49Å; K457-A460 PolarHBondContact O-N 3.19Å; K457-A460 VanDerWaalsContact O-N 3.08Å; A458-A460 VanDerWaalsContact C-N 3.31Å; A458-A460 PolarHBondContact O-N 3.2Å; A460-T463 PolarHBondContact O-N 3.15Å; A460-Y464 WeakPolarHBondContact O-CB 3.33Å; A460-Y464 PolarHBondContact O-N 2.85Å; A460-V480 HydrophobicContact CB-CG1 3.81Å
461	I	95.9	Very high	93.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-47.6	174.2	-67.7	169.7	0	0	0	110.6	L447 L453 K457 A458 T463 Y464 R465 F471 L477 V480 I483	L447-I461 HydrophobicContact CD1-CG2 4.09Å; L453-I461 HydrophobicContact CD1-CD1 3.6Å; L453-I461 HydrophobicContact CD2-CD1 4.2Å; K457-I461 WeakPolarHBondContact O-CG1 3.31Å; K457-I461 PolarHBondContact O-N 2.8Å; A458-I461 PolarHBondContact O-N 2.83Å; I461-T463 VanDerWaalsContact C-N 3.34Å; I461-T463 PolarHBondContact O-N 3.22Å; I461-Y464 PolarHBondContact O-N 2.78Å; I461-R465 WeakPolarHBondContact O-CB 3.43Å; I461-R465 PolarHBondContact O-N 2.93Å; I461-F471 HydrophobicContact CG2-CE2 3.79Å; I461-F471 HydrophobicContact CG2-CZ 3.82Å; I461-L477 HydrophobicContact CD1-CD2 4.08Å; I461-L477 HydrophobicContact CG1-CD2 4.21Å; I461-V480 HydrophobicContact CG1-CG1 4.21Å; I461-I483 HydrophobicContact CD1-CD1 3.84Å; I461-I483 HydrophobicContact CG1-CD1 3.73Å
462	L	93.6	Very high	93.5	Very high	35 Å²	35	63.5 Å²	63.5	18%	0.183	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-41.9	177.4	-69	177.9	0	0	0	112.2	L444 L447 A458 K459 Y464 R465 S466	L444-L462 HydrophobicContact CB-CD1 3.6Å; L444-L462 HydrophobicContact CD1-CD1 3.91Å; L444-L462 HydrophobicContact CG-CD1 4.27Å; L447-L462 HydrophobicContact CD1-CD2 3.94Å; L447-L462 HydrophobicContact CD1-CG 4.16Å; A458-L462 WeakPolarHBondContact O-CG 3.34Å; A458-L462 PolarHBondContact O-N 2.94Å; K459-L462 PolarHBondContact O-N 2.86Å; L462-Y464 VanDerWaalsContact C-N 3.34Å; L462-Y464 PolarHBondContact O-N 2.71Å; L462-R465 VanDerWaalsContact CD2-CZ 3.41Å; L462-R465 PolarHBondContact O-N 2.95Å; L462-S466 PolarHBondContact O-N 2.79Å; L462-S466 PolarHBondContact O-OG 2.6Å
463	T	95.5	Very high	93.5	Very high	70 Å²	70	63.4 Å²	63.4	43%	0.429	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-44	177	-56.2	0	0	0	0	110.9	K459 A460 I461 S466 Q467	K459-T463 WeakPolarHBondContact O-CB 3.34Å; K459-T463 PolarHBondContact O-N 2.96Å; K459-T463 PolarHBondContact O-OG1 3.22Å; A460-T463 PolarHBondContact O-N 3.15Å; I461-T463 VanDerWaalsContact C-N 3.34Å; I461-T463 PolarHBondContact O-N 3.22Å; T463-S466 PolarHBondContact O-N 2.84Å; T463-Q467 HydrophobicContact CG2-CG 4.48Å; T463-Q467 WeakPolarHBondContact O-CB 3.19Å; T463-Q467 VanDerWaalsContact O-CG 3.3Å; T463-Q467 WeakPolarHBondContact O-CG 3.29Å; T463-Q467 PolarHBondContact O-N 2.83Å
464	Y	95.4	Very high	93.5	Very high	37 Å²	37	62.9 Å²	62.9	15%	0.145	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-46.5	175.4	-177.2	-85.3	0	0	0	111.3	A460 I461 L462 S466 Q467 V468 F471 K479 V480	A460-Y464 WeakPolarHBondContact O-CB 3.33Å; A460-Y464 PolarHBondContact O-N 2.85Å; I461-Y464 PolarHBondContact O-N 2.78Å; L462-Y464 VanDerWaalsContact C-N 3.34Å; L462-Y464 PolarHBondContact O-N 2.71Å; Y464-S466 VanDerWaalsContact C-N 3.28Å; Y464-S466 PolarHBondContact O-N 2.97Å; Y464-Q467 PolarHBondContact O-N 3.22Å; Y464-Q467 VanDerWaalsContact O-N 3.11Å; Y464-V468 HydrophobicContact CD1-CB 4.3Å; Y464-V468 HydrophobicContact CD1-CG2 4.46Å; Y464-V468 HydrophobicContact CD2-CG2 3.9Å; Y464-V468 HydrophobicContact CE1-CB 3.97Å; Y464-V468 HydrophobicContact CE1-CG1 4.15Å; Y464-V468 HydrophobicContact CE1-CG2 4.26Å; Y464-V468 HydrophobicContact CE2-CB 4.28Å; Y464-V468 HydrophobicContact CE2-CG2 3.68Å; Y464-V468 HydrophobicContact CG-CG2 4.29Å; Y464-V468 PolarHBondContact O-N 3.45Å; Y464-F471 HydrophobicContact CD1-CD1 4.29Å; Y464-F471 AromaticContact CD1-CE1 3.43Å; Y464-F471 HydrophobicContact CD1-CE1 3.43Å; Y464-F471 VanDerWaalsContact CD1-CE1 3.43Å; Y464-F471 HydrophobicContact CD1-CE2 4.22Å; Y464-F471 AromaticContact CD1-CZ 3.38Å; Y464-F471 HydrophobicContact CD1-CZ 3.38Å; Y464-F471 HydrophobicContact CE1-CD1 4.05Å; Y464-F471 AromaticContact CE1-CE1 3.54Å; Y464-F471 HydrophobicContact CE1-CE1 3.54Å; Y464-F471 AromaticContact CE1-CZ 3.98Å; Y464-F471 HydrophobicContact CE1-CZ 3.98Å; Y464-F471 HydrophobicContact CG-CE1 4.4Å; Y464-F471 HydrophobicContact CG-CZ 4.23Å; Y464-K479 HydrophobicContact CE2-CB 3.8Å; Y464-K479 WeakPolarHBondContact OH-CD 3.19Å; Y464-V480 HydrophobicContact CD1-CG2 4.12Å; Y464-V480 HydrophobicContact CD2-CG2 4.04Å; Y464-V480 HydrophobicContact CG-CG2 3.79Å
465	R	92.3	Very high	93.5	Very high	62 Å²	62	62.8 Å²	62.8	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-56.6	-40.7	176.7	-170.8	174.4	73.6	-168.9	10.6	112.3	L439 N440 A442 I461 L462 G469 F471	L439-R465 PolarHBondContact O-NH1 3.27Å; N440-R465 WeakPolarHBondContact O-CD 3.26Å; N440-R465 PolarHBondContact O-NH1 3.41Å; N440-R465 VanDerWaalsContact O-NH1 3.17Å; A442-R465 PolarHBondContact O-NH1 2.75Å; I461-R465 WeakPolarHBondContact O-CB 3.43Å; I461-R465 PolarHBondContact O-N 2.93Å; L462-R465 VanDerWaalsContact CD2-CZ 3.41Å; L462-R465 PolarHBondContact O-N 2.95Å; R465-G469 CarbonylContact O-C 3.57Å; R465-G469 WeakPolarHBondContact O-CA 3.29Å; R465-G469 PolarHBondContact O-N 2.96Å; R465-F471 HydrophobicContact CB-CE2 4.09Å
466	S	91.4	Very high	93.5	Very high	106 Å²	106	58.3 Å²	58.3	74%	0.741	31%	0.313	S	S	*	.	H	α-helix	trans	-73	-30.2	177.2	-65.8	0	0	0	0	114	L462 T463 Y464	L462-S466 PolarHBondContact O-N 2.79Å; L462-S466 PolarHBondContact O-OG 2.6Å; T463-S466 PolarHBondContact O-N 2.84Å; Y464-S466 VanDerWaalsContact C-N 3.28Å; Y464-S466 PolarHBondContact O-N 2.97Å
467	Q	93.4	Very high	93.4	Very high	155 Å²	155	51 Å²	51	72%	0.724	28%	0.277	S	S	*	.	H	α-helix	trans	-91.7	-41	-174.9	-73	176.5	-5.9	0	0	113.6	T463 Y464	T463-Q467 HydrophobicContact CG2-CG 4.48Å; T463-Q467 WeakPolarHBondContact O-CB 3.19Å; T463-Q467 VanDerWaalsContact O-CG 3.3Å; T463-Q467 WeakPolarHBondContact O-CG 3.29Å; T463-Q467 PolarHBondContact O-N 2.83Å; Y464-Q467 PolarHBondContact O-N 3.22Å; Y464-Q467 VanDerWaalsContact O-N 3.11Å
468	V	92.3	Very high	93.4	Very high	95 Å²	95	52.1 Å²	52.1	58%	0.576	29%	0.285	S	S	*	.	H	α-helix	trans	-99.8	-26.8	-173.8	-177.2	0	0	0	0	111.6	Y464	Y464-V468 HydrophobicContact CD1-CB 4.3Å; Y464-V468 HydrophobicContact CD1-CG2 4.46Å; Y464-V468 HydrophobicContact CD2-CG2 3.9Å; Y464-V468 HydrophobicContact CE1-CB 3.97Å; Y464-V468 HydrophobicContact CE1-CG1 4.15Å; Y464-V468 HydrophobicContact CE1-CG2 4.26Å; Y464-V468 HydrophobicContact CE2-CB 4.28Å; Y464-V468 HydrophobicContact CE2-CG2 3.68Å; Y464-V468 HydrophobicContact CG-CG2 4.29Å; Y464-V468 PolarHBondContact O-N 3.45Å
469	G	88.9	Confident	93.3	Very high	22 Å²	22	58.3 Å²	58.3	23%	0.227	31%	0.312	C	S	.	.			trans	105.4	-166.3	-173.2	0	0	0	0	0	112.4	R465	R465-G469 CarbonylContact O-C 3.57Å; R465-G469 WeakPolarHBondContact O-CA 3.29Å; R465-G469 PolarHBondContact O-N 2.96Å
470	P	89.6	Confident	93.3	Very high	51 Å²	51	53.9 Å²	53.9	33%	0.331	29%	0.293	S	S	.	.	S	Bend	trans	-66.3	145.4	-176.1	27.9	-34.2	0	0	0	111.9	N440	N440-P470 WeakPolarHBondContact OD1-CA 3.45Å
471	F	91.5	Very high	93.2	Very high	3 Å²	3	61.7 Å²	61.7	1%	0.013	32%	0.322	C	S	.	.			trans	-64.5	134.2	167.9	-64.3	-87.5	0	0	0	109	L439 N440 I461 Y464 R465 D476 L477 V480 V497	L439-F471 HydrophobicContact CB-CD2 3.85Å; L439-F471 HydrophobicContact CB-CE2 4.41Å; L439-F471 HydrophobicContact CB-CG 4.3Å; L439-F471 HydrophobicContact CD1-CB 4.42Å; L439-F471 HydrophobicContact CD1-CD1 4.47Å; L439-F471 HydrophobicContact CD1-CD2 4.45Å; L439-F471 HydrophobicContact CD1-CG 4.2Å; N440-F471 PolarHBondContact ND2-O 2.84Å; N440-F471 WeakPolarHBondContact OD1-CD2 3.4Å; N440-F471 PolarHBondContact OD1-N 3.18Å; I461-F471 HydrophobicContact CG2-CE2 3.79Å; I461-F471 HydrophobicContact CG2-CZ 3.82Å; Y464-F471 HydrophobicContact CD1-CD1 4.29Å; Y464-F471 AromaticContact CD1-CE1 3.43Å; Y464-F471 HydrophobicContact CD1-CE1 3.43Å; Y464-F471 VanDerWaalsContact CD1-CE1 3.43Å; Y464-F471 HydrophobicContact CD1-CE2 4.22Å; Y464-F471 AromaticContact CD1-CZ 3.38Å; Y464-F471 HydrophobicContact CD1-CZ 3.38Å; Y464-F471 HydrophobicContact CE1-CD1 4.05Å; Y464-F471 AromaticContact CE1-CE1 3.54Å; Y464-F471 HydrophobicContact CE1-CE1 3.54Å; Y464-F471 AromaticContact CE1-CZ 3.98Å; Y464-F471 HydrophobicContact CE1-CZ 3.98Å; Y464-F471 HydrophobicContact CG-CE1 4.4Å; Y464-F471 HydrophobicContact CG-CZ 4.23Å; R465-F471 HydrophobicContact CB-CE2 4.09Å; F471-D476 HydrophobicContact CD1-CB 3.67Å; F471-D476 HydrophobicContact CE1-CB 4.42Å; F471-L477 HydrophobicContact CE1-CD2 4.15Å; F471-L477 HydrophobicContact CZ-CD2 4.43Å; F471-V480 HydrophobicContact CE1-CG2 3.83Å; F471-V480 HydrophobicContact CZ-CG2 4Å; F471-V497 HydrophobicContact CB-CG1 4.49Å; F471-V497 HydrophobicContact CB-CG2 4.42Å; F471-V497 WeakPolarHBondContact O-CG1 3.31Å
472	R	89.9	Confident	93	Very high	155 Å²	155	64.4 Å²	64.4	59%	0.585	35%	0.35	S	S	*	.	S	Bend	trans	-99.2	-28.9	179	-63.2	179.3	179.9	-92.3	-2.2	111.8	D476	R472-D476 WeakPolarHBondContact CA-OD2 3.49Å; R472-D476 PolarHBondContact N-OD2 3.37Å
473	S	92.3	Very high	93.1	Very high	33 Å²	33	63.1 Å²	63.1	23%	0.231	34%	0.343	C	S	.	.	S	Bend	trans	-143	164.1	175.2	68.1	0	0	0	0	111.5	A475 D476 D578	S473-A475 PolarHBondContact O-N 3Å; S473-A475 PolarHBondContact OG-N 3.25Å; S473-D476 PolarHBondContact N-OD2 3.41Å; S473-D476 WeakPolarHBondContact O-CB 3.44Å; S473-D476 PolarHBondContact O-N 2.81Å; S473-D578 WeakPolarHBondContact CA-OD2 2.93Å; S473-D578 WeakPolarHBondContact CB-OD2 3.46Å
474	R	94.2	Very high	93	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.008	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-58.4	-37.6	171	-73.4	175.1	175.1	163.5	-11.8	112.1	D476 L477 F488 A492 V495 V497 L577 D578 T580 V582 P584 Y587	R474-D476 PolarHBondContact O-N 3.27Å; R474-D476 VanDerWaalsContact O-N 3.08Å; R474-L477 VanDerWaalsContact O-CB 3.28Å; R474-L477 WeakPolarHBondContact O-CB 3.45Å; R474-L477 WeakPolarHBondContact O-CG 3.47Å; R474-L477 PolarHBondContact O-N 3.18Å; R474-F488 HydrophobicContact CB-CE2 4.35Å; R474-F488 HydrophobicContact CB-CZ 4.46Å; R474-F488 VanDerWaalsContact O-CE2 3.27Å; R474-F488 WeakPolarHBondContact O-CE2 3.24Å; R474-A492 WeakPolarHBondContact CD-O 3Å; R474-A492 PolarHBondContact NE-O 3.43Å; R474-A492 VanDerWaalsContact NE-O 3.13Å; R474-V495 HydrophobicContact CG-CG2 4.21Å; R474-V495 PolarHBondContact NE-O 3.17Å; R474-V495 PolarHBondContact NH2-O 2.97Å; R474-V497 HydrophobicContact CG-CG2 4.3Å; R474-L577 PolarHBondContact NH1-O 3.43Å; R474-D578 HydrophobicContact CG-CB 4.24Å; R474-D578 PolarHBondContact N-OD2 3.48Å; R474-T580 PolarHBondContact NH2-O 2.97Å; R474-V582 PolarHBondContact NH1-O 3.34Å; R474-P584 HydrophobicContact CB-CG 4.32Å; R474-Y587 WeakPolarHBondContact CD-OH 3.37Å; R474-Y587 PolarHBondContact NH1-OH 2.88Å
475	A	93.2	Very high	93	Very high	53 Å²	53	65.6 Å²	65.6	44%	0.438	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-58.6	-24.1	-178.7	0	0	0	0	0	113.2	S473 L477 L478	S473-A475 PolarHBondContact O-N 3Å; S473-A475 PolarHBondContact OG-N 3.25Å; A475-L477 PolarHBondContact O-N 2.89Å; A475-L477 VanDerWaalsContact O-N 3.14Å; A475-L478 WeakPolarHBondContact O-CB 3.29Å; A475-L478 PolarHBondContact O-N 3.06Å; A475-L478 VanDerWaalsContact O-N 3.08Å
476	D	93.2	Very high	93.1	Very high	16 Å²	16	66.4 Å²	66.4	9%	0.086	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-61.1	-20.3	174.2	-68.2	-33.7	0	0	0	113.1	F471 R472 S473 R474 L478 K479	F471-D476 HydrophobicContact CD1-CB 3.67Å; F471-D476 HydrophobicContact CE1-CB 4.42Å; R472-D476 WeakPolarHBondContact CA-OD2 3.49Å; R472-D476 PolarHBondContact N-OD2 3.37Å; S473-D476 PolarHBondContact N-OD2 3.41Å; S473-D476 WeakPolarHBondContact O-CB 3.44Å; S473-D476 PolarHBondContact O-N 2.81Å; R474-D476 PolarHBondContact O-N 3.27Å; R474-D476 VanDerWaalsContact O-N 3.08Å; D476-L478 PolarHBondContact O-N 3.12Å; D476-K479 HydrophobicContact CB-CD 4.46Å; D476-K479 VanDerWaalsContact O-CB 3.28Å; D476-K479 WeakPolarHBondContact O-CB 3.26Å; D476-K479 PolarHBondContact O-N 3.35Å; D476-K479 WeakPolarHBondContact OD1-CE 3.38Å; D476-K479 IonicContact OD1-NZ 2.69Å; D476-K479 PolarHBondContact OD1-NZ 3.1Å
477	L	94.5	Very high	93.3	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-59.1	-30.7	172.8	-76.5	176.2	0	0	0	113	L439 I461 F471 R474 A475 K479 V480 I483 F488 V495	L439-L477 HydrophobicContact CD1-CD1 3.92Å; L439-L477 HydrophobicContact CD1-CD2 3.78Å; L439-L477 HydrophobicContact CD1-CG 3.75Å; L439-L477 HydrophobicContact CD2-CD2 4.01Å; I461-L477 HydrophobicContact CD1-CD2 4.08Å; I461-L477 HydrophobicContact CG1-CD2 4.21Å; F471-L477 HydrophobicContact CE1-CD2 4.15Å; F471-L477 HydrophobicContact CZ-CD2 4.43Å; R474-L477 VanDerWaalsContact O-CB 3.28Å; R474-L477 WeakPolarHBondContact O-CB 3.45Å; R474-L477 WeakPolarHBondContact O-CG 3.47Å; R474-L477 PolarHBondContact O-N 3.18Å; A475-L477 PolarHBondContact O-N 2.89Å; A475-L477 VanDerWaalsContact O-N 3.14Å; L477-K479 PolarHBondContact O-N 2.87Å; L477-V480 WeakPolarHBondContact O-CB 3.34Å; L477-V480 PolarHBondContact O-N 3.3Å; L477-V480 VanDerWaalsContact O-N 3.08Å; L477-I483 HydrophobicContact CB-CG2 4.46Å; L477-I483 HydrophobicContact CD2-CD1 4.11Å; L477-I483 WeakPolarHBondContact O-CB 3.12Å; L477-F488 HydrophobicContact CB-CD2 3.94Å; L477-F488 HydrophobicContact CB-CE2 4.22Å; L477-F488 HydrophobicContact CD1-CD2 4.34Å; L477-F488 HydrophobicContact CD1-CE2 4.41Å; L477-V495 HydrophobicContact CD1-CG2 3.76Å
478	L	95.6	Very high	93.5	Very high	74 Å²	74	55.5 Å²	55.5	39%	0.387	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-67.5	-17.5	176.8	-68.6	169.7	0	0	0	112.7	A475 D476 V480 F488	A475-L478 WeakPolarHBondContact O-CB 3.29Å; A475-L478 PolarHBondContact O-N 3.06Å; A475-L478 VanDerWaalsContact O-N 3.08Å; D476-L478 PolarHBondContact O-N 3.12Å; L478-V480 VanDerWaalsContact C-N 3.29Å; L478-F488 HydrophobicContact CD1-CD1 4.47Å; L478-F488 HydrophobicContact CD1-CG 4.49Å; L478-F488 HydrophobicContact CD2-CB 3.65Å; L478-F488 HydrophobicContact CD2-CD1 4.43Å; L478-F488 HydrophobicContact CD2-CD2 4.34Å; L478-F488 HydrophobicContact CD2-CG 3.88Å; L478-F488 HydrophobicContact CG-CB 4.32Å; L478-F488 HydrophobicContact CG-CD1 4.5Å; L478-F488 HydrophobicContact CG-CD2 4.1Å; L478-F488 HydrophobicContact CG-CG 4.04Å
479	K	94.8	Very high	93.6	Very high	130 Å²	130	52.8 Å²	52.8	57%	0.565	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-79.2	-14.4	174.7	-56.8	171.3	-179.7	167.9	0	111.9	Y464 D476 L477	Y464-K479 HydrophobicContact CE2-CB 3.8Å; Y464-K479 WeakPolarHBondContact OH-CD 3.19Å; D476-K479 HydrophobicContact CB-CD 4.46Å; D476-K479 VanDerWaalsContact O-CB 3.28Å; D476-K479 WeakPolarHBondContact O-CB 3.26Å; D476-K479 PolarHBondContact O-N 3.35Å; D476-K479 WeakPolarHBondContact OD1-CE 3.38Å; D476-K479 IonicContact OD1-NZ 2.69Å; D476-K479 PolarHBondContact OD1-NZ 3.1Å; L477-K479 PolarHBondContact O-N 2.87Å
480	V	95.4	Very high	93.9	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.03	32%	0.323	C	S	.	.	S	Bend	trans	-79.8	127	-179.2	-176.3	0	0	0	0	110.5	A460 I461 Y464 F471 L477 L478 G482 I483	A460-V480 HydrophobicContact CB-CG1 3.81Å; I461-V480 HydrophobicContact CG1-CG1 4.21Å; Y464-V480 HydrophobicContact CD1-CG2 4.12Å; Y464-V480 HydrophobicContact CD2-CG2 4.04Å; Y464-V480 HydrophobicContact CG-CG2 3.79Å; F471-V480 HydrophobicContact CE1-CG2 3.83Å; F471-V480 HydrophobicContact CZ-CG2 4Å; L477-V480 WeakPolarHBondContact O-CB 3.34Å; L477-V480 PolarHBondContact O-N 3.3Å; L477-V480 VanDerWaalsContact O-N 3.08Å; L478-V480 VanDerWaalsContact C-N 3.29Å; V480-G482 PolarHBondContact O-N 2.96Å; V480-I483 HydrophobicContact CB-CB 4.44Å; V480-I483 HydrophobicContact CB-CD1 3.89Å; V480-I483 HydrophobicContact CB-CG1 4.14Å; V480-I483 HydrophobicContact CG1-CD1 4.02Å; V480-I483 HydrophobicContact CG1-CG1 4.23Å; V480-I483 HydrophobicContact CG2-CD1 4.43Å; V480-I483 PolarHBondContact O-N 3.1Å; V480-I483 VanDerWaalsContact O-N 3.09Å
481	K	93.5	Very high	94.1	Very high	191 Å²	191	55 Å²	55	83%	0.83	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	122.3	177.8	-175	179.1	178.7	179.4	0	111.5
482	G	92.5	Very high	94.3	Very high	56 Å²	56	54.8 Å²	54.8	58%	0.577	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.9	-4.4	178.6	0	0	0	0	0	114.8	V480	V480-G482 PolarHBondContact O-N 2.96Å
483	I	94.8	Very high	94.4	Very high	9 Å²	9	48 Å²	48	5%	0.046	29%	0.285	C	S	.	.			trans	-99.8	101.9	171	-57.4	-171.8	0	0	0	108.3	L453 I461 L477 V480 T487 F488	L453-I483 HydrophobicContact CD2-CD1 4.42Å; I461-I483 HydrophobicContact CD1-CD1 3.84Å; I461-I483 HydrophobicContact CG1-CD1 3.73Å; L477-I483 HydrophobicContact CB-CG2 4.46Å; L477-I483 HydrophobicContact CD2-CD1 4.11Å; L477-I483 WeakPolarHBondContact O-CB 3.12Å; V480-I483 HydrophobicContact CB-CB 4.44Å; V480-I483 HydrophobicContact CB-CD1 3.89Å; V480-I483 HydrophobicContact CB-CG1 4.14Å; V480-I483 HydrophobicContact CG1-CD1 4.02Å; V480-I483 HydrophobicContact CG1-CG1 4.23Å; V480-I483 HydrophobicContact CG2-CD1 4.43Å; V480-I483 PolarHBondContact O-N 3.1Å; V480-I483 VanDerWaalsContact O-N 3.09Å; I483-T487 HydrophobicContact CG1-CG2 4.5Å; I483-T487 HydrophobicContact CG2-CG2 4.03Å; I483-F488 HydrophobicContact CG2-CB 4.43Å
484	G	94.6	Very high	94.5	Very high	39 Å²	39	49.9 Å²	49.9	40%	0.402	29%	0.29	S	S	.	.			trans	-97.4	178.5	171.1	0	0	0	0	0	112.1	A486 T487 F488	G484-A486 VanDerWaalsContact C-N 3.29Å; G484-A486 PolarHBondContact O-N 3.49Å; G484-T487 WeakPolarHBondContact O-CB 3.4Å; G484-T487 PolarHBondContact O-N 2.97Å; G484-F488 PolarHBondContact O-N 2.57Å
485	Q	95.2	Very high	94.5	Very high	119 Å²	119	49.8 Å²	49.8	56%	0.556	29%	0.289	S	S	*	.	H	α-helix	trans	-51.8	-43.8	-176.2	-165.8	63.7	20.9	0	0	113.5	T487 F488 A489	Q485-T487 VanDerWaalsContact C-N 3.33Å; Q485-T487 PolarHBondContact O-N 3.24Å; Q485-F488 PolarHBondContact O-N 2.89Å; Q485-A489 WeakPolarHBondContact O-CB 3.33Å; Q485-A489 PolarHBondContact O-N 3.29Å
486	A	95	Very high	94.4	Very high	79 Å²	79	48.1 Å²	48.1	65%	0.653	27%	0.271	S	S	*	.	H	α-helix	trans	-65.7	-34.2	179.3	0	0	0	0	0	113	G484 Q490	G484-A486 VanDerWaalsContact C-N 3.29Å; G484-A486 PolarHBondContact O-N 3.49Å; A486-Q490 WeakPolarHBondContact O-CG 3.42Å; A486-Q490 PolarHBondContact O-N 3.1Å
487	T	96	Very high	94.2	Very high	20 Å²	20	47.4 Å²	47.4	12%	0.123	27%	0.268	C	S	.	.	H	α-helix	trans	-73.8	-42.1	175.3	-61.3	0	0	0	0	110.6	L453 K457 I483 G484 Q485 Q490 C491	L453-T487 HydrophobicContact CD2-CG2 4.02Å; K457-T487 HydrophobicContact CD-CG2 3.9Å; K457-T487 VanDerWaalsContact NZ-CG2 3.29Å; K457-T487 PolarHBondContact NZ-OG1 2.87Å; I483-T487 HydrophobicContact CG1-CG2 4.5Å; I483-T487 HydrophobicContact CG2-CG2 4.03Å; G484-T487 WeakPolarHBondContact O-CB 3.4Å; G484-T487 PolarHBondContact O-N 2.97Å; Q485-T487 VanDerWaalsContact C-N 3.33Å; Q485-T487 PolarHBondContact O-N 3.24Å; T487-Q490 PolarHBondContact O-N 3.2Å; T487-Q490 VanDerWaalsContact O-N 3.11Å; T487-C491 PolarHBondContact O-N 2.99Å; T487-C491 PolarHBondContact O-SG 3.07Å
488	F	96.6	Very high	93.6	Very high	12 Å²	12	49.7 Å²	49.7	5%	0.053	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-49.1	176.7	179.8	-102.8	0	0	0	111.4	R474 L477 L478 I483 G484 Q485 Q490 C491 A492 P584	R474-F488 HydrophobicContact CB-CE2 4.35Å; R474-F488 HydrophobicContact CB-CZ 4.46Å; R474-F488 VanDerWaalsContact O-CE2 3.27Å; R474-F488 WeakPolarHBondContact O-CE2 3.24Å; L477-F488 HydrophobicContact CB-CD2 3.94Å; L477-F488 HydrophobicContact CB-CE2 4.22Å; L477-F488 HydrophobicContact CD1-CD2 4.34Å; L477-F488 HydrophobicContact CD1-CE2 4.41Å; L478-F488 HydrophobicContact CD1-CD1 4.47Å; L478-F488 HydrophobicContact CD1-CG 4.49Å; L478-F488 HydrophobicContact CD2-CB 3.65Å; L478-F488 HydrophobicContact CD2-CD1 4.43Å; L478-F488 HydrophobicContact CD2-CD2 4.34Å; L478-F488 HydrophobicContact CD2-CG 3.88Å; L478-F488 HydrophobicContact CG-CB 4.32Å; L478-F488 HydrophobicContact CG-CD1 4.5Å; L478-F488 HydrophobicContact CG-CD2 4.1Å; L478-F488 HydrophobicContact CG-CG 4.04Å; I483-F488 HydrophobicContact CG2-CB 4.43Å; G484-F488 PolarHBondContact O-N 2.57Å; Q485-F488 PolarHBondContact O-N 2.89Å; F488-Q490 PolarHBondContact O-N 3.14Å; F488-Q490 VanDerWaalsContact O-N 3.13Å; F488-C491 PolarHBondContact O-N 3.27Å; F488-A492 HydrophobicContact CD1-CB 4.37Å; F488-A492 HydrophobicContact CD2-CB 4.07Å; F488-A492 HydrophobicContact CE1-CB 4.09Å; F488-A492 HydrophobicContact CE2-CB 3.74Å; F488-A492 HydrophobicContact CG-CB 4.37Å; F488-A492 HydrophobicContact CZ-CB 3.77Å; F488-A492 WeakPolarHBondContact O-CB 3.43Å; F488-A492 PolarHBondContact O-N 3.06Å; F488-P584 HydrophobicContact CE1-CB 4.33Å; F488-P584 HydrophobicContact CE1-CG 4.47Å; F488-P584 HydrophobicContact CZ-CB 4.28Å; F488-P584 HydrophobicContact CZ-CG 4.08Å
489	A	94.4	Very high	92.3	Very high	38 Å²	38	48.6 Å²	48.6	31%	0.314	28%	0.275	S	S	.	.	H	α-helix	trans	-60.6	-23.3	176.9	0	0	0	0	0	113.9	Q485 H583	Q485-A489 WeakPolarHBondContact O-CB 3.33Å; Q485-A489 PolarHBondContact O-N 3.29Å; A489-H583 PolarHBondContact O-NE2 2.84Å
490	Q	94.6	Very high	90.5	Very high	119 Å²	119	46.4 Å²	46.4	56%	0.556	27%	0.273	S	S	*	.	H	α-helix	trans	-87	-34.2	177.8	-69.4	-70.3	-33.8	0	0	112.6	A486 T487 F488 F494	A486-Q490 WeakPolarHBondContact O-CG 3.42Å; A486-Q490 PolarHBondContact O-N 3.1Å; T487-Q490 PolarHBondContact O-N 3.2Å; T487-Q490 VanDerWaalsContact O-N 3.11Å; F488-Q490 PolarHBondContact O-N 3.14Å; F488-Q490 VanDerWaalsContact O-N 3.13Å; Q490-F494 VanDerWaalsContact O-CD2 3.31Å; Q490-F494 WeakPolarHBondContact O-CD2 3.03Å; Q490-F494 WeakPolarHBondContact O-CE2 3.46Å
491	C	94.9	Very high	87.9	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-101.1	-22.9	-174.3	69.2	0	0	0	0	114.4	V450 A451 L453 T487 F488 G493 F494 V495	V450-C491 HydrophobicContact CG1-CB 4.08Å; A451-C491 WeakPolarHBondContact O-CA 3.44Å; A451-C491 WeakPolarHBondContact O-CB 3.28Å; L453-C491 HydrophobicContact CD2-CB 4.09Å; L453-C491 HydrophobicContact CG-CB 4.04Å; T487-C491 PolarHBondContact O-N 2.99Å; T487-C491 PolarHBondContact O-SG 3.07Å; F488-C491 PolarHBondContact O-N 3.27Å; C491-G493 VanDerWaalsContact C-N 3.31Å; C491-G493 PolarHBondContact O-N 3.47Å; C491-F494 PolarHBondContact O-N 3.1Å; C491-V495 PolarHBondContact O-N 3.3Å
492	A	94.6	Very high	84.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.7	-166	0	0	0	0	0	114.1	R474 F488 F494 V495 P584	R474-A492 WeakPolarHBondContact CD-O 3Å; R474-A492 PolarHBondContact NE-O 3.43Å; R474-A492 VanDerWaalsContact NE-O 3.13Å; F488-A492 HydrophobicContact CD1-CB 4.37Å; F488-A492 HydrophobicContact CD2-CB 4.07Å; F488-A492 HydrophobicContact CE1-CB 4.09Å; F488-A492 HydrophobicContact CE2-CB 3.74Å; F488-A492 HydrophobicContact CG-CB 4.37Å; F488-A492 HydrophobicContact CZ-CB 3.77Å; F488-A492 WeakPolarHBondContact O-CB 3.43Å; F488-A492 PolarHBondContact O-N 3.06Å; A492-F494 VanDerWaalsContact C-N 3.28Å; A492-F494 PolarHBondContact O-N 3.42Å; A492-V495 WeakPolarHBondContact O-CG2 3.47Å; A492-P584 HydrophobicContact CB-CG 3.84Å
493	G	92.8	Very high	81.8	Confident	13 Å²	13	52.6 Å²	52.6	13%	0.134	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.9	175.9	0	0	0	0	0	114.3	C491 H583	C491-G493 VanDerWaalsContact C-N 3.31Å; C491-G493 PolarHBondContact O-N 3.47Å; G493-H583 PolarHBondContact N-CD2 2.91Å; G493-H583 VanDerWaalsContact N-CD2 3.35Å
494	F	94	Very high	78.8	Confident	72 Å²	72	56.1 Å²	56.1	32%	0.316	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-8.5	-175.5	-51.8	-57.6	0	0	0	113.1	S433 G436 V437 V450 A451 Q490 C491 A492	S433-F494 VanDerWaalsContact O-CD1 3.3Å; S433-F494 WeakPolarHBondContact O-CD1 3.41Å; G436-F494 CarbonylContact C-O 3.58Å; G436-F494 WeakPolarHBondContact CA-O 3.2Å; V437-F494 PolarHBondContact N-O 2.85Å; V450-F494 HydrophobicContact CG1-CB 4Å; A451-F494 HydrophobicContact CB-CD2 3.75Å; A451-F494 HydrophobicContact CB-CE2 3.61Å; Q490-F494 VanDerWaalsContact O-CD2 3.31Å; Q490-F494 WeakPolarHBondContact O-CD2 3.03Å; Q490-F494 WeakPolarHBondContact O-CE2 3.46Å; C491-F494 PolarHBondContact O-N 3.1Å; A492-F494 VanDerWaalsContact C-N 3.28Å; A492-F494 PolarHBondContact O-N 3.42Å
495	V	93.5	Very high	75.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	146.3	177.8	-64.5	0	0	0	0	110.7	V437 L439 V450 R474 L477 C491 A492	V437-V495 CarbonylContact O-C 3.56Å; V437-V495 VanDerWaalsContact O-CA 3.3Å; V437-V495 WeakPolarHBondContact O-CA 3.24Å; L439-V495 HydrophobicContact CD1-CB 4.23Å; L439-V495 HydrophobicContact CD1-CG2 4.2Å; L439-V495 HydrophobicContact CD2-CB 3.83Å; L439-V495 HydrophobicContact CD2-CG1 3.67Å; L439-V495 HydrophobicContact CD2-CG2 4.46Å; L439-V495 HydrophobicContact CG-CB 3.86Å; L439-V495 HydrophobicContact CG-CG1 4.29Å; L439-V495 HydrophobicContact CG-CG2 4.38Å; V450-V495 HydrophobicContact CG1-CG1 4.16Å; R474-V495 HydrophobicContact CG-CG2 4.21Å; R474-V495 PolarHBondContact NE-O 3.17Å; R474-V495 PolarHBondContact NH2-O 2.97Å; L477-V495 HydrophobicContact CD1-CG2 3.76Å; C491-V495 PolarHBondContact O-N 3.3Å; A492-V495 WeakPolarHBondContact O-CG2 3.47Å
496	R	91.4	Very high	72.5	Confident	17 Å²	17	61.5 Å²	61.5	6%	0.064	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	154.6	177.3	-57.9	178.9	-168.8	-164.9	-5.3	109.5	V435 V437 D438 L439 D578 D651 F652	V435-R496 PolarHBondContact O-NH2 2.9Å; V437-R496 PolarHBondContact O-N 3.19Å; D438-R496 WeakPolarHBondContact CA-O 3.41Å; L439-R496 PolarHBondContact N-O 2.85Å; R496-D578 VanDerWaalsContact CA-O 3.25Å; R496-D578 WeakPolarHBondContact CA-O 3.44Å; R496-D651 VanDerWaalsContact CD-OD1 3.22Å; R496-D651 WeakPolarHBondContact CD-OD1 3.48Å; R496-D651 IonicContact CZ-OD1 3.13Å; R496-D651 IonicContact NE-OD1 2.63Å; R496-D651 VanDerWaalsContact NH1-C 3.29Å; R496-D651 PolarHBondContact NH1-O 2.85Å; R496-D651 IonicContact NH1-OD1 3.44Å; R496-D651 PolarHBondContact NH1-OD1 3.09Å; R496-F652 PolarHBondContact NH1-O 2.84Å; R496-F652 PolarHBondContact NH2-O 3.13Å
497	V	90.2	Very high	69.5	Low	1 Å²	1	62.4 Å²	62.4	1%	0.006	35%	0.347	C	S	.	.			trans	-125.7	117	174.2	-179.9	0	0	0	0	108.9	L439 F471 R474 D578 Q579	L439-V497 HydrophobicContact CD1-CG2 3.95Å; F471-V497 HydrophobicContact CB-CG1 4.49Å; F471-V497 HydrophobicContact CB-CG2 4.42Å; F471-V497 WeakPolarHBondContact O-CG1 3.31Å; R474-V497 HydrophobicContact CG-CG2 4.3Å; V497-D578 HydrophobicContact CB-CB 4.27Å; V497-D578 PolarHBondContact N-O 3.42Å; V497-D578 VanDerWaalsContact N-O 3.11Å; V497-Q579 WeakPolarHBondContact O-CG 3.37Å
498	K	81.7	Confident	66.6	Low	49 Å²	49	65.5 Å²	65.5	21%	0.213	38%	0.384	C	S	.	.			trans	-89.1	135.5	172.8	-65.9	-174.5	-178.1	-167.3	0	111.4	P247 D438 N440 T500 D651	P247-K498 PolarHBondContact O-NZ 3.27Å; D438-K498 WeakPolarHBondContact OD2-CD 3.35Å; N440-K498 PolarHBondContact ND2-O 3.39Å; K498-T500 PolarHBondContact O-N 2.87Å; K498-D651 WeakPolarHBondContact CE-OD2 3.4Å; K498-D651 IonicContact NZ-OD2 2.8Å; K498-D651 PolarHBondContact NZ-OD2 3.46Å
499	P	68.8	Low	64.1	Low	51 Å²	51	68.7 Å²	68.7	33%	0.331	40%	0.404	S	S	.	.			trans	-67.5	132.3	171.6	28.2	-29.2	0	0	0	108.9	Y501 F574	P499-Y501 PolarHBondContact O-N 2.88Å; P499-F574 HydrophobicContact CB-CD2 3.95Å; P499-F574 HydrophobicContact CB-CE2 4.19Å; P499-F574 HydrophobicContact CB-CG 4.23Å; P499-F574 HydrophobicContact CG-CD2 4.2Å; P499-F574 HydrophobicContact CG-CE1 4.3Å; P499-F574 HydrophobicContact CG-CE2 3.97Å; P499-F574 HydrophobicContact CG-CG 4.48Å; P499-F574 HydrophobicContact CG-CZ 4.03Å
500	T	56.4	Low	61.4	Low	85 Å²	85	71.4 Å²	71.4	52%	0.521	41%	0.409	S	S	.	.	S	Bend	trans	-76.6	-12	-179.8	-33.4	0	0	0	0	112.1	K498	K498-T500 PolarHBondContact O-N 2.87Å
501	Y	41.4	Very low	58.6	Low	144 Å²	144	71 Å²	71	57%	0.565	41%	0.411	S	S	*	.			trans	-161.1	125.4	-179.4	12.8	-95.4	0	0	0	109.1	P499	P499-Y501 PolarHBondContact O-N 2.88Å
502	S	30	Very low	56.1	Low	92 Å²	92	74 Å²	74	64%	0.643	43%	0.428	S	S	*	.			trans	-97.6	116.8	165	179.4	0	0	0	0	108.6	T504	S502-T504 PolarHBondContact OG-N 3.43Å; S502-T504 PolarHBondContact OG-OG1 3.36Å
503	T	28	Very low	53.2	Low	145 Å²	145	82 Å²	82	89%	0.89	47%	0.466	S	S	*	.			trans	-85.6	9.5	168.2	30.1	0	0	0	0	112.6
504	T	29.7	Very low	50.3	Low	83 Å²	83	88.8 Å²	88.8	51%	0.509	50%	0.496	S	S	.	.	S	Bend	trans	-86.6	119.6	-178.8	-34.7	0	0	0	0	109.5	S502 L506	S502-T504 PolarHBondContact OG-N 3.43Å; S502-T504 PolarHBondContact OG-OG1 3.36Å; T504-L506 PolarHBondContact O-N 3.47Å
505	T	26.2	Very low	47.2	Very low	127 Å²	127	91.4 Å²	91.4	78%	0.779	51%	0.512	S	S	*	.			trans	-45.9	122.1	169.5	43.4	0	0	0	0	110	D507	T505-D507 PolarHBondContact O-N 3.45Å; T505-D507 VanDerWaalsContact O-N 3.12Å
506	L	32	Very low	44	Very low	145 Å²	145	96.5 Å²	96.5	76%	0.759	55%	0.548	S	S	*	.			trans	-60.9	109.8	177.3	-82.2	149.7	0	0	0	109.2	T504	T504-L506 PolarHBondContact O-N 3.47Å
507	D	33.3	Very low	41	Very low	97 Å²	97	103.1 Å²	103.1	52%	0.519	58%	0.583	S	S	.	*			trans	-81.4	125.2	161.3	-149.4	-0.3	0	0	0	105.8	T505 T509 K510	T505-D507 PolarHBondContact O-N 3.45Å; T505-D507 VanDerWaalsContact O-N 3.12Å; D507-T509 PolarHBondContact O-N 2.95Å; D507-K510 PolarHBondContact O-N 3.36Å
508	G	33.8	Very low	38.2	Very low	86 Å²	86	108 Å²	108	89%	0.887	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	10.4	-171.7	0	0	0	0	0	115.8
509	T	43.9	Very low	36	Very low	79 Å²	79	111.1 Å²	111.1	49%	0.485	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.1	1.4	174.5	64.6	0	0	0	0	112.9	D507	D507-T509 PolarHBondContact O-N 2.95Å
510	K	37.6	Very low	34.3	Very low	95 Å²	95	112 Å²	112	41%	0.413	66%	0.663	S	S	.	*			trans	-95.5	101.2	176.9	-68.1	-176.3	179.6	179.9	0	108.8	D507 V512	D507-K510 PolarHBondContact O-N 3.36Å; K510-V512 VanDerWaalsContact C-N 3.25Å; K510-V512 PolarHBondContact O-N 2.69Å
511	D	36.2	Very low	33.5	Very low	110 Å²	110	115.8 Å²	115.8	59%	0.588	68%	0.68	S	S	*	*			trans	-67.8	75.9	177	-55.1	-41.4	0	0	0	111.2	R610	D511-R610 IonicContact OD2-NH2 3.76Å; D511-R610 PolarHBondContact OD2-NH2 2.84Å
512	V	43.4	Very low	33.4	Very low	62 Å²	62	115.5 Å²	115.5	38%	0.376	69%	0.688	S	S	.	*			trans	-149.6	92.1	158.2	-177.5	0	0	0	0	107.8	A246 K510 M514	A246-V512 HydrophobicContact CB-CG1 3.71Å; A246-V512 HydrophobicContact CB-CG2 4.45Å; K510-V512 VanDerWaalsContact C-N 3.25Å; K510-V512 PolarHBondContact O-N 2.69Å; V512-M514 HydrophobicContact CG1-CG 3.89Å; V512-M514 PolarHBondContact O-N 3.2Å
513	E	32.1	Very low	33.8	Very low	169 Å²	169	117.3 Å²	117.3	79%	0.79	69%	0.691	S	S	*	*			trans	-71.4	112	164.6	-71.5	-176	164.6	0	0	108.4
514	M	32	Very low	34.4	Very low	155 Å²	155	117.4 Å²	117.4	76%	0.764	69%	0.686	S	S	*	*			trans	-103.9	113.2	168.7	-79.7	-88.5	-75.8	0	0	107.7	V512 S516	V512-M514 HydrophobicContact CG1-CG 3.89Å; V512-M514 PolarHBondContact O-N 3.2Å; M514-S516 PolarHBondContact O-N 2.81Å
515	I	29.5	Very low	34.6	Very low	128 Å²	128	116.8 Å²	116.8	66%	0.656	70%	0.696	S	S	*	*			trans	-72.7	116.5	174.8	-60.7	173	0	0	0	108.6	I517	I515-I517 HydrophobicContact CG2-CG1 4.18Å
516	S	26.8	Very low	35.1	Very low	106 Å²	106	118.3 Å²	118.3	74%	0.741	70%	0.699	S	S	*	*			trans	-75.7	120	165.5	-163.6	0	0	0	0	108.7	M514	M514-S516 PolarHBondContact O-N 2.81Å
517	I	29	Very low	35.3	Very low	157 Å²	157	118.5 Å²	118.5	81%	0.805	70%	0.701	S	S	*	*			trans	-103.5	90.6	168.1	-50.9	175.5	0	0	0	107.3	I515	I515-I517 HydrophobicContact CG2-CG1 4.18Å
518	S	30.9	Very low	35.3	Very low	104 Å²	104	120.6 Å²	120.6	73%	0.727	71%	0.711	S	S	*	*			trans	-87.3	113.5	157.3	43	0	0	0	0	108	G520	S518-G520 PolarHBondContact O-N 2.88Å
519	S	36	Very low	35.1	Very low	113 Å²	113	122.5 Å²	122.5	79%	0.79	71%	0.706	S	S	*	*			trans	-59.7	123.9	164	45.2	0	0	0	0	109.5
520	G	33.3	Very low	34.4	Very low	69 Å²	69	124.7 Å²	124.7	71%	0.711	72%	0.723	S	S	*	*			trans	-71.3	155.8	172.5	0	0	0	0	0	112.4	S518	S518-G520 PolarHBondContact O-N 2.88Å
521	D	38.7	Very low	33.8	Very low	166 Å²	166	127.2 Å²	127.2	89%	0.888	74%	0.741	S	S	*	*			trans	-129.8	143	141.3	-104.8	-20.4	0	0	0	107.3
522	D	39.3	Very low	33.6	Very low	137 Å²	137	128.6 Å²	128.6	73%	0.733	75%	0.754	S	S	*	*			trans	-78.1	159.5	-159.8	-64.5	-54.2	0	0	0	115.2
523	N	38.6	Very low	32.8	Very low	130 Å²	130	133.6 Å²	133.6	70%	0.695	77%	0.773	S	S	*	*			trans	80.8	124.3	137	-76	-10.5	0	0	0	122.4
524	D	39.3	Very low	32.6	Very low	148 Å²	148	132 Å²	132	79%	0.791	77%	0.769	S	S	*	*			trans	77.9	107.2	136.9	-58.1	-28.4	0	0	0	119.9
525	G	35.2	Very low	32.2	Very low	69 Å²	69	130 Å²	130	71%	0.711	77%	0.765	S	S	*	*				85.7	116.6	111.8	0	0	0	0	0	118.3
526	D	36.4	Very low	32.1	Very low	160 Å²	160	131 Å²	131	86%	0.856	77%	0.772	S	S	*	*			trans	75.9	101.9	150.7	-59.4	-15.1	0	0	0	119.7
527	D	35.2	Very low	32.1	Very low	149 Å²	149	131.9 Å²	131.9	80%	0.797	77%	0.767	S	S	*	*				54.1	136.7	120.1	-116.4	-4.9	0	0	0	121.8
528	L	34	Very low	32.1	Very low	140 Å²	140	132.6 Å²	132.6	73%	0.733	77%	0.765	S	S	*	*			trans	86.1	95.9	157	-64.2	149.2	0	0	0	119.6
529	T	28.8	Very low	31.9	Very low	126 Å²	126	133.2 Å²	133.2	77%	0.773	76%	0.764	S	S	*	*				28.2	120.5	125	61.4	0	0	0	0	119.7
530	C	29.8	Very low	31.7	Very low	126 Å²	126	131.7 Å²	131.7	85%	0.851	77%	0.766	S	S	*	*				168.6	130.2	126.7	177.7	0	0	0	0	111
531	D	26.2	Very low	31.5	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	77%	0.77	S	S	*	*			trans	-50.8	141.9	168.3	-62.8	-57.8	0	0	0	113.3
532	T	30.8	Very low	31.2	Very low	139 Å²	139	133.1 Å²	133.1	85%	0.853	77%	0.772	S	S	*	*				-172.8	157.9	117.8	-12.2	0	0	0	0	112.3
533	Q	26.4	Very low	30.7	Very low	168 Å²	168	136.2 Å²	136.2	79%	0.785	78%	0.779	S	S	*	*			trans	-70.5	174.2	-172.6	-61.4	164.1	-5.6	0	0	116.1
534	I	27.8	Very low	30.3	Very low	135 Å²	135	141.6 Å²	141.6	69%	0.692	79%	0.79	S	S	*	*			trans	106.7	102.3	144.5	-50.6	-168.2	0	0	0	118.8
535	T	25.2	Very low	29.8	Very low	112 Å²	112	144.4 Å²	144.4	69%	0.687	80%	0.795	S	S	*	*			trans	35.1	131.1	135.1	72.1	0	0	0	0	124.5
536	N	26.4	Very low	29.4	Very low	149 Å²	149	149.5 Å²	149.5	80%	0.797	80%	0.8	S	S	*	*				75.9	145.2	127.8	-74.3	-10.9	0	0	0	123.3
537	I	25.9	Very low	29.2	Very low	126 Å²	126	149.9 Å²	149.9	65%	0.646	80%	0.8	S	S	*	*			trans	92.4	118.9	149.9	-30.7	-177.2	0	0	0	118.4
538	F	29.6	Very low	28.8	Very low	172 Å²	172	147 Å²	147	75%	0.754	79%	0.792	S	S	*	*				162.2	102.9	112.5	-94.4	-84.5	0	0	0	111.8
539	T	27.6	Very low	28.6	Very low	116 Å²	116	148.2 Å²	148.2	71%	0.712	80%	0.799	S	S	*	*				67	127.2	106.3	69.2	0	0	0	0	118.6
540	G	30.4	Very low	28.5	Very low	81 Å²	81	151 Å²	151	84%	0.835	80%	0.803	S	S	*	*			trans	-154.1	112.1	156.2	0	0	0	0	0	110
541	S	28.7	Very low	28.6	Very low	113 Å²	113	150.8 Å²	150.8	79%	0.79	80%	0.803	S	S	*	*			trans	-104.6	134.4	-172.8	-51.5	0	0	0	0	111.4
542	T	33.5	Very low	28.7	Very low	152 Å²	152	151.4 Å²	151.4	93%	0.933	81%	0.806	S	S	*	*			trans	-140.1	131	154.8	43.5	0	0	0	0	112.1
543	K	28	Very low	28.8	Very low	203 Å²	203	154.6 Å²	154.6	88%	0.883	81%	0.808	S	S	*	*			trans	-69.5	146	-172.2	-70.2	165.9	169.4	169.5	0	113.7
544	R	30.9	Very low	29	Very low	243 Å²	243	156.4 Å²	156.4	92%	0.917	81%	0.813	S	S	*	*				-179.8	119.5	116.5	-99	169.6	-173.5	-175.6	3.5	114.9
545	K	29.2	Very low	28.7	Very low	206 Å²	206	155.7 Å²	155.7	90%	0.896	82%	0.819	S	S	*	*			trans	55.2	112	142.3	-76.6	-176	172.4	-179	0	122
546	H	26.1	Very low	28.9	Very low	177 Å²	177	160.5 Å²	160.5	82%	0.819	83%	0.83	S	S	*	*			trans	-60.3	140.5	154.5	-108.1	-95.6	0	0	0	113.8
547	I	32	Very low	28.8	Very low	168 Å²	168	163.3 Å²	163.3	86%	0.862	84%	0.836	S	S	*	*			trans	-137.8	117.5	139.2	-65.6	-177.6	0	0	0	107.2
548	S	26.6	Very low	29	Very low	89 Å²	89	160.5 Å²	160.5	62%	0.622	84%	0.837	S	S	*	*			trans	-81	142.2	170.4	47.1	0	0	0	0	110.8
549	N	29.6	Very low	28.8	Very low	165 Å²	165	163.8 Å²	163.8	88%	0.882	85%	0.845	S	S	*	*			trans	-152.5	117.5	145.4	-104.6	-12.3	0	0	0	110.2
550	E	27.6	Very low	28.9	Very low	185 Å²	185	165.2 Å²	165.2	86%	0.864	85%	0.847	S	S	*	*			trans	-66.2	140.8	170	-66	173.7	130.1	0	0	110.7
551	S	32.7	Very low	28.8	Very low	121 Å²	121	168.7 Å²	168.7	85%	0.846	84%	0.843	S	S	*	*			trans	-155.8	114.6	140.1	48.5	0	0	0	0	111.3
552	N	27.3	Very low	28.7	Very low	159 Å²	159	170.6 Å²	170.6	85%	0.85	84%	0.844	S	S	*	*			trans	-54.4	129.9	169.9	-82.7	-49.6	0	0	0	112.5
553	K	32.1	Very low	28.5	Very low	206 Å²	206	168.6 Å²	168.6	90%	0.896	83%	0.831	S	S	*	*			trans	-153.6	95.5	149.1	-111.2	170.1	-170.6	177	0	112.7
554	K	30.8	Very low	28.5	Very low	206 Å²	206	162.9 Å²	162.9	90%	0.896	82%	0.822	S	S	*	*			trans	27.9	108.2	147.4	-72	-179.2	174.9	177.8	0	119.5
555	C	22.9	Very low	28.4	Very low	121 Å²	121	156.8 Å²	156.8	82%	0.818	81%	0.812	S	S	*	*			trans	-21.2	131.3	148.3	-93.1	0	0	0	0	117.6
556	K	28.5	Very low	28.2	Very low	212 Å²	212	153 Å²	153	92%	0.922	81%	0.806	S	S	*	*			trans	-113.3	113.7	138.8	-88.7	-177.2	174.8	178.7	0	107.8	G558	K556-G558 PolarHBondContact O-N 2.94Å
557	K	25.3	Very low	28.3	Very low	209 Å²	209	150.4 Å²	150.4	91%	0.909	80%	0.798	S	S	*	*			trans	-65.4	114.3	175.9	-78.8	177.8	172.5	178.6	0	109.8
558	G	28.8	Very low	28.1	Very low	66 Å²	66	152.4 Å²	152.4	68%	0.68	80%	0.804	S	S	*	*			trans	-113.4	124.2	162.2	0	0	0	0	0	108.2	K556 I560	K556-G558 PolarHBondContact O-N 2.94Å; G558-I560 PolarHBondContact O-N 3.01Å
559	R	26	Very low	28.2	Very low	242 Å²	242	152.4 Å²	152.4	91%	0.913	80%	0.804	S	S	*	*			trans	-59.3	112.9	-172	-155.5	177.3	-161.2	171	2.2	110.9
560	I	30	Very low	28.3	Very low	146 Å²	146	149.8 Å²	149.8	75%	0.749	79%	0.79	S	S	*	*			trans	-77.3	116.9	161.2	-64.3	172.6	0	0	0	105.3	G558 D562	G558-I560 PolarHBondContact O-N 3.01Å; I560-D562 PolarHBondContact O-N 2.99Å
561	M	27.7	Very low	28.6	Very low	154 Å²	154	147.7 Å²	147.7	76%	0.759	79%	0.79	S	S	*	*			trans	-81.9	103.5	167.1	-74.9	179.3	70.2	0	0	106.8	V563	M561-V563 PolarHBondContact O-N 3.46Å; M561-V563 VanDerWaalsContact O-N 3.16Å
562	D	26.6	Very low	29.3	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	78%	0.778	S	S	*	*			trans	-65.6	104.6	158.2	-73	-36.1	0	0	0	107.1	I560 A564	I560-D562 PolarHBondContact O-N 2.99Å; D562-A564 PolarHBondContact O-N 3.39Å
563	V	29.4	Very low	31	Very low	109 Å²	109	144.9 Å²	144.9	66%	0.661	77%	0.772	S	S	*	*			trans	-90.4	92.6	165.7	-178.9	0	0	0	0	106.3	M561 V565	M561-V563 PolarHBondContact O-N 3.46Å; M561-V563 VanDerWaalsContact O-N 3.16Å; V563-V565 HydrophobicContact CG1-CG2 3.92Å; V563-V565 PolarHBondContact O-N 2.95Å
564	A	27.5	Very low	33.3	Very low	83 Å²	83	138.1 Å²	138.1	69%	0.686	74%	0.743	S	S	*	*			trans	-65.9	105.5	161.4	0	0	0	0	0	107.6	D562 T566	D562-A564 PolarHBondContact O-N 3.39Å; A564-T566 VanDerWaalsContact C-N 3.3Å; A564-T566 PolarHBondContact O-N 3.48Å; A564-T566 VanDerWaalsContact O-N 3.15Å
565	V	29	Very low	36.1	Very low	115 Å²	115	130 Å²	130	70%	0.697	71%	0.71	S	S	*	*			trans	-82.5	84.6	169.4	-177.1	0	0	0	0	107.2	V563	V563-V565 HydrophobicContact CG1-CG2 3.92Å; V563-V565 PolarHBondContact O-N 2.95Å
566	T	25.8	Very low	39.3	Very low	128 Å²	128	125 Å²	125	79%	0.785	68%	0.675	S	S	*	*			trans	-97.1	88.9	155.7	42.6	0	0	0	0	107.2	A564	A564-T566 VanDerWaalsContact C-N 3.3Å; A564-T566 PolarHBondContact O-N 3.48Å; A564-T566 VanDerWaalsContact O-N 3.15Å
567	D	27.7	Very low	42.4	Very low	122 Å²	122	115 Å²	115	65%	0.652	63%	0.632	S	S	*	*			trans	-152.8	113.2	155.3	-118.8	-16.4	0	0	0	108.9	S569	D567-S569 PolarHBondContact O-N 2.92Å
568	Q	27.4	Very low	45.6	Very low	209 Å²	209	105.1 Å²	105.1	98%	0.977	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	38.1	-177.8	-71.6	179.2	-8.2	0	0	112.2
569	S	29.5	Very low	48.4	Very low	90 Å²	90	103 Å²	103	63%	0.629	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	0.6	179.8	54.5	0	0	0	0	114.7	D567 V571	D567-S569 PolarHBondContact O-N 2.92Å; S569-V571 PolarHBondContact O-N 3.26Å
570	D	32.5	Very low	51.5	Low	109 Å²	109	92 Å²	92	58%	0.583	52%	0.522	S	S	*	.			trans	-98.4	48.2	-173.6	-102.9	-9.8	0	0	0	113.8	N572	D570-N572 PolarHBondContact O-N 3.42Å; D570-N572 PolarHBondContact OD1-ND2 2.92Å; D570-N572 VanDerWaalsContact OD1-ND2 3.12Å
571	V	33.2	Very low	54.4	Low	141 Å²	141	88 Å²	88	86%	0.855	51%	0.51	S	S	*	.			trans	-76.3	67.1	157	-168.2	0	0	0	0	107.2	S569 C573	S569-V571 PolarHBondContact O-N 3.26Å; V571-C573 VanDerWaalsContact C-N 3.27Å; V571-C573 PolarHBondContact O-N 2.8Å
572	N	47.8	Very low	57.5	Low	112 Å²	112	80.9 Å²	80.9	60%	0.599	48%	0.475	S	S	*	.			trans	-64.7	92.7	175.7	-99.1	-41.4	0	0	0	108.3	D570	D570-N572 PolarHBondContact O-N 3.42Å; D570-N572 PolarHBondContact OD1-ND2 2.92Å; D570-N572 VanDerWaalsContact OD1-ND2 3.12Å
573	C	63.4	Low	60.7	Low	109 Å²	109	75.6 Å²	75.6	74%	0.736	45%	0.445	S	S	*	.			trans	-59.1	131.3	-177.5	-168.9	0	0	0	0	109.7	V571 N575	V571-C573 VanDerWaalsContact C-N 3.27Å; V571-C573 PolarHBondContact O-N 2.8Å; C573-N575 PolarHBondContact O-N 3.33Å
574	F	80.1	Confident	63.8	Low	65 Å²	65	71.5 Å²	71.5	29%	0.285	42%	0.421	S	S	.	.			trans	-51.8	125.8	174.4	166.1	-102	0	0	0	110.5	P499 P576 Q579	P499-F574 HydrophobicContact CB-CD2 3.95Å; P499-F574 HydrophobicContact CB-CE2 4.19Å; P499-F574 HydrophobicContact CB-CG 4.23Å; P499-F574 HydrophobicContact CG-CD2 4.2Å; P499-F574 HydrophobicContact CG-CE1 4.3Å; P499-F574 HydrophobicContact CG-CE2 3.97Å; P499-F574 HydrophobicContact CG-CG 4.48Å; P499-F574 HydrophobicContact CG-CZ 4.03Å; F574-P576 HydrophobicContact CE1-CB 4.05Å; F574-P576 WeakPolarHBondContact O-CD 3.49Å; F574-Q579 HydrophobicContact CE2-CG 4.21Å; F574-Q579 HydrophobicContact CZ-CG 3.79Å
575	N	89.2	Confident	66.9	Low	36 Å²	36	72.7 Å²	72.7	19%	0.193	42%	0.416	C	S	.	.			trans	-90.4	113.2	175.1	-175.2	-9.4	0	0	0	109.6	C573 L577 D578 Y587	C573-N575 PolarHBondContact O-N 3.33Å; N575-L577 PolarHBondContact O-N 3.48Å; N575-L577 VanDerWaalsContact O-N 3.12Å; N575-L577 WeakPolarHBondContact OD1-CB 3.36Å; N575-L577 PolarHBondContact OD1-N 2.89Å; N575-D578 VanDerWaalsContact O-CB 3.31Å; N575-D578 WeakPolarHBondContact O-CB 3.41Å; N575-D578 PolarHBondContact O-N 3.17Å; N575-Y587 WeakPolarHBondContact ND2-CD2 3.5Å; N575-Y587 VanDerWaalsContact ND2-CE2 3.31Å; N575-Y587 WeakPolarHBondContact ND2-CE2 3.3Å
576	P	89.9	Confident	70	Confident	14 Å²	14	67.8 Å²	67.8	9%	0.091	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-63.2	-21	-178.4	23.9	-31.5	0	0	0	113.6	F574 D578 Q579 L601 V604 L650	F574-P576 HydrophobicContact CE1-CB 4.05Å; F574-P576 WeakPolarHBondContact O-CD 3.49Å; P576-D578 PolarHBondContact O-N 3.11Å; P576-Q579 PolarHBondContact O-N 2.88Å; P576-Q579 VanDerWaalsContact O-N 3.16Å; P576-L601 HydrophobicContact CG-CD1 4.33Å; P576-L601 HydrophobicContact CG-CG 3.98Å; P576-L601 WeakPolarHBondContact CG-O 3.08Å; P576-V604 HydrophobicContact CB-CB 3.99Å; P576-V604 HydrophobicContact CB-CG1 4.25Å; P576-V604 HydrophobicContact CG-CB 4.03Å; P576-V604 HydrophobicContact CG-CG2 4.41Å; P576-L650 HydrophobicContact CB-CD2 4.14Å
577	L	92.8	Very high	73.3	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-65.1	-22.7	173.3	-63.4	175.3	0	0	0	112.8	R474 N575 Q579 T580 V582 Y587 A590 L601 V604 L646	R474-L577 PolarHBondContact NH1-O 3.43Å; N575-L577 PolarHBondContact O-N 3.48Å; N575-L577 VanDerWaalsContact O-N 3.12Å; N575-L577 WeakPolarHBondContact OD1-CB 3.36Å; N575-L577 PolarHBondContact OD1-N 2.89Å; L577-Q579 PolarHBondContact O-N 3.23Å; L577-Q579 VanDerWaalsContact O-N 3.15Å; L577-T580 PolarHBondContact O-N 2.73Å; L577-T580 PolarHBondContact O-OG1 3.07Å; L577-V582 HydrophobicContact CD2-CG2 4.49Å; L577-Y587 HydrophobicContact CB-CD1 4.18Å; L577-Y587 HydrophobicContact CB-CE1 3.73Å; L577-Y587 HydrophobicContact CD1-CD1 3.87Å; L577-Y587 HydrophobicContact CD1-CE1 4.3Å; L577-Y587 HydrophobicContact CD1-CG 4.12Å; L577-A590 HydrophobicContact CD1-CB 3.95Å; L577-A590 HydrophobicContact CD2-CB 4.46Å; L577-L601 HydrophobicContact CD1-CD1 3.81Å; L577-L601 HydrophobicContact CG-CD1 3.84Å; L577-V604 HydrophobicContact CD2-CG1 4.36Å; L577-V604 HydrophobicContact CD2-CG2 4.35Å; L577-L646 HydrophobicContact CD2-CD2 4.39Å
578	D	92.8	Very high	76.4	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-66.9	-11.1	175.2	-72.4	-11.1	0	0	0	112.9	S473 R474 R496 V497 N575 P576 Y587	S473-D578 WeakPolarHBondContact CA-OD2 2.93Å; S473-D578 WeakPolarHBondContact CB-OD2 3.46Å; R474-D578 HydrophobicContact CG-CB 4.24Å; R474-D578 PolarHBondContact N-OD2 3.48Å; R496-D578 VanDerWaalsContact CA-O 3.25Å; R496-D578 WeakPolarHBondContact CA-O 3.44Å; V497-D578 HydrophobicContact CB-CB 4.27Å; V497-D578 PolarHBondContact N-O 3.42Å; V497-D578 VanDerWaalsContact N-O 3.11Å; N575-D578 VanDerWaalsContact O-CB 3.31Å; N575-D578 WeakPolarHBondContact O-CB 3.41Å; N575-D578 PolarHBondContact O-N 3.17Å; P576-D578 PolarHBondContact O-N 3.11Å; D578-Y587 WeakPolarHBondContact OD1-CE2 3.43Å; D578-Y587 PolarHBondContact OD1-OH 3.26Å
579	Q	89	Confident	79.5	Confident	20 Å²	20	56.4 Å²	56.4	9%	0.093	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-100.2	4.8	171.8	-70.4	-173.8	-50.4	0	0	113.6	V497 F574 P576 L577 L650 D651	V497-Q579 WeakPolarHBondContact O-CG 3.37Å; F574-Q579 HydrophobicContact CE2-CG 4.21Å; F574-Q579 HydrophobicContact CZ-CG 3.79Å; P576-Q579 PolarHBondContact O-N 2.88Å; P576-Q579 VanDerWaalsContact O-N 3.16Å; L577-Q579 PolarHBondContact O-N 3.23Å; L577-Q579 VanDerWaalsContact O-N 3.15Å; Q579-L650 HydrophobicContact CB-CB 4.4Å; Q579-L650 HydrophobicContact CB-CD2 4.2Å; Q579-D651 PolarHBondContact O-N 3.45Å
580	T	90.6	Very high	82.6	Confident	13 Å²	13	52.1 Å²	52.1	8%	0.08	29%	0.291	C	S	.	.	S	Bend	trans	-111.6	169.1	-179.8	73.2	0	0	0	0	111.1	R474 L577 V582 V604 L650	R474-T580 PolarHBondContact NH2-O 2.97Å; L577-T580 PolarHBondContact O-N 2.73Å; L577-T580 PolarHBondContact O-OG1 3.07Å; T580-V582 PolarHBondContact O-N 2.89Å; T580-V582 WeakPolarHBondContact OG1-CB 3.45Å; T580-V582 WeakPolarHBondContact OG1-CG2 3.45Å; T580-V582 PolarHBondContact OG1-N 3.21Å; T580-V604 HydrophobicContact CG2-CG1 4.19Å; T580-L650 HydrophobicContact CG2-CD2 4.45Å
581	A	90.4	Very high	85.6	Confident	60 Å²	60	48.7 Å²	48.7	50%	0.496	28%	0.278	S	S	.	.	S	Bend	trans	-75.3	-1.9	173.3	0	0	0	0	0	113.9	H583	A581-H583 PolarHBondContact O-N 3.4Å
582	V	93.7	Very high	88.5	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	26%	0.257	C	S	.	.			trans	-65	126.2	-179.5	179.1	0	0	0	0	109.5	R474 L577 T580 Y587 A590 I642 A645	R474-V582 PolarHBondContact NH1-O 3.34Å; L577-V582 HydrophobicContact CD2-CG2 4.49Å; T580-V582 PolarHBondContact O-N 2.89Å; T580-V582 WeakPolarHBondContact OG1-CB 3.45Å; T580-V582 WeakPolarHBondContact OG1-CG2 3.45Å; T580-V582 PolarHBondContact OG1-N 3.21Å; V582-Y587 HydrophobicContact CB-CE1 4.46Å; V582-Y587 HydrophobicContact CG1-CD1 3.96Å; V582-Y587 HydrophobicContact CG1-CE1 4.11Å; V582-Y587 WeakPolarHBondContact O-CE1 3.43Å; V582-A590 HydrophobicContact CG1-CB 4.08Å; V582-I642 HydrophobicContact CG1-CG1 4.19Å; V582-I642 HydrophobicContact CG2-CB 4.5Å; V582-I642 HydrophobicContact CG2-CG1 4.26Å; V582-I642 HydrophobicContact CG2-CG2 4.25Å; V582-A645 HydrophobicContact CG2-CB 3.79Å
583	H	94.3	Very high	90.6	Very high	42 Å²	42	40.5 Å²	40.5	19%	0.194	23%	0.229	C	C	.	.			trans	-72.6	143.2	178.6	-168.2	-91.7	0	0	0	111.7	A489 G493 A581 D585 S586 Y587	A489-H583 PolarHBondContact O-NE2 2.84Å; G493-H583 PolarHBondContact N-CD2 2.91Å; G493-H583 VanDerWaalsContact N-CD2 3.35Å; A581-H583 PolarHBondContact O-N 3.4Å; H583-D585 IonicContact CE1-OD1 3.07Å; H583-D585 IonicContact CE1-OD2 3.69Å; H583-D585 PolarHBondContact CE1-OD2 3.12Å; H583-D585 VanDerWaalsContact CE1-OD2 3.3Å; H583-D585 WeakPolarHBondContact ND1-CB 3.32Å; H583-D585 PolarHBondContact ND1-N 3.16Å; H583-D585 VanDerWaalsContact ND1-N 3.16Å; H583-D585 IonicContact ND1-OD1 3.77Å; H583-D585 IonicContact ND1-OD2 2.82Å; H583-D585 PolarHBondContact O-N 3.29Å; H583-S586 PolarHBondContact O-N 2.78Å; H583-Y587 WeakPolarHBondContact O-CD1 3.49Å
584	P	93.5	Very high	92.1	Very high	24 Å²	24	35.4 Å²	35.4	16%	0.156	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-52.6	-35.8	177.6	-31.3	38.6	0	0	0	115.5	R474 F488 A492 S586 Y587	R474-P584 HydrophobicContact CB-CG 4.32Å; F488-P584 HydrophobicContact CE1-CB 4.33Å; F488-P584 HydrophobicContact CE1-CG 4.47Å; F488-P584 HydrophobicContact CZ-CB 4.28Å; F488-P584 HydrophobicContact CZ-CG 4.08Å; A492-P584 HydrophobicContact CB-CG 3.84Å; P584-S586 PolarHBondContact O-N 3.36Å; P584-S586 VanDerWaalsContact O-N 3.09Å; P584-Y587 VanDerWaalsContact CA-CE1 3.49Å; P584-Y587 HydrophobicContact CB-CD2 4.38Å; P584-Y587 HydrophobicContact CB-CE1 4.4Å; P584-Y587 HydrophobicContact CB-CE2 4.09Å; P584-Y587 HydrophobicContact CG-CE1 4.35Å; P584-Y587 HydrophobicContact CG-CE2 4.27Å; P584-Y587 WeakPolarHBondContact O-CB 3.44Å; P584-Y587 PolarHBondContact O-N 3.28Å; P584-Y587 VanDerWaalsContact O-N 3.12Å
585	D	92.2	Very high	92.7	Very high	107 Å²	107	36 Å²	36	57%	0.572	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-60.9	-18.8	176.4	-63.4	-4.3	0	0	0	113.2	H583	H583-D585 IonicContact CE1-OD1 3.07Å; H583-D585 IonicContact CE1-OD2 3.69Å; H583-D585 PolarHBondContact CE1-OD2 3.12Å; H583-D585 VanDerWaalsContact CE1-OD2 3.3Å; H583-D585 WeakPolarHBondContact ND1-CB 3.32Å; H583-D585 PolarHBondContact ND1-N 3.16Å; H583-D585 VanDerWaalsContact ND1-N 3.16Å; H583-D585 IonicContact ND1-OD1 3.77Å; H583-D585 IonicContact ND1-OD2 2.82Å; H583-D585 PolarHBondContact O-N 3.29Å
586	S	94	Very high	92.8	Very high	12 Å²	12	36.4 Å²	36.4	8%	0.084	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-106.9	10.3	-180	-55.8	0	0	0	0	113.5	H583 P584 E588 V589 A590	H583-S586 PolarHBondContact O-N 2.78Å; P584-S586 PolarHBondContact O-N 3.36Å; P584-S586 VanDerWaalsContact O-N 3.09Å; S586-E588 PolarHBondContact O-N 3.26Å; S586-V589 PolarHBondContact O-N 3.4Å; S586-A590 PolarHBondContact O-N 3Å
587	Y	94.5	Very high	92.9	Very high	37 Å²	37	36.9 Å²	36.9	15%	0.145	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-39.9	-177.5	-77.8	2.5	0	0	0	113.5	R474 N575 L577 D578 V582 H583 P584 V589 A590 A591	R474-Y587 WeakPolarHBondContact CD-OH 3.37Å; R474-Y587 PolarHBondContact NH1-OH 2.88Å; N575-Y587 WeakPolarHBondContact ND2-CD2 3.5Å; N575-Y587 VanDerWaalsContact ND2-CE2 3.31Å; N575-Y587 WeakPolarHBondContact ND2-CE2 3.3Å; L577-Y587 HydrophobicContact CB-CD1 4.18Å; L577-Y587 HydrophobicContact CB-CE1 3.73Å; L577-Y587 HydrophobicContact CD1-CD1 3.87Å; L577-Y587 HydrophobicContact CD1-CE1 4.3Å; L577-Y587 HydrophobicContact CD1-CG 4.12Å; D578-Y587 WeakPolarHBondContact OD1-CE2 3.43Å; D578-Y587 PolarHBondContact OD1-OH 3.26Å; V582-Y587 HydrophobicContact CB-CE1 4.46Å; V582-Y587 HydrophobicContact CG1-CD1 3.96Å; V582-Y587 HydrophobicContact CG1-CE1 4.11Å; V582-Y587 WeakPolarHBondContact O-CE1 3.43Å; H583-Y587 WeakPolarHBondContact O-CD1 3.49Å; P584-Y587 VanDerWaalsContact CA-CE1 3.49Å; P584-Y587 HydrophobicContact CB-CD2 4.38Å; P584-Y587 HydrophobicContact CB-CE1 4.4Å; P584-Y587 HydrophobicContact CB-CE2 4.09Å; P584-Y587 HydrophobicContact CG-CE1 4.35Å; P584-Y587 HydrophobicContact CG-CE2 4.27Å; P584-Y587 WeakPolarHBondContact O-CB 3.44Å; P584-Y587 PolarHBondContact O-N 3.28Å; P584-Y587 VanDerWaalsContact O-N 3.12Å; Y587-V589 VanDerWaalsContact C-N 3.29Å; Y587-V589 PolarHBondContact O-N 2.97Å; Y587-A590 PolarHBondContact O-N 2.89Å; Y587-A591 WeakPolarHBondContact O-CB 3.37Å; Y587-A591 PolarHBondContact O-N 3.2Å
588	E	93.2	Very high	92.9	Very high	163 Å²	163	45.3 Å²	45.3	76%	0.762	25%	0.25	S	C	*	.	H	α-helix	trans	-60.3	-43.3	176.2	-63.6	-175.4	173	0	0	111	S586 A591 N592	S586-E588 PolarHBondContact O-N 3.26Å; E588-A591 PolarHBondContact O-N 2.97Å; E588-N592 VanDerWaalsContact O-CG 3.27Å; E588-N592 PolarHBondContact O-N 3.3Å; E588-N592 VanDerWaalsContact O-N 3.09Å; E588-N592 PolarHBondContact O-ND2 3.44Å
589	V	94	Very high	92.8	Very high	21 Å²	21	46.5 Å²	46.5	13%	0.127	26%	0.256	C	S	.	.	H	α-helix	trans	-68.4	-40.9	178.7	179.5	0	0	0	0	111.4	S586 Y587 A591 N592 I593 F629 V634 L639 I642	S586-V589 PolarHBondContact O-N 3.4Å; Y587-V589 VanDerWaalsContact C-N 3.29Å; Y587-V589 PolarHBondContact O-N 2.97Å; V589-A591 VanDerWaalsContact C-N 3.34Å; V589-A591 PolarHBondContact O-N 3.46Å; V589-N592 WeakPolarHBondContact O-CB 3.35Å; V589-N592 PolarHBondContact O-N 2.81Å; V589-I593 HydrophobicContact CG1-CD1 4.25Å; V589-I593 WeakPolarHBondContact O-CG1 3.45Å; V589-I593 PolarHBondContact O-N 2.97Å; V589-F629 HydrophobicContact CG1-CB 4.12Å; V589-V634 HydrophobicContact CG1-CG1 4.48Å; V589-V634 HydrophobicContact CG2-CG2 4.35Å; V589-L639 HydrophobicContact CG1-CD2 3.27Å; V589-I642 HydrophobicContact CG1-CD1 4.42Å
590	A	94.2	Very high	92.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-41.7	174.8	0	0	0	0	0	111.9	L577 V582 S586 Y587 N592 I593 I594 I642	L577-A590 HydrophobicContact CD1-CB 3.95Å; L577-A590 HydrophobicContact CD2-CB 4.46Å; V582-A590 HydrophobicContact CG1-CB 4.08Å; S586-A590 PolarHBondContact O-N 3Å; Y587-A590 PolarHBondContact O-N 2.89Å; A590-N592 VanDerWaalsContact C-N 3.32Å; A590-N592 PolarHBondContact O-N 3.49Å; A590-I593 PolarHBondContact O-N 2.88Å; A590-I594 WeakPolarHBondContact O-CB 3.25Å; A590-I594 WeakPolarHBondContact O-CD1 3.07Å; A590-I594 VanDerWaalsContact O-CG1 3.25Å; A590-I594 WeakPolarHBondContact O-CG1 3.47Å; A590-I594 PolarHBondContact O-N 3.37Å; A590-I642 HydrophobicContact CB-CG2 3.82Å
591	A	94.3	Very high	92.9	Very high	37 Å²	37	53.4 Å²	53.4	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-62.6	-37.4	175.2	0	0	0	0	0	112.6	Y587 E588 V589 I594 S595	Y587-A591 WeakPolarHBondContact O-CB 3.37Å; Y587-A591 PolarHBondContact O-N 3.2Å; E588-A591 PolarHBondContact O-N 2.97Å; V589-A591 VanDerWaalsContact C-N 3.34Å; V589-A591 PolarHBondContact O-N 3.46Å; A591-I594 PolarHBondContact O-N 3.3Å; A591-S595 WeakPolarHBondContact O-CB 3.3Å; A591-S595 PolarHBondContact O-N 3.34Å; A591-S595 PolarHBondContact O-OG 2.92Å
592	N	93.7	Very high	92.7	Very high	80 Å²	80	55.6 Å²	55.6	43%	0.428	30%	0.3	S	S	.	.	H	α-helix	trans	-66.8	-41.1	174.6	-67.4	-26.4	0	0	0	112.2	E588 V589 A590 S595 L596 F629	E588-N592 VanDerWaalsContact O-CG 3.27Å; E588-N592 PolarHBondContact O-N 3.3Å; E588-N592 VanDerWaalsContact O-N 3.09Å; E588-N592 PolarHBondContact O-ND2 3.44Å; V589-N592 WeakPolarHBondContact O-CB 3.35Å; V589-N592 PolarHBondContact O-N 2.81Å; A590-N592 VanDerWaalsContact C-N 3.32Å; A590-N592 PolarHBondContact O-N 3.49Å; N592-S595 WeakPolarHBondContact O-CB 3.16Å; N592-S595 PolarHBondContact O-N 2.84Å; N592-L596 PolarHBondContact O-N 3.28Å; N592-F629 HydrophobicContact CB-CD1 3.91Å; N592-F629 HydrophobicContact CB-CE1 3.62Å; N592-F629 HydrophobicContact CB-CZ 4.17Å
593	I	93.3	Very high	92.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-43.4	174.3	-66.7	168.2	0	0	0	110.6	V589 A590 S595 L596 L597 L626 F629 L639 I642 L646	V589-I593 HydrophobicContact CG1-CD1 4.25Å; V589-I593 WeakPolarHBondContact O-CG1 3.45Å; V589-I593 PolarHBondContact O-N 2.97Å; A590-I593 PolarHBondContact O-N 2.88Å; I593-S595 VanDerWaalsContact C-N 3.27Å; I593-S595 PolarHBondContact O-N 3.15Å; I593-L596 WeakPolarHBondContact O-CB 3.49Å; I593-L596 PolarHBondContact O-N 2.78Å; I593-L596 VanDerWaalsContact O-N 3.13Å; I593-L597 WeakPolarHBondContact O-CG 3.3Å; I593-L597 PolarHBondContact O-N 3.01Å; I593-L626 HydrophobicContact CD1-CD2 4.12Å; I593-L626 HydrophobicContact CG1-CD2 4.17Å; I593-F629 HydrophobicContact CG1-CD2 4.04Å; I593-F629 HydrophobicContact CG1-CE2 4.21Å; I593-L639 HydrophobicContact CD1-CB 4.49Å; I593-L639 HydrophobicContact CD1-CD2 4.09Å; I593-I642 HydrophobicContact CD1-CB 4.32Å; I593-I642 HydrophobicContact CD1-CG2 3.92Å; I593-L646 HydrophobicContact CG2-CD1 4.12Å
594	I	93.9	Very high	92.2	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-42.3	175.8	-72.4	163.7	0	0	0	110.7	A590 A591 L596 L597 Q598 L599 L601 V604 M609 L646	A590-I594 WeakPolarHBondContact O-CB 3.25Å; A590-I594 WeakPolarHBondContact O-CD1 3.07Å; A590-I594 VanDerWaalsContact O-CG1 3.25Å; A590-I594 WeakPolarHBondContact O-CG1 3.47Å; A590-I594 PolarHBondContact O-N 3.37Å; A591-I594 PolarHBondContact O-N 3.3Å; I594-L596 PolarHBondContact O-N 2.98Å; I594-L597 CarbonylContact O-C 3.57Å; I594-L597 WeakPolarHBondContact O-CB 3.45Å; I594-L597 PolarHBondContact O-N 3.1Å; I594-L597 VanDerWaalsContact O-N 3.15Å; I594-Q598 PolarHBondContact O-N 2.87Å; I594-L599 HydrophobicContact CG2-CB 4.27Å; I594-L599 WeakPolarHBondContact CG2-O 3.48Å; I594-L599 PolarHBondContact O-N 3.46Å; I594-L599 VanDerWaalsContact O-N 3.17Å; I594-L601 HydrophobicContact CD1-CD1 3.93Å; I594-V604 HydrophobicContact CD1-CG2 3.57Å; I594-V604 HydrophobicContact CG1-CG2 4.45Å; I594-M609 HydrophobicContact CB-CE 4.36Å; I594-M609 HydrophobicContact CD1-CE 4.47Å; I594-M609 HydrophobicContact CG1-CE 3.89Å; I594-M609 HydrophobicContact CG1-SD 4.46Å; I594-M609 HydrophobicContact CG2-CE 3.81Å; I594-L646 HydrophobicContact CD1-CD2 4.11Å; I594-L646 HydrophobicContact CG1-CD1 3.91Å; I594-L646 HydrophobicContact CG1-CD2 4.14Å
595	S	93.8	Very high	91.6	Very high	77 Å²	77	55 Å²	55	54%	0.538	30%	0.301	S	S	.	.	H	α-helix	trans	-65.7	-36.9	176.2	-58.5	0	0	0	0	112.1	A591 N592 I593 L597 Q598	A591-S595 WeakPolarHBondContact O-CB 3.3Å; A591-S595 PolarHBondContact O-N 3.34Å; A591-S595 PolarHBondContact O-OG 2.92Å; N592-S595 WeakPolarHBondContact O-CB 3.16Å; N592-S595 PolarHBondContact O-N 2.84Å; I593-S595 VanDerWaalsContact C-N 3.27Å; I593-S595 PolarHBondContact O-N 3.15Å; S595-L597 VanDerWaalsContact C-N 3.25Å; S595-L597 PolarHBondContact O-N 3.15Å; S595-Q598 PolarHBondContact O-N 2.97Å
596	L	91.7	Very high	91.3	Very high	46 Å²	46	50.9 Å²	50.9	24%	0.241	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-32.3	173	179.8	66.1	0	0	0	112.2	N592 I593 I594 Q598 F616 R625 F629	N592-L596 PolarHBondContact O-N 3.28Å; I593-L596 WeakPolarHBondContact O-CB 3.49Å; I593-L596 PolarHBondContact O-N 2.78Å; I593-L596 VanDerWaalsContact O-N 3.13Å; I594-L596 PolarHBondContact O-N 2.98Å; L596-Q598 PolarHBondContact O-N 2.92Å; L596-F616 HydrophobicContact CD2-CE2 3.77Å; L596-F616 HydrophobicContact CD2-CZ 3.89Å; L596-F616 HydrophobicContact CG-CE2 4.41Å; L596-R625 HydrophobicContact CD2-CB 4.45Å; L596-F629 HydrophobicContact CB-CE2 4.4Å; L596-F629 HydrophobicContact CB-CZ 4.31Å; L596-F629 HydrophobicContact CD2-CE2 3.81Å; L596-F629 HydrophobicContact CD2-CZ 4.35Å
597	L	91.4	Very high	90.9	Very high	23 Å²	23	54.8 Å²	54.8	12%	0.12	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2.1	173.5	-61.8	177.3	0	0	0	113.3	I593 I594 S595 L599 M609 A613 F616	I593-L597 WeakPolarHBondContact O-CG 3.3Å; I593-L597 PolarHBondContact O-N 3.01Å; I594-L597 CarbonylContact O-C 3.57Å; I594-L597 WeakPolarHBondContact O-CB 3.45Å; I594-L597 PolarHBondContact O-N 3.1Å; I594-L597 VanDerWaalsContact O-N 3.15Å; S595-L597 VanDerWaalsContact C-N 3.25Å; S595-L597 PolarHBondContact O-N 3.15Å; L597-L599 VanDerWaalsContact C-N 3.28Å; L597-L599 HydrophobicContact CB-CD1 4.44Å; L597-L599 PolarHBondContact O-N 2.98Å; L597-M609 HydrophobicContact CD1-SD 4.15Å; L597-A613 HydrophobicContact CD1-CB 4.19Å; L597-F616 HydrophobicContact CD2-CB 3.62Å; L597-F616 HydrophobicContact CD2-CD2 3.67Å; L597-F616 HydrophobicContact CD2-CE2 4.48Å; L597-F616 HydrophobicContact CD2-CG 3.72Å
598	Q	91.7	Very high	90.6	Very high	180 Å²	180	59.4 Å²	59.4	84%	0.841	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	33.8	-178.2	-53.7	176.8	-8.6	0	0	113.3	I594 S595 L596	I594-Q598 PolarHBondContact O-N 2.87Å; S595-Q598 PolarHBondContact O-N 2.97Å; L596-Q598 PolarHBondContact O-N 2.92Å
599	L	92.1	Very high	90.4	Very high	28 Å²	28	51.6 Å²	51.6	15%	0.147	28%	0.282	C	S	.	.			trans	-122.5	167.8	179.2	-67	173.2	0	0	0	110.8	I594 L597 D603 M609 A612	I594-L599 HydrophobicContact CG2-CB 4.27Å; I594-L599 WeakPolarHBondContact CG2-O 3.48Å; I594-L599 PolarHBondContact O-N 3.46Å; I594-L599 VanDerWaalsContact O-N 3.17Å; L597-L599 VanDerWaalsContact C-N 3.28Å; L597-L599 HydrophobicContact CB-CD1 4.44Å; L597-L599 PolarHBondContact O-N 2.98Å; L599-D603 HydrophobicContact CB-CB 4.28Å; L599-D603 HydrophobicContact CD2-CB 4.44Å; L599-M609 HydrophobicContact CB-CE 3.74Å; L599-M609 VanDerWaalsContact CD1-CA 3.48Å; L599-M609 HydrophobicContact CD1-CB 4.04Å; L599-M609 HydrophobicContact CD1-CE 3.81Å; L599-M609 HydrophobicContact CD1-CG 4.47Å; L599-M609 HydrophobicContact CD1-SD 3.66Å; L599-M609 HydrophobicContact CG-CE 4.46Å; L599-A612 HydrophobicContact CD1-CB 3.88Å
600	N	90.8	Very high	90.3	Very high	110 Å²	110	53.2 Å²	53.2	59%	0.588	29%	0.286	S	S	*	.			trans	-104.2	163.3	177.7	-62.8	-67.1	0	0	0	111.5	T602 D603	N600-T602 PolarHBondContact O-N 3.32Å; N600-D603 PolarHBondContact N-OD2 2.99Å; N600-D603 WeakPolarHBondContact O-CB 3.23Å; N600-D603 PolarHBondContact O-N 2.89Å
601	L	89.3	Confident	90.1	Very high	67 Å²	67	55.8 Å²	55.8	35%	0.351	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-57.1	-33.6	175.9	-171	64.8	0	0	0	112.1	P576 L577 I594 D603 V604	P576-L601 HydrophobicContact CG-CD1 4.33Å; P576-L601 HydrophobicContact CG-CG 3.98Å; P576-L601 WeakPolarHBondContact CG-O 3.08Å; L577-L601 HydrophobicContact CD1-CD1 3.81Å; L577-L601 HydrophobicContact CG-CD1 3.84Å; I594-L601 HydrophobicContact CD1-CD1 3.93Å; L601-D603 PolarHBondContact O-N 2.92Å; L601-V604 HydrophobicContact CD1-CG2 4.22Å; L601-V604 WeakPolarHBondContact O-CB 3.49Å; L601-V604 WeakPolarHBondContact O-CG2 3.49Å; L601-V604 PolarHBondContact O-N 3.13Å
602	T	87.9	Confident	90	Very high	106 Å²	106	55.1 Å²	55.1	65%	0.65	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-66.9	-16.9	176.4	52.4	0	0	0	0	114.2	N600 V604	N600-T602 PolarHBondContact O-N 3.32Å; T602-V604 VanDerWaalsContact C-N 3.33Å
603	D	88.5	Confident	89.9	Confident	38 Å²	38	51.3 Å²	51.3	20%	0.203	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-85	-7.9	179.1	-60.7	-46.1	0	0	0	112.2	L599 N600 L601 G605 S606 M609	L599-D603 HydrophobicContact CB-CB 4.28Å; L599-D603 HydrophobicContact CD2-CB 4.44Å; N600-D603 PolarHBondContact N-OD2 2.99Å; N600-D603 WeakPolarHBondContact O-CB 3.23Å; N600-D603 PolarHBondContact O-N 2.89Å; L601-D603 PolarHBondContact O-N 2.92Å; D603-G605 PolarHBondContact O-N 3.42Å; D603-S606 WeakPolarHBondContact O-CB 3.42Å; D603-S606 PolarHBondContact O-N 3.33Å; D603-S606 PolarHBondContact O-OG 2.93Å; D603-M609 HydrophobicContact CB-CE 4.12Å; D603-M609 WeakPolarHBondContact O-CB 3.39Å
604	V	87.6	Confident	89.8	Confident	7 Å²	7	53.9 Å²	53.9	4%	0.042	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	127.6	179.7	175.9	0	0	0	0	110.7	P576 L577 T580 I594 L601 T602 S606 M609 L646 L650	P576-V604 HydrophobicContact CB-CB 3.99Å; P576-V604 HydrophobicContact CB-CG1 4.25Å; P576-V604 HydrophobicContact CG-CB 4.03Å; P576-V604 HydrophobicContact CG-CG2 4.41Å; L577-V604 HydrophobicContact CD2-CG1 4.36Å; L577-V604 HydrophobicContact CD2-CG2 4.35Å; T580-V604 HydrophobicContact CG2-CG1 4.19Å; I594-V604 HydrophobicContact CD1-CG2 3.57Å; I594-V604 HydrophobicContact CG1-CG2 4.45Å; L601-V604 HydrophobicContact CD1-CG2 4.22Å; L601-V604 WeakPolarHBondContact O-CB 3.49Å; L601-V604 WeakPolarHBondContact O-CG2 3.49Å; L601-V604 PolarHBondContact O-N 3.13Å; T602-V604 VanDerWaalsContact C-N 3.33Å; V604-S606 VanDerWaalsContact C-N 3.26Å; V604-S606 PolarHBondContact O-N 3.1Å; V604-M609 HydrophobicContact CG2-CE 4.02Å; V604-L646 HydrophobicContact CG1-CD2 4.18Å; V604-L646 HydrophobicContact CG2-CD2 4.09Å; V604-L650 HydrophobicContact CG1-CD2 3.92Å
605	G	82	Confident	89.7	Confident	15 Å²	15	60 Å²	60	16%	0.155	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	-9.2	-175.4	0	0	0	0	0	115.9	D603	D603-G605 PolarHBondContact O-N 3.42Å
606	S	85.8	Confident	89.6	Confident	19 Å²	19	56.8 Å²	56.8	13%	0.133	30%	0.296	C	S	.	.	S	Bend	trans	-65.4	154.1	171.3	73.3	0	0	0	0	111	D603 V604 K608 M609 R610	D603-S606 WeakPolarHBondContact O-CB 3.42Å; D603-S606 PolarHBondContact O-N 3.33Å; D603-S606 PolarHBondContact O-OG 2.93Å; V604-S606 VanDerWaalsContact C-N 3.26Å; V604-S606 PolarHBondContact O-N 3.1Å; S606-K608 PolarHBondContact O-N 3.11Å; S606-K608 VanDerWaalsContact O-N 3.16Å; S606-M609 PolarHBondContact O-N 3.28Å; S606-M609 VanDerWaalsContact O-N 3.11Å; S606-M609 PolarHBondContact OG-N 2.98Å; S606-R610 WeakPolarHBondContact O-CG 3.34Å; S606-R610 PolarHBondContact O-N 3.43Å
607	M	84.4	Confident	89.5	Confident	94 Å²	94	57 Å²	57	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-56.7	-32.3	174.4	-173.2	58.9	177.1	0	0	112.1	R610 T611	M607-R610 PolarHBondContact O-N 3.42Å; M607-R610 VanDerWaalsContact SD-CZ 3.53Å; M607-R610 PolarHBondContact SD-NH2 3.31Å; M607-T611 VanDerWaalsContact O-CB 3.31Å; M607-T611 WeakPolarHBondContact O-CB 3.35Å; M607-T611 PolarHBondContact O-N 2.89Å; M607-T611 PolarHBondContact O-OG1 2.86Å
608	K	90	Very high	89.4	Confident	134 Å²	134	61.9 Å²	61.9	58%	0.583	32%	0.321	S	S	*	.	H	α-helix	trans	-61.4	-49.5	175.6	-65.5	-179.4	-177.3	173.4	0	111.4	S606 T611 A612	S606-K608 PolarHBondContact O-N 3.11Å; S606-K608 VanDerWaalsContact O-N 3.16Å; K608-T611 PolarHBondContact O-N 2.92Å; K608-A612 WeakPolarHBondContact O-CB 3.38Å; K608-A612 PolarHBondContact O-N 3Å
609	M	88.9	Confident	89.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-48.9	175.4	179.6	68.5	70.9	0	0	111.9	I594 L597 L599 D603 V604 S606 T611 A612 A613 L646	I594-M609 HydrophobicContact CB-CE 4.36Å; I594-M609 HydrophobicContact CD1-CE 4.47Å; I594-M609 HydrophobicContact CG1-CE 3.89Å; I594-M609 HydrophobicContact CG1-SD 4.46Å; I594-M609 HydrophobicContact CG2-CE 3.81Å; L597-M609 HydrophobicContact CD1-SD 4.15Å; L599-M609 HydrophobicContact CB-CE 3.74Å; L599-M609 VanDerWaalsContact CD1-CA 3.48Å; L599-M609 HydrophobicContact CD1-CB 4.04Å; L599-M609 HydrophobicContact CD1-CE 3.81Å; L599-M609 HydrophobicContact CD1-CG 4.47Å; L599-M609 HydrophobicContact CD1-SD 3.66Å; L599-M609 HydrophobicContact CG-CE 4.46Å; D603-M609 HydrophobicContact CB-CE 4.12Å; D603-M609 WeakPolarHBondContact O-CB 3.39Å; V604-M609 HydrophobicContact CG2-CE 4.02Å; S606-M609 PolarHBondContact O-N 3.28Å; S606-M609 VanDerWaalsContact O-N 3.11Å; S606-M609 PolarHBondContact OG-N 2.98Å; M609-T611 VanDerWaalsContact C-N 3.28Å; M609-T611 PolarHBondContact O-N 2.83Å; M609-A612 PolarHBondContact O-N 3.18Å; M609-A613 VanDerWaalsContact O-CB 3.24Å; M609-A613 WeakPolarHBondContact O-CB 3.11Å; M609-A613 PolarHBondContact O-N 3.01Å; M609-L646 HydrophobicContact CG-CB 4.46Å; M609-L646 HydrophobicContact SD-CB 4.47Å; M609-L646 HydrophobicContact SD-CD2 4.45Å
610	R	90	Very high	89.2	Confident	55 Å²	55	62.6 Å²	62.6	21%	0.208	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-42.3	-178.4	-63.9	-170.5	-65	124.8	-10.9	111.5	D511 S606 M607 T614 T647	D511-R610 IonicContact OD2-NH2 3.76Å; D511-R610 PolarHBondContact OD2-NH2 2.84Å; S606-R610 WeakPolarHBondContact O-CG 3.34Å; S606-R610 PolarHBondContact O-N 3.43Å; M607-R610 PolarHBondContact O-N 3.42Å; M607-R610 VanDerWaalsContact SD-CZ 3.53Å; M607-R610 PolarHBondContact SD-NH2 3.31Å; R610-T614 VanDerWaalsContact O-CB 3.24Å; R610-T614 WeakPolarHBondContact O-CB 3.43Å; R610-T614 PolarHBondContact O-N 2.99Å; R610-T614 PolarHBondContact O-OG1 3.22Å; R610-T647 WeakPolarHBondContact CD-O 3.42Å; R610-T647 VanDerWaalsContact CG-O 3.27Å; R610-T647 WeakPolarHBondContact CG-O 3.37Å
611	T	90.8	Very high	89.1	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.331	32%	0.319	S	S	.	.	H	α-helix	trans	-65.4	-48.5	177.8	-56	0	0	0	0	111.4	M607 K608 M609 T614 Q615	M607-T611 VanDerWaalsContact O-CB 3.31Å; M607-T611 WeakPolarHBondContact O-CB 3.35Å; M607-T611 PolarHBondContact O-N 2.89Å; M607-T611 PolarHBondContact O-OG1 2.86Å; K608-T611 PolarHBondContact O-N 2.92Å; M609-T611 VanDerWaalsContact C-N 3.28Å; M609-T611 PolarHBondContact O-N 2.83Å; T611-T614 PolarHBondContact O-N 2.95Å; T611-Q615 WeakPolarHBondContact O-CB 3.44Å; T611-Q615 VanDerWaalsContact O-CG 3.29Å; T611-Q615 WeakPolarHBondContact O-CG 3.44Å; T611-Q615 PolarHBondContact O-N 2.89Å
612	A	92.6	Very high	89.1	Confident	22 Å²	22	59.5 Å²	59.5	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-44.9	179	0	0	0	0	0	112.1	L599 K608 M609 Q615 F616	L599-A612 HydrophobicContact CD1-CB 3.88Å; K608-A612 WeakPolarHBondContact O-CB 3.38Å; K608-A612 PolarHBondContact O-N 3Å; M609-A612 PolarHBondContact O-N 3.18Å; A612-Q615 PolarHBondContact O-N 2.99Å; A612-F616 WeakPolarHBondContact O-CB 3.26Å; A612-F616 PolarHBondContact O-N 3.36Å
613	A	91.3	Very high	89.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-41.2	176.9	0	0	0	0	0	111.8	L597 M609 F616 M617 L643 L646 T647	L597-A613 HydrophobicContact CD1-CB 4.19Å; M609-A613 VanDerWaalsContact O-CB 3.24Å; M609-A613 WeakPolarHBondContact O-CB 3.11Å; M609-A613 PolarHBondContact O-N 3.01Å; A613-F616 PolarHBondContact O-N 3.19Å; A613-M617 WeakPolarHBondContact O-CB 3.31Å; A613-M617 PolarHBondContact O-N 3.48Å; A613-L643 HydrophobicContact CB-CD1 4.07Å; A613-L646 HydrophobicContact CB-CB 4.06Å; A613-T647 HydrophobicContact CB-CG2 3.87Å
614	T	91.4	Very high	89.3	Confident	54 Å²	54	61.3 Å²	61.3	33%	0.331	31%	0.306	S	S	.	.	H	α-helix	trans	-65.2	-43.5	176.7	-58.5	0	0	0	0	111.4	R610 T611 F616 M617 I618	R610-T614 VanDerWaalsContact O-CB 3.24Å; R610-T614 WeakPolarHBondContact O-CB 3.43Å; R610-T614 PolarHBondContact O-N 2.99Å; R610-T614 PolarHBondContact O-OG1 3.22Å; T611-T614 PolarHBondContact O-N 2.95Å; T614-F616 VanDerWaalsContact C-N 3.34Å; T614-F616 PolarHBondContact O-N 3.37Å; T614-M617 PolarHBondContact O-N 3.07Å; T614-I618 HydrophobicContact CG2-CD1 4.08Å; T614-I618 WeakPolarHBondContact O-CG1 3.33Å; T614-I618 PolarHBondContact O-N 3.09Å
615	Q	91.9	Very high	89.5	Confident	131 Å²	131	64.9 Å²	64.9	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-43.9	175	-74.2	174.9	0.8	0	0	111.5	T611 A612 M617 I618 S619	T611-Q615 WeakPolarHBondContact O-CB 3.44Å; T611-Q615 VanDerWaalsContact O-CG 3.29Å; T611-Q615 WeakPolarHBondContact O-CG 3.44Å; T611-Q615 PolarHBondContact O-N 2.89Å; A612-Q615 PolarHBondContact O-N 2.99Å; Q615-M617 VanDerWaalsContact C-N 3.32Å; Q615-M617 PolarHBondContact O-N 3.24Å; Q615-I618 PolarHBondContact O-N 3.32Å; Q615-S619 PolarHBondContact O-N 3.32Å
616	F	91.8	Very high	89.9	Confident	9 Å²	9	64.2 Å²	64.2	4%	0.039	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-36.7	175.9	-173.6	-86	0	0	0	112	L596 L597 A612 A613 T614 I618 S619 R622 R625 L626 L643	L596-F616 HydrophobicContact CD2-CE2 3.77Å; L596-F616 HydrophobicContact CD2-CZ 3.89Å; L596-F616 HydrophobicContact CG-CE2 4.41Å; L597-F616 HydrophobicContact CD2-CB 3.62Å; L597-F616 HydrophobicContact CD2-CD2 3.67Å; L597-F616 HydrophobicContact CD2-CE2 4.48Å; L597-F616 HydrophobicContact CD2-CG 3.72Å; A612-F616 WeakPolarHBondContact O-CB 3.26Å; A612-F616 PolarHBondContact O-N 3.36Å; A613-F616 PolarHBondContact O-N 3.19Å; T614-F616 VanDerWaalsContact C-N 3.34Å; T614-F616 PolarHBondContact O-N 3.37Å; F616-I618 VanDerWaalsContact C-N 3.28Å; F616-I618 PolarHBondContact O-N 3.1Å; F616-S619 WeakPolarHBondContact O-CB 3.38Å; F616-S619 PolarHBondContact O-N 3.11Å; F616-S619 PolarHBondContact O-OG 3.14Å; F616-R622 HydrophobicContact CD1-CG 3.96Å; F616-R622 HydrophobicContact CE1-CB 4.41Å; F616-R622 HydrophobicContact CE1-CG 3.64Å; F616-R625 HydrophobicContact CE2-CB 4.21Å; F616-R625 HydrophobicContact CZ-CB 3.91Å; F616-L626 HydrophobicContact CE1-CD1 4.25Å; F616-L626 HydrophobicContact CE1-CD2 3.83Å; F616-L626 HydrophobicContact CE1-CG 3.88Å; F616-L626 HydrophobicContact CZ-CD2 4.06Å; F616-L626 HydrophobicContact CZ-CG 4.16Å; F616-L643 HydrophobicContact CB-CD1 4.48Å; F616-L643 HydrophobicContact CD1-CD1 3.72Å; F616-L643 HydrophobicContact CD1-CD2 3.58Å; F616-L643 HydrophobicContact CD1-CG 4.3Å; F616-L643 HydrophobicContact CE1-CD1 4.4Å; F616-L643 HydrophobicContact CE1-CD2 4.08Å; F616-L643 HydrophobicContact CG-CD1 4.44Å
617	M	88.9	Confident	90.1	Very high	52 Å²	52	68.6 Å²	68.6	26%	0.256	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-31.8	178.4	-170.4	174.6	64.7	0	0	113.3	A613 T614 Q615 R622 L643 V644 T647	A613-M617 WeakPolarHBondContact O-CB 3.31Å; A613-M617 PolarHBondContact O-N 3.48Å; T614-M617 PolarHBondContact O-N 3.07Å; Q615-M617 VanDerWaalsContact C-N 3.32Å; Q615-M617 PolarHBondContact O-N 3.24Å; M617-R622 PolarHBondContact O-NH1 3.39Å; M617-L643 HydrophobicContact CB-CD2 3.82Å; M617-L643 HydrophobicContact CB-CG 4.46Å; M617-L643 HydrophobicContact CG-CD2 4.14Å; M617-V644 HydrophobicContact SD-CG2 4.11Å; M617-T647 HydrophobicContact CE-CG2 4.37Å; M617-T647 HydrophobicContact SD-CG2 4.31Å
618	I	90.7	Very high	90.4	Very high	124 Å²	124	70 Å²	70	64%	0.636	34%	0.336	S	S	*	.	H	α-helix	trans	-82	-19	178.7	-63.1	164.9	0	0	0	111.8	T614 Q615 F616	T614-I618 HydrophobicContact CG2-CD1 4.08Å; T614-I618 WeakPolarHBondContact O-CG1 3.33Å; T614-I618 PolarHBondContact O-N 3.09Å; Q615-I618 PolarHBondContact O-N 3.32Å; F616-I618 VanDerWaalsContact C-N 3.28Å; F616-I618 PolarHBondContact O-N 3.1Å
619	S	90.5	Very high	90.5	Very high	32 Å²	32	65.5 Å²	65.5	22%	0.224	32%	0.316	C	S	.	.			trans	-63.5	137.5	-177.9	69.7	0	0	0	0	113	Q615 F616 D621 R622	Q615-S619 PolarHBondContact O-N 3.32Å; F616-S619 WeakPolarHBondContact O-CB 3.38Å; F616-S619 PolarHBondContact O-N 3.11Å; F616-S619 PolarHBondContact O-OG 3.14Å; S619-D621 WeakPolarHBondContact CB-OD1 3.3Å; S619-D621 PolarHBondContact O-N 2.93Å; S619-D621 PolarHBondContact OG-OD1 3.48Å; S619-R622 VanDerWaalsContact O-CB 3.32Å; S619-R622 WeakPolarHBondContact O-CB 3.38Å; S619-R622 PolarHBondContact O-N 2.88Å; S619-R622 PolarHBondContact OG-N 3.17Å
620	E	87.7	Confident	90.5	Very high	192 Å²	192	68 Å²	68	90%	0.897	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.5	180	-65	-174.7	174.6	0	0	112.8
621	D	89.5	Confident	90.5	Very high	74 Å²	74	68.3 Å²	68.3	40%	0.396	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4.6	-178.8	69.4	-19.3	0	0	0	113.7	S619 D623 K624 R625	S619-D621 WeakPolarHBondContact CB-OD1 3.3Å; S619-D621 PolarHBondContact O-N 2.93Å; S619-D621 PolarHBondContact OG-OD1 3.48Å; D621-D623 VanDerWaalsContact C-N 3.34Å; D621-D623 PolarHBondContact O-N 3.32Å; D621-K624 PolarHBondContact O-N 3.39Å; D621-R625 VanDerWaalsContact CG-CD 3.48Å; D621-R625 WeakPolarHBondContact O-CG 3.25Å; D621-R625 PolarHBondContact O-N 3.46Å; D621-R625 WeakPolarHBondContact OD2-CD 3.43Å
622	R	89.2	Confident	90.3	Very high	38 Å²	38	76.4 Å²	76.4	14%	0.143	38%	0.375	C	S	.	.	H	α-helix	trans	-45.2	-55.9	-179.6	-178.9	-164.4	68.8	-146.6	-5.2	112.2	F616 M617 S619 K624 R625 L626 L643	F616-R622 HydrophobicContact CD1-CG 3.96Å; F616-R622 HydrophobicContact CE1-CB 4.41Å; F616-R622 HydrophobicContact CE1-CG 3.64Å; M617-R622 PolarHBondContact O-NH1 3.39Å; S619-R622 VanDerWaalsContact O-CB 3.32Å; S619-R622 WeakPolarHBondContact O-CB 3.38Å; S619-R622 PolarHBondContact O-N 2.88Å; S619-R622 PolarHBondContact OG-N 3.17Å; R622-K624 PolarHBondContact O-N 3.08Å; R622-R625 PolarHBondContact O-N 3.3Å; R622-L626 HydrophobicContact CG-CD1 3.88Å; R622-L626 HydrophobicContact CG-CG 4.42Å; R622-L626 WeakPolarHBondContact O-CG 3.12Å; R622-L626 PolarHBondContact O-N 3.2Å; R622-L643 HydrophobicContact CG-CD2 4.19Å
623	D	90.4	Very high	90	Very high	17 Å²	17	81.6 Å²	81.6	9%	0.091	40%	0.404	C	S	.	.	H	α-helix	trans	-66.2	-41.2	-172.2	-68.8	-17.7	0	0	0	111.4	D621 R625 L626 E627 L636 R640	D621-D623 VanDerWaalsContact C-N 3.34Å; D621-D623 PolarHBondContact O-N 3.32Å; D623-R625 VanDerWaalsContact C-N 3.3Å; D623-R625 PolarHBondContact O-N 3.45Å; D623-L626 PolarHBondContact O-N 3.37Å; D623-L626 VanDerWaalsContact O-N 3.16Å; D623-E627 WeakPolarHBondContact O-CG 3.29Å; D623-E627 PolarHBondContact O-N 2.95Å; D623-L636 HydrophobicContact CB-CD1 4.37Å; D623-L636 HydrophobicContact CB-CD2 4.13Å; D623-R640 VanDerWaalsContact CG-NH2 3.27Å; D623-R640 IonicContact OD1-CZ 3.38Å; D623-R640 IonicContact OD1-NE 3.83Å; D623-R640 PolarHBondContact OD1-NE 2.95Å; D623-R640 IonicContact OD1-NH2 3.22Å; D623-R640 PolarHBondContact OD1-NH2 3.08Å; D623-R640 IonicContact OD2-CZ 2.92Å; D623-R640 IonicContact OD2-NE 2.76Å; D623-R640 IonicContact OD2-NH2 3.75Å; D623-R640 PolarHBondContact OD2-NH2 2.8Å
624	K	90.6	Very high	89.9	Confident	164 Å²	164	82 Å²	82	71%	0.713	41%	0.406	S	S	*	.	H	α-helix	trans	-61.7	-38.4	174.5	-66.4	179.6	-179	173.5	0	112.3	D621 R622	D621-K624 PolarHBondContact O-N 3.39Å; R622-K624 PolarHBondContact O-N 3.08Å
625	R	90.7	Very high	90	Very high	83 Å²	83	81.1 Å²	81.1	31%	0.313	41%	0.409	S	S	.	.	H	α-helix	trans	-74.2	-26.6	177.7	-71.9	177.5	64.5	-170	3.6	112.6	L596 F616 D621 R622 D623 Q628	L596-R625 HydrophobicContact CD2-CB 4.45Å; F616-R625 HydrophobicContact CE2-CB 4.21Å; F616-R625 HydrophobicContact CZ-CB 3.91Å; D621-R625 VanDerWaalsContact CG-CD 3.48Å; D621-R625 WeakPolarHBondContact O-CG 3.25Å; D621-R625 PolarHBondContact O-N 3.46Å; D621-R625 WeakPolarHBondContact OD2-CD 3.43Å; R622-R625 PolarHBondContact O-N 3.3Å; D623-R625 VanDerWaalsContact C-N 3.3Å; D623-R625 PolarHBondContact O-N 3.45Å; R625-Q628 VanDerWaalsContact O-CG 3.3Å; R625-Q628 WeakPolarHBondContact O-CG 3.49Å; R625-Q628 PolarHBondContact O-NE2 3.27Å
626	L	90.8	Very high	90	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-81.1	-33.6	174.3	-70.9	178.1	0	0	0	111.8	I593 F616 R622 D623 Q628 F629 L636 L639 R640	I593-L626 HydrophobicContact CD1-CD2 4.12Å; I593-L626 HydrophobicContact CG1-CD2 4.17Å; F616-L626 HydrophobicContact CE1-CD1 4.25Å; F616-L626 HydrophobicContact CE1-CD2 3.83Å; F616-L626 HydrophobicContact CE1-CG 3.88Å; F616-L626 HydrophobicContact CZ-CD2 4.06Å; F616-L626 HydrophobicContact CZ-CG 4.16Å; R622-L626 HydrophobicContact CG-CD1 3.88Å; R622-L626 HydrophobicContact CG-CG 4.42Å; R622-L626 WeakPolarHBondContact O-CG 3.12Å; R622-L626 PolarHBondContact O-N 3.2Å; D623-L626 PolarHBondContact O-N 3.37Å; D623-L626 VanDerWaalsContact O-N 3.16Å; L626-Q628 PolarHBondContact O-N 3.46Å; L626-F629 PolarHBondContact O-N 2.95Å; L626-L636 HydrophobicContact CB-CD1 3.85Å; L626-L639 HydrophobicContact CB-CB 4.25Å; L626-L639 HydrophobicContact CB-CD1 3.9Å; L626-L639 HydrophobicContact CD1-CB 4.12Å; L626-L639 HydrophobicContact CD2-CB 4.3Å; L626-L639 HydrophobicContact CG-CB 4.46Å; L626-L639 WeakPolarHBondContact O-CD1 3.27Å; L626-R640 HydrophobicContact CD1-CG 4.42Å
627	E	90.8	Very high	90.1	Very high	112 Å²	112	81.1 Å²	81.1	52%	0.523	41%	0.413	S	S	.	.	H	α-helix	trans	-51.5	-29.8	-179.9	-85.7	172.4	-165.9	0	0	113.8	D623 F629 C630	D623-E627 WeakPolarHBondContact O-CG 3.29Å; D623-E627 PolarHBondContact O-N 2.95Å; E627-F629 PolarHBondContact O-N 2.97Å; E627-F629 VanDerWaalsContact O-N 3.17Å; E627-C630 WeakPolarHBondContact O-CB 3.34Å; E627-C630 PolarHBondContact O-N 3.05Å; E627-C630 VanDerWaalsContact O-N 3.12Å
628	Q	90.9	Very high	90.3	Very high	123 Å²	123	81.1 Å²	81.1	58%	0.575	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.3	175.9	76.1	-172.6	-39.6	0	0	114.2	R625 L626	R625-Q628 VanDerWaalsContact O-CG 3.3Å; R625-Q628 WeakPolarHBondContact O-CG 3.49Å; R625-Q628 PolarHBondContact O-NE2 3.27Å; L626-Q628 PolarHBondContact O-N 3.46Å
629	F	90.7	Very high	90.4	Very high	40 Å²	40	75.2 Å²	75.2	18%	0.175	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-0.5	178.8	-54.7	-61.9	0	0	0	113.3	V589 N592 I593 L596 L626 E627 S631 L639	V589-F629 HydrophobicContact CG1-CB 4.12Å; N592-F629 HydrophobicContact CB-CD1 3.91Å; N592-F629 HydrophobicContact CB-CE1 3.62Å; N592-F629 HydrophobicContact CB-CZ 4.17Å; I593-F629 HydrophobicContact CG1-CD2 4.04Å; I593-F629 HydrophobicContact CG1-CE2 4.21Å; L596-F629 HydrophobicContact CB-CE2 4.4Å; L596-F629 HydrophobicContact CB-CZ 4.31Å; L596-F629 HydrophobicContact CD2-CE2 3.81Å; L596-F629 HydrophobicContact CD2-CZ 4.35Å; L626-F629 PolarHBondContact O-N 2.95Å; E627-F629 PolarHBondContact O-N 2.97Å; E627-F629 VanDerWaalsContact O-N 3.17Å; F629-S631 PolarHBondContact O-N 3.13Å; F629-L639 HydrophobicContact CB-CD1 4.19Å; F629-L639 HydrophobicContact CB-CD2 4.22Å
630	C	90.2	Very high	90.6	Very high	53 Å²	53	76.6 Å²	76.6	36%	0.358	39%	0.386	S	S	.	.			trans	-63.6	135.7	174.9	-72.7	0	0	0	0	110.2	E627 V634	E627-C630 WeakPolarHBondContact O-CB 3.34Å; E627-C630 PolarHBondContact O-N 3.05Å; E627-C630 VanDerWaalsContact O-N 3.12Å; C630-V634 WeakPolarHBondContact CA-O 3.34Å
631	S	89	Confident	90.8	Very high	61 Å²	61	72.7 Å²	72.7	43%	0.427	37%	0.371	S	S	.	.			trans	-129.2	178.8	176.8	81.1	0	0	0	0	109.9	F629 T633 V634	F629-S631 PolarHBondContact O-N 3.13Å; S631-T633 PolarHBondContact O-N 3.04Å; S631-T633 PolarHBondContact OG-N 2.95Å; S631-T633 PolarHBondContact OG-OG1 3.25Å; S631-V634 PolarHBondContact N-O 2.93Å; S631-V634 PolarHBondContact OG-N 2.94Å; S631-V634 VanDerWaalsContact OG-N 3.07Å
632	K	86.8	Confident	91.1	Very high	224 Å²	224	69.5 Å²	69.5	97%	0.974	35%	0.354	S	S	*	.	S	Bend	trans	-61.5	-22.6	174.3	-69	-176	-179.9	179	0	112.9
633	T	86.5	Confident	91.2	Very high	130 Å²	130	67.7 Å²	67.7	80%	0.798	35%	0.347	S	S	*	.	S	Bend	trans	-104.4	-27.6	-177.6	52.2	0	0	0	0	113	S631	S631-T633 PolarHBondContact O-N 3.04Å; S631-T633 PolarHBondContact OG-N 2.95Å; S631-T633 PolarHBondContact OG-OG1 3.25Å
634	V	89.4	Confident	91.3	Very high	8 Å²	8	69 Å²	69	5%	0.048	36%	0.356	C	S	.	.			trans	-114.1	110.7	-176.3	-176.3	0	0	0	0	109.6	V589 C630 S631 T638 L639	V589-V634 HydrophobicContact CG1-CG1 4.48Å; V589-V634 HydrophobicContact CG2-CG2 4.35Å; C630-V634 WeakPolarHBondContact CA-O 3.34Å; S631-V634 PolarHBondContact N-O 2.93Å; S631-V634 PolarHBondContact OG-N 2.94Å; S631-V634 VanDerWaalsContact OG-N 3.07Å; V634-T638 HydrophobicContact CG1-CG2 3.95Å; V634-L639 HydrophobicContact CG1-CD2 3.6Å; V634-L639 HydrophobicContact CG1-CG 4.14Å
635	G	92.5	Very high	91.3	Very high	37 Å²	37	61.6 Å²	61.6	38%	0.381	33%	0.325	S	S	.	.			trans	-88.4	172.1	175.1	0	0	0	0	0	112.9	D637 T638 L639	G635-D637 VanDerWaalsContact C-N 3.29Å; G635-D637 PolarHBondContact O-N 3.31Å; G635-T638 WeakPolarHBondContact O-CB 3.5Å; G635-T638 PolarHBondContact O-N 2.89Å; G635-L639 PolarHBondContact O-N 3.16Å
636	L	93.1	Very high	91.4	Very high	37 Å²	37	57.7 Å²	57.7	19%	0.194	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-37.9	-178.1	-177.9	62.3	0	0	0	113	D623 L626 T638 L639 R640	D623-L636 HydrophobicContact CB-CD1 4.37Å; D623-L636 HydrophobicContact CB-CD2 4.13Å; L626-L636 HydrophobicContact CB-CD1 3.85Å; L636-T638 VanDerWaalsContact C-N 3.33Å; L636-T638 PolarHBondContact O-N 2.88Å; L636-L639 WeakPolarHBondContact O-CB 3.45Å; L636-L639 PolarHBondContact O-N 3.41Å; L636-L639 VanDerWaalsContact O-N 3.13Å; L636-R640 WeakPolarHBondContact O-CG 3.19Å; L636-R640 PolarHBondContact O-N 3.22Å
637	D	92.8	Very high	91.4	Very high	103 Å²	103	59 Å²	59	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-39	179.2	-61.5	-45.4	0	0	0	111.9	G635 L639 R640 D641	G635-D637 VanDerWaalsContact C-N 3.29Å; G635-D637 PolarHBondContact O-N 3.31Å; D637-L639 VanDerWaalsContact C-N 3.28Å; D637-L639 PolarHBondContact O-N 3.25Å; D637-R640 WeakPolarHBondContact O-CB 3.45Å; D637-R640 PolarHBondContact O-N 2.92Å; D637-R640 VanDerWaalsContact O-N 3.16Å; D637-R640 IonicContact OD1-CZ 3.53Å; D637-R640 IonicContact OD1-NH1 3.74Å; D637-R640 PolarHBondContact OD1-NH1 2.83Å; D637-D641 PolarHBondContact O-N 2.99Å
638	T	93.4	Very high	91.1	Very high	52 Å²	52	56.9 Å²	56.9	32%	0.319	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-37.2	173.7	-49.5	0	0	0	0	111.7	V634 G635 L636 D641 I642	V634-T638 HydrophobicContact CG1-CG2 3.95Å; G635-T638 WeakPolarHBondContact O-CB 3.5Å; G635-T638 PolarHBondContact O-N 2.89Å; L636-T638 VanDerWaalsContact C-N 3.33Å; L636-T638 PolarHBondContact O-N 2.88Å; T638-D641 PolarHBondContact O-N 2.8Å; T638-I642 HydrophobicContact CG2-CD1 4.31Å; T638-I642 VanDerWaalsContact O-CG1 3.23Å; T638-I642 WeakPolarHBondContact O-CG1 3.1Å; T638-I642 PolarHBondContact O-N 2.89Å
639	L	93.7	Very high	90.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.6	-38.7	176.1	-56	178.1	0	0	0	111.7	V589 I593 L626 F629 V634 G635 L636 D637 I642 L643	V589-L639 HydrophobicContact CG1-CD2 3.27Å; I593-L639 HydrophobicContact CD1-CB 4.49Å; I593-L639 HydrophobicContact CD1-CD2 4.09Å; L626-L639 HydrophobicContact CB-CB 4.25Å; L626-L639 HydrophobicContact CB-CD1 3.9Å; L626-L639 HydrophobicContact CD1-CB 4.12Å; L626-L639 HydrophobicContact CD2-CB 4.3Å; L626-L639 HydrophobicContact CG-CB 4.46Å; L626-L639 WeakPolarHBondContact O-CD1 3.27Å; F629-L639 HydrophobicContact CB-CD1 4.19Å; F629-L639 HydrophobicContact CB-CD2 4.22Å; V634-L639 HydrophobicContact CG1-CD2 3.6Å; V634-L639 HydrophobicContact CG1-CG 4.14Å; G635-L639 PolarHBondContact O-N 3.16Å; L636-L639 WeakPolarHBondContact O-CB 3.45Å; L636-L639 PolarHBondContact O-N 3.41Å; L636-L639 VanDerWaalsContact O-N 3.13Å; D637-L639 VanDerWaalsContact C-N 3.28Å; D637-L639 PolarHBondContact O-N 3.25Å; L639-I642 PolarHBondContact O-N 2.88Å; L639-L643 PolarHBondContact O-N 3.1Å
640	R	94	Very high	90.3	Very high	61 Å²	61	52.9 Å²	52.9	23%	0.23	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-42.8	173.4	-68.1	170.8	178.7	159.4	-9.7	110.8	D623 L626 L636 D637 I642 L643 V644	D623-R640 VanDerWaalsContact CG-NH2 3.27Å; D623-R640 IonicContact OD1-CZ 3.38Å; D623-R640 IonicContact OD1-NE 3.83Å; D623-R640 PolarHBondContact OD1-NE 2.95Å; D623-R640 IonicContact OD1-NH2 3.22Å; D623-R640 PolarHBondContact OD1-NH2 3.08Å; D623-R640 IonicContact OD2-CZ 2.92Å; D623-R640 IonicContact OD2-NE 2.76Å; D623-R640 IonicContact OD2-NH2 3.75Å; D623-R640 PolarHBondContact OD2-NH2 2.8Å; L626-R640 HydrophobicContact CD1-CG 4.42Å; L636-R640 WeakPolarHBondContact O-CG 3.19Å; L636-R640 PolarHBondContact O-N 3.22Å; D637-R640 WeakPolarHBondContact O-CB 3.45Å; D637-R640 PolarHBondContact O-N 2.92Å; D637-R640 VanDerWaalsContact O-N 3.16Å; D637-R640 IonicContact OD1-CZ 3.53Å; D637-R640 IonicContact OD1-NH1 3.74Å; D637-R640 PolarHBondContact OD1-NH1 2.83Å; R640-I642 PolarHBondContact O-N 3.12Å; R640-L643 WeakPolarHBondContact O-CB 3.27Å; R640-L643 PolarHBondContact O-N 3.04Å; R640-V644 WeakPolarHBondContact O-CG2 3.42Å; R640-V644 PolarHBondContact O-N 3.05Å
641	D	92.8	Very high	89.7	Confident	110 Å²	110	51 Å²	51	59%	0.588	28%	0.278	S	S	*	.	H	α-helix	trans	-63.6	-40.8	176.7	-69.5	-25.8	0	0	0	112.2	D637 T638 L643 V644 A645	D637-D641 PolarHBondContact O-N 2.99Å; T638-D641 PolarHBondContact O-N 2.8Å; D641-L643 VanDerWaalsContact C-N 3.34Å; D641-L643 PolarHBondContact O-N 3.44Å; D641-V644 PolarHBondContact O-N 3.14Å; D641-A645 WeakPolarHBondContact O-CB 3.45Å; D641-A645 PolarHBondContact O-N 2.59Å
642	I	94.2	Very high	89.3	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-60.7	-45.5	173.6	-68.5	164.4	0	0	0	110.2	V582 V589 A590 I593 T638 L639 R640 V644 A645 L646	V582-I642 HydrophobicContact CG1-CG1 4.19Å; V582-I642 HydrophobicContact CG2-CB 4.5Å; V582-I642 HydrophobicContact CG2-CG1 4.26Å; V582-I642 HydrophobicContact CG2-CG2 4.25Å; V589-I642 HydrophobicContact CG1-CD1 4.42Å; A590-I642 HydrophobicContact CB-CG2 3.82Å; I593-I642 HydrophobicContact CD1-CB 4.32Å; I593-I642 HydrophobicContact CD1-CG2 3.92Å; T638-I642 HydrophobicContact CG2-CD1 4.31Å; T638-I642 VanDerWaalsContact O-CG1 3.23Å; T638-I642 WeakPolarHBondContact O-CG1 3.1Å; T638-I642 PolarHBondContact O-N 2.89Å; L639-I642 PolarHBondContact O-N 2.88Å; R640-I642 PolarHBondContact O-N 3.12Å; I642-V644 PolarHBondContact O-N 2.97Å; I642-A645 WeakPolarHBondContact O-CB 3.48Å; I642-A645 PolarHBondContact O-N 2.86Å; I642-L646 HydrophobicContact CG2-CD1 4.34Å; I642-L646 WeakPolarHBondContact O-CG 3.29Å; I642-L646 PolarHBondContact O-N 3.45Å
643	L	93.1	Very high	88.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-44.8	177.7	-177.1	70	0	0	0	111.5	A613 F616 M617 R622 L639 R640 D641 A645 L646 T647	A613-L643 HydrophobicContact CB-CD1 4.07Å; F616-L643 HydrophobicContact CB-CD1 4.48Å; F616-L643 HydrophobicContact CD1-CD1 3.72Å; F616-L643 HydrophobicContact CD1-CD2 3.58Å; F616-L643 HydrophobicContact CD1-CG 4.3Å; F616-L643 HydrophobicContact CE1-CD1 4.4Å; F616-L643 HydrophobicContact CE1-CD2 4.08Å; F616-L643 HydrophobicContact CG-CD1 4.44Å; M617-L643 HydrophobicContact CB-CD2 3.82Å; M617-L643 HydrophobicContact CB-CG 4.46Å; M617-L643 HydrophobicContact CG-CD2 4.14Å; R622-L643 HydrophobicContact CG-CD2 4.19Å; L639-L643 PolarHBondContact O-N 3.1Å; R640-L643 WeakPolarHBondContact O-CB 3.27Å; R640-L643 PolarHBondContact O-N 3.04Å; D641-L643 VanDerWaalsContact C-N 3.34Å; D641-L643 PolarHBondContact O-N 3.44Å; L643-A645 VanDerWaalsContact C-N 3.3Å; L643-A645 PolarHBondContact O-N 2.76Å; L643-L646 WeakPolarHBondContact O-CB 3.21Å; L643-L646 PolarHBondContact O-N 2.92Å; L643-L646 VanDerWaalsContact O-N 3.08Å; L643-T647 WeakPolarHBondContact O-CG2 3.41Å; L643-T647 PolarHBondContact O-N 2.88Å; L643-T647 VanDerWaalsContact O-N 3.12Å
644	V	92	Very high	88.6	Confident	45 Å²	45	35.1 Å²	35.1	27%	0.273	19%	0.192	S	C	.	.	H	α-helix	trans	-58	-43.9	174.5	170.2	0	0	0	0	110.6	M617 R640 D641 I642 L646 T647	M617-V644 HydrophobicContact SD-CG2 4.11Å; R640-V644 WeakPolarHBondContact O-CG2 3.42Å; R640-V644 PolarHBondContact O-N 3.05Å; D641-V644 PolarHBondContact O-N 3.14Å; I642-V644 PolarHBondContact O-N 2.97Å; V644-L646 VanDerWaalsContact C-N 3.28Å; V644-L646 PolarHBondContact O-N 2.84Å; V644-T647 PolarHBondContact O-N 3.35Å; V644-T647 VanDerWaalsContact O-N 3.11Å; V644-T647 PolarHBondContact O-OG1 2.71Å
645	A	91	Very high	88.3	Confident	8 Å²	8	35.3 Å²	35.3	7%	0.066	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-36	175.7	0	0	0	0	0	112.6	V582 D641 I642 L643 T647 R648	V582-A645 HydrophobicContact CG2-CB 3.79Å; D641-A645 WeakPolarHBondContact O-CB 3.45Å; D641-A645 PolarHBondContact O-N 2.59Å; I642-A645 WeakPolarHBondContact O-CB 3.48Å; I642-A645 PolarHBondContact O-N 2.86Å; L643-A645 VanDerWaalsContact C-N 3.3Å; L643-A645 PolarHBondContact O-N 2.76Å; A645-T647 VanDerWaalsContact C-N 3.34Å; A645-R648 PolarHBondContact O-N 3.19Å
646	L	92	Very high	87	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-73.1	-20.7	176.4	-64.9	174.4	0	0	0	113.9	L577 I593 I594 V604 M609 A613 I642 L643 V644 R648	L577-L646 HydrophobicContact CD2-CD2 4.39Å; I593-L646 HydrophobicContact CG2-CD1 4.12Å; I594-L646 HydrophobicContact CD1-CD2 4.11Å; I594-L646 HydrophobicContact CG1-CD1 3.91Å; I594-L646 HydrophobicContact CG1-CD2 4.14Å; V604-L646 HydrophobicContact CG1-CD2 4.18Å; V604-L646 HydrophobicContact CG2-CD2 4.09Å; M609-L646 HydrophobicContact CG-CB 4.46Å; M609-L646 HydrophobicContact SD-CB 4.47Å; M609-L646 HydrophobicContact SD-CD2 4.45Å; A613-L646 HydrophobicContact CB-CB 4.06Å; I642-L646 HydrophobicContact CG2-CD1 4.34Å; I642-L646 WeakPolarHBondContact O-CG 3.29Å; I642-L646 PolarHBondContact O-N 3.45Å; L643-L646 WeakPolarHBondContact O-CB 3.21Å; L643-L646 PolarHBondContact O-N 2.92Å; L643-L646 VanDerWaalsContact O-N 3.08Å; V644-L646 VanDerWaalsContact C-N 3.28Å; V644-L646 PolarHBondContact O-N 2.84Å; L646-R648 PolarHBondContact O-N 3.44Å
647	T	89.8	Confident	85.5	Confident	27 Å²	27	38.5 Å²	38.5	17%	0.166	20%	0.196	C	C	.	.	H	α-helix	trans	-72.5	-17.7	172.4	69.6	0	0	0	0	113.2	R610 A613 M617 L643 V644 A645	R610-T647 WeakPolarHBondContact CD-O 3.42Å; R610-T647 VanDerWaalsContact CG-O 3.27Å; R610-T647 WeakPolarHBondContact CG-O 3.37Å; A613-T647 HydrophobicContact CB-CG2 3.87Å; M617-T647 HydrophobicContact CE-CG2 4.37Å; M617-T647 HydrophobicContact SD-CG2 4.31Å; L643-T647 WeakPolarHBondContact O-CG2 3.41Å; L643-T647 PolarHBondContact O-N 2.88Å; L643-T647 VanDerWaalsContact O-N 3.12Å; V644-T647 PolarHBondContact O-N 3.35Å; V644-T647 VanDerWaalsContact O-N 3.11Å; V644-T647 PolarHBondContact O-OG1 2.71Å; A645-T647 VanDerWaalsContact C-N 3.34Å
648	R	84.9	Confident	84	Confident	67 Å²	67	36.1 Å²	36.1	25%	0.253	19%	0.187	S	C	.	.	S	Bend	trans	-91.3	151.5	-175	-65.9	170	177	154.6	2.2	111.2	A645 L646 F652 E654	A645-R648 PolarHBondContact O-N 3.19Å; L646-R648 PolarHBondContact O-N 3.44Å; R648-F652 HydrophobicContact CB-CB 3.87Å; R648-F652 HydrophobicContact CB-CD1 4.28Å; R648-F652 HydrophobicContact CB-CD2 4.43Å; R648-F652 HydrophobicContact CB-CG 3.95Å; R648-F652 HydrophobicContact CG-CB 4.45Å; R648-F652 HydrophobicContact CG-CD1 3.92Å; R648-F652 HydrophobicContact CG-CE1 4.26Å; R648-F652 HydrophobicContact CG-CG 4.07Å; R648-E654 WeakPolarHBondContact CD-OE1 3.3Å; R648-E654 IonicContact CZ-OE1 2.74Å; R648-E654 IonicContact CZ-OE2 2.75Å; R648-E654 IonicContact NE-OE1 3.59Å; R648-E654 PolarHBondContact NE-OE1 3.31Å; R648-E654 IonicContact NE-OE2 3.48Å; R648-E654 IonicContact NH1-OE1 3.59Å; R648-E654 PolarHBondContact NH1-OE1 3.31Å; R648-E654 IonicContact NH1-OE2 3.88Å; R648-E654 IonicContact NH2-OE1 2.78Å; R648-E654 IonicContact NH2-OE2 3.51Å; R648-E654 PolarHBondContact NH2-OE2 2.86Å
649	P	83.5	Confident	82.4	Confident	37 Å²	37	34.7 Å²	34.7	24%	0.24	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-66.2	165.1	167.8	30	-35.1	0	0	0	111	F652	P649-F652 HydrophobicContact CG-CB 4.13Å; P649-F652 HydrophobicContact CG-CD2 3.64Å; P649-F652 HydrophobicContact CG-CG 4.35Å; P649-F652 WeakPolarHBondContact O-CB 3.47Å; P649-F652 PolarHBondContact O-N 2.98Å
650	L	82.7	Confident	81.2	Confident	43 Å²	43	35.4 Å²	35.4	23%	0.225	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	139.8	175	-66	175.9	0	0	0	110.4	P576 Q579 T580 V604 F652	P576-L650 HydrophobicContact CB-CD2 4.14Å; Q579-L650 HydrophobicContact CB-CB 4.4Å; Q579-L650 HydrophobicContact CB-CD2 4.2Å; T580-L650 HydrophobicContact CG2-CD2 4.45Å; V604-L650 HydrophobicContact CG1-CD2 3.92Å; L650-F652 PolarHBondContact O-N 3.32Å
651	D	76.5	Confident	80.1	Confident	13 Å²	13	33.6 Å²	33.6	7%	0.07	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	32	-179.5	-161.7	37.6	0	0	0	114.8	P247 R496 K498 Q579 D653	P247-D651 WeakPolarHBondContact CD-OD2 3.28Å; P247-D651 HydrophobicContact CG-CB 4.3Å; P247-D651 WeakPolarHBondContact CG-O 3.41Å; P247-D651 WeakPolarHBondContact CG-OD2 3.33Å; R496-D651 VanDerWaalsContact CD-OD1 3.22Å; R496-D651 WeakPolarHBondContact CD-OD1 3.48Å; R496-D651 IonicContact CZ-OD1 3.13Å; R496-D651 IonicContact NE-OD1 2.63Å; R496-D651 VanDerWaalsContact NH1-C 3.29Å; R496-D651 PolarHBondContact NH1-O 2.85Å; R496-D651 IonicContact NH1-OD1 3.44Å; R496-D651 PolarHBondContact NH1-OD1 3.09Å; K498-D651 WeakPolarHBondContact CE-OD2 3.4Å; K498-D651 IonicContact NZ-OD2 2.8Å; K498-D651 PolarHBondContact NZ-OD2 3.46Å; Q579-D651 PolarHBondContact O-N 3.45Å; D651-D653 PolarHBondContact O-N 3.17Å
652	F	79.8	Confident	79.3	Confident	43 Å²	43	30.5 Å²	30.5	19%	0.189	16%	0.16	C	C	.	.			trans	-55.5	131.6	174.1	-175.9	-99	0	0	0	111.6	A243 R496 R648 P649 L650 E654	A243-F652 HydrophobicContact CB-CE2 4.01Å; R496-F652 PolarHBondContact NH1-O 2.84Å; R496-F652 PolarHBondContact NH2-O 3.13Å; R648-F652 HydrophobicContact CB-CB 3.87Å; R648-F652 HydrophobicContact CB-CD1 4.28Å; R648-F652 HydrophobicContact CB-CD2 4.43Å; R648-F652 HydrophobicContact CB-CG 3.95Å; R648-F652 HydrophobicContact CG-CB 4.45Å; R648-F652 HydrophobicContact CG-CD1 3.92Å; R648-F652 HydrophobicContact CG-CE1 4.26Å; R648-F652 HydrophobicContact CG-CG 4.07Å; P649-F652 HydrophobicContact CG-CB 4.13Å; P649-F652 HydrophobicContact CG-CD2 3.64Å; P649-F652 HydrophobicContact CG-CG 4.35Å; P649-F652 WeakPolarHBondContact O-CB 3.47Å; P649-F652 PolarHBondContact O-N 2.98Å; L650-F652 PolarHBondContact O-N 3.32Å; F652-E654 WeakPolarHBondContact CD1-OE1 3.44Å
653	D	79.7	Confident	78.5	Confident	9 Å²	9	32.7 Å²	32.7	5%	0.048	17%	0.169	C	C	.	.			trans	-95.4	117.9	177.1	-168.6	-21.6	0	0	0	108.3	R221 D651 R655	R221-D653 VanDerWaalsContact NH2-CB 3.26Å; R221-D653 IonicContact NH2-OD2 2.81Å; R221-D653 PolarHBondContact NH2-OD2 3.15Å; D651-D653 PolarHBondContact O-N 3.17Å; D653-R655 PolarHBondContact O-N 3Å; D653-R655 VanDerWaalsContact OD1-CB 3.31Å; D653-R655 WeakPolarHBondContact OD1-CB 3.39Å; D653-R655 WeakPolarHBondContact OD1-CG 3.44Å; D653-R655 IonicContact OD1-CZ 3.39Å; D653-R655 PolarHBondContact OD1-N 3.44Å; D653-R655 VanDerWaalsContact OD1-N 3.17Å; D653-R655 IonicContact OD1-NE 2.61Å; D653-R655 PolarHBondContact OD1-NE 2.97Å; D653-R655 IonicContact OD1-NH2 2.86Å; D653-R655 IonicContact OD2-CZ 2.65Å; D653-R655 IonicContact OD2-NE 3.92Å; D653-R655 PolarHBondContact OD2-NE 2.84Å; D653-R655 IonicContact OD2-NH2 3.59Å; D653-R655 PolarHBondContact OD2-NH2 2.9Å
654	E	79.1	Confident	77.5	Confident	30 Å²	30	33.8 Å²	33.8	14%	0.14	17%	0.174	C	C	.	.			trans	-72.1	-7.1	-176.9	-57.9	-67.3	156.7	0	0	113.2	F434 R648 F652	F434-E654 HydrophobicContact CD1-CB 3.76Å; F434-E654 HydrophobicContact CD1-CG 4.35Å; F434-E654 HydrophobicContact CE1-CB 3.24Å; F434-E654 HydrophobicContact CE1-CG 3.98Å; F434-E654 HydrophobicContact CZ-CB 3.85Å; F434-E654 HydrophobicContact CZ-CG 4.22Å; R648-E654 WeakPolarHBondContact CD-OE1 3.3Å; R648-E654 IonicContact CZ-OE1 2.74Å; R648-E654 IonicContact CZ-OE2 2.75Å; R648-E654 IonicContact NE-OE1 3.59Å; R648-E654 PolarHBondContact NE-OE1 3.31Å; R648-E654 IonicContact NE-OE2 3.48Å; R648-E654 IonicContact NH1-OE1 3.59Å; R648-E654 PolarHBondContact NH1-OE1 3.31Å; R648-E654 IonicContact NH1-OE2 3.88Å; R648-E654 IonicContact NH2-OE1 2.78Å; R648-E654 IonicContact NH2-OE2 3.51Å; R648-E654 PolarHBondContact NH2-OE2 2.86Å; F652-E654 WeakPolarHBondContact CD1-OE1 3.44Å
655	R	83.6	Confident	76.3	Confident	11 Å²	11	34.9 Å²	34.9	4%	0.042	18%	0.184	C	C	.	.			trans	-71.6	138.3	177	-67.4	178.6	-70.8	-179.7	-3.5	110.3	M216 A218 S242 D393 V435 D653	M216-R655 HydrophobicContact CE-CB 4.43Å; M216-R655 HydrophobicContact CE-CG 3.62Å; M216-R655 WeakPolarHBondContact O-CB 3.37Å; M216-R655 WeakPolarHBondContact O-CG 3.41Å; M216-R655 HydrophobicContact SD-CG 4.13Å; A218-R655 HydrophobicContact CB-CB 4.11Å; S242-R655 WeakPolarHBondContact CB-O 3.27Å; S242-R655 PolarHBondContact OG-O 3.33Å; S242-R655 VanDerWaalsContact OG-O 3.13Å; D393-R655 IonicContact OD1-CZ 2.66Å; D393-R655 IonicContact OD1-NH1 2.8Å; D393-R655 PolarHBondContact OD1-NH1 3.29Å; D393-R655 IonicContact OD2-NH1 2.93Å; V435-R655 HydrophobicContact CG2-CG 3.66Å; D653-R655 PolarHBondContact O-N 3Å; D653-R655 VanDerWaalsContact OD1-CB 3.31Å; D653-R655 WeakPolarHBondContact OD1-CB 3.39Å; D653-R655 WeakPolarHBondContact OD1-CG 3.44Å; D653-R655 IonicContact OD1-CZ 3.39Å; D653-R655 PolarHBondContact OD1-N 3.44Å; D653-R655 VanDerWaalsContact OD1-N 3.17Å; D653-R655 IonicContact OD1-NE 2.61Å; D653-R655 PolarHBondContact OD1-NE 2.97Å; D653-R655 IonicContact OD1-NH2 2.86Å; D653-R655 IonicContact OD2-CZ 2.65Å; D653-R655 IonicContact OD2-NE 3.92Å; D653-R655 PolarHBondContact OD2-NE 2.84Å; D653-R655 IonicContact OD2-NH2 3.59Å; D653-R655 PolarHBondContact OD2-NH2 2.9Å
656	Q	66.2	Low	75.1	Confident	123 Å²	123	39 Å²	39	58%	0.575	21%	0.208	S	C	*	.	B	Isolated β-bridge	trans	-100.2	146.2	-177.5	-63.8	178.5	2.3	0	0	110.9	C658	Q656-C658 VanDerWaalsContact CB-SG 3.5Å; Q656-C658 PolarHBondContact O-N 3.34Å
657	D	60.9	Low	73.6	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.102	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-75.9	-1.4	177.9	-53	-60.4	0	0	0	113.7	A218 M239 I240 S241 S242 F659 T660	A218-D657 WeakPolarHBondContact CB-OD1 3.33Å; M239-D657 HydrophobicContact CE-CB 4.17Å; I240-D657 VanDerWaalsContact O-OD1 3.11Å; S241-D657 VanDerWaalsContact CA-OD2 3.26Å; S241-D657 WeakPolarHBondContact CA-OD2 3.42Å; S242-D657 WeakPolarHBondContact CB-OD2 3.3Å; S242-D657 PolarHBondContact N-OD1 3.38Å; S242-D657 PolarHBondContact N-OD2 2.79Å; S242-D657 PolarHBondContact OG-OD2 3.25Å; D657-F659 PolarHBondContact O-N 3.48Å; D657-T660 HydrophobicContact CB-CG2 3.91Å; D657-T660 WeakPolarHBondContact O-CB 3.46Å; D657-T660 VanDerWaalsContact O-CG2 3.31Å; D657-T660 WeakPolarHBondContact O-CG2 3.5Å; D657-T660 PolarHBondContact O-N 2.89Å; D657-T660 PolarHBondContact O-OG1 2.87Å
658	C	60.3	Low	72.8	Confident	52 Å²	52	42.7 Å²	42.7	35%	0.351	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-57.9	-21.9	176.6	60.9	0	0	0	0	112.2	Q656	Q656-C658 VanDerWaalsContact CB-SG 3.5Å; Q656-C658 PolarHBondContact O-N 3.34Å
659	F	61.5	Low	72.4	Confident	22 Å²	22	44.4 Å²	44.4	10%	0.096	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-97.9	3.9	178.8	-48.8	-65.5	0	0	0	114.6	R213 M216 T217 D657 R682	R213-F659 HydrophobicContact CB-CD1 4.42Å; R213-F659 HydrophobicContact CB-CE1 4.05Å; R213-F659 HydrophobicContact CB-CZ 4.42Å; R213-F659 HydrophobicContact CG-CE1 4.04Å; R213-F659 HydrophobicContact CG-CZ 4.25Å; M216-F659 HydrophobicContact CB-CE2 4.31Å; M216-F659 WeakPolarHBondContact O-CD2 3.39Å; T217-F659 HydrophobicContact CG2-CB 3.81Å; T217-F659 WeakPolarHBondContact CG2-O 3.37Å; T217-F659 WeakPolarHBondContact OG1-CB 3.3Å; D657-F659 PolarHBondContact O-N 3.48Å; F659-R682 PolarHBondContact O-NE 3.21Å; F659-R682 PolarHBondContact O-NH2 3.3Å
660	T	67.4	Low	72.4	Confident	15 Å²	15	43.9 Å²	43.9	9%	0.092	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-56.4	145.1	-179.8	50	0	0	0	0	111.9	M239 D657 R682 R748	M239-T660 PolarHBondContact SD-OG1 3.14Å; M239-T660 VanDerWaalsContact SD-OG1 3.37Å; D657-T660 HydrophobicContact CB-CG2 3.91Å; D657-T660 WeakPolarHBondContact O-CB 3.46Å; D657-T660 VanDerWaalsContact O-CG2 3.31Å; D657-T660 WeakPolarHBondContact O-CG2 3.5Å; D657-T660 PolarHBondContact O-N 2.89Å; D657-T660 PolarHBondContact O-OG1 2.87Å; T660-R682 WeakPolarHBondContact O-CD 3.4Å; T660-R682 PolarHBondContact O-NE 3.3Å; T660-R748 PolarHBondContact OG1-NH2 3.3Å
661	P	71.6	Confident	72.5	Confident	23 Å²	23	45.2 Å²	45.2	15%	0.149	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-66.9	156	179.9	24.8	-29.6	0	0	0	111.8	A354 L391 F663	A354-P661 HydrophobicContact CB-CB 3.87Å; A354-P661 HydrophobicContact CB-CG 4.03Å; L391-P661 HydrophobicContact CD1-CB 4.44Å; L391-P661 HydrophobicContact CD1-CG 3.39Å; P661-F663 HydrophobicContact CG-CE2 4.34Å; P661-F663 HydrophobicContact CG-CZ 4.33Å; P661-F663 PolarHBondContact O-N 3.18Å
662	L	75.4	Confident	72.9	Confident	45 Å²	45	48.6 Å²	48.6	24%	0.236	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-78	116.6	173.7	-173.3	63.6	0	0	0	108.5	H664	L662-H664 VanDerWaalsContact CD2-CE1 3.46Å; L662-H664 WeakPolarHBondContact CD2-CE1 3.48Å; L662-H664 PolarHBondContact O-CD2 3.37Å
663	F	78	Confident	73.2	Confident	52 Å²	52	47 Å²	47	23%	0.228	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.2	173	-71.8	-79.6	0	0	0	110.1	L220 T321 R352 Y353 A354 L391 P661	L220-F663 HydrophobicContact CD1-CE2 4.13Å; L220-F663 HydrophobicContact CD1-CZ 3.9Å; L220-F663 HydrophobicContact CD2-CZ 4.1Å; T321-F663 HydrophobicContact CG2-CE1 3.78Å; T321-F663 HydrophobicContact CG2-CZ 4.31Å; R352-F663 HydrophobicContact CB-CB 4.49Å; R352-F663 HydrophobicContact CB-CD1 4.22Å; R352-F663 HydrophobicContact CG-CD1 3.83Å; R352-F663 HydrophobicContact CG-CE1 4.31Å; R352-F663 HydrophobicContact CG-CG 4.43Å; Y353-F663 CarbonylContact O-C 3.59Å; Y353-F663 VanDerWaalsContact O-CA 3.32Å; Y353-F663 WeakPolarHBondContact O-CA 3.35Å; A354-F663 HydrophobicContact CB-CD1 3.8Å; A354-F663 HydrophobicContact CB-CE1 3.67Å; A354-F663 HydrophobicContact CB-CZ 4.31Å; L391-F663 HydrophobicContact CD2-CE1 4.49Å; P661-F663 HydrophobicContact CG-CE2 4.34Å; P661-F663 HydrophobicContact CG-CZ 4.33Å; P661-F663 PolarHBondContact O-N 3.18Å
664	H	72.2	Confident	73.7	Confident	24 Å²	24	55.8 Å²	55.8	11%	0.111	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.7	179.2	-61.9	-77.5	0	0	0	110.8	Y353 L662 D694	Y353-H664 HydrophobicContact CD1-CB 4.18Å; Y353-H664 VanDerWaalsContact CD1-O 3.23Å; Y353-H664 WeakPolarHBondContact CD1-O 3.37Å; Y353-H664 HydrophobicContact CE1-CB 3.52Å; Y353-H664 WeakPolarHBondContact CE1-O 3.34Å; Y353-H664 HydrophobicContact CE2-CB 4.11Å; Y353-H664 VanDerWaalsContact CZ-CB 3.48Å; Y353-H664 PolarHBondContact N-O 3.14Å; Y353-H664 PolarHBondContact O-N 2.79Å; L662-H664 VanDerWaalsContact CD2-CE1 3.46Å; L662-H664 WeakPolarHBondContact CD2-CE1 3.48Å; L662-H664 PolarHBondContact O-CD2 3.37Å; H664-D694 IonicContact NE2-OD2 2.75Å
665	S	66.3	Low	74.3	Confident	68 Å²	68	62.6 Å²	62.6	48%	0.476	32%	0.318	S	S	.	.			trans	-123.3	-16	170.3	56.8	0	0	0	0	112.6
666	T	65.3	Low	74.6	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.583	34%	0.339	S	S	*	.	S	Bend	trans	-124	149.7	-176.1	45	0	0	0	0	111.8
667	V	61.9	Low	75.8	Confident	47 Å²	47	61.3 Å²	61.3	29%	0.285	33%	0.326	S	S	.	.			trans	-90.4	126.4	176.8	-177.1	0	0	0	0	109.5	A338 K669	A338-V667 HydrophobicContact CB-CB 4.5Å; A338-V667 HydrophobicContact CB-CG2 3.24Å; V667-K669 HydrophobicContact CG1-CG 4.41Å
668	M	72.8	Confident	77.3	Confident	59 Å²	59	66.3 Å²	66.3	29%	0.291	35%	0.348	S	S	.	.			trans	-120.1	137.8	158.9	-75.5	-176.8	44.3	0	0	109.5	L673 M677 V697	M668-L673 HydrophobicContact CE-CD2 3.78Å; M668-M677 HydrophobicContact CE-CE 3.49Å; M668-M677 VanDerWaalsContact CE-CE 3.49Å; M668-M677 HydrophobicContact SD-CE 4.39Å; M668-V697 HydrophobicContact CB-CG1 4Å; M668-V697 HydrophobicContact CE-CG1 3.85Å
669	K	76.5	Confident	78.6	Confident	103 Å²	103	64.3 Å²	64.3	45%	0.448	34%	0.335	S	S	.	.			trans	-102.1	158.7	173.1	-65.1	179.1	-179.4	177.4	0	110.3	V667 S671 D672	V667-K669 HydrophobicContact CG1-CG 4.41Å; K669-S671 WeakPolarHBondContact CB-OG 3.27Å; K669-S671 PolarHBondContact O-N 2.94Å; K669-D672 WeakPolarHBondContact CB-OD2 3.48Å; K669-D672 PolarHBondContact N-OD2 3.22Å; K669-D672 WeakPolarHBondContact O-CB 3.22Å; K669-D672 PolarHBondContact O-N 3.25Å
670	I	82.9	Confident	79.9	Confident	26 Å²	26	69.8 Å²	69.8	13%	0.133	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29.9	172	-168.7	167.8	0	0	0	112.5	D672 L673 E699 V756 K761 V763	I670-D672 PolarHBondContact O-N 3.34Å; I670-L673 WeakPolarHBondContact O-CB 3.42Å; I670-L673 PolarHBondContact O-N 3.24Å; I670-E699 HydrophobicContact CD1-CB 4.48Å; I670-E699 HydrophobicContact CD1-CG 4.16Å; I670-V756 HydrophobicContact CD1-CG1 4.38Å; I670-V756 HydrophobicContact CG1-CG1 3.88Å; I670-K761 HydrophobicContact CD1-CB 4.43Å; I670-V763 HydrophobicContact CD1-CG2 3.77Å; I670-V763 HydrophobicContact CG1-CG2 3.97Å
671	S	84	Confident	80.6	Confident	70 Å²	70	69.3 Å²	69.3	49%	0.49	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.1	175.4	52.2	0	0	0	0	113.6	K669 L673	K669-S671 WeakPolarHBondContact CB-OG 3.27Å; K669-S671 PolarHBondContact O-N 2.94Å; S671-L673 VanDerWaalsContact C-N 3.29Å
672	D	85	Confident	81.3	Confident	85 Å²	85	70 Å²	70	46%	0.455	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-85.3	-11.9	-175.8	-50.4	-24.3	0	0	0	110.9	K669 I670	K669-D672 WeakPolarHBondContact CB-OD2 3.48Å; K669-D672 PolarHBondContact N-OD2 3.22Å; K669-D672 WeakPolarHBondContact O-CB 3.22Å; K669-D672 PolarHBondContact O-N 3.25Å; I670-D672 PolarHBondContact O-N 3.34Å
673	L	87.1	Confident	81.8	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.052	35%	0.345	C	S	.	.			trans	-77.6	136.7	178.4	-65.5	-178	0	0	0	112.2	M668 I670 S671 M677 V679 I695 V697 V753 V756 V763	M668-L673 HydrophobicContact CE-CD2 3.78Å; I670-L673 WeakPolarHBondContact O-CB 3.42Å; I670-L673 PolarHBondContact O-N 3.24Å; S671-L673 VanDerWaalsContact C-N 3.29Å; L673-M677 HydrophobicContact CD2-CE 4.08Å; L673-M677 HydrophobicContact CD2-SD 3.83Å; L673-V679 HydrophobicContact CD2-CG1 4.01Å; L673-I695 HydrophobicContact CD1-CD1 3.87Å; L673-I695 HydrophobicContact CD2-CD1 4.48Å; L673-V697 HydrophobicContact CD1-CB 4.32Å; L673-V697 HydrophobicContact CD1-CG1 3.96Å; L673-V697 HydrophobicContact CD1-CG2 3.98Å; L673-V697 HydrophobicContact CD2-CG1 3.99Å; L673-V697 HydrophobicContact CG-CG1 3.99Å; L673-V753 HydrophobicContact CD2-CG2 4.36Å; L673-V756 HydrophobicContact CB-CG1 4.47Å; L673-V756 HydrophobicContact CB-CG2 3.76Å; L673-V756 HydrophobicContact CD1-CG2 4.48Å; L673-V763 HydrophobicContact CD1-CB 4.49Å; L673-V763 HydrophobicContact CD1-CG1 3.88Å; L673-V763 HydrophobicContact CD1-CG2 3.75Å
674	R	89.4	Confident	82	Confident	193 Å²	193	68.1 Å²	68.1	73%	0.728	35%	0.347	S	S	*	.			trans	-125	142.6	176.6	-63.5	-87.2	-94.1	-82.1	-3	109.3	G676 M677	R674-G676 PolarHBondContact O-N 3.22Å; R674-M677 WeakPolarHBondContact O-CB 3.24Å; R674-M677 PolarHBondContact O-N 3.11Å
675	K	91.3	Very high	82.6	Confident	172 Å²	172	68.4 Å²	68.4	75%	0.748	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	129.5	171.3	-178.1	174.3	-179	179.8	0	109.5	S754	K675-S754 WeakPolarHBondContact CD-O 3.49Å; K675-S754 VanDerWaalsContact CE-O 3.25Å; K675-S754 WeakPolarHBondContact CE-O 3.43Å; K675-S754 WeakPolarHBondContact CG-O 3.48Å
676	G	90.8	Very high	83.6	Confident	47 Å²	47	65.4 Å²	65.4	49%	0.485	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	-8.9	-175.3	0	0	0	0	0	115.2	R674 V753	R674-G676 PolarHBondContact O-N 3.22Å; G676-V753 PolarHBondContact N-O 2.96Å
677	M	91.6	Very high	84.6	Confident	61 Å²	61	61.3 Å²	61.3	30%	0.3	30%	0.303	S	S	.	.			trans	-64.2	134.7	174.9	-175.9	173.3	164	0	0	110.6	M668 L673 R674 V679 T752 V753	M668-M677 HydrophobicContact CE-CE 3.49Å; M668-M677 VanDerWaalsContact CE-CE 3.49Å; M668-M677 HydrophobicContact SD-CE 4.39Å; L673-M677 HydrophobicContact CD2-CE 4.08Å; L673-M677 HydrophobicContact CD2-SD 3.83Å; R674-M677 WeakPolarHBondContact O-CB 3.24Å; R674-M677 PolarHBondContact O-N 3.11Å; M677-V679 HydrophobicContact CE-CG1 4.21Å; M677-V679 HydrophobicContact CG-CG1 4.26Å; M677-T752 WeakPolarHBondContact O-CA 3.4Å; M677-V753 HydrophobicContact CB-CG2 4.25Å; M677-V753 PolarHBondContact O-N 2.95Å
678	Q	91	Very high	85.6	Confident	124 Å²	124	60.3 Å²	60.3	58%	0.579	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.2	171	-68	-171.3	3.6	0	0	109.2	A751	Q678-A751 WeakPolarHBondContact CA-O 3.33Å
679	V	88.8	Confident	86.2	Confident	10 Å²	10	59.5 Å²	59.5	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150	179.2	-65.3	0	0	0	0	109.8	L673 M677 I695 K750 A751 V753 L765	L673-V679 HydrophobicContact CD2-CG1 4.01Å; M677-V679 HydrophobicContact CE-CG1 4.21Å; M677-V679 HydrophobicContact CG-CG1 4.26Å; V679-I695 HydrophobicContact CB-CB 4.46Å; V679-I695 HydrophobicContact CB-CG2 4.48Å; V679-I695 HydrophobicContact CG1-CD1 4.48Å; V679-I695 HydrophobicContact CG2-CD1 4.34Å; V679-I695 HydrophobicContact CG2-CG2 4.08Å; V679-K750 WeakPolarHBondContact O-CA 3.41Å; V679-A751 PolarHBondContact N-O 3.36Å; V679-A751 PolarHBondContact O-N 3.07Å; V679-V753 HydrophobicContact CG1-CG2 3.83Å; V679-V753 HydrophobicContact CG2-CG2 4.13Å; V679-L765 HydrophobicContact CG2-CD2 3.78Å
680	K	87.5	Confident	86.8	Confident	136 Å²	136	54.6 Å²	54.6	59%	0.591	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	150.7	165.7	-66.7	-178.2	-179.4	178.8	0	108.2	I749 M771	K680-I749 CarbonylContact C-O 3.25Å; K680-I749 VanDerWaalsContact CA-O 3.29Å; K680-I749 WeakPolarHBondContact CA-O 3.43Å; K680-M771 HydrophobicContact CD-CE 4.41Å; K680-M771 HydrophobicContact CD-SD 4.22Å; K680-M771 HydrophobicContact CG-SD 4.31Å
681	G	83.9	Confident	87.2	Confident	6 Å²	6	53.4 Å²	53.4	6%	0.062	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	-178.2	176.6	0	0	0	0	0	113	D694 R748 I749	G681-D694 CarbonylContact C-O 3.54Å; G681-D694 WeakPolarHBondContact CA-O 3.36Å; G681-R748 WeakPolarHBondContact O-CA 3.26Å; G681-I749 PolarHBondContact N-O 3.21Å; G681-I749 PolarHBondContact O-N 3.23Å
682	R	84.9	Confident	87.5	Confident	38 Å²	38	52.4 Å²	52.4	14%	0.143	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.1	177.9	-176.6	178.1	174	-78.4	-0.6	109.5	F659 T660 E684 C693 D694 D747	F659-R682 PolarHBondContact O-NE 3.21Å; F659-R682 PolarHBondContact O-NH2 3.3Å; T660-R682 WeakPolarHBondContact O-CD 3.4Å; T660-R682 PolarHBondContact O-NE 3.3Å; R682-E684 PolarHBondContact O-N 3.21Å; R682-C693 CarbonylContact O-C 3.52Å; R682-C693 WeakPolarHBondContact O-CA 3.35Å; R682-D694 PolarHBondContact N-O 2.85Å; R682-D694 PolarHBondContact O-N 3.36Å; R682-D747 WeakPolarHBondContact CA-O 3.22Å
683	V	87.4	Confident	87.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	115.7	176.3	-179.3	0	0	0	0	109.6	V686 A691 R744 G746 D747 I749	V683-V686 HydrophobicContact CG1-CG2 3.64Å; V683-A691 HydrophobicContact CG1-CB 4.08Å; V683-R744 WeakPolarHBondContact CB-O 3.36Å; V683-R744 WeakPolarHBondContact CG1-O 3.43Å; V683-G746 WeakPolarHBondContact O-CA 3.45Å; V683-G746 PolarHBondContact O-N 2.92Å; V683-D747 HydrophobicContact CB-CB 4.49Å; V683-D747 HydrophobicContact CG2-CB 3.94Å; V683-D747 PolarHBondContact N-O 3.36Å; V683-I749 HydrophobicContact CG2-CG2 4.06Å
684	E	81.6	Confident	87.6	Confident	56 Å²	56	48.7 Å²	48.7	26%	0.262	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-26.8	178.9	-72.6	-155.4	146.8	0	0	113.8	R682 F692 D694 N700 L745	R682-E684 PolarHBondContact O-N 3.21Å; E684-F692 PolarHBondContact N-O 3.14Å; E684-D694 HydrophobicContact CG-CB 3.82Å; E684-N700 PolarHBondContact OE2-ND2 3.46Å; E684-N700 PolarHBondContact OE2-OD1 2.9Å; E684-N700 VanDerWaalsContact OE2-OD1 3.12Å; E684-L745 WeakPolarHBondContact O-CD1 3.41Å
685	N	84.9	Confident	87.4	Confident	31 Å²	31	40 Å²	40	17%	0.166	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	135.7	179	-166.8	4.1	0	0	0	110.7	N210 A691 F692	N210-N685 PolarHBondContact ND2-OD1 3.2Å; N685-A691 CarbonylContact O-C 3.59Å; N685-A691 WeakPolarHBondContact O-CA 3.28Å; N685-F692 HydrophobicContact CB-CB 4.32Å; N685-F692 HydrophobicContact CB-CD2 4.41Å; N685-F692 PolarHBondContact N-O 2.74Å; N685-F692 VanDerWaalsContact N-O 3.15Å; N685-F692 PolarHBondContact O-N 3.29Å
686	V	87.3	Confident	86.7	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.03	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.8	172.3	-177.6	0	0	0	0	108.8	V206 N210 V683 F741	V206-V686 WeakPolarHBondContact CG1-O 3.43Å; N210-V686 PolarHBondContact ND2-O 3.34Å; V683-V686 HydrophobicContact CG1-CG2 3.64Å; V686-F741 HydrophobicContact CG1-CD1 4.41Å; V686-F741 HydrophobicContact CG1-CG 4.35Å
687	T	86.1	Confident	86.1	Confident	8 Å²	8	30.4 Å²	30.4	5%	0.049	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	169.5	179.2	72.4	0	0	0	0	110.3	F689 G690 F692	T687-F689 HydrophobicContact CG2-CE1 4.15Å; T687-F689 HydrophobicContact CG2-CZ 4Å; T687-F689 PolarHBondContact O-N 2.77Å; T687-F689 WeakPolarHBondContact OG1-CD1 3.48Å; T687-F689 WeakPolarHBondContact OG1-CD2 3.39Å; T687-F689 WeakPolarHBondContact OG1-CE1 3.26Å; T687-F689 WeakPolarHBondContact OG1-CE2 3.27Å; T687-F689 WeakPolarHBondContact OG1-CG 3.33Å; T687-F689 WeakPolarHBondContact OG1-CZ 3.41Å; T687-F689 PolarHBondContact OG1-N 2.85Å; T687-G690 WeakPolarHBondContact CA-O 3.25Å; T687-G690 WeakPolarHBondContact CB-O 3.36Å; T687-G690 PolarHBondContact N-O 3.1Å; T687-G690 PolarHBondContact O-N 2.83Å; T687-G690 PolarHBondContact OG1-N 2.89Å; T687-G690 PolarHBondContact OG1-O 3.47Å; T687-F692 HydrophobicContact CG2-CD2 4.15Å; T687-F692 HydrophobicContact CG2-CE2 3.83Å
688	T	82	Confident	85.1	Confident	26 Å²	26	31.4 Å²	31.4	16%	0.16	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.7	178.1	57	0	0	0	0	114.2	H123 V206 R705	H123-T688 PolarHBondContact ND1-OG1 3.08Å; V206-T688 HydrophobicContact CG2-CG2 3.93Å; T688-R705 PolarHBondContact O-NH1 3.31Å
689	F	85.6	Confident	84.6	Confident	43 Å²	43	27 Å²	27	19%	0.189	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-12.3	-174.6	57.1	-95.4	0	0	0	114.9	H123 M410 Y411 T687 F692 Y702 R705	H123-F689 HydrophobicContact CB-CD1 4.11Å; H123-F689 HydrophobicContact CB-CE1 4.49Å; H123-F689 AromaticContact CG-CD1 3.74Å; H123-F689 AromaticContact ND1-CD1 3.77Å; M410-F689 HydrophobicContact CE-CE1 3.6Å; M410-F689 HydrophobicContact CE-CZ 3.7Å; M410-F689 HydrophobicContact SD-CE1 4.3Å; M410-F689 HydrophobicContact SD-CZ 3.9Å; Y411-F689 HydrophobicContact CE2-CE1 4.36Å; T687-F689 HydrophobicContact CG2-CE1 4.15Å; T687-F689 HydrophobicContact CG2-CZ 4Å; T687-F689 PolarHBondContact O-N 2.77Å; T687-F689 WeakPolarHBondContact OG1-CD1 3.48Å; T687-F689 WeakPolarHBondContact OG1-CD2 3.39Å; T687-F689 WeakPolarHBondContact OG1-CE1 3.26Å; T687-F689 WeakPolarHBondContact OG1-CE2 3.27Å; T687-F689 WeakPolarHBondContact OG1-CG 3.33Å; T687-F689 WeakPolarHBondContact OG1-CZ 3.41Å; T687-F689 PolarHBondContact OG1-N 2.85Å; F689-F692 AromaticContact CE2-CE2 3.99Å; F689-F692 HydrophobicContact CE2-CE2 3.99Å; F689-F692 AromaticContact CE2-CZ 3.96Å; F689-F692 HydrophobicContact CE2-CZ 3.96Å; F689-F692 HydrophobicContact CZ-CE2 4.11Å; F689-F692 HydrophobicContact CZ-CZ 4.27Å; F689-Y702 AromaticContact CD2-CE2 3.88Å; F689-Y702 HydrophobicContact CD2-CE2 3.88Å; F689-Y702 AromaticContact CE2-CE2 3.9Å; F689-Y702 HydrophobicContact CE2-CE2 3.9Å; F689-Y702 PolarHBondContact O-OH 2.88Å; F689-R705 WeakPolarHBondContact O-CB 3.49Å; F689-R705 PolarHBondContact O-N 2.96Å; F689-R705 VanDerWaalsContact O-N 3.15Å
690	G	89.8	Confident	84.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-179.1	-176.3	0	0	0	0	0	112.4	T687 I703 Y708	T687-G690 WeakPolarHBondContact CA-O 3.25Å; T687-G690 WeakPolarHBondContact CB-O 3.36Å; T687-G690 PolarHBondContact N-O 3.1Å; T687-G690 PolarHBondContact O-N 2.83Å; T687-G690 PolarHBondContact OG1-N 2.89Å; T687-G690 PolarHBondContact OG1-O 3.47Å; G690-I703 CarbonylContact C-O 3.58Å; G690-I703 WeakPolarHBondContact CA-O 3.46Å; G690-Y708 WeakPolarHBondContact CA-OH 3.22Å; G690-Y708 PolarHBondContact O-OH 3.47Å
691	A	90.9	Very high	84.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	152.8	178.6	0	0	0	0	0	110.5	V683 N685 I703 Y708 L743	V683-A691 HydrophobicContact CG1-CB 4.08Å; N685-A691 CarbonylContact O-C 3.59Å; N685-A691 WeakPolarHBondContact O-CA 3.28Å; A691-I703 HydrophobicContact CB-CB 4.33Å; A691-I703 PolarHBondContact N-O 2.75Å; A691-I703 PolarHBondContact O-N 3.01Å; A691-Y708 HydrophobicContact CB-CE1 4.02Å; A691-Y708 WeakPolarHBondContact CB-OH 3.19Å; A691-Y708 PolarHBondContact N-OH 3.32Å; A691-L743 HydrophobicContact CB-CD1 4.48Å
692	F	90.3	Very high	85.2	Confident	49 Å²	49	26.2 Å²	26.2	22%	0.215	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.9	172.8	-64.3	-85.3	0	0	0	108.1	E684 N685 T687 F689 N700 A701 Y702	E684-F692 PolarHBondContact N-O 3.14Å; N685-F692 HydrophobicContact CB-CB 4.32Å; N685-F692 HydrophobicContact CB-CD2 4.41Å; N685-F692 PolarHBondContact N-O 2.74Å; N685-F692 VanDerWaalsContact N-O 3.15Å; N685-F692 PolarHBondContact O-N 3.29Å; T687-F692 HydrophobicContact CG2-CD2 4.15Å; T687-F692 HydrophobicContact CG2-CE2 3.83Å; F689-F692 AromaticContact CE2-CE2 3.99Å; F689-F692 HydrophobicContact CE2-CE2 3.99Å; F689-F692 AromaticContact CE2-CZ 3.96Å; F689-F692 HydrophobicContact CE2-CZ 3.96Å; F689-F692 HydrophobicContact CZ-CE2 4.11Å; F689-F692 HydrophobicContact CZ-CZ 4.27Å; F692-N700 HydrophobicContact CB-CB 4.2Å; F692-N700 HydrophobicContact CD1-CB 4.47Å; F692-A701 CarbonylContact C-O 3.46Å; F692-A701 WeakPolarHBondContact CA-O 3.23Å; F692-Y702 HydrophobicContact CD1-CD2 4.15Å; F692-Y702 AromaticContact CE1-CD2 3.69Å; F692-Y702 HydrophobicContact CE1-CD2 3.69Å; F692-Y702 HydrophobicContact CE1-CG 4.39Å; F692-Y702 HydrophobicContact CE2-CD2 4.42Å; F692-Y702 AromaticContact CZ-CD2 3.85Å; F692-Y702 HydrophobicContact CZ-CD2 3.85Å; F692-Y702 HydrophobicContact CZ-CE2 4.23Å
693	C	89.2	Confident	85.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137.9	-173.3	-52.3	0	0	0	0	110.5	R682 N700 A701 I703 I749	R682-C693 CarbonylContact O-C 3.52Å; R682-C693 WeakPolarHBondContact O-CA 3.35Å; C693-N700 CarbonylContact O-C 3.53Å; C693-N700 WeakPolarHBondContact O-CA 3.44Å; C693-A701 PolarHBondContact N-O 3.45Å; C693-A701 PolarHBondContact O-N 3.13Å; C693-I703 WeakPolarHBondContact SG-CD1 3.34Å; C693-I749 HydrophobicContact CB-CD1 3.88Å; C693-I749 VanDerWaalsContact SG-CD1 3.57Å
694	D	85.2	Confident	85.8	Confident	17 Å²	17	25.6 Å²	25.6	9%	0.091	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	123.6	167.6	-179.7	18.3	0	0	0	109	H664 G681 R682 E684 G696	H664-D694 IonicContact NE2-OD2 2.75Å; G681-D694 CarbonylContact C-O 3.54Å; G681-D694 WeakPolarHBondContact CA-O 3.36Å; R682-D694 PolarHBondContact N-O 2.85Å; R682-D694 PolarHBondContact O-N 3.36Å; E684-D694 HydrophobicContact CG-CB 3.82Å; D694-G696 PolarHBondContact OD1-N 2.9Å
695	I	85.3	Confident	86	Confident	10 Å²	10	27.7 Å²	27.7	5%	0.051	14%	0.135	C	C	.	.			trans	-114.9	10.7	175.5	62	170.7	0	0	0	111.7	L673 V679 V697 A701 V763 L765	L673-I695 HydrophobicContact CD1-CD1 3.87Å; L673-I695 HydrophobicContact CD2-CD1 4.48Å; V679-I695 HydrophobicContact CB-CB 4.46Å; V679-I695 HydrophobicContact CB-CG2 4.48Å; V679-I695 HydrophobicContact CG1-CD1 4.48Å; V679-I695 HydrophobicContact CG2-CD1 4.34Å; V679-I695 HydrophobicContact CG2-CG2 4.08Å; I695-V697 HydrophobicContact CD1-CG1 4.26Å; I695-V697 HydrophobicContact CD1-CG2 3.75Å; I695-V697 HydrophobicContact CG1-CB 4.38Å; I695-V697 HydrophobicContact CG1-CG1 4.15Å; I695-V697 HydrophobicContact CG1-CG2 3.56Å; I695-A701 HydrophobicContact CD1-CB 3.92Å; I695-A701 HydrophobicContact CG1-CB 4.19Å; I695-A701 HydrophobicContact CG2-CB 4.11Å; I695-V763 HydrophobicContact CD1-CG1 4Å; I695-L765 HydrophobicContact CG2-CD1 4.03Å
696	G	77.3	Confident	86.1	Confident	18 Å²	18	33.4 Å²	33.4	19%	0.186	16%	0.16	C	C	.	.	S	Bend	trans	79.9	25.1	179.3	0	0	0	0	0	115.3	D694	D694-G696 PolarHBondContact OD1-N 2.9Å
697	V	77.6	Confident	86.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-117.1	23.6	-178.1	-58.5	0	0	0	0	114.6	M668 L673 I695 E699 V763	M668-V697 HydrophobicContact CB-CG1 4Å; M668-V697 HydrophobicContact CE-CG1 3.85Å; L673-V697 HydrophobicContact CD1-CB 4.32Å; L673-V697 HydrophobicContact CD1-CG1 3.96Å; L673-V697 HydrophobicContact CD1-CG2 3.98Å; L673-V697 HydrophobicContact CD2-CG1 3.99Å; L673-V697 HydrophobicContact CG-CG1 3.99Å; I695-V697 HydrophobicContact CD1-CG1 4.26Å; I695-V697 HydrophobicContact CD1-CG2 3.75Å; I695-V697 HydrophobicContact CG1-CB 4.38Å; I695-V697 HydrophobicContact CG1-CG1 4.15Å; I695-V697 HydrophobicContact CG1-CG2 3.56Å; V697-E699 PolarHBondContact O-N 2.95Å; V697-V763 HydrophobicContact CG2-CG2 4.46Å
698	E	71.5	Confident	86.3	Confident	83 Å²	83	36.4 Å²	36.4	39%	0.388	17%	0.173	S	C	.	.	S	Bend	trans	67.6	-13.5	-177.7	-48.4	175.9	-177.7	0	0	116	R331	R331-E698 HydrophobicContact CB-CB 4.43Å; R331-E698 HydrophobicContact CB-CG 4.38Å; R331-E698 HydrophobicContact CG-CB 3.98Å; R331-E698 HydrophobicContact CG-CG 4.44Å; R331-E698 PolarHBondContact NE-O 2.65Å; R331-E698 PolarHBondContact NH2-O 3.28Å
699	E	79.7	Confident	86.3	Confident	31 Å²	31	36.6 Å²	36.6	15%	0.145	18%	0.175	C	C	.	.	S	Bend	trans	-122.4	134.7	179.3	-64.9	-68.8	179.4	0	0	111	R331 I670 V697 A701 K761	R331-E699 VanDerWaalsContact CZ-CD 3.47Å; R331-E699 IonicContact CZ-OE1 3.48Å; R331-E699 IonicContact CZ-OE2 3.5Å; R331-E699 IonicContact NH1-OE1 3.13Å; R331-E699 PolarHBondContact NH1-OE1 3.36Å; R331-E699 IonicContact NH2-OE1 2.95Å; R331-E699 PolarHBondContact NH2-OE1 3.25Å; R331-E699 IonicContact NH2-OE2 3.05Å; R331-E699 PolarHBondContact NH2-OE2 3.44Å; I670-E699 HydrophobicContact CD1-CB 4.48Å; I670-E699 HydrophobicContact CD1-CG 4.16Å; V697-E699 PolarHBondContact O-N 2.95Å; E699-A701 PolarHBondContact O-N 2.85Å; E699-K761 HydrophobicContact CG-CB 3.97Å; E699-K761 VanDerWaalsContact OE1-CB 3.24Å; E699-K761 WeakPolarHBondContact OE1-CB 3.33Å; E699-K761 WeakPolarHBondContact OE1-CD 3.43Å
700	N	86.8	Confident	85.7	Confident	66 Å²	66	45.7 Å²	45.7	35%	0.353	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-68	125.9	174.8	-79	-12.2	0	0	0	110.5	E684 F692 C693	E684-N700 PolarHBondContact OE2-ND2 3.46Å; E684-N700 PolarHBondContact OE2-OD1 2.9Å; E684-N700 VanDerWaalsContact OE2-OD1 3.12Å; F692-N700 HydrophobicContact CB-CB 4.2Å; F692-N700 HydrophobicContact CD1-CB 4.47Å; C693-N700 CarbonylContact O-C 3.53Å; C693-N700 WeakPolarHBondContact O-CA 3.44Å
701	A	91.4	Very high	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.6	175	0	0	0	0	0	110.1	F692 C693 I695 E699 V763 L765	F692-A701 CarbonylContact C-O 3.46Å; F692-A701 WeakPolarHBondContact CA-O 3.23Å; C693-A701 PolarHBondContact N-O 3.45Å; C693-A701 PolarHBondContact O-N 3.13Å; I695-A701 HydrophobicContact CD1-CB 3.92Å; I695-A701 HydrophobicContact CG1-CB 4.19Å; I695-A701 HydrophobicContact CG2-CB 4.11Å; E699-A701 PolarHBondContact O-N 2.85Å; A701-V763 CarbonylContact C-O 3.5Å; A701-V763 WeakPolarHBondContact CA-O 3.35Å; A701-V763 HydrophobicContact CB-CB 3.97Å; A701-V763 HydrophobicContact CB-CG1 3.9Å; A701-L765 HydrophobicContact CB-CD1 3.59Å; A701-L765 HydrophobicContact CB-CD2 4.05Å; A701-L765 HydrophobicContact CB-CG 3.68Å
702	Y	94.1	Very high	81.4	Confident	70 Å²	70	57 Å²	57	28%	0.275	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.7	-177.6	176.5	-112	0	0	0	111.5	F689 F692 P704 V763 A764 L765	F689-Y702 AromaticContact CD2-CE2 3.88Å; F689-Y702 HydrophobicContact CD2-CE2 3.88Å; F689-Y702 AromaticContact CE2-CE2 3.9Å; F689-Y702 HydrophobicContact CE2-CE2 3.9Å; F689-Y702 PolarHBondContact O-OH 2.88Å; F692-Y702 HydrophobicContact CD1-CD2 4.15Å; F692-Y702 AromaticContact CE1-CD2 3.69Å; F692-Y702 HydrophobicContact CE1-CD2 3.69Å; F692-Y702 HydrophobicContact CE1-CG 4.39Å; F692-Y702 HydrophobicContact CE2-CD2 4.42Å; F692-Y702 AromaticContact CZ-CD2 3.85Å; F692-Y702 HydrophobicContact CZ-CD2 3.85Å; F692-Y702 HydrophobicContact CZ-CE2 4.23Å; Y702-P704 HydrophobicContact CD1-CG 4.15Å; Y702-P704 HydrophobicContact CE1-CB 4.13Å; Y702-P704 HydrophobicContact CE1-CG 3.72Å; Y702-V763 PolarHBondContact N-O 2.85Å; Y702-A764 WeakPolarHBondContact O-CA 3.5Å; Y702-L765 PolarHBondContact O-N 3.36Å
703	I	93.6	Very high	78.4	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109.9	173.9	-54.9	179.9	0	0	0	108.3	G690 A691 C693 E707 Y708 L743 I749 L765 V768	G690-I703 CarbonylContact C-O 3.58Å; G690-I703 WeakPolarHBondContact CA-O 3.46Å; A691-I703 HydrophobicContact CB-CB 4.33Å; A691-I703 PolarHBondContact N-O 2.75Å; A691-I703 PolarHBondContact O-N 3.01Å; C693-I703 WeakPolarHBondContact SG-CD1 3.34Å; I703-E707 HydrophobicContact CG2-CB 4Å; I703-Y708 HydrophobicContact CB-CE1 4.33Å; I703-Y708 HydrophobicContact CG2-CD1 3.81Å; I703-Y708 HydrophobicContact CG2-CE1 3.85Å; I703-L743 HydrophobicContact CB-CD1 4.47Å; I703-L743 HydrophobicContact CD1-CD1 3.86Å; I703-L743 HydrophobicContact CG2-CD1 3.9Å; I703-I749 HydrophobicContact CD1-CD1 3.43Å; I703-I749 VanDerWaalsContact CD1-CD1 3.43Å; I703-L765 HydrophobicContact CD1-CD1 4.31Å; I703-L765 HydrophobicContact CG1-CB 4.14Å; I703-L765 HydrophobicContact CG1-CD1 4.17Å; I703-V768 HydrophobicContact CD1-CG1 4.11Å; I703-V768 HydrophobicContact CD1-CG2 3.95Å; I703-V768 HydrophobicContact CG1-CG2 4.36Å; I703-V768 HydrophobicContact CG2-CG2 3.79Å
704	P	90.9	Very high	75.4	Confident	24 Å²	24	65.8 Å²	65.8	16%	0.156	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	145	171.4	-19.9	30.5	0	0	0	111.8	Y702 H706 E707 Y708	Y702-P704 HydrophobicContact CD1-CG 4.15Å; Y702-P704 HydrophobicContact CE1-CB 4.13Å; Y702-P704 HydrophobicContact CE1-CG 3.72Å; P704-H706 WeakPolarHBondContact CB-CE1 3.43Å; P704-H706 PolarHBondContact O-N 2.82Å; P704-E707 HydrophobicContact CB-CG 4.48Å; P704-E707 HydrophobicContact CG-CG 4.38Å; P704-E707 WeakPolarHBondContact O-CB 3.46Å; P704-E707 PolarHBondContact O-N 3.43Å; P704-Y708 WeakPolarHBondContact O-CD1 3.36Å
705	R	86.9	Confident	72.6	Confident	100 Å²	100	69 Å²	69	38%	0.377	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-54.4	-30.4	-179.6	-172.8	172.4	-175.6	164.6	1.8	115.1	T688 F689 E707 Y708 M740	T688-R705 PolarHBondContact O-NH1 3.31Å; F689-R705 WeakPolarHBondContact O-CB 3.49Å; F689-R705 PolarHBondContact O-N 2.96Å; F689-R705 VanDerWaalsContact O-N 3.15Å; R705-E707 VanDerWaalsContact C-N 3.28Å; R705-E707 PolarHBondContact O-N 3.15Å; R705-Y708 HydrophobicContact CG-CD2 4.45Å; R705-Y708 VanDerWaalsContact O-CB 3.26Å; R705-Y708 WeakPolarHBondContact O-CB 3.47Å; R705-Y708 PolarHBondContact O-N 3.01Å; R705-M740 PolarHBondContact NH2-O 3.28Å
706	H	87	Confident	69.9	Low	152 Å²	152	75.9 Å²	75.9	70%	0.704	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-75.3	-15.9	179.4	61.5	-94.1	0	0	0	113.9	P704 Y708	P704-H706 WeakPolarHBondContact CB-CE1 3.43Å; P704-H706 PolarHBondContact O-N 2.82Å; H706-Y708 VanDerWaalsContact C-N 3.29Å
707	E	89.2	Confident	67.7	Low	55 Å²	55	83 Å²	83	26%	0.257	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-87.6	-0.7	174.5	-70.5	-65.9	155.2	0	0	112.5	I703 P704 R705 H766 K767	I703-E707 HydrophobicContact CG2-CB 4Å; P704-E707 HydrophobicContact CB-CG 4.48Å; P704-E707 HydrophobicContact CG-CG 4.38Å; P704-E707 WeakPolarHBondContact O-CB 3.46Å; P704-E707 PolarHBondContact O-N 3.43Å; R705-E707 VanDerWaalsContact C-N 3.28Å; R705-E707 PolarHBondContact O-N 3.15Å; E707-H766 HydrophobicContact CG-CB 4.18Å; E707-H766 WeakPolarHBondContact OE2-CA 3.41Å; E707-H766 WeakPolarHBondContact OE2-CB 3.46Å; E707-K767 PolarHBondContact OE2-N 3.13Å
708	Y	87.6	Confident	65.2	Low	20 Å²	20	90.6 Å²	90.6	8%	0.078	46%	0.464	C	S	.	.	S	Bend	trans	-63.5	140.6	176.9	-78.3	22.7	0	0	0	109.5	G690 A691 I703 P704 R705 H706 R710 F741 T742 L743	G690-Y708 WeakPolarHBondContact CA-OH 3.22Å; G690-Y708 PolarHBondContact O-OH 3.47Å; A691-Y708 HydrophobicContact CB-CE1 4.02Å; A691-Y708 WeakPolarHBondContact CB-OH 3.19Å; A691-Y708 PolarHBondContact N-OH 3.32Å; I703-Y708 HydrophobicContact CB-CE1 4.33Å; I703-Y708 HydrophobicContact CG2-CD1 3.81Å; I703-Y708 HydrophobicContact CG2-CE1 3.85Å; P704-Y708 WeakPolarHBondContact O-CD1 3.36Å; R705-Y708 HydrophobicContact CG-CD2 4.45Å; R705-Y708 VanDerWaalsContact O-CB 3.26Å; R705-Y708 WeakPolarHBondContact O-CB 3.47Å; R705-Y708 PolarHBondContact O-N 3.01Å; H706-Y708 VanDerWaalsContact C-N 3.29Å; Y708-R710 PolarHBondContact O-N 2.98Å; Y708-F741 HydrophobicContact CE2-CB 4.27Å; Y708-F741 AromaticContact CE2-CD1 3.88Å; Y708-F741 HydrophobicContact CE2-CD1 3.88Å; Y708-T742 WeakPolarHBondContact CB-OG1 3.4Å; Y708-L743 HydrophobicContact CD1-CB 4.38Å; Y708-L743 HydrophobicContact CD1-CD1 3.55Å; Y708-L743 HydrophobicContact CD1-CG 4.06Å; Y708-L743 HydrophobicContact CD2-CB 3.95Å; Y708-L743 HydrophobicContact CD2-CG 4.23Å; Y708-L743 HydrophobicContact CE1-CB 4.3Å; Y708-L743 HydrophobicContact CE1-CD1 3.68Å; Y708-L743 HydrophobicContact CE1-CG 4.35Å; Y708-L743 HydrophobicContact CE2-CB 3.85Å; Y708-L743 HydrophobicContact CG-CB 4.21Å; Y708-L743 HydrophobicContact CG-CD1 4.01Å; Y708-L743 HydrophobicContact CG-CG 4Å
709	P	83.3	Confident	63	Low	31 Å²	31	94.4 Å²	94.4	20%	0.201	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-53.3	133	176	-18.2	27.6	0	0	0	109.3	T742 L743 V770	P709-T742 WeakPolarHBondContact O-CB 3.28Å; P709-T742 WeakPolarHBondContact O-CG2 3.48Å; P709-T742 PolarHBondContact O-OG1 3.33Å; P709-L743 HydrophobicContact CG-CD2 3.84Å; P709-L743 HydrophobicContact CG-CG 4.34Å; P709-V770 HydrophobicContact CG-CG2 4.06Å
710	R	71.7	Confident	60.5	Low	233 Å²	233	96.9 Å²	96.9	88%	0.879	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-71.3	141.4	169.5	-64.3	-176.7	-175.8	176	1.5	107.4	Y708 C712	Y708-R710 PolarHBondContact O-N 2.98Å; R710-C712 VanDerWaalsContact C-N 3.32Å; R710-C712 PolarHBondContact O-N 3.41Å
711	N	56.2	Low	57.7	Low	116 Å²	116	99.5 Å²	99.5	62%	0.62	54%	0.535	S	S	*	.			trans	-56.8	101	169.6	-81.1	-6	0	0	0	107.5	S713 T742	N711-S713 PolarHBondContact O-N 2.91Å; N711-S713 VanDerWaalsContact O-N 3.12Å; N711-T742 WeakPolarHBondContact OD1-CG2 3.36Å
712	C	34.2	Very low	54.6	Low	121 Å²	121	106.5 Å²	106.5	82%	0.818	57%	0.568	S	S	*	*			trans	-62.5	114	159.7	-87.6	0	0	0	0	105	R710 T714	R710-C712 VanDerWaalsContact C-N 3.32Å; R710-C712 PolarHBondContact O-N 3.41Å; C712-T714 PolarHBondContact O-N 3.32Å
713	S	28.1	Very low	51.7	Low	91 Å²	91	106.9 Å²	106.9	64%	0.636	58%	0.577	S	S	*	*			trans	-29.1	118.7	166.5	38.8	0	0	0	0	111.4	N711 S715	N711-S713 PolarHBondContact O-N 2.91Å; N711-S713 VanDerWaalsContact O-N 3.12Å; S713-S715 PolarHBondContact O-N 2.99Å
714	T	26.8	Very low	48.6	Very low	143 Å²	143	111 Å²	111	88%	0.877	61%	0.607	S	S	*	*	S	Bend	trans	-12.5	91	150.8	38.4	0	0	0	0	113.5	C712	C712-T714 PolarHBondContact O-N 3.32Å
715	S	26.2	Very low	45.6	Very low	86 Å²	86	116.2 Å²	116.2	60%	0.601	64%	0.638	S	S	*	*	S	Bend	trans	-134.1	-7.8	165.6	58.5	0	0	0	0	114.1	S713	S713-S715 PolarHBondContact O-N 2.99Å
716	N	27.6	Very low	42.8	Very low	153 Å²	153	118 Å²	118	82%	0.818	66%	0.661	S	S	*	*	S	Bend	trans	-125	8.9	179.4	-70.4	-17.8	0	0	0	115.6
717	L	30.3	Very low	40	Very low	167 Å²	167	114.2 Å²	114.2	87%	0.874	66%	0.662	S	S	*	*			trans	-108.9	65.2	158.4	-83.4	119.3	0	0	0	108.6
718	K	25.5	Very low	37	Very low	160 Å²	160	120 Å²	120	70%	0.696	69%	0.693	S	S	*	*			trans	-111.6	62.4	162.4	-89.8	-161.2	171.4	-130.6	0	108.3	E722	K718-E722 IonicContact NZ-OE1 3.74Å; K718-E722 PolarHBondContact NZ-OE1 3.13Å
719	I	26.5	Very low	34	Very low	163 Å²	163	122.6 Å²	122.6	84%	0.836	73%	0.726	S	S	*	*	S	Bend	trans	-142.8	113.4	160.3	-55.5	-178.3	0	0	0	105.7
720	A	26.9	Very low	31.4	Very low	83 Å²	83	127.7 Å²	127.7	69%	0.686	76%	0.756	S	S	*	*	S	Bend	trans	80.3	66.9	173.8	0	0	0	0	0	119.3
721	S	27.8	Very low	29.2	Very low	121 Å²	121	121.6 Å²	121.6	85%	0.846	75%	0.749	S	S	*	*			trans	179.4	69	136.8	41.3	0	0	0	0	111.4
722	E	26.3	Very low	27.7	Very low	148 Å²	148	124.6 Å²	124.6	69%	0.692	77%	0.765	S	S	*	*			trans	-110	104.3	160.8	-77.8	-177.9	-178.2	0	0	107.7	K718	K718-E722 IonicContact NZ-OE1 3.74Å; K718-E722 PolarHBondContact NZ-OE1 3.13Å
723	T	32.3	Very low	27.3	Very low	77 Å²	77	121.4 Å²	121.4	47%	0.472	75%	0.753	S	S	.	*			trans	167.5	128.9	160.9	21.5	0	0	0	0	106.6
724	S	29.4	Very low	27.3	Very low	88 Å²	88	119.9 Å²	119.9	62%	0.615	75%	0.752	S	S	*	*			cis	179.9	127.1	-7.5	31.4	0	0	0	0	104.3
725	T	27.7	Very low	27.5	Very low	132 Å²	132	119.4 Å²	119.4	81%	0.81	74%	0.744	S	S	*	*			trans	-13.1	122.3	157.3	-37	0	0	0	0	116.5
726	T	29	Very low	27.8	Very low	139 Å²	139	121.5 Å²	121.5	85%	0.853	75%	0.747	S	S	*	*				161.2	127.5	121.8	40.2	0	0	0	0	111.5
727	G	26.4	Very low	28.1	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	73%	0.733	S	S	*	*			trans	104.8	108.4	147.1	0	0	0	0	0	118.9
728	I	27.7	Very low	28.6	Very low	176 Å²	176	117.7 Å²	117.7	90%	0.903	72%	0.719	S	S	*	*			trans	85.6	87	142.7	-45.8	171.6	0	0	0	117.2
729	G	24.1	Very low	29.5	Very low	75 Å²	75	117.5 Å²	117.5	77%	0.773	72%	0.719	S	S	*	*				76.6	64.7	115	0	0	0	0	0	119.1
730	V	28	Very low	30.6	Very low	137 Å²	137	114.2 Å²	114.2	83%	0.83	70%	0.701	S	S	*	*			trans	-136.8	129.5	145.2	-173.6	0	0	0	0	107.6	D732	V730-D732 PolarHBondContact O-N 3.35Å
731	S	25.5	Very low	32.1	Very low	105 Å²	105	112 Å²	112	73%	0.734	68%	0.676	S	S	*	*			trans	-39.6	125.1	-174.6	47.5	0	0	0	0	115.2	G733	S731-G733 PolarHBondContact O-N 2.89Å
732	D	25.7	Very low	34.4	Very low	179 Å²	179	107.9 Å²	107.9	96%	0.957	65%	0.645	S	S	*	*	S	Bend	trans	-46	96.2	157.2	-166.3	13.7	0	0	0	110.4	V730	V730-D732 PolarHBondContact O-N 3.35Å
733	G	26.2	Very low	37.1	Very low	55 Å²	55	100.8 Å²	100.8	57%	0.567	61%	0.612	S	S	*	*			trans	-168.3	-1.2	-175.7	0	0	0	0	0	116.1	S731	S731-G733 PolarHBondContact O-N 2.89Å
734	G	26.9	Very low	39.4	Very low	59 Å²	59	101.8 Å²	101.8	61%	0.608	61%	0.607	S	S	*	*	S	Bend	trans	-96.8	-22	-170.9	0	0	0	0	0	116.9
735	D	30.6	Very low	41.9	Very low	133 Å²	133	98.1 Å²	98.1	71%	0.711	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	23.9	-165	-93.4	-26.6	0	0	0	115.9
736	I	32.5	Very low	44.3	Very low	129 Å²	129	91.9 Å²	91.9	66%	0.662	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-25.5	171.4	-58.6	173.5	0	0	0	111.1	H738 K739	I736-H738 PolarHBondContact O-N 3.47Å; I736-K739 PolarHBondContact O-N 3.22Å
737	H	35.2	Very low	46.9	Very low	115 Å²	115	86.4 Å²	86.4	53%	0.532	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-72	-28.4	-170.3	-82.1	-80	0	0	0	114.4	E205 K739	E205-H737 IonicContact OE1-CE1 3.07Å; E205-H737 PolarHBondContact OE1-CE1 3.49Å; E205-H737 IonicContact OE1-CG 2.86Å; E205-H737 IonicContact OE1-ND1 3.17Å; E205-H737 PolarHBondContact OE1-ND1 3.14Å; H737-K739 VanDerWaalsContact C-N 3.28Å; H737-K739 PolarHBondContact O-N 2.9Å
738	H	41.3	Very low	49.6	Very low	125 Å²	125	86.2 Å²	86.2	58%	0.579	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-79.1	-3	178.8	-71.7	-55.6	0	0	0	115.3	I736	I736-H738 PolarHBondContact O-N 3.47Å
739	K	43.5	Very low	52.5	Low	157 Å²	157	77.9 Å²	77.9	68%	0.683	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-90.8	-6.8	-179.1	-78.5	178.1	178.7	167.4	0	115	I736 H737	I736-K739 PolarHBondContact O-N 3.22Å; H737-K739 VanDerWaalsContact C-N 3.28Å; H737-K739 PolarHBondContact O-N 2.9Å
740	M	50.4	Low	55.6	Low	94 Å²	94	78.4 Å²	78.4	46%	0.463	42%	0.424	S	S	.	.	S	Bend	trans	-72.3	-33.9	-168.3	-84.6	-145	-177	0	0	114.9	R705	R705-M740 PolarHBondContact NH2-O 3.28Å
741	F	58.1	Low	58.7	Low	36 Å²	36	72 Å²	72	16%	0.158	39%	0.385	C	S	.	.			trans	-142.5	125.2	-176.5	-53.9	-78	0	0	0	110.8	V206 V686 Y708 L743	V206-F741 HydrophobicContact CG2-CE2 3.83Å; V206-F741 HydrophobicContact CG2-CZ 4.03Å; V686-F741 HydrophobicContact CG1-CD1 4.41Å; V686-F741 HydrophobicContact CG1-CG 4.35Å; Y708-F741 HydrophobicContact CE2-CB 4.27Å; Y708-F741 AromaticContact CE2-CD1 3.88Å; Y708-F741 HydrophobicContact CE2-CD1 3.88Å; F741-L743 WeakPolarHBondContact CB-O 3.42Å
742	T	75.5	Confident	61.9	Low	34 Å²	34	68 Å²	68	21%	0.209	36%	0.356	C	S	.	.	S	Bend	trans	-84.2	-29.6	175.2	58.9	0	0	0	0	111.9	Y708 P709 N711	Y708-T742 WeakPolarHBondContact CB-OG1 3.4Å; P709-T742 WeakPolarHBondContact O-CB 3.28Å; P709-T742 WeakPolarHBondContact O-CG2 3.48Å; P709-T742 PolarHBondContact O-OG1 3.33Å; N711-T742 WeakPolarHBondContact OD1-CG2 3.36Å
743	L	83.2	Confident	65.2	Low	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-87.9	144	163.4	-67.5	-177.3	0	0	0	110.9	A691 I703 Y708 P709 F741 I749 V768 V770	A691-L743 HydrophobicContact CB-CD1 4.48Å; I703-L743 HydrophobicContact CB-CD1 4.47Å; I703-L743 HydrophobicContact CD1-CD1 3.86Å; I703-L743 HydrophobicContact CG2-CD1 3.9Å; Y708-L743 HydrophobicContact CD1-CB 4.38Å; Y708-L743 HydrophobicContact CD1-CD1 3.55Å; Y708-L743 HydrophobicContact CD1-CG 4.06Å; Y708-L743 HydrophobicContact CD2-CB 3.95Å; Y708-L743 HydrophobicContact CD2-CG 4.23Å; Y708-L743 HydrophobicContact CE1-CB 4.3Å; Y708-L743 HydrophobicContact CE1-CD1 3.68Å; Y708-L743 HydrophobicContact CE1-CG 4.35Å; Y708-L743 HydrophobicContact CE2-CB 3.85Å; Y708-L743 HydrophobicContact CG-CB 4.21Å; Y708-L743 HydrophobicContact CG-CD1 4.01Å; Y708-L743 HydrophobicContact CG-CG 4Å; P709-L743 HydrophobicContact CG-CD2 3.84Å; P709-L743 HydrophobicContact CG-CG 4.34Å; F741-L743 WeakPolarHBondContact CB-O 3.42Å; L743-I749 HydrophobicContact CD2-CG2 4.02Å; L743-V768 HydrophobicContact CD1-CG1 4.03Å; L743-V768 HydrophobicContact CD2-CG1 4.08Å; L743-V770 HydrophobicContact CD2-CG2 3.55Å
744	R	81.7	Confident	68.4	Low	97 Å²	97	58.6 Å²	58.6	37%	0.366	30%	0.296	S	S	.	.			trans	-144.8	151.4	-162.3	-93.1	168.4	-179.8	-153.5	4.9	108.9	R213 V683 G746 D747	R213-R744 VanDerWaalsContact CZ-CB 3.43Å; V683-R744 WeakPolarHBondContact CB-O 3.36Å; V683-R744 WeakPolarHBondContact CG1-O 3.43Å; R744-G746 PolarHBondContact O-N 2.92Å; R744-D747 WeakPolarHBondContact CB-OD1 3.42Å; R744-D747 VanDerWaalsContact CB-OD2 3.28Å; R744-D747 WeakPolarHBondContact CB-OD2 3.3Å; R744-D747 PolarHBondContact N-OD2 3.09Å; R744-D747 WeakPolarHBondContact O-CB 3.42Å; R744-D747 VanDerWaalsContact O-CG 3.23Å; R744-D747 PolarHBondContact O-N 3.49Å
745	L	81.6	Confident	71.4	Confident	12 Å²	12	57.1 Å²	57.1	6%	0.063	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	133	-178.9	-164.1	85.7	0	0	0	110.1	N210 R213 L214 E684 D747	N210-L745 HydrophobicContact CB-CD2 4.33Å; N210-L745 WeakPolarHBondContact O-CD2 3.23Å; R213-L745 HydrophobicContact CB-CB 4.08Å; R213-L745 HydrophobicContact CB-CD2 4.11Å; R213-L745 VanDerWaalsContact CD-CB 3.5Å; R213-L745 HydrophobicContact CG-CB 4.47Å; R213-L745 PolarHBondContact NH1-O 3.33Å; L214-L745 HydrophobicContact CB-CD2 4.15Å; E684-L745 WeakPolarHBondContact O-CD1 3.41Å; L745-D747 VanDerWaalsContact C-N 3.3Å; L745-D747 PolarHBondContact O-N 2.96Å
746	G	77.2	Confident	74.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-9.6	179.9	0	0	0	0	0	115.5	V683 R744 R748	V683-G746 WeakPolarHBondContact O-CA 3.45Å; V683-G746 PolarHBondContact O-N 2.92Å; R744-G746 PolarHBondContact O-N 2.92Å; G746-R748 PolarHBondContact O-N 3.07Å
747	D	83.1	Confident	77	Confident	24 Å²	24	49.7 Å²	49.7	13%	0.128	24%	0.244	C	C	.	.			trans	-54.1	130.7	176.8	-73.5	-2.2	0	0	0	110.7	R682 V683 R744 L745 I749 V770	R682-D747 WeakPolarHBondContact CA-O 3.22Å; V683-D747 HydrophobicContact CB-CB 4.49Å; V683-D747 HydrophobicContact CG2-CB 3.94Å; V683-D747 PolarHBondContact N-O 3.36Å; R744-D747 WeakPolarHBondContact CB-OD1 3.42Å; R744-D747 VanDerWaalsContact CB-OD2 3.28Å; R744-D747 WeakPolarHBondContact CB-OD2 3.3Å; R744-D747 PolarHBondContact N-OD2 3.09Å; R744-D747 WeakPolarHBondContact O-CB 3.42Å; R744-D747 VanDerWaalsContact O-CG 3.23Å; R744-D747 PolarHBondContact O-N 3.49Å; L745-D747 VanDerWaalsContact C-N 3.3Å; L745-D747 PolarHBondContact O-N 2.96Å; D747-I749 HydrophobicContact CB-CG2 4.39Å; D747-V770 HydrophobicContact CB-CG1 4.16Å
748	R	84.2	Confident	79.4	Confident	68 Å²	68	49.3 Å²	49.3	26%	0.257	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	129.8	167.8	-68.8	-176.2	178.5	-129.3	-0.5	108.1	M239 T660 G681 G746 V770 M771	M239-R748 PolarHBondContact SD-NH2 3.23Å; M239-R748 VanDerWaalsContact SD-NH2 3.41Å; T660-R748 PolarHBondContact OG1-NH2 3.3Å; G681-R748 WeakPolarHBondContact O-CA 3.26Å; G746-R748 PolarHBondContact O-N 3.07Å; R748-V770 CarbonylContact O-C 3.58Å; R748-V770 WeakPolarHBondContact O-CA 3.32Å; R748-M771 HydrophobicContact CB-CB 4.05Å; R748-M771 PolarHBondContact O-N 2.55Å
749	I	88.4	Confident	81.4	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.1	-176.2	61.7	165	0	0	0	111.6	K680 G681 V683 C693 I703 L743 D747 L765 V768 F769	K680-I749 CarbonylContact C-O 3.25Å; K680-I749 VanDerWaalsContact CA-O 3.29Å; K680-I749 WeakPolarHBondContact CA-O 3.43Å; G681-I749 PolarHBondContact N-O 3.21Å; G681-I749 PolarHBondContact O-N 3.23Å; V683-I749 HydrophobicContact CG2-CG2 4.06Å; C693-I749 HydrophobicContact CB-CD1 3.88Å; C693-I749 VanDerWaalsContact SG-CD1 3.57Å; I703-I749 HydrophobicContact CD1-CD1 3.43Å; I703-I749 VanDerWaalsContact CD1-CD1 3.43Å; L743-I749 HydrophobicContact CD2-CG2 4.02Å; D747-I749 HydrophobicContact CB-CG2 4.39Å; I749-L765 HydrophobicContact CD1-CD1 4.21Å; I749-V768 HydrophobicContact CB-CG1 3.98Å; I749-V768 HydrophobicContact CD1-CG1 4.2Å; I749-V768 HydrophobicContact CG2-CG1 3.92Å; I749-F769 CarbonylContact C-O 3.59Å; I749-F769 VanDerWaalsContact CA-O 3.24Å; I749-F769 WeakPolarHBondContact CA-O 3.28Å
750	K	89.8	Confident	83.3	Confident	86 Å²	86	50.7 Å²	50.7	37%	0.374	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.8	159.7	-170.8	177.7	-179.4	-176.5	0	108	V679 F769 M771	V679-K750 WeakPolarHBondContact O-CA 3.41Å; K750-F769 PolarHBondContact N-O 3.05Å; K750-F769 PolarHBondContact O-N 3.46Å; K750-M771 HydrophobicContact CB-CG 4.44Å; K750-M771 HydrophobicContact CB-SD 4.38Å
751	A	92.4	Very high	84.9	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.017	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	166.8	-178.1	0	0	0	0	0	111.8	Q678 V679 L765 V768	Q678-A751 WeakPolarHBondContact CA-O 3.33Å; V679-A751 PolarHBondContact N-O 3.36Å; V679-A751 PolarHBondContact O-N 3.07Å; A751-L765 HydrophobicContact CB-CB 3.93Å; A751-L765 HydrophobicContact CB-CD1 3.97Å; A751-L765 HydrophobicContact CB-CG 4.39Å; A751-V768 HydrophobicContact CB-CG2 4.05Å
752	T	93.3	Very high	86.3	Confident	20 Å²	20	57.9 Å²	57.9	12%	0.123	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.2	174	-51.5	0	0	0	0	109.6	M677 S754 L765 H766	M677-T752 WeakPolarHBondContact O-CA 3.4Å; T752-S754 PolarHBondContact O-N 3.42Å; T752-L765 WeakPolarHBondContact O-CA 3.44Å; T752-H766 WeakPolarHBondContact CG2-NE2 3.34Å; T752-H766 PolarHBondContact N-O 3.11Å; T752-H766 PolarHBondContact O-CD2 3.13Å; T752-H766 PolarHBondContact O-N 2.77Å
753	V	93.6	Very high	87.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	114.2	175.3	178.2	0	0	0	0	109.9	L673 G676 M677 V679 V756 V763 L765	L673-V753 HydrophobicContact CD2-CG2 4.36Å; G676-V753 PolarHBondContact N-O 2.96Å; M677-V753 HydrophobicContact CB-CG2 4.25Å; M677-V753 PolarHBondContact O-N 2.95Å; V679-V753 HydrophobicContact CG1-CG2 3.83Å; V679-V753 HydrophobicContact CG2-CG2 4.13Å; V753-V756 HydrophobicContact CG1-CG2 3.4Å; V753-V763 HydrophobicContact CG1-CG1 4.45Å; V753-L765 HydrophobicContact CG2-CD2 4.11Å
754	S	93.6	Very high	87.6	Confident	38 Å²	38	57.8 Å²	57.8	27%	0.266	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-35.6	178.7	54.4	0	0	0	0	112.4	K675 T752 A764 H766	K675-S754 WeakPolarHBondContact CD-O 3.49Å; K675-S754 VanDerWaalsContact CE-O 3.25Å; K675-S754 WeakPolarHBondContact CE-O 3.43Å; K675-S754 WeakPolarHBondContact CG-O 3.48Å; T752-S754 PolarHBondContact O-N 3.42Å; S754-A764 PolarHBondContact N-O 3.38Å; S754-A764 WeakPolarHBondContact OG-CB 3.46Å; S754-A764 PolarHBondContact OG-O 2.94Å; S754-H766 VanDerWaalsContact CA-CD2 3.43Å; S754-H766 WeakPolarHBondContact CA-CD2 3.34Å; S754-H766 WeakPolarHBondContact CB-CD2 3.03Å; S754-H766 PolarHBondContact N-CD2 2.98Å
755	G	90.7	Very high	88.1	Confident	27 Å²	27	53.2 Å²	53.2	28%	0.278	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	144.1	-177.2	0	0	0	0	0	111.5	A764	G755-A764 PolarHBondContact O-N 3.14Å
756	V	90.1	Very high	88.6	Confident	45 Å²	45	54.7 Å²	54.7	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.2	175.1	-175.1	0	0	0	0	106.9	I670 L673 V753 I758	I670-V756 HydrophobicContact CD1-CG1 4.38Å; I670-V756 HydrophobicContact CG1-CG1 3.88Å; L673-V756 HydrophobicContact CB-CG1 4.47Å; L673-V756 HydrophobicContact CB-CG2 3.76Å; L673-V756 HydrophobicContact CD1-CG2 4.48Å; V753-V756 HydrophobicContact CG1-CG2 3.4Å; V756-I758 HydrophobicContact CG1-CG1 4.16Å
757	D	89.4	Confident	89.2	Confident	62 Å²	62	60.7 Å²	60.7	33%	0.332	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	100	174.2	-169.9	-34.5	0	0	0	108.1	K759 Y760 K761 R762	D757-K759 VanDerWaalsContact C-N 3.33Å; D757-K759 PolarHBondContact OD1-N 2.92Å; D757-Y760 WeakPolarHBondContact OD1-CD2 2.89Å; D757-Y760 PolarHBondContact OD1-N 3.29Å; D757-Y760 VanDerWaalsContact OD2-CD2 3.27Å; D757-Y760 WeakPolarHBondContact OD2-CD2 3.35Å; D757-K761 CarbonylContact O-C 3.49Å; D757-K761 WeakPolarHBondContact O-CA 3.41Å; D757-K761 PolarHBondContact O-N 3.35Å; D757-R762 HydrophobicContact CB-CB 4.2Å; D757-R762 PolarHBondContact N-O 3.25Å; D757-R762 PolarHBondContact O-N 2.84Å
758	I	86	Confident	89.5	Confident	107 Å²	107	59.9 Å²	59.9	55%	0.549	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-36.3	-176.6	-59.2	174	0	0	0	110.4	V756 K761	V756-I758 HydrophobicContact CG1-CG1 4.16Å; I758-K761 PolarHBondContact O-N 3.2Å
759	K	84.6	Confident	89.7	Confident	170 Å²	170	63.1 Å²	63.1	74%	0.739	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-45.4	-177.3	-178.7	174.6	-179.7	172.2	0	111.2	D757	D757-K759 VanDerWaalsContact C-N 3.33Å; D757-K759 PolarHBondContact OD1-N 2.92Å
760	Y	83.1	Confident	89.5	Confident	141 Å²	141	65.8 Å²	65.8	55%	0.553	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	4	179.2	-59.7	-73.9	0	0	0	113.6	D757 R762	D757-Y760 WeakPolarHBondContact OD1-CD2 2.89Å; D757-Y760 PolarHBondContact OD1-N 3.29Å; D757-Y760 VanDerWaalsContact OD2-CD2 3.27Å; D757-Y760 WeakPolarHBondContact OD2-CD2 3.35Å; Y760-R762 VanDerWaalsContact C-N 3.34Å; Y760-R762 WeakPolarHBondContact O-CG 3.43Å; Y760-R762 PolarHBondContact O-N 3.26Å
761	K	83.4	Confident	88.9	Confident	110 Å²	110	65.4 Å²	65.4	48%	0.478	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	46.8	-179.9	-51.6	-171	-173.2	-178.4	0	113.4	I670 E699 D757 I758	I670-K761 HydrophobicContact CD1-CB 4.43Å; E699-K761 HydrophobicContact CG-CB 3.97Å; E699-K761 VanDerWaalsContact OE1-CB 3.24Å; E699-K761 WeakPolarHBondContact OE1-CB 3.33Å; E699-K761 WeakPolarHBondContact OE1-CD 3.43Å; D757-K761 CarbonylContact O-C 3.49Å; D757-K761 WeakPolarHBondContact O-CA 3.41Å; D757-K761 PolarHBondContact O-N 3.35Å; I758-K761 PolarHBondContact O-N 3.2Å
762	R	87.9	Confident	87.5	Confident	170 Å²	170	75.1 Å²	75.1	64%	0.642	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.7	-179.4	-62.6	178.2	178.4	170.7	-1.6	110.2	D757 Y760	D757-R762 HydrophobicContact CB-CB 4.2Å; D757-R762 PolarHBondContact N-O 3.25Å; D757-R762 PolarHBondContact O-N 2.84Å; Y760-R762 VanDerWaalsContact C-N 3.34Å; Y760-R762 WeakPolarHBondContact O-CG 3.43Å; Y760-R762 PolarHBondContact O-N 3.26Å
763	V	91.5	Very high	87.2	Confident	3 Å²	3	77.9 Å²	77.9	2%	0.018	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.4	170.1	-176	0	0	0	0	107.5	I670 L673 I695 V697 A701 Y702 V753 L765	I670-V763 HydrophobicContact CD1-CG2 3.77Å; I670-V763 HydrophobicContact CG1-CG2 3.97Å; L673-V763 HydrophobicContact CD1-CB 4.49Å; L673-V763 HydrophobicContact CD1-CG1 3.88Å; L673-V763 HydrophobicContact CD1-CG2 3.75Å; I695-V763 HydrophobicContact CD1-CG1 4Å; V697-V763 HydrophobicContact CG2-CG2 4.46Å; A701-V763 CarbonylContact C-O 3.5Å; A701-V763 WeakPolarHBondContact CA-O 3.35Å; A701-V763 HydrophobicContact CB-CB 3.97Å; A701-V763 HydrophobicContact CB-CG1 3.9Å; Y702-V763 PolarHBondContact N-O 2.85Å; V753-V763 HydrophobicContact CG1-CG1 4.45Å; V763-L765 HydrophobicContact CG1-CD2 4.08Å
764	A	93.7	Very high	86.9	Confident	30 Å²	30	82 Å²	82	25%	0.248	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.4	173.2	0	0	0	0	0	109.4	Y702 S754 G755	Y702-A764 WeakPolarHBondContact O-CA 3.5Å; S754-A764 PolarHBondContact N-O 3.38Å; S754-A764 WeakPolarHBondContact OG-CB 3.46Å; S754-A764 PolarHBondContact OG-O 2.94Å; G755-A764 PolarHBondContact O-N 3.14Å
765	L	93.2	Very high	86.5	Confident	1 Å²	1	84.4 Å²	84.4	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154.1	176.6	-49.7	176.5	0	0	0	110.7	V679 I695 A701 Y702 I703 I749 A751 T752 V753 V763	V679-L765 HydrophobicContact CG2-CD2 3.78Å; I695-L765 HydrophobicContact CG2-CD1 4.03Å; A701-L765 HydrophobicContact CB-CD1 3.59Å; A701-L765 HydrophobicContact CB-CD2 4.05Å; A701-L765 HydrophobicContact CB-CG 3.68Å; Y702-L765 PolarHBondContact O-N 3.36Å; I703-L765 HydrophobicContact CD1-CD1 4.31Å; I703-L765 HydrophobicContact CG1-CB 4.14Å; I703-L765 HydrophobicContact CG1-CD1 4.17Å; I749-L765 HydrophobicContact CD1-CD1 4.21Å; A751-L765 HydrophobicContact CB-CB 3.93Å; A751-L765 HydrophobicContact CB-CD1 3.97Å; A751-L765 HydrophobicContact CB-CG 4.39Å; T752-L765 WeakPolarHBondContact O-CA 3.44Å; V753-L765 HydrophobicContact CG2-CD2 4.11Å; V763-L765 HydrophobicContact CG1-CD2 4.08Å
766	H	92.4	Very high	86.2	Confident	43 Å²	43	87.8 Å²	87.8	20%	0.199	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	172.1	174.2	74.4	115.8	0	0	0	110	E707 T752 S754	E707-H766 HydrophobicContact CG-CB 4.18Å; E707-H766 WeakPolarHBondContact OE2-CA 3.41Å; E707-H766 WeakPolarHBondContact OE2-CB 3.46Å; T752-H766 WeakPolarHBondContact CG2-NE2 3.34Å; T752-H766 PolarHBondContact N-O 3.11Å; T752-H766 PolarHBondContact O-CD2 3.13Å; T752-H766 PolarHBondContact O-N 2.77Å; S754-H766 VanDerWaalsContact CA-CD2 3.43Å; S754-H766 WeakPolarHBondContact CA-CD2 3.34Å; S754-H766 WeakPolarHBondContact CB-CD2 3.03Å; S754-H766 PolarHBondContact N-CD2 2.98Å
767	K	89.1	Confident	86	Confident	127 Å²	127	90.5 Å²	90.5	55%	0.552	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.7	57.4	-177.4	-65.4	173.9	178.2	-175.8	0	111.6	E707 F769	E707-K767 PolarHBondContact OE2-N 3.13Å; K767-F769 HydrophobicContact CB-CE2 4.43Å; K767-F769 VanDerWaalsContact O-CD2 3.3Å; K767-F769 WeakPolarHBondContact O-CD2 3.39Å; K767-F769 WeakPolarHBondContact O-CE2 3.43Å
768	V	89.6	Confident	85.8	Confident	7 Å²	7	92.4 Å²	92.4	4%	0.042	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.2	-173.9	-172.8	0	0	0	0	110.7	I703 L743 I749 A751	I703-V768 HydrophobicContact CD1-CG1 4.11Å; I703-V768 HydrophobicContact CD1-CG2 3.95Å; I703-V768 HydrophobicContact CG1-CG2 4.36Å; I703-V768 HydrophobicContact CG2-CG2 3.79Å; L743-V768 HydrophobicContact CD1-CG1 4.03Å; L743-V768 HydrophobicContact CD2-CG1 4.08Å; I749-V768 HydrophobicContact CB-CG1 3.98Å; I749-V768 HydrophobicContact CD1-CG1 4.2Å; I749-V768 HydrophobicContact CG2-CG1 3.92Å; A751-V768 HydrophobicContact CB-CG2 4.05Å
769	F	88.8	Confident	85.7	Confident	135 Å²	135	91.4 Å²	91.4	59%	0.592	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.2	174	-60.1	-89.2	0	0	0	109.3	I749 K750 K767	I749-F769 CarbonylContact C-O 3.59Å; I749-F769 VanDerWaalsContact CA-O 3.24Å; I749-F769 WeakPolarHBondContact CA-O 3.28Å; K750-F769 PolarHBondContact N-O 3.05Å; K750-F769 PolarHBondContact O-N 3.46Å; K767-F769 HydrophobicContact CB-CE2 4.43Å; K767-F769 VanDerWaalsContact O-CD2 3.3Å; K767-F769 WeakPolarHBondContact O-CD2 3.39Å; K767-F769 WeakPolarHBondContact O-CE2 3.43Å
770	V	84.1	Confident	85.8	Confident	58 Å²	58	85.3 Å²	85.3	35%	0.352	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.3	171.8	-175.7	0	0	0	0	108.6	P709 L743 D747 R748	P709-V770 HydrophobicContact CG-CG2 4.06Å; L743-V770 HydrophobicContact CD2-CG2 3.55Å; D747-V770 HydrophobicContact CB-CG1 4.16Å; R748-V770 CarbonylContact O-C 3.58Å; R748-V770 WeakPolarHBondContact O-CA 3.32Å
771	M	76.5	Confident	86.1	Confident	78 Å²	78	80.7 Å²	80.7	38%	0.384	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.3	172	-60	179.5	59.6	0	0	107.6	K680 R748 K750	K680-M771 HydrophobicContact CD-CE 4.41Å; K680-M771 HydrophobicContact CD-SD 4.22Å; K680-M771 HydrophobicContact CG-SD 4.31Å; R748-M771 HydrophobicContact CB-CB 4.05Å; R748-M771 PolarHBondContact O-N 2.55Å; K750-M771 HydrophobicContact CB-CG 4.44Å; K750-M771 HydrophobicContact CB-SD 4.38Å
772	T	62.7	Low	86.3	Confident	206 Å²	206	78 Å²	78	100%	1.264	39%	0.391	S	S	*	.			trans	-79.2	0	175.6	51.5	0	0	0	0	111.9

Retrieved 772 of 772 residues in 351.7 ms (Link to these results)

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